data_c17395_2l87 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c17395_2l87 _Entry.Title ; The 27-residue N- terminus CCR5-peptide in a ternary complex with HIV-1 gp120 and a CD4-mimic peptide ; _Entry.Version_type original _Entry.Submission_date 2011-01-06 _Entry.Accession_date 2011-01-06 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.31 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Einat Schnur . . . c17395_2l87 2 Eran Noah . . . c17395_2l87 3 Inbal Ayzenshtat . . . c17395_2l87 4 Hasmik Sargsyan . . . c17395_2l87 5 Tatsuya Inuib . . . c17395_2l87 6 Fa-Xiang Ding . . . c17395_2l87 7 Boris Arshava . . . c17395_2l87 8 Yael Sagi . . . c17395_2l87 9 Naama Kessler . . . c17395_2l87 10 Rina Levy . . . c17395_2l87 11 Tali Scherf . . . c17395_2l87 12 Fred Naider . . . c17395_2l87 13 Jacob Anglister . . . c17395_2l87 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . c17395_2l87 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID helix . c17395_2l87 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c17395_2l87 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 164 c17395_2l87 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 2 . . 2012-08-28 2011-01-06 update BMRB 'update entry citation' c17395_2l87 1 . . 2011-02-04 2011-01-06 original author 'original release' c17395_2l87 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c17395_2l87 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21763489 _Citation.Full_citation . _Citation.Title 'The conformation and orientation of a 27-residue CCR5 peptide in a ternary complex with HIV-1 gp120 and a CD4-mimic peptide.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 410 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 778 _Citation.Page_last 797 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Einat Schnur . . . c17395_2l87 1 2 Eran Noah . . . c17395_2l87 1 3 Inbal Ayzenshtat . . . c17395_2l87 1 4 Hasmik Sargsyan . . . c17395_2l87 1 5 Tatsuya Inui . . . c17395_2l87 1 6 Fa-Xiang Ding . . . c17395_2l87 1 7 Boris Arshava . . . c17395_2l87 1 8 Yael Sagi . . . c17395_2l87 1 9 Naama Kessler . . . c17395_2l87 1 10 Rina Levy . . . c17395_2l87 1 11 Tali Scherf . . . c17395_2l87 1 12 Fred Naider . . . c17395_2l87 1 13 Jacob Anglister . . . c17395_2l87 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c17395_2l87 _Assembly.ID 1 _Assembly.Name CCR5 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 CCR5 1 $entity A . yes native no no . . . c17395_2l87 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID c17395_2l87 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CCR5 _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 ; MDYQVSSPIXDINXYTSEPA QKINVKQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer yes _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 27 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3357.671 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2012-09-03 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no PDB 2L87 . 'The 27-Residue N-Terminus Ccr5-Peptide In A Ternary Complex With Hiv-1 Gp120 And A Cd4-Mimic Peptide' . . . . . 100.00 27 100.00 100.00 5.62e-08 . . . . c17395_2l87 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . c17395_2l87 1 2 . ASP . c17395_2l87 1 3 . TYR . c17395_2l87 1 4 . GLN . c17395_2l87 1 5 . VAL . c17395_2l87 1 6 . SER . c17395_2l87 1 7 . SER . c17395_2l87 1 8 . PRO . c17395_2l87 1 9 . ILE . c17395_2l87 1 10 . TYS . c17395_2l87 1 11 . ASP . c17395_2l87 1 12 . ILE . c17395_2l87 1 13 . ASN . c17395_2l87 1 14 . TYS . c17395_2l87 1 15 . TYR . c17395_2l87 1 16 . THR . c17395_2l87 1 17 . SER . c17395_2l87 1 18 . GLU . c17395_2l87 1 19 . PRO . c17395_2l87 1 20 . ALA . c17395_2l87 1 21 . GLN . c17395_2l87 1 22 . LYS . c17395_2l87 1 23 . ILE . c17395_2l87 1 24 . ASN . c17395_2l87 1 25 . VAL . c17395_2l87 1 26 . LYS . c17395_2l87 1 27 . GLN . c17395_2l87 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 . MET 1 1 c17395_2l87 1 . ASP 2 2 c17395_2l87 1 . TYR 3 3 c17395_2l87 1 . GLN 4 4 c17395_2l87 1 . VAL 5 5 c17395_2l87 1 . SER 6 6 c17395_2l87 1 . SER 7 7 c17395_2l87 1 . PRO 8 8 c17395_2l87 1 . ILE 9 9 c17395_2l87 1 . TYS 10 10 c17395_2l87 1 . ASP 11 11 c17395_2l87 1 . ILE 12 12 c17395_2l87 1 . ASN 13 13 c17395_2l87 1 . TYS 14 14 c17395_2l87 1 . TYR 15 15 c17395_2l87 1 . THR 16 16 c17395_2l87 1 . SER 17 17 c17395_2l87 1 . GLU 18 18 c17395_2l87 1 . PRO 19 19 c17395_2l87 1 . ALA 20 20 c17395_2l87 1 . GLN 21 21 c17395_2l87 1 . LYS 22 22 c17395_2l87 1 . ILE 23 23 c17395_2l87 1 . ASN 24 24 c17395_2l87 1 . VAL 25 25 c17395_2l87 1 . LYS 26 26 c17395_2l87 1 . GLN 27 27 c17395_2l87 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 c17395_2l87 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . c17395_2l87 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 c17395_2l87 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c17395_2l87 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_TYS _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_TYS _Chem_comp.Entry_ID c17395_2l87 _Chem_comp.ID TYS _Chem_comp.Provenance . _Chem_comp.Name O-SULFO-L-TYROSINE _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code . _Chem_comp.PDB_code TYS _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces STY _Chem_comp.One_letter_code Y _Chem_comp.Three_letter_code TYS _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code . _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 TYR _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 yes _Chem_comp.Formula 'C9 H11 N O6 S' _Chem_comp.Formula_weight 261.252 _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 ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Dec 9 13:16:12 2011 ; _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 O=S(=O)(Oc1ccc(cc1)CC(C(=O)O)N)O SMILES ACDLabs 10.04 c17395_2l87 TYS N[C@@H](Cc1ccc(O[S](O)(=O)=O)cc1)C(O)=O SMILES_CANONICAL CACTVS 3.341 c17395_2l87 TYS N[CH](Cc1ccc(O[S](O)(=O)=O)cc1)C(O)=O SMILES CACTVS 3.341 c17395_2l87 TYS c1cc(ccc1C[C@@H](C(=O)O)N)OS(=O)(=O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c17395_2l87 TYS c1cc(ccc1CC(C(=O)O)N)OS(=O)(=O)O SMILES 'OpenEye OEToolkits' 1.5.0 c17395_2l87 TYS InChI=1S/C9H11NO6S/c10-8(9(11)12)5-6-1-3-7(4-2-6)16-17(13,14)15/h1-4,8H,5,10H2,(H,11,12)(H,13,14,15)/t8-/m0/s1 InChI InChI 1.03 c17395_2l87 TYS CIQHWLTYGMYQQR-QMMMGPOBSA-N InChIKey InChI 1.03 c17395_2l87 TYS 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 O-sulfo-L-tyrosine 'SYSTEMATIC NAME' ACDLabs 10.04 c17395_2l87 TYS '(2S)-2-amino-3-(4-sulfooxyphenyl)propanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c17395_2l87 TYS 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 0 . . . . no no . . . . 16.013 . 1.950 . -4.617 . -3.373 1.476 -0.740 1 . c17395_2l87 TYS CA . CA . . C . . S 0 . . . . no no . . . . 16.552 . 1.871 . -3.258 . -3.510 0.055 -0.396 2 . c17395_2l87 TYS CB . CB . . C . . N 0 . . . . no no . . . . 15.386 . 1.742 . -2.268 . -2.563 -0.284 0.757 3 . c17395_2l87 TYS CG . CG . . C . . N 0 . . . . yes no . . . . 14.473 . 2.961 . -2.241 . -1.136 -0.121 0.299 4 . c17395_2l87 TYS CD1 . CD1 . . C . . N 0 . . . . yes no . . . . 15.001 . 4.212 . -1.950 . -0.502 1.099 0.441 5 . c17395_2l87 TYS CD2 . CD2 . . C . . N 0 . . . . yes no . . . . 13.124 . 2.796 . -2.486 . -0.463 -1.192 -0.257 6 . c17395_2l87 TYS CE1 . CE1 . . C . . N 0 . . . . yes no . . . . 14.186 . 5.316 . -1.930 . 0.806 1.252 0.023 7 . c17395_2l87 TYS CE2 . CE2 . . C . . N 0 . . . . yes no . . . . 12.300 . 3.899 . -2.461 . 0.845 -1.045 -0.677 8 . c17395_2l87 TYS CZ . CZ . . C . . N 0 . . . . yes no . . . . 12.840 . 5.140 . -2.179 . 1.482 0.180 -0.541 9 . c17395_2l87 TYS OH . OH . . O . . N 0 . . . . no no . . . . 12.096 . 6.125 . -2.152 . 2.768 0.327 -0.954 10 . c17395_2l87 TYS S . S . . S . . N 0 . . . . no no . . . . 11.372 . 6.454 . -0.939 . 3.803 0.015 0.118 11 . c17395_2l87 TYS O1 . O1 . . O . . N 0 . . . . no no . . . . 12.284 . 6.826 . 0.109 . 5.061 0.409 -0.412 12 . c17395_2l87 TYS O2 . O2 . . O . . N 0 . . . . no no . . . . 10.523 . 5.390 . -0.492 . 3.280 0.520 1.339 13 . c17395_2l87 TYS O3 . O3 . . O . . N 0 . . . . no no . . . . 10.554 . 7.603 . -1.197 . 3.855 -1.499 0.266 14 . c17395_2l87 TYS C . C . . C . . N 0 . . . . no no . . . . 17.545 . 0.752 . -2.992 . -4.931 -0.226 0.023 15 . c17395_2l87 TYS O . O . . O . . N 0 . . . . no yes . . . . 18.218 . 0.693 . -1.959 . -5.645 0.680 0.381 16 . c17395_2l87 TYS OXT . OXT . . O . . N 0 . . . . no yes . . . . 17.577 . -0.181 . -3.935 . -5.402 -1.483 -0.004 17 . c17395_2l87 TYS H . H . . H . . N 0 . . . . no no . . . . 15.014 . 1.968 . -4.579 . -3.941 1.710 -1.541 18 . c17395_2l87 TYS HN2 . HN2 . . H . . N 0 . . . . no no . . . . 16.345 . 2.783 . -5.059 . -3.600 2.063 0.048 19 . c17395_2l87 TYS HA . HA . . H . . N 0 . . . . no no . . . . 17.127 . 2.800 . -3.127 . -3.260 -0.555 -1.263 20 . c17395_2l87 TYS HB2 . HB2 . . H . . N 0 . . . . no no . . . . 14.783 . 0.869 . -2.560 . -2.755 0.387 1.594 21 . c17395_2l87 TYS HB3 . HB3 . . H . . N 0 . . . . no no . . . . 15.822 . 1.640 . -1.263 . -2.728 -1.315 1.072 22 . c17395_2l87 TYS HD1 . HD1 . . H . . N 0 . . . . no no . . . . 16.055 . 4.316 . -1.739 . -1.028 1.934 0.880 23 . c17395_2l87 TYS HD2 . HD2 . . H . . N 0 . . . . no no . . . . 12.721 . 1.816 . -2.694 . -0.960 -2.146 -0.363 24 . c17395_2l87 TYS HE1 . HE1 . . H . . N 0 . . . . no no . . . . 14.588 . 6.297 . -1.725 . 1.301 2.205 0.133 25 . c17395_2l87 TYS HE2 . HE2 . . H . . N 0 . . . . no no . . . . 11.243 . 3.796 . -2.660 . 1.371 -1.883 -1.111 26 . c17395_2l87 TYS HO3 . HO3 . . H . . N 0 . . . . no no . . . . 10.373 . 8.053 . -0.380 . 4.487 -1.808 0.929 27 . c17395_2l87 TYS HXT . HXT . . H . . N 0 . . . . no yes . . . . 18.183 . -0.868 . -3.681 . -6.319 -1.613 0.273 28 . c17395_2l87 TYS stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c17395_2l87 TYS 2 . SING N H no N 2 . c17395_2l87 TYS 3 . SING N HN2 no N 3 . c17395_2l87 TYS 4 . SING CA CB no N 4 . c17395_2l87 TYS 5 . SING CA C no N 5 . c17395_2l87 TYS 6 . SING CA HA no N 6 . c17395_2l87 TYS 7 . SING CB CG no N 7 . c17395_2l87 TYS 8 . SING CB HB2 no N 8 . c17395_2l87 TYS 9 . SING CB HB3 no N 9 . c17395_2l87 TYS 10 . DOUB CG CD1 yes N 10 . c17395_2l87 TYS 11 . SING CG CD2 yes N 11 . c17395_2l87 TYS 12 . SING CD1 CE1 yes N 12 . c17395_2l87 TYS 13 . SING CD1 HD1 no N 13 . c17395_2l87 TYS 14 . DOUB CD2 CE2 yes N 14 . c17395_2l87 TYS 15 . SING CD2 HD2 no N 15 . c17395_2l87 TYS 16 . DOUB CE1 CZ yes N 16 . c17395_2l87 TYS 17 . SING CE1 HE1 no N 17 . c17395_2l87 TYS 18 . SING CE2 CZ yes N 18 . c17395_2l87 TYS 19 . SING CE2 HE2 no N 19 . c17395_2l87 TYS 20 . SING CZ OH no N 20 . c17395_2l87 TYS 21 . SING OH S no N 21 . c17395_2l87 TYS 22 . DOUB S O1 no N 22 . c17395_2l87 TYS 23 . DOUB S O2 no N 23 . c17395_2l87 TYS 24 . SING S O3 no N 24 . c17395_2l87 TYS 25 . SING O3 HO3 no N 25 . c17395_2l87 TYS 26 . DOUB C O no N 26 . c17395_2l87 TYS 27 . SING C OXT no N 27 . c17395_2l87 TYS 28 . SING OXT HXT no N 28 . c17395_2l87 TYS stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c17395_2l87 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Nt-CCR5 'natural abundance' . . 1 $entity . . 1 . . mM . . . . c17395_2l87 1 2 gp120/CD4mimic 'natural abundance' . . . . . . 0.1 . . mM . . . . c17395_2l87 1 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . c17395_2l87 1 4 H2O 'natural abundance' . . . . . . 5 . . % . . . . c17395_2l87 1 stop_ save_ ####################### # Sample conditions # ####################### save_pH_7.0_300_mM_NaCl _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode pH_7.0_300_mM_NaCl _Sample_condition_list.Entry_ID c17395_2l87 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH c17395_2l87 1 'ionic strength' 300 . mM c17395_2l87 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID c17395_2l87 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . c17395_2l87 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' c17395_2l87 1 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID c17395_2l87 _Software.ID 2 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . c17395_2l87 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' c17395_2l87 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID c17395_2l87 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c17395_2l87 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 800 . . . c17395_2l87 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 c17395_2l87 _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.X_ray_instrument_ID _Experiment.X_ray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH_7.0_300_mM_NaCl . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c17395_2l87 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID c17395_2l87 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c17395_2l87 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TMS 'methyl protons' . . . . ppm 0.00 external indirect 1 . . . . . . . . . c17395_2l87 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c17395_2l87 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $pH_7.0_300_mM_NaCl _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY' . . . c17395_2l87 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 ASP H H 1 8.118 . . 1 . . . A 2 ASP H . c17395_2l87 1 2 . 1 1 2 2 ASP HA H 1 4.436 . . 1 . . . A 2 ASP HA . c17395_2l87 1 3 . 1 1 3 3 TYR H H 1 8.226 . . 1 . . . A 3 TYR H . c17395_2l87 1 4 . 1 1 3 3 TYR HA H 1 4.546 . . 1 . . . A 3 TYR HA . c17395_2l87 1 5 . 1 1 3 3 TYR HB2 H 1 2.938 . . 2 . . . A 3 TYR HB2 . c17395_2l87 1 6 . 1 1 3 3 TYR HB3 H 1 3.052 . . 2 . . . A 3 TYR HB3 . c17395_2l87 1 7 . 1 1 3 3 TYR HD1 H 1 7.120 . . 2 . . . A 3 TYR HD1 . c17395_2l87 1 8 . 1 1 3 3 TYR HD2 H 1 7.120 . . 2 . . . A 3 TYR HD2 . c17395_2l87 1 9 . 1 1 3 3 TYR HE1 H 1 6.831 . . 2 . . . A 3 TYR HE1 . c17395_2l87 1 10 . 1 1 3 3 TYR HE2 H 1 6.831 . . 2 . . . A 3 TYR HE2 . c17395_2l87 1 11 . 1 1 4 4 GLN H H 1 8.316 . . 1 . . . A 4 GLN H . c17395_2l87 1 12 . 1 1 4 4 GLN HA H 1 4.350 . . 1 . . . A 4 GLN HA . c17395_2l87 1 13 . 1 1 4 4 GLN HG2 H 1 2.283 . . 2 . . . A 4 GLN HG2 . c17395_2l87 1 14 . 1 1 4 4 GLN HG3 H 1 2.283 . . 2 . . . A 4 GLN HG3 . c17395_2l87 1 15 . 1 1 4 4 GLN HE21 H 1 7.536 . . 2 . . . A 4 GLN HE21 . c17395_2l87 1 16 . 1 1 4 4 GLN HE22 H 1 7.536 . . 2 . . . A 4 GLN HE22 . c17395_2l87 1 17 . 1 1 5 5 VAL H H 1 8.122 . . 1 . . . A 5 VAL H . c17395_2l87 1 18 . 1 1 5 5 VAL HA H 1 4.117 . . 1 . . . A 5 VAL HA . c17395_2l87 1 19 . 1 1 5 5 VAL HB H 1 2.093 . . 1 . . . A 5 VAL HB . c17395_2l87 1 20 . 1 1 5 5 VAL HG11 H 1 0.952 . . 4 . . . A 5 VAL HG11 . c17395_2l87 1 21 . 1 1 5 5 VAL HG12 H 1 0.952 . . 4 . . . A 5 VAL HG12 . c17395_2l87 1 22 . 1 1 5 5 VAL HG13 H 1 0.952 . . 4 . . . A 5 VAL HG13 . c17395_2l87 1 23 . 1 1 5 5 VAL HG21 H 1 0.952 . . 4 . . . A 5 VAL HG21 . c17395_2l87 1 24 . 1 1 5 5 VAL HG22 H 1 0.952 . . 4 . . . A 5 VAL HG22 . c17395_2l87 1 25 . 1 1 5 5 VAL HG23 H 1 0.952 . . 4 . . . A 5 VAL HG23 . c17395_2l87 1 26 . 1 1 6 6 SER H H 1 8.359 . . 1 . . . A 6 SER H . c17395_2l87 1 27 . 1 1 6 6 SER HA H 1 4.505 . . 1 . . . A 6 SER HA . c17395_2l87 1 28 . 1 1 6 6 SER HB2 H 1 3.865 . . 2 . . . A 6 SER HB2 . c17395_2l87 1 29 . 1 1 6 6 SER HB3 H 1 3.865 . . 2 . . . A 6 SER HB3 . c17395_2l87 1 30 . 1 1 7 7 SER H H 1 8.265 . . 1 . . . A 7 SER H . c17395_2l87 1 31 . 1 1 7 7 SER HB2 H 1 3.849 . . 2 . . . A 7 SER HB2 . c17395_2l87 1 32 . 1 1 7 7 SER HB3 H 1 3.849 . . 2 . . . A 7 SER HB3 . c17395_2l87 1 33 . 1 1 8 8 PRO HA H 1 4.396 . . 1 . . . A 8 PRO HA . c17395_2l87 1 34 . 1 1 8 8 PRO HB2 H 1 1.739 . . 2 . . . A 8 PRO HB2 . c17395_2l87 1 35 . 1 1 8 8 PRO HB3 H 1 2.175 . . 2 . . . A 8 PRO HB3 . c17395_2l87 1 36 . 1 1 8 8 PRO HG2 H 1 1.986 . . 2 . . . A 8 PRO HG2 . c17395_2l87 1 37 . 1 1 8 8 PRO HG3 H 1 1.986 . . 2 . . . A 8 PRO HG3 . c17395_2l87 1 38 . 1 1 8 8 PRO HD2 H 1 3.715 . . 2 . . . A 8 PRO HD2 . c17395_2l87 1 39 . 1 1 8 8 PRO HD3 H 1 3.785 . . 2 . . . A 8 PRO HD3 . c17395_2l87 1 40 . 1 1 9 9 ILE H H 1 7.972 . . 1 . . . A 9 ILE H . c17395_2l87 1 41 . 1 1 9 9 ILE HA H 1 4.030 . . 1 . . . A 9 ILE HA . c17395_2l87 1 42 . 1 1 9 9 ILE HB H 1 1.699 . . 1 . . . A 9 ILE HB . c17395_2l87 1 43 . 1 1 9 9 ILE HG12 H 1 1.072 . . 9 . . . A 9 ILE HG12 . c17395_2l87 1 44 . 1 1 9 9 ILE HG13 H 1 1.331 . . 9 . . . A 9 ILE HG13 . c17395_2l87 1 45 . 1 1 9 9 ILE HG21 H 1 0.789 . . 4 . . . A 9 ILE HG21 . c17395_2l87 1 46 . 1 1 9 9 ILE HG22 H 1 0.789 . . 4 . . . A 9 ILE HG22 . c17395_2l87 1 47 . 1 1 9 9 ILE HG23 H 1 0.789 . . 4 . . . A 9 ILE HG23 . c17395_2l87 1 48 . 1 1 9 9 ILE HD11 H 1 0.735 . . 1 . . . A 9 ILE HD11 . c17395_2l87 1 49 . 1 1 9 9 ILE HD12 H 1 0.735 . . 1 . . . A 9 ILE HD12 . c17395_2l87 1 50 . 1 1 9 9 ILE HD13 H 1 0.735 . . 1 . . . A 9 ILE HD13 . c17395_2l87 1 51 . 1 1 10 10 TYS H H 1 8.074 . . 1 . . . A 10 TYS H . c17395_2l87 1 52 . 1 1 10 10 TYS HA H 1 4.687 . . 1 . . . A 10 TYS HA . c17395_2l87 1 53 . 1 1 10 10 TYS HB2 H 1 2.944 . . 2 . . . A 10 TYS HB2 . c17395_2l87 1 54 . 1 1 10 10 TYS HB3 H 1 3.169 . . 2 . . . A 10 TYS HB3 . c17395_2l87 1 55 . 1 1 10 10 TYS HD1 H 1 7.222 . . 2 . . . A 10 TYS HD1 . c17395_2l87 1 56 . 1 1 10 10 TYS HD2 H 1 7.222 . . 2 . . . A 10 TYS HD2 . c17395_2l87 1 57 . 1 1 10 10 TYS HE1 H 1 7.196 . . 2 . . . A 10 TYS HE1 . c17395_2l87 1 58 . 1 1 10 10 TYS HE2 H 1 7.196 . . 2 . . . A 10 TYS HE2 . c17395_2l87 1 59 . 1 1 11 11 ASP H H 1 8.224 . . 1 . . . A 11 ASP H . c17395_2l87 1 60 . 1 1 11 11 ASP HA H 1 4.668 . . 1 . . . A 11 ASP HA . c17395_2l87 1 61 . 1 1 11 11 ASP HB2 H 1 2.613 . . 2 . . . A 11 ASP HB2 . c17395_2l87 1 62 . 1 1 11 11 ASP HB3 H 1 2.746 . . 2 . . . A 11 ASP HB3 . c17395_2l87 1 63 . 1 1 12 12 ILE H H 1 8.109 . . 1 . . . A 12 ILE H . c17395_2l87 1 64 . 1 1 12 12 ILE HA H 1 4.096 . . 1 . . . A 12 ILE HA . c17395_2l87 1 65 . 1 1 12 12 ILE HB H 1 1.863 . . 1 . . . A 12 ILE HB . c17395_2l87 1 66 . 1 1 12 12 ILE HG12 H 1 1.203 . . 9 . . . A 12 ILE HG12 . c17395_2l87 1 67 . 1 1 12 12 ILE HG13 H 1 1.441 . . 9 . . . A 12 ILE HG13 . c17395_2l87 1 68 . 1 1 12 12 ILE HG21 H 1 0.896 . . 4 . . . A 12 ILE HG21 . c17395_2l87 1 69 . 1 1 12 12 ILE HG22 H 1 0.896 . . 4 . . . A 12 ILE HG22 . c17395_2l87 1 70 . 1 1 12 12 ILE HG23 H 1 0.896 . . 4 . . . A 12 ILE HG23 . c17395_2l87 1 71 . 1 1 12 12 ILE HD11 H 1 0.842 . . 1 . . . A 12 ILE HD11 . c17395_2l87 1 72 . 1 1 12 12 ILE HD12 H 1 0.842 . . 1 . . . A 12 ILE HD12 . c17395_2l87 1 73 . 1 1 12 12 ILE HD13 H 1 0.842 . . 1 . . . A 12 ILE HD13 . c17395_2l87 1 74 . 1 1 13 13 ASN H H 1 8.407 . . 1 . . . A 13 ASN H . c17395_2l87 1 75 . 1 1 13 13 ASN HA H 1 4.652 . . 1 . . . A 13 ASN HA . c17395_2l87 1 76 . 1 1 13 13 ASN HB2 H 1 2.666 . . 2 . . . A 13 ASN HB2 . c17395_2l87 1 77 . 1 1 13 13 ASN HB3 H 1 2.666 . . 2 . . . A 13 ASN HB3 . c17395_2l87 1 78 . 1 1 13 13 ASN HD21 H 1 7.643 . . 2 . . . A 13 ASN HD21 . c17395_2l87 1 79 . 1 1 13 13 ASN HD22 H 1 6.894 . . 2 . . . A 13 ASN HD22 . c17395_2l87 1 80 . 1 1 14 14 TYS H H 1 8.046 . . 1 . . . A 14 TYS H . c17395_2l87 1 81 . 1 1 14 14 TYS HA H 1 4.463 . . 1 . . . A 14 TYS HA . c17395_2l87 1 82 . 1 1 14 14 TYS HB2 H 1 2.976 . . 2 . . . A 14 TYS HB2 . c17395_2l87 1 83 . 1 1 14 14 TYS HB3 H 1 3.005 . . 2 . . . A 14 TYS HB3 . c17395_2l87 1 84 . 1 1 14 14 TYS HD1 H 1 7.065 . . 2 . . . A 14 TYS HD1 . c17395_2l87 1 85 . 1 1 14 14 TYS HD2 H 1 7.065 . . 2 . . . A 14 TYS HD2 . c17395_2l87 1 86 . 1 1 14 14 TYS HE1 H 1 7.174 . . 2 . . . A 14 TYS HE1 . c17395_2l87 1 87 . 1 1 14 14 TYS HE2 H 1 7.174 . . 2 . . . A 14 TYS HE2 . c17395_2l87 1 88 . 1 1 15 15 TYR H H 1 8.020 . . 1 . . . A 15 TYR H . c17395_2l87 1 89 . 1 1 15 15 TYR HA H 1 4.558 . . 1 . . . A 15 TYR HA . c17395_2l87 1 90 . 1 1 15 15 TYR HB2 H 1 2.937 . . 2 . . . A 15 TYR HB2 . c17395_2l87 1 91 . 1 1 15 15 TYR HB3 H 1 3.089 . . 2 . . . A 15 TYR HB3 . c17395_2l87 1 92 . 1 1 15 15 TYR HD1 H 1 7.137 . . 2 . . . A 15 TYR HD1 . c17395_2l87 1 93 . 1 1 15 15 TYR HD2 H 1 7.137 . . 2 . . . A 15 TYR HD2 . c17395_2l87 1 94 . 1 1 15 15 TYR HE1 H 1 6.840 . . 2 . . . A 15 TYR HE1 . c17395_2l87 1 95 . 1 1 15 15 TYR HE2 H 1 6.840 . . 2 . . . A 15 TYR HE2 . c17395_2l87 1 96 . 1 1 16 16 THR H H 1 7.914 . . 1 . . . A 16 THR H . c17395_2l87 1 97 . 1 1 16 16 THR HA H 1 4.349 . . 1 . . . A 16 THR HA . c17395_2l87 1 98 . 1 1 16 16 THR HB H 1 4.227 . . 1 . . . A 16 THR HB . c17395_2l87 1 99 . 1 1 16 16 THR HG21 H 1 1.184 . . 1 . . . A 16 THR HG21 . c17395_2l87 1 100 . 1 1 16 16 THR HG22 H 1 1.184 . . 1 . . . A 16 THR HG22 . c17395_2l87 1 101 . 1 1 16 16 THR HG23 H 1 1.184 . . 1 . . . A 16 THR HG23 . c17395_2l87 1 102 . 1 1 17 17 SER H H 1 8.169 . . 1 . . . A 17 SER H . c17395_2l87 1 103 . 1 1 17 17 SER HA H 1 4.449 . . 1 . . . A 17 SER HA . c17395_2l87 1 104 . 1 1 17 17 SER HB2 H 1 3.876 . . 2 . . . A 17 SER HB2 . c17395_2l87 1 105 . 1 1 17 17 SER HB3 H 1 3.876 . . 2 . . . A 17 SER HB3 . c17395_2l87 1 106 . 1 1 18 18 GLU H H 1 8.317 . . 1 . . . A 18 GLU H . c17395_2l87 1 107 . 1 1 18 18 GLU HA H 1 4.586 . . 1 . . . A 18 GLU HA . c17395_2l87 1 108 . 1 1 19 19 PRO HA H 1 4.591 . . 1 . . . A 19 PRO HA . c17395_2l87 1 109 . 1 1 19 19 PRO HB2 H 1 1.903 . . 2 . . . A 19 PRO HB2 . c17395_2l87 1 110 . 1 1 19 19 PRO HB3 H 1 2.271 . . 2 . . . A 19 PRO HB3 . c17395_2l87 1 111 . 1 1 19 19 PRO HG2 H 1 2.026 . . 2 . . . A 19 PRO HG2 . c17395_2l87 1 112 . 1 1 19 19 PRO HG3 H 1 2.026 . . 2 . . . A 19 PRO HG3 . c17395_2l87 1 113 . 1 1 19 19 PRO HD2 H 1 3.681 . . 2 . . . A 19 PRO HD2 . c17395_2l87 1 114 . 1 1 19 19 PRO HD3 H 1 3.787 . . 2 . . . A 19 PRO HD3 . c17395_2l87 1 115 . 1 1 20 20 ALA H H 1 8.344 . . 1 . . . A 20 ALA H . c17395_2l87 1 116 . 1 1 20 20 ALA HA H 1 4.260 . . 1 . . . A 20 ALA HA . c17395_2l87 1 117 . 1 1 20 20 ALA HB1 H 1 1.385 . . 1 . . . A 20 ALA HB1 . c17395_2l87 1 118 . 1 1 20 20 ALA HB2 H 1 1.385 . . 1 . . . A 20 ALA HB2 . c17395_2l87 1 119 . 1 1 20 20 ALA HB3 H 1 1.385 . . 1 . . . A 20 ALA HB3 . c17395_2l87 1 120 . 1 1 21 21 GLN H H 1 8.229 . . 1 . . . A 21 GLN H . c17395_2l87 1 121 . 1 1 21 21 GLN HA H 1 4.314 . . 1 . . . A 21 GLN HA . c17395_2l87 1 122 . 1 1 21 21 GLN HB2 H 1 1.985 . . 2 . . . A 21 GLN HB2 . c17395_2l87 1 123 . 1 1 21 21 GLN HG2 H 1 2.366 . . 2 . . . A 21 GLN HG2 . c17395_2l87 1 124 . 1 1 21 21 GLN HE21 H 1 7.551 . . 2 . . . A 21 GLN HE21 . c17395_2l87 1 125 . 1 1 21 21 GLN HE22 H 1 7.551 . . 2 . . . A 21 GLN HE22 . c17395_2l87 1 126 . 1 1 22 22 LYS H H 1 8.296 . . 1 . . . A 22 LYS H . c17395_2l87 1 127 . 1 1 22 22 LYS HA H 1 4.314 . . 1 . . . A 22 LYS HA . c17395_2l87 1 128 . 1 1 22 22 LYS HB2 H 1 1.753 . . 2 . . . A 22 LYS HB2 . c17395_2l87 1 129 . 1 1 22 22 LYS HB3 H 1 1.808 . . 2 . . . A 22 LYS HB3 . c17395_2l87 1 130 . 1 1 22 22 LYS HG2 H 1 1.385 . . 2 . . . A 22 LYS HG2 . c17395_2l87 1 131 . 1 1 22 22 LYS HG3 H 1 1.385 . . 2 . . . A 22 LYS HG3 . c17395_2l87 1 132 . 1 1 23 23 ILE H H 1 8.108 . . 1 . . . A 23 ILE H . c17395_2l87 1 133 . 1 1 23 23 ILE HA H 1 4.175 . . 1 . . . A 23 ILE HA . c17395_2l87 1 134 . 1 1 23 23 ILE HB H 1 1.864 . . 1 . . . A 23 ILE HB . c17395_2l87 1 135 . 1 1 23 23 ILE HG12 H 1 1.198 . . 9 . . . A 23 ILE HG12 . c17395_2l87 1 136 . 1 1 23 23 ILE HG13 H 1 1.442 . . 9 . . . A 23 ILE HG13 . c17395_2l87 1 137 . 1 1 23 23 ILE HG21 H 1 0.896 . . 4 . . . A 23 ILE HG21 . c17395_2l87 1 138 . 1 1 23 23 ILE HG22 H 1 0.896 . . 4 . . . A 23 ILE HG22 . c17395_2l87 1 139 . 1 1 23 23 ILE HG23 H 1 0.896 . . 4 . . . A 23 ILE HG23 . c17395_2l87 1 140 . 1 1 23 23 ILE HD11 H 1 0.844 . . 1 . . . A 23 ILE HD11 . c17395_2l87 1 141 . 1 1 23 23 ILE HD12 H 1 0.844 . . 1 . . . A 23 ILE HD11 . c17395_2l87 1 142 . 1 1 23 23 ILE HD13 H 1 0.844 . . 1 . . . A 23 ILE HD11 . c17395_2l87 1 143 . 1 1 24 24 ASN H H 1 8.530 . . 1 . . . A 24 ASN H . c17395_2l87 1 144 . 1 1 24 24 ASN HA H 1 4.697 . . 1 . . . A 24 ASN HA . c17395_2l87 1 145 . 1 1 24 24 ASN HB2 H 1 2.734 . . 2 . . . A 24 ASN HB2 . c17395_2l87 1 146 . 1 1 24 24 ASN HB3 H 1 2.829 . . 2 . . . A 24 ASN HB3 . c17395_2l87 1 147 . 1 1 24 24 ASN HD21 H 1 7.575 . . 2 . . . A 24 ASN HD21 . c17395_2l87 1 148 . 1 1 24 24 ASN HD22 H 1 6.897 . . 2 . . . A 24 ASN HD22 . c17395_2l87 1 149 . 1 1 25 25 VAL H H 1 8.046 . . 1 . . . A 25 VAL H . c17395_2l87 1 150 . 1 1 25 25 VAL HA H 1 4.124 . . 1 . . . A 25 VAL HA . c17395_2l87 1 151 . 1 1 25 25 VAL HB H 1 2.095 . . 1 . . . A 25 VAL HB . c17395_2l87 1 152 . 1 1 25 25 VAL HG11 H 1 0.924 . . 4 . . . A 25 VAL HG11 . c17395_2l87 1 153 . 1 1 25 25 VAL HG12 H 1 0.924 . . 4 . . . A 25 VAL HG12 . c17395_2l87 1 154 . 1 1 25 25 VAL HG13 H 1 0.924 . . 4 . . . A 25 VAL HG13 . c17395_2l87 1 155 . 1 1 25 25 VAL HG21 H 1 0.924 . . 4 . . . A 25 VAL HG21 . c17395_2l87 1 156 . 1 1 25 25 VAL HG22 H 1 0.924 . . 4 . . . A 25 VAL HG22 . c17395_2l87 1 157 . 1 1 25 25 VAL HG23 H 1 0.924 . . 4 . . . A 25 VAL HG23 . c17395_2l87 1 158 . 1 1 26 26 LYS H H 1 8.352 . . 1 . . . A 26 LYS H . c17395_2l87 1 159 . 1 1 26 26 LYS HA H 1 4.351 . . 1 . . . A 26 LYS HA . c17395_2l87 1 160 . 1 1 26 26 LYS HB2 H 1 1.767 . . 2 . . . A 26 LYS HB2 . c17395_2l87 1 161 . 1 1 26 26 LYS HB3 H 1 1.862 . . 2 . . . A 26 LYS HB3 . c17395_2l87 1 162 . 1 1 26 26 LYS HG2 H 1 1.467 . . 2 . . . A 26 LYS HG2 . c17395_2l87 1 163 . 1 1 26 26 LYS HG3 H 1 1.467 . . 2 . . . A 26 LYS HG3 . c17395_2l87 1 164 . 1 1 27 27 GLN H H 1 8.027 . . 1 . . . A 27 GLN H . c17395_2l87 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 c17395_2l87 _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 c17395_2l87 _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 . . . c17395_2l87 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 . . . . c17395_2l87 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 7 SER C C -10.686 -0.849 5.513 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 1 . 2 . 1 1 7 SER CA C -11.905 -0.009 5.892 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 1 . 3 . 1 1 7 SER CB C -12.992 -0.888 6.487 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 1 . 4 . 1 1 7 SER H H -13.212 0.285 4.274 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 1 . 5 . 1 1 7 SER HA H -11.599 0.718 6.626 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 1 . 6 . 1 1 7 SER HB2 H -13.911 -0.708 5.941 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 1 . 7 . 1 1 7 SER HB3 H -12.711 -1.926 6.388 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 1 . 8 . 1 1 7 SER HG H -14.145 -0.511 8.025 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 1 . 9 . 1 1 7 SER N N -12.475 0.699 4.763 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 1 . 10 . 1 1 7 SER O O -9.712 -0.884 6.258 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 1 . 11 . 1 1 7 SER OG O -13.203 -0.593 7.857 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 1 . 12 . 1 1 8 PRO C C -8.467 -1.516 3.309 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 1 . 13 . 1 1 8 PRO CA C -9.580 -2.353 3.894 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 1 . 14 . 1 1 8 PRO CB C -10.190 -3.249 2.810 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 1 . 15 . 1 1 8 PRO CD C -11.772 -1.535 3.365 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 1 . 16 . 1 1 8 PRO CG C -11.645 -2.914 2.782 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 1 . 17 . 1 1 8 PRO HA H -9.188 -2.957 4.690 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 1 . 18 . 1 1 8 PRO HB2 H -9.719 -3.036 1.858 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 1 . 19 . 1 1 8 PRO HB3 H -10.031 -4.284 3.074 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 1 . 20 . 1 1 8 PRO HD2 H -11.599 -0.775 2.609 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 1 . 21 . 1 1 8 PRO HD3 H -12.734 -1.407 3.834 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 1 . 22 . 1 1 8 PRO HG2 H -12.004 -2.926 1.766 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 1 . 23 . 1 1 8 PRO HG3 H -12.189 -3.624 3.384 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 1 . 24 . 1 1 8 PRO N N -10.700 -1.526 4.347 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 1 . 25 . 1 1 8 PRO O O -7.715 -1.966 2.444 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 1 . 26 . 1 1 9 ILE C C -6.027 0.286 3.961 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 1 . 27 . 1 1 9 ILE CA C -7.361 0.617 3.335 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 1 . 28 . 1 1 9 ILE CB C -7.758 2.069 3.636 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 1 . 29 . 1 1 9 ILE CD1 C -6.238 2.708 5.587 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 1 . 30 . 1 1 9 ILE CG1 C -7.644 2.377 5.134 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 1 . 31 . 1 1 9 ILE CG2 C -9.178 2.317 3.158 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 1 . 32 . 1 1 9 ILE H H -8.999 -0.011 4.477 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 1 . 33 . 1 1 9 ILE HA H -7.275 0.499 2.277 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 1 . 34 . 1 1 9 ILE HB H -7.104 2.712 3.083 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 1 . 35 . 1 1 9 ILE HD11 H -5.946 2.030 6.376 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 1 . 36 . 1 1 9 ILE HD12 H -6.209 3.724 5.955 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 1 . 37 . 1 1 9 ILE HD13 H -5.558 2.607 4.755 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 1 . 38 . 1 1 9 ILE HG12 H -8.273 3.225 5.369 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 1 . 39 . 1 1 9 ILE HG13 H -7.979 1.514 5.697 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 1 . 40 . 1 1 9 ILE HG21 H -9.809 1.498 3.476 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 1 . 41 . 1 1 9 ILE HG22 H -9.188 2.384 2.080 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 1 . 42 . 1 1 9 ILE HG23 H -9.544 3.240 3.582 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 1 . 43 . 1 1 9 ILE N N -8.373 -0.299 3.791 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 1 . 44 . 1 1 9 ILE O O -4.973 0.610 3.423 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 1 . 45 . 1 1 10 TYS C C -4.149 -1.874 4.993 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 1 . 46 . 1 1 10 TYS CA C -4.866 -0.785 5.782 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 1 . 47 . 1 1 10 TYS CB C -5.122 -1.258 7.217 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 1 . 48 . 1 1 10 TYS CD1 C -7.169 -2.626 6.688 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 1 . 49 . 1 1 10 TYS CD2 C -7.155 -1.257 8.625 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 1 . 50 . 1 1 10 TYS CE1 C -8.445 -3.053 6.996 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 1 . 51 . 1 1 10 TYS CE2 C -8.421 -1.666 8.941 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 1 . 52 . 1 1 10 TYS CG C -6.513 -1.723 7.503 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 1 . 53 . 1 1 10 TYS CZ C -9.072 -2.569 8.128 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 1 . 54 . 1 1 10 TYS H H -6.965 -0.617 5.455 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 1 . 55 . 1 1 10 TYS HA H -4.229 0.075 5.818 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 1 . 56 . 1 1 10 TYS HB2 H -4.923 -0.442 7.896 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 1 . 57 . 1 1 10 TYS HB3 H -4.455 -2.073 7.444 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 1 . 58 . 1 1 10 TYS HD1 H -6.676 -2.990 5.799 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 1 . 59 . 1 1 10 TYS HD2 H -6.645 -0.547 9.257 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 1 . 60 . 1 1 10 TYS HE1 H -8.947 -3.752 6.353 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 1 . 61 . 1 1 10 TYS HE2 H -8.893 -1.276 9.819 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 1 . 62 . 1 1 10 TYS N N -6.086 -0.382 5.094 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 1 . 63 . 1 1 10 TYS O O -2.938 -2.054 5.120 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 1 . 64 . 1 1 10 TYS O1 O -9.064 -5.386 8.373 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 1 . 65 . 1 1 10 TYS O2 O -10.746 -4.926 10.146 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 1 . 66 . 1 1 10 TYS O3 O -11.424 -5.008 7.820 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 1 . 67 . 1 1 10 TYS OH O -10.249 -3.141 8.550 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 1 . 68 . 1 1 10 TYS S S -10.289 -4.655 8.754 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 1 . 69 . 1 1 11 ASP C C -3.823 -3.110 2.017 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 1 . 70 . 1 1 11 ASP CA C -4.345 -3.653 3.347 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 1 . 71 . 1 1 11 ASP CB C -5.396 -4.735 3.088 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 1 . 72 . 1 1 11 ASP CG C -5.489 -5.735 4.225 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 1 . 73 . 1 1 11 ASP H H -5.862 -2.397 4.104 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 1 . 74 . 1 1 11 ASP HA H -3.523 -4.090 3.891 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 1 . 75 . 1 1 11 ASP HB2 H -6.364 -4.266 2.967 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 1 . 76 . 1 1 11 ASP HB3 H -5.138 -5.269 2.182 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 1 . 77 . 1 1 11 ASP N N -4.906 -2.592 4.167 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 1 . 78 . 1 1 11 ASP O O -3.387 -3.877 1.158 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 1 . 79 . 1 1 11 ASP OD1 O -4.438 -6.276 4.625 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 1 . 80 . 1 1 11 ASP OD2 O -6.612 -5.976 4.712 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 1 . 81 . 1 1 12 ILE C C -1.893 -0.903 0.640 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 1 . 82 . 1 1 12 ILE CA C -3.397 -1.175 0.602 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 1 . 83 . 1 1 12 ILE CB C -4.153 0.131 0.274 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 1 . 84 . 1 1 12 ILE CD1 C -2.561 2.097 0.557 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 1 . 85 . 1 1 12 ILE CG1 C -3.680 1.280 1.165 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 1 . 86 . 1 1 12 ILE CG2 C -5.653 -0.072 0.420 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 1 . 87 . 1 1 12 ILE H H -4.229 -1.216 2.555 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 1 . 88 . 1 1 12 ILE HA H -3.592 -1.873 -0.194 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 1 . 89 . 1 1 12 ILE HB H -3.952 0.383 -0.757 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 1 . 90 . 1 1 12 ILE HD11 H -2.558 1.964 -0.514 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 1 . 91 . 1 1 12 ILE HD12 H -1.615 1.769 0.963 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 1 . 92 . 1 1 12 ILE HD13 H -2.709 3.142 0.790 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 1 . 93 . 1 1 12 ILE HG12 H -4.509 1.941 1.347 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 1 . 94 . 1 1 12 ILE HG13 H -3.331 0.882 2.104 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 1 . 95 . 1 1 12 ILE HG21 H -5.847 -0.785 1.207 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 1 . 96 . 1 1 12 ILE HG22 H -6.058 -0.444 -0.510 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 1 . 97 . 1 1 12 ILE HG23 H -6.122 0.869 0.664 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 1 . 98 . 1 1 12 ILE N N -3.869 -1.787 1.842 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 1 . 99 . 1 1 12 ILE O O -1.349 -0.257 -0.257 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 1 . 100 . 1 1 13 ASN C C 0.985 -2.311 1.087 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 1 . 101 . 1 1 13 ASN CA C 0.217 -1.225 1.813 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 1 . 102 . 1 1 13 ASN CB C 0.613 -1.206 3.286 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 1 . 103 . 1 1 13 ASN CG C -0.032 -0.064 4.046 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 1 . 104 . 1 1 13 ASN H H -1.704 -1.919 2.354 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 1 . 105 . 1 1 13 ASN HA H 0.484 -0.283 1.369 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 1 . 106 . 1 1 13 ASN HB2 H 0.311 -2.135 3.743 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 1 . 107 . 1 1 13 ASN HB3 H 1.685 -1.104 3.358 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 1 . 108 . 1 1 13 ASN HD21 H 1.005 -0.532 5.677 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 1 . 109 . 1 1 13 ASN HD22 H -0.058 0.821 5.827 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 1 . 110 . 1 1 13 ASN N N -1.223 -1.406 1.673 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 1 . 111 . 1 1 13 ASN ND2 N 0.343 0.091 5.311 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 1 . 112 . 1 1 13 ASN O O 2.192 -2.442 1.264 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 1 . 113 . 1 1 13 ASN OD1 O -0.857 0.671 3.504 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 1 . 114 . 1 1 14 TYS C C 2.053 -3.568 -1.389 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 1 . 115 . 1 1 14 TYS CA C 0.960 -4.135 -0.491 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 1 . 116 . 1 1 14 TYS CB C -0.039 -4.967 -1.307 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 1 . 117 . 1 1 14 TYS CD1 C -2.208 -4.777 -2.539 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 1 . 118 . 1 1 14 TYS CD2 C -0.927 -2.800 -2.241 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 1 . 119 . 1 1 14 TYS CE1 C -3.169 -4.063 -3.212 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 1 . 120 . 1 1 14 TYS CE2 C -1.884 -2.071 -2.915 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 1 . 121 . 1 1 14 TYS CG C -1.074 -4.161 -2.044 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 1 . 122 . 1 1 14 TYS CZ C -3.007 -2.706 -3.403 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 1 . 123 . 1 1 14 TYS H H -0.663 -2.936 0.136 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 1 . 124 . 1 1 14 TYS HA H 1.431 -4.768 0.233 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 1 . 125 . 1 1 14 TYS HB2 H -0.567 -5.634 -0.646 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 1 . 126 . 1 1 14 TYS HB3 H 0.501 -5.549 -2.036 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 1 . 127 . 1 1 14 TYS HD1 H -2.333 -5.839 -2.390 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 1 . 128 . 1 1 14 TYS HD2 H -0.049 -2.312 -1.853 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 1 . 129 . 1 1 14 TYS HE1 H -4.041 -4.568 -3.585 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 1 . 130 . 1 1 14 TYS HE2 H -1.750 -1.011 -3.059 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 1 . 131 . 1 1 14 TYS N N 0.295 -3.082 0.254 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 1 . 132 . 1 1 14 TYS O O 2.889 -4.312 -1.902 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 1 . 133 . 1 1 14 TYS O1 O -3.695 0.177 -3.010 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 1 . 134 . 1 1 14 TYS O2 O -5.778 -1.182 -3.026 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 1 . 135 . 1 1 14 TYS O3 O -4.971 -0.173 -5.077 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 1 . 136 . 1 1 14 TYS OH O -3.848 -2.035 -4.260 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 1 . 137 . 1 1 14 TYS S S -4.546 -0.772 -3.756 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 1 . 138 . 1 1 15 TYR C C 4.456 -1.909 -1.693 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 1 . 139 . 1 1 15 TYR CA C 3.111 -1.599 -2.334 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 1 . 140 . 1 1 15 TYR CB C 2.868 -0.085 -2.393 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 1 . 141 . 1 1 15 TYR CD1 C 3.039 0.380 0.084 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 1 . 142 . 1 1 15 TYR CD2 C 4.354 1.703 -1.400 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 1 . 143 . 1 1 15 TYR CE1 C 3.550 1.076 1.163 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 1 . 144 . 1 1 15 TYR CE2 C 4.871 2.402 -0.327 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 1 . 145 . 1 1 15 TYR CG C 3.431 0.682 -1.214 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 1 . 146 . 1 1 15 TYR CZ C 4.466 2.084 0.953 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 1 . 147 . 1 1 15 TYR H H 1.415 -1.693 -1.083 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 1 . 148 . 1 1 15 TYR HA H 3.085 -2.013 -3.331 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 1 . 149 . 1 1 15 TYR HB2 H 3.323 0.310 -3.290 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 1 . 150 . 1 1 15 TYR HB3 H 1.801 0.095 -2.424 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 1 . 151 . 1 1 15 TYR HD1 H 2.322 -0.412 0.246 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 1 . 152 . 1 1 15 TYR HD2 H 4.669 1.948 -2.404 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 1 . 153 . 1 1 15 TYR HE1 H 3.233 0.827 2.165 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 1 . 154 . 1 1 15 TYR HE2 H 5.588 3.193 -0.491 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 1 . 155 . 1 1 15 TYR HH H 5.154 2.168 2.745 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 1 . 156 . 1 1 15 TYR N N 2.079 -2.244 -1.541 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 1 . 157 . 1 1 15 TYR O O 5.489 -1.973 -2.358 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 1 . 158 . 1 1 15 TYR OH O 4.978 2.777 2.025 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 1 . 159 . 1 1 16 THR C C 5.770 -3.966 0.412 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 1 . 160 . 1 1 16 THR CA C 5.563 -2.461 0.413 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 1 . 161 . 1 1 16 THR CB C 5.359 -1.952 1.842 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 1 . 162 . 1 1 16 THR CG2 C 4.474 -2.847 2.687 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 1 . 163 . 1 1 16 THR H H 3.533 -2.066 0.066 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 1 . 164 . 1 1 16 THR HA H 6.424 -1.985 -0.022 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 1 . 165 . 1 1 16 THR HB H 4.882 -0.985 1.791 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 1 . 166 . 1 1 16 THR HG1 H 7.087 -2.634 2.462 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 1 . 167 . 1 1 16 THR HG21 H 3.877 -2.239 3.350 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 1 . 168 . 1 1 16 THR HG22 H 5.088 -3.518 3.268 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 1 . 169 . 1 1 16 THR HG23 H 3.822 -3.420 2.044 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 1 . 170 . 1 1 16 THR N N 4.400 -2.122 -0.383 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 1 . 171 . 1 1 16 THR O O 6.898 -4.456 0.471 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 1 . 172 . 1 1 16 THR OG1 O 6.598 -1.808 2.512 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 1 . 173 . 1 1 17 SER C C 5.277 -6.706 -0.938 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 1 . 174 . 1 1 17 SER CA C 4.703 -6.149 0.360 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 1 . 175 . 1 1 17 SER CB C 3.306 -6.712 0.591 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 1 . 176 . 1 1 17 SER H H 3.785 -4.230 0.323 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 1 . 177 . 1 1 17 SER HA H 5.341 -6.454 1.171 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 1 . 178 . 1 1 17 SER HB2 H 2.594 -6.112 0.048 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 1 . 179 . 1 1 17 SER HB3 H 3.267 -7.729 0.234 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 1 . 180 . 1 1 17 SER HG H 3.314 -7.480 2.392 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 1 . 181 . 1 1 17 SER N N 4.661 -4.693 0.357 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 1 . 182 . 1 1 17 SER O O 5.589 -7.894 -1.025 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 1 . 183 . 1 1 17 SER OG O 2.965 -6.695 1.966 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 1 . 184 . 1 1 18 GLU C C 7.490 -6.261 -3.190 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 1 . 185 . 1 1 18 GLU CA C 5.962 -6.277 -3.223 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 1 . 186 . 1 1 18 GLU CB C 5.441 -5.388 -4.356 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 1 . 187 . 1 1 18 GLU CD C 5.347 -6.011 -6.805 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 1 . 188 . 1 1 18 GLU CG C 4.700 -6.156 -5.440 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 1 . 189 . 1 1 18 GLU H H 5.159 -4.918 -1.812 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 1 . 190 . 1 1 18 GLU HA H 5.634 -7.292 -3.395 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 1 . 191 . 1 1 18 GLU HB2 H 4.766 -4.655 -3.940 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 1 . 192 . 1 1 18 GLU HB3 H 6.275 -4.877 -4.812 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 1 . 193 . 1 1 18 GLU HG2 H 4.686 -7.203 -5.176 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 1 . 194 . 1 1 18 GLU HG3 H 3.688 -5.786 -5.496 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 1 . 195 . 1 1 18 GLU N N 5.419 -5.851 -1.939 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 1 . 196 . 1 1 18 GLU O O 8.130 -7.287 -3.418 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 1 . 197 . 1 1 18 GLU OE1 O 5.220 -4.925 -7.408 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 1 . 198 . 1 1 18 GLU OE2 O 5.980 -6.983 -7.268 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 1 . 199 . 1 1 19 PRO C C 10.175 -5.632 -1.622 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 1 . 200 . 1 1 19 PRO CA C 9.556 -4.955 -2.846 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 1 . 201 . 1 1 19 PRO CB C 9.781 -3.437 -2.769 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 1 . 202 . 1 1 19 PRO CD C 7.436 -3.821 -2.632 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 1 . 203 . 1 1 19 PRO CG C 8.460 -2.824 -3.081 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 1 . 204 . 1 1 19 PRO HA H 10.013 -5.338 -3.738 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 1 . 205 . 1 1 19 PRO HB2 H 10.109 -3.170 -1.771 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 1 . 206 . 1 1 19 PRO HB3 H 10.531 -3.149 -3.492 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 1 . 207 . 1 1 19 PRO HD2 H 7.230 -3.707 -1.581 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 1 . 208 . 1 1 19 PRO HD3 H 6.539 -3.723 -3.213 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 1 . 209 . 1 1 19 PRO HG2 H 8.346 -1.897 -2.538 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 1 . 210 . 1 1 19 PRO HG3 H 8.376 -2.650 -4.144 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 1 . 211 . 1 1 19 PRO N N 8.100 -5.095 -2.905 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 1 . 212 . 1 1 19 PRO O O 11.054 -5.064 -0.974 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 1 . 213 . 1 1 20 ALA C C 11.763 -7.709 -0.259 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 1 . 214 . 1 1 20 ALA CA C 10.252 -7.575 -0.164 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 1 . 215 . 1 1 20 ALA CB C 9.598 -8.946 -0.063 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 1 . 216 . 1 1 20 ALA H H 9.028 -7.252 -1.857 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 1 . 217 . 1 1 20 ALA HA H 10.011 -7.020 0.720 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 1 . 218 . 1 1 20 ALA HB1 H 9.651 -9.441 -1.021 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 1 . 219 . 1 1 20 ALA HB2 H 8.564 -8.831 0.226 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 1 . 220 . 1 1 20 ALA HB3 H 10.115 -9.538 0.677 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 1 . 221 . 1 1 20 ALA N N 9.724 -6.843 -1.310 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 1 . 222 . 1 1 20 ALA O O 12.466 -7.751 0.752 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 1 . 223 . 1 1 21 GLN C C 14.328 -6.498 -1.797 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 1 . 224 . 1 1 21 GLN CA C 13.680 -7.877 -1.746 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 1 . 225 . 1 1 21 GLN CB C 13.923 -8.620 -3.061 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 1 . 226 . 1 1 21 GLN CD C 12.589 -10.247 -4.462 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 1 . 227 . 1 1 21 GLN CG C 13.249 -9.981 -3.123 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 1 . 228 . 1 1 21 GLN H H 11.630 -7.713 -2.239 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 1 . 229 . 1 1 21 GLN HA H 14.120 -8.440 -0.937 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 1 . 230 . 1 1 21 GLN HB2 H 13.547 -8.019 -3.876 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 1 . 231 . 1 1 21 GLN HE21 H 13.831 -11.761 -4.802 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 1 . 232 . 1 1 21 GLN HE22 H 12.673 -11.446 -6.045 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 1 . 233 . 1 1 21 GLN HG2 H 13.992 -10.745 -2.947 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 1 . 234 . 1 1 21 GLN N N 12.252 -7.762 -1.486 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 1 . 235 . 1 1 21 GLN NE2 N 13.082 -11.252 -5.175 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 1 . 236 . 1 1 21 GLN O O 15.469 -6.319 -1.372 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 1 . 237 . 1 1 21 GLN OE1 O 11.648 -9.555 -4.851 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 1 . 238 . 1 1 22 LYS C C 14.259 -3.530 -1.051 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 1 . 239 . 1 1 22 LYS CA C 14.084 -4.157 -2.430 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 1 . 240 . 1 1 22 LYS CB C 13.126 -3.310 -3.269 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 1 . 241 . 1 1 22 LYS CD C 12.205 -3.014 -5.589 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 1 . 242 . 1 1 22 LYS CE C 10.959 -3.482 -6.322 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 1 . 243 . 1 1 22 LYS CG C 12.633 -4.011 -4.524 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 1 . 244 . 1 1 22 LYS H H 12.686 -5.732 -2.642 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 1 . 245 . 1 1 22 LYS HA H 15.042 -4.191 -2.923 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 1 . 246 . 1 1 22 LYS HB2 H 12.270 -3.053 -2.664 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 1 . 247 . 1 1 22 LYS HB3 H 13.632 -2.402 -3.564 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 1 . 248 . 1 1 22 LYS HD2 H 11.998 -2.064 -5.117 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 1 . 249 . 1 1 22 LYS HD3 H 13.009 -2.896 -6.301 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 1 . 250 . 1 1 22 LYS HE2 H 11.257 -3.961 -7.243 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 1 . 251 . 1 1 22 LYS HE3 H 10.437 -4.194 -5.699 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 1 . 252 . 1 1 22 LYS HG2 H 13.429 -4.623 -4.919 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 1 . 253 . 1 1 22 LYS HG3 H 11.788 -4.634 -4.268 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 1 . 254 . 1 1 22 LYS HZ1 H 10.195 -1.569 -5.971 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 1 . 255 . 1 1 22 LYS HZ2 H 9.053 -2.665 -6.571 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 1 . 256 . 1 1 22 LYS HZ3 H 10.220 -2.008 -7.604 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 1 . 257 . 1 1 22 LYS N N 13.588 -5.524 -2.322 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 1 . 258 . 1 1 22 LYS NZ N 10.043 -2.352 -6.639 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 1 . 259 . 1 1 22 LYS O O 15.232 -2.819 -0.801 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 1 . 260 . 1 1 23 ILE C C 13.943 -4.277 2.168 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 1 . 261 . 1 1 23 ILE CA C 13.357 -3.260 1.192 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 1 . 262 . 1 1 23 ILE CB C 11.956 -2.842 1.683 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 1 . 263 . 1 1 23 ILE CD1 C 9.740 -2.195 0.609 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 1 . 264 . 1 1 23 ILE CG1 C 11.241 -2.007 0.617 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 1 . 265 . 1 1 23 ILE CG2 C 12.060 -2.063 2.988 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 1 . 266 . 1 1 23 ILE H H 12.558 -4.372 -0.422 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 1 . 267 . 1 1 23 ILE HA H 13.988 -2.383 1.180 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 1 . 268 . 1 1 23 ILE HB H 11.384 -3.737 1.873 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 1 . 269 . 1 1 23 ILE HD11 H 9.291 -1.487 -0.074 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 1 . 270 . 1 1 23 ILE HD12 H 9.351 -2.032 1.603 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 1 . 271 . 1 1 23 ILE HD13 H 9.505 -3.200 0.290 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 1 . 272 . 1 1 23 ILE HG12 H 11.442 -0.961 0.793 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 1 . 273 . 1 1 23 ILE HG13 H 11.615 -2.280 -0.358 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 1 . 274 . 1 1 23 ILE HG21 H 13.076 -2.104 3.353 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 1 . 275 . 1 1 23 ILE HG22 H 11.398 -2.500 3.721 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 1 . 276 . 1 1 23 ILE HG23 H 11.780 -1.034 2.818 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 1 . 277 . 1 1 23 ILE N N 13.310 -3.800 -0.161 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 1 . 278 . 1 1 23 ILE O O 13.608 -4.280 3.353 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 2 . 279 . 1 1 7 SER C C -8.798 0.723 5.993 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 2 . 280 . 1 1 7 SER CA C -9.343 1.861 6.837 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 2 . 281 . 1 1 7 SER CB C -10.637 1.453 7.522 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 2 . 282 . 1 1 7 SER H H -10.537 3.348 5.953 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 2 . 283 . 1 1 7 SER HA H -8.607 2.110 7.582 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 2 . 284 . 1 1 7 SER HB2 H -11.418 2.137 7.207 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 2 . 285 . 1 1 7 SER HB3 H -10.899 0.447 7.230 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 2 . 286 . 1 1 7 SER HG H -9.653 1.185 9.196 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 2 . 287 . 1 1 7 SER N N -9.611 3.042 6.040 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 2 . 288 . 1 1 7 SER O O -7.813 0.094 6.371 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 2 . 289 . 1 1 7 SER OG O -10.517 1.511 8.934 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 2 . 290 . 1 1 8 PRO C C -7.543 -0.395 3.415 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 2 . 291 . 1 1 8 PRO CA C -8.947 -0.644 3.956 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 2 . 292 . 1 1 8 PRO CB C -9.971 -0.661 2.817 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 2 . 293 . 1 1 8 PRO CD C -10.585 1.123 4.282 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 2 . 294 . 1 1 8 PRO CG C -11.143 0.106 3.330 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 2 . 295 . 1 1 8 PRO HA H -8.957 -1.588 4.470 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 2 . 296 . 1 1 8 PRO HB2 H -9.543 -0.189 1.942 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 2 . 297 . 1 1 8 PRO HB3 H -10.237 -1.683 2.589 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 2 . 298 . 1 1 8 PRO HD2 H -10.296 2.020 3.752 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 2 . 299 . 1 1 8 PRO HD3 H -11.300 1.351 5.058 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 2 . 300 . 1 1 8 PRO HG2 H -11.650 0.596 2.511 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 2 . 301 . 1 1 8 PRO HG3 H -11.820 -0.559 3.846 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 2 . 302 . 1 1 8 PRO N N -9.410 0.434 4.834 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 2 . 303 . 1 1 8 PRO O O -7.166 -0.911 2.363 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 2 . 304 . 1 1 9 ILE C C -4.480 -0.428 4.115 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 2 . 305 . 1 1 9 ILE CA C -5.422 0.719 3.798 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 2 . 306 . 1 1 9 ILE CB C -4.968 1.979 4.548 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 2 . 307 . 1 1 9 ILE CD1 C -2.526 1.683 5.228 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 2 . 308 . 1 1 9 ILE CG1 C -3.509 2.286 4.242 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 2 . 309 . 1 1 9 ILE CG2 C -5.191 1.820 6.048 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 2 . 310 . 1 1 9 ILE H H -7.131 0.757 4.973 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 2 . 311 . 1 1 9 ILE HA H -5.394 0.911 2.748 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 2 . 312 . 1 1 9 ILE HB H -5.576 2.802 4.207 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 2 . 313 . 1 1 9 ILE HD11 H -2.316 2.398 6.009 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 2 . 314 . 1 1 9 ILE HD12 H -1.610 1.430 4.714 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 2 . 315 . 1 1 9 ILE HD13 H -2.954 0.791 5.662 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 2 . 316 . 1 1 9 ILE HG12 H -3.270 1.903 3.260 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 2 . 317 . 1 1 9 ILE HG13 H -3.380 3.354 4.253 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 2 . 318 . 1 1 9 ILE HG21 H -6.248 1.859 6.264 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 2 . 319 . 1 1 9 ILE HG22 H -4.689 2.620 6.572 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 2 . 320 . 1 1 9 ILE HG23 H -4.793 0.871 6.372 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 2 . 321 . 1 1 9 ILE N N -6.776 0.391 4.155 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 2 . 322 . 1 1 9 ILE O O -3.312 -0.417 3.732 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 2 . 323 . 1 1 10 TYS C C -3.999 -3.496 3.983 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 2 . 324 . 1 1 10 TYS CA C -4.167 -2.569 5.173 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 2 . 325 . 1 1 10 TYS CB C -4.721 -3.350 6.375 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 2 . 326 . 1 1 10 TYS CD1 C -5.611 -1.872 8.166 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 2 . 327 . 1 1 10 TYS CD2 C -7.178 -2.913 6.711 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 2 . 328 . 1 1 10 TYS CE1 C -6.632 -1.277 8.855 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 2 . 329 . 1 1 10 TYS CE2 C -8.215 -2.315 7.394 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 2 . 330 . 1 1 10 TYS CG C -5.863 -2.695 7.089 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 2 . 331 . 1 1 10 TYS CZ C -7.939 -1.497 8.471 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 2 . 332 . 1 1 10 TYS H H -5.930 -1.367 5.105 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 2 . 333 . 1 1 10 TYS HA H -3.194 -2.188 5.419 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 2 . 334 . 1 1 10 TYS HB2 H -3.935 -3.470 7.102 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 2 . 335 . 1 1 10 TYS HB3 H -5.053 -4.321 6.049 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 2 . 336 . 1 1 10 TYS HD1 H -4.589 -1.700 8.465 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 2 . 337 . 1 1 10 TYS HD2 H -7.385 -3.554 5.868 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 2 . 338 . 1 1 10 TYS HE1 H -6.401 -0.645 9.687 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 2 . 339 . 1 1 10 TYS HE2 H -9.232 -2.490 7.086 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 2 . 340 . 1 1 10 TYS N N -4.990 -1.418 4.820 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 2 . 341 . 1 1 10 TYS O O -2.884 -3.904 3.656 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 2 . 342 . 1 1 10 TYS O1 O -10.422 -1.075 11.306 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 2 . 343 . 1 1 10 TYS O2 O -8.958 -2.969 10.633 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 2 . 344 . 1 1 10 TYS O3 O -7.978 -0.858 11.315 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 2 . 345 . 1 1 10 TYS OH O -8.970 -0.975 9.218 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 2 . 346 . 1 1 10 TYS S S -9.171 -1.494 10.642 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 2 . 347 . 1 1 11 ASP C C -4.459 -3.960 0.967 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 2 . 348 . 1 1 11 ASP CA C -5.048 -4.692 2.168 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 2 . 349 . 1 1 11 ASP CB C -6.443 -5.212 1.822 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 2 . 350 . 1 1 11 ASP CG C -6.813 -6.450 2.616 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 2 . 351 . 1 1 11 ASP H H -5.963 -3.462 3.625 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 2 . 352 . 1 1 11 ASP HA H -4.412 -5.528 2.412 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 2 . 353 . 1 1 11 ASP HB2 H -7.172 -4.440 2.032 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 2 . 354 . 1 1 11 ASP HB3 H -6.472 -5.459 0.768 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 2 . 355 . 1 1 11 ASP N N -5.101 -3.821 3.329 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 2 . 356 . 1 1 11 ASP O O -4.163 -4.578 -0.056 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 2 . 357 . 1 1 11 ASP OD1 O -6.846 -6.367 3.863 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 2 . 358 . 1 1 11 ASP OD2 O -7.067 -7.501 1.992 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 2 . 359 . 1 1 12 ILE C C -2.190 -1.829 0.051 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 2 . 360 . 1 1 12 ILE CA C -3.713 -1.870 -0.014 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 2 . 361 . 1 1 12 ILE CB C -4.282 -0.434 -0.090 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 2 . 362 . 1 1 12 ILE CD1 C -2.342 1.094 0.534 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 2 . 363 . 1 1 12 ILE CG1 C -3.653 0.474 0.965 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 2 . 364 . 1 1 12 ILE CG2 C -5.796 -0.454 0.057 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 2 . 365 . 1 1 12 ILE H H -4.515 -2.192 1.936 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 2 . 366 . 1 1 12 ILE HA H -3.988 -2.373 -0.923 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 2 . 367 . 1 1 12 ILE HB H -4.052 -0.040 -1.069 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 2 . 368 . 1 1 12 ILE HD11 H -2.288 1.110 -0.544 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 2 . 369 . 1 1 12 ILE HD12 H -1.521 0.511 0.927 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 2 . 370 . 1 1 12 ILE HD13 H -2.280 2.104 0.912 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 2 . 371 . 1 1 12 ILE HG12 H -4.338 1.273 1.185 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 2 . 372 . 1 1 12 ILE HG13 H -3.475 -0.095 1.860 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 2 . 373 . 1 1 12 ILE HG21 H -6.253 -0.228 -0.895 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 2 . 374 . 1 1 12 ILE HG22 H -6.098 0.287 0.784 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 2 . 375 . 1 1 12 ILE HG23 H -6.115 -1.431 0.387 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 2 . 376 . 1 1 12 ILE N N -4.279 -2.643 1.089 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 2 . 377 . 1 1 12 ILE O O -1.543 -1.175 -0.765 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 2 . 378 . 1 1 13 ASN C C 0.458 -3.646 0.343 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 2 . 379 . 1 1 13 ASN CA C -0.179 -2.567 1.194 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 2 . 380 . 1 1 13 ASN CB C 0.182 -2.786 2.657 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 2 . 381 . 1 1 13 ASN CG C -0.355 -1.692 3.558 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 2 . 382 . 1 1 13 ASN H H -2.187 -3.031 1.650 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 2 . 383 . 1 1 13 ASN HA H 0.219 -1.621 0.877 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 2 . 384 . 1 1 13 ASN HB2 H -0.227 -3.729 2.980 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 2 . 385 . 1 1 13 ASN HB3 H 1.258 -2.811 2.749 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 2 . 386 . 1 1 13 ASN HD21 H -1.042 -3.051 4.837 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 2 . 387 . 1 1 13 ASN HD22 H -1.327 -1.402 5.269 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 2 . 388 . 1 1 13 ASN N N -1.622 -2.529 1.027 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 2 . 389 . 1 1 13 ASN ND2 N -0.970 -2.088 4.667 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 2 . 390 . 1 1 13 ASN O O 1.668 -3.839 0.397 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 2 . 391 . 1 1 13 ASN OD1 O -0.219 -0.505 3.263 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 2 . 392 . 1 1 14 TYS C C 1.289 -4.795 -2.249 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 2 . 393 . 1 1 14 TYS CA C 0.219 -5.374 -1.323 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 2 . 394 . 1 1 14 TYS CB C -0.869 -6.094 -2.129 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 2 . 395 . 1 1 14 TYS CD1 C -1.716 -3.832 -2.842 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 2 . 396 . 1 1 14 TYS CD2 C -3.129 -5.717 -3.133 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 2 . 397 . 1 1 14 TYS CE1 C -2.688 -3.012 -3.376 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 2 . 398 . 1 1 14 TYS CE2 C -4.107 -4.912 -3.667 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 2 . 399 . 1 1 14 TYS CG C -1.922 -5.192 -2.713 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 2 . 400 . 1 1 14 TYS CZ C -3.887 -3.556 -3.790 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 2 . 401 . 1 1 14 TYS H H -1.298 -4.146 -0.490 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 2 . 402 . 1 1 14 TYS HA H 0.703 -6.079 -0.677 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 2 . 403 . 1 1 14 TYS HB2 H -1.375 -6.800 -1.489 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 2 . 404 . 1 1 14 TYS HB3 H -0.409 -6.628 -2.945 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 2 . 405 . 1 1 14 TYS HD1 H -0.779 -3.416 -2.511 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 2 . 406 . 1 1 14 TYS HD2 H -3.301 -6.777 -3.035 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 2 . 407 . 1 1 14 TYS HE1 H -2.508 -1.954 -3.468 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 2 . 408 . 1 1 14 TYS HE2 H -5.038 -5.346 -3.983 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 2 . 409 . 1 1 14 TYS N N -0.337 -4.339 -0.465 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 2 . 410 . 1 1 14 TYS O O 2.059 -5.535 -2.860 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 2 . 411 . 1 1 14 TYS O1 O -5.409 -1.671 -6.716 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 2 . 412 . 1 1 14 TYS O2 O -3.987 -3.712 -6.649 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 2 . 413 . 1 1 14 TYS O3 O -3.161 -1.623 -5.734 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 2 . 414 . 1 1 14 TYS OH O -4.764 -2.789 -4.521 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 2 . 415 . 1 1 14 TYS S S -4.402 -2.452 -5.969 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 2 . 416 . 1 1 15 TYR C C 3.738 -3.127 -2.532 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 2 . 417 . 1 1 15 TYR CA C 2.369 -2.794 -3.110 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 2 . 418 . 1 1 15 TYR CB C 2.121 -1.280 -3.090 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 2 . 419 . 1 1 15 TYR CD1 C 2.513 -0.935 -0.618 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 2 . 420 . 1 1 15 TYR CD2 C 3.645 0.502 -2.146 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 2 . 421 . 1 1 15 TYR CE1 C 3.103 -0.278 0.445 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 2 . 422 . 1 1 15 TYR CE2 C 4.240 1.165 -1.089 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 2 . 423 . 1 1 15 TYR CG C 2.772 -0.558 -1.929 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 2 . 424 . 1 1 15 TYR CZ C 3.966 0.771 0.204 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 2 . 425 . 1 1 15 TYR H H 0.750 -2.928 -1.774 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 2 . 426 . 1 1 15 TYR HA H 2.305 -3.162 -4.123 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 2 . 427 . 1 1 15 TYR HB2 H 2.499 -0.847 -4.003 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 2 . 428 . 1 1 15 TYR HB3 H 1.055 -1.106 -3.025 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 2 . 429 . 1 1 15 TYR HD1 H 1.837 -1.759 -0.433 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 2 . 430 . 1 1 15 TYR HD2 H 3.856 0.809 -3.160 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 2 . 431 . 1 1 15 TYR HE1 H 2.889 -0.587 1.457 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 2 . 432 . 1 1 15 TYR HE2 H 4.915 1.986 -1.278 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 2 . 433 . 1 1 15 TYR HH H 4.788 0.795 1.942 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 2 . 434 . 1 1 15 TYR N N 1.362 -3.466 -2.309 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 2 . 435 . 1 1 15 TYR O O 4.750 -3.134 -3.231 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 2 . 436 . 1 1 15 TYR OH O 4.557 1.429 1.259 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 2 . 437 . 1 1 16 THR C C 5.161 -5.283 -0.602 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 2 . 438 . 1 1 16 THR CA C 4.921 -3.783 -0.497 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 2 . 439 . 1 1 16 THR CB C 4.741 -3.380 0.970 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 2 . 440 . 1 1 16 THR CG2 C 3.915 -4.364 1.776 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 2 . 441 . 1 1 16 THR H H 2.877 -3.401 -0.757 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 2 . 442 . 1 1 16 THR HA H 5.762 -3.252 -0.916 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 2 . 443 . 1 1 16 THR HB H 4.229 -2.431 0.999 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 2 . 444 . 1 1 16 THR HG1 H 6.439 -4.084 1.644 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 2 . 445 . 1 1 16 THR HG21 H 4.570 -5.052 2.288 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 2 . 446 . 1 1 16 THR HG22 H 3.262 -4.912 1.113 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 2 . 447 . 1 1 16 THR HG23 H 3.320 -3.825 2.498 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 2 . 448 . 1 1 16 THR N N 3.729 -3.420 -1.235 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 2 . 449 . 1 1 16 THR O O 6.301 -5.749 -0.592 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 2 . 450 . 1 1 16 THR OG1 O 5.993 -3.235 1.614 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 2 . 451 . 1 1 17 SER C C 5.021 -7.937 -1.945 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 2 . 452 . 1 1 17 SER CA C 4.134 -7.485 -0.792 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 2 . 453 . 1 1 17 SER CB C 2.732 -8.076 -0.947 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 2 . 454 . 1 1 17 SER H H 3.182 -5.588 -0.687 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 2 . 455 . 1 1 17 SER HA H 4.566 -7.848 0.121 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 2 . 456 . 1 1 17 SER HB2 H 2.061 -7.592 -0.252 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 2 . 457 . 1 1 17 SER HB3 H 2.384 -7.913 -1.956 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 2 . 458 . 1 1 17 SER HG H 2.381 -9.629 0.196 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 2 . 459 . 1 1 17 SER N N 4.066 -6.031 -0.695 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 2 . 460 . 1 1 17 SER O O 5.510 -9.066 -1.958 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 2 . 461 . 1 1 17 SER OG O 2.732 -9.469 -0.683 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 2 . 462 . 1 1 18 GLU C C 7.537 -7.072 -3.750 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 2 . 463 . 1 1 18 GLU CA C 6.070 -7.373 -4.055 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 2 . 464 . 1 1 18 GLU CB C 5.608 -6.605 -5.297 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 2 . 465 . 1 1 18 GLU CD C 3.607 -7.340 -6.656 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 2 . 466 . 1 1 18 GLU CG C 5.094 -7.505 -6.410 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 2 . 467 . 1 1 18 GLU H H 4.821 -6.170 -2.839 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 2 . 468 . 1 1 18 GLU HA H 5.971 -8.432 -4.245 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 2 . 469 . 1 1 18 GLU HB2 H 4.816 -5.929 -5.014 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 2 . 470 . 1 1 18 GLU HB3 H 6.438 -6.031 -5.683 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 2 . 471 . 1 1 18 GLU HG2 H 5.622 -7.267 -7.321 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 2 . 472 . 1 1 18 GLU HG3 H 5.288 -8.533 -6.142 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 2 . 473 . 1 1 18 GLU N N 5.232 -7.053 -2.907 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 2 . 474 . 1 1 18 GLU O O 8.374 -7.974 -3.766 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 2 . 475 . 1 1 18 GLU OE1 O 3.208 -6.291 -7.204 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 2 . 476 . 1 1 18 GLU OE2 O 2.841 -8.260 -6.299 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 2 . 477 . 1 1 19 PRO C C 9.652 -5.743 -1.725 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 2 . 478 . 1 1 19 PRO CA C 9.245 -5.397 -3.157 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 2 . 479 . 1 1 19 PRO CB C 9.241 -3.871 -3.351 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 2 . 480 . 1 1 19 PRO CD C 6.978 -4.651 -3.424 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 2 . 481 . 1 1 19 PRO CG C 7.873 -3.524 -3.844 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 2 . 482 . 1 1 19 PRO HA H 9.936 -5.842 -3.845 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 2 . 483 . 1 1 19 PRO HB2 H 9.447 -3.387 -2.406 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 2 . 484 . 1 1 19 PRO HB3 H 9.999 -3.601 -4.073 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 2 . 485 . 1 1 19 PRO HD2 H 6.603 -4.487 -2.426 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 2 . 486 . 1 1 19 PRO HD3 H 6.175 -4.769 -4.121 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 2 . 487 . 1 1 19 PRO HG2 H 7.545 -2.598 -3.396 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 2 . 488 . 1 1 19 PRO HG3 H 7.884 -3.437 -4.921 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 2 . 489 . 1 1 19 PRO N N 7.878 -5.799 -3.465 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 2 . 490 . 1 1 19 PRO O O 10.194 -4.904 -1.006 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 2 . 491 . 1 1 20 ALA C C 11.162 -7.067 0.401 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 2 . 492 . 1 1 20 ALA CA C 9.727 -7.427 0.037 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 2 . 493 . 1 1 20 ALA CB C 9.505 -8.926 0.171 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 2 . 494 . 1 1 20 ALA H H 8.951 -7.606 -1.925 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 2 . 495 . 1 1 20 ALA HA H 9.068 -6.929 0.720 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 2 . 496 . 1 1 20 ALA HB1 H 8.503 -9.111 0.528 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 2 . 497 . 1 1 20 ALA HB2 H 10.219 -9.335 0.870 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 2 . 498 . 1 1 20 ALA HB3 H 9.636 -9.396 -0.794 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 2 . 499 . 1 1 20 ALA N N 9.387 -6.980 -1.312 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 2 . 500 . 1 1 20 ALA O O 11.496 -6.895 1.572 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 2 . 501 . 1 1 21 GLN C C 13.590 -5.091 -0.384 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 2 . 502 . 1 1 21 GLN CA C 13.404 -6.605 -0.419 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 2 . 503 . 1 1 21 GLN CB C 14.261 -7.210 -1.533 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 2 . 504 . 1 1 21 GLN CD C 15.379 -9.390 -2.149 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 2 . 505 . 1 1 21 GLN CG C 14.110 -8.717 -1.664 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 2 . 506 . 1 1 21 GLN H H 11.666 -7.097 -1.521 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 2 . 507 . 1 1 21 GLN HA H 13.717 -7.016 0.530 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 2 . 508 . 1 1 21 GLN HB2 H 13.981 -6.758 -2.472 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 2 . 509 . 1 1 21 GLN HE21 H 14.434 -10.065 -3.764 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 2 . 510 . 1 1 21 GLN HE22 H 16.103 -10.495 -3.636 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 2 . 511 . 1 1 21 GLN HG2 H 13.851 -9.127 -0.699 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 2 . 512 . 1 1 21 GLN N N 12.000 -6.950 -0.616 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 2 . 513 . 1 1 21 GLN NE2 N 15.297 -10.050 -3.299 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 2 . 514 . 1 1 21 GLN O O 14.489 -4.580 0.283 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 2 . 515 . 1 1 21 GLN OE1 O 16.422 -9.317 -1.499 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 2 . 516 . 1 1 22 LYS C C 12.637 -2.313 0.224 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 2 . 517 . 1 1 22 LYS CA C 12.801 -2.922 -1.165 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 2 . 518 . 1 1 22 LYS CB C 11.723 -2.375 -2.102 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 2 . 519 . 1 1 22 LYS CD C 10.903 -0.443 -3.487 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 2 . 520 . 1 1 22 LYS CE C 10.724 1.039 -3.190 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 2 . 521 . 1 1 22 LYS CG C 12.077 -1.031 -2.718 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 2 . 522 . 1 1 22 LYS H H 12.038 -4.843 -1.621 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 2 . 523 . 1 1 22 LYS HA H 13.771 -2.651 -1.552 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 2 . 524 . 1 1 22 LYS HB2 H 11.563 -3.084 -2.901 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 2 . 525 . 1 1 22 LYS HB3 H 10.804 -2.260 -1.546 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 2 . 526 . 1 1 22 LYS HD2 H 11.081 -0.567 -4.545 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 2 . 527 . 1 1 22 LYS HD3 H 10.002 -0.968 -3.208 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 2 . 528 . 1 1 22 LYS HE2 H 9.715 1.204 -2.846 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 2 . 529 . 1 1 22 LYS HE3 H 11.419 1.325 -2.414 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 2 . 530 . 1 1 22 LYS HG2 H 12.359 -0.348 -1.930 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 2 . 531 . 1 1 22 LYS HG3 H 12.909 -1.166 -3.395 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 2 . 532 . 1 1 22 LYS HZ1 H 10.795 1.328 -5.258 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 2 . 533 . 1 1 22 LYS HZ2 H 11.953 2.217 -4.401 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 2 . 534 . 1 1 22 LYS HZ3 H 10.333 2.704 -4.389 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 2 . 535 . 1 1 22 LYS N N 12.733 -4.379 -1.110 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 2 . 536 . 1 1 22 LYS NZ N 10.968 1.880 -4.394 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 2 . 537 . 1 1 22 LYS O O 13.558 -1.690 0.752 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 2 . 538 . 1 1 23 ILE C C 11.423 -3.011 3.219 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 2 . 539 . 1 1 23 ILE CA C 11.172 -1.964 2.138 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 2 . 540 . 1 1 23 ILE CB C 9.716 -1.469 2.243 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 2 . 541 . 1 1 23 ILE CD1 C 7.881 -0.292 0.928 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 2 . 542 . 1 1 23 ILE CG1 C 9.358 -0.606 1.031 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 2 . 543 . 1 1 23 ILE CG2 C 9.511 -0.691 3.533 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 2 . 544 . 1 1 23 ILE H H 10.763 -3.002 0.338 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 2 . 545 . 1 1 23 ILE HA H 11.829 -1.123 2.306 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 2 . 546 . 1 1 23 ILE HB H 9.067 -2.332 2.264 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 2 . 547 . 1 1 23 ILE HD11 H 7.739 0.779 0.947 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 2 . 548 . 1 1 23 ILE HD12 H 7.360 -0.740 1.761 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 2 . 549 . 1 1 23 ILE HD13 H 7.492 -0.690 0.003 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 2 . 550 . 1 1 23 ILE HG12 H 9.892 0.331 1.094 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 2 . 551 . 1 1 23 ILE HG13 H 9.653 -1.122 0.129 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 2 . 552 . 1 1 23 ILE HG21 H 10.305 -0.926 4.226 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 2 . 553 . 1 1 23 ILE HG22 H 8.560 -0.961 3.969 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 2 . 554 . 1 1 23 ILE HG23 H 9.522 0.368 3.321 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 2 . 555 . 1 1 23 ILE N N 11.458 -2.498 0.810 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 2 . 556 . 1 1 23 ILE O O 10.646 -3.141 4.164 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 3 . 557 . 1 1 7 SER C C -10.167 0.833 4.448 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 3 . 558 . 1 1 7 SER CA C -11.126 1.910 4.939 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 3 . 559 . 1 1 7 SER CB C -12.551 1.386 4.964 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 3 . 560 . 1 1 7 SER H H -11.769 3.184 3.399 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 3 . 561 . 1 1 7 SER HA H -10.832 2.184 5.938 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 3 . 562 . 1 1 7 SER HB2 H -13.171 2.068 4.392 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 3 . 563 . 1 1 7 SER HB3 H -12.583 0.405 4.516 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 3 . 564 . 1 1 7 SER HG H -13.880 1.793 6.346 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 3 . 565 . 1 1 7 SER N N -11.110 3.103 4.117 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 3 . 566 . 1 1 7 SER O O -9.538 0.168 5.258 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 3 . 567 . 1 1 7 SER OG O -13.051 1.310 6.288 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 3 . 568 . 1 1 8 PRO C C -7.690 0.071 2.562 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 3 . 569 . 1 1 8 PRO CA C -9.137 -0.385 2.572 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 3 . 570 . 1 1 8 PRO CB C -9.642 -0.583 1.137 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 3 . 571 . 1 1 8 PRO CD C -10.723 1.349 2.060 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 3 . 572 . 1 1 8 PRO CG C -10.853 0.287 1.008 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 3 . 573 . 1 1 8 PRO HA H -9.213 -1.311 3.117 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 3 . 574 . 1 1 8 PRO HB2 H -8.869 -0.287 0.438 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 3 . 575 . 1 1 8 PRO HB3 H -9.889 -1.623 0.988 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 3 . 576 . 1 1 8 PRO HD2 H -10.125 2.177 1.701 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 3 . 577 . 1 1 8 PRO HD3 H -11.696 1.683 2.384 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 3 . 578 . 1 1 8 PRO HG2 H -10.882 0.735 0.028 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 3 . 579 . 1 1 8 PRO HG3 H -11.740 -0.301 1.182 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 3 . 580 . 1 1 8 PRO N N -10.032 0.631 3.125 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 3 . 581 . 1 1 8 PRO O O -6.896 -0.348 1.718 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 3 . 582 . 1 1 9 ILE C C -5.148 0.521 4.481 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 3 . 583 . 1 1 9 ILE CA C -6.008 1.445 3.630 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 3 . 584 . 1 1 9 ILE CB C -6.002 2.878 4.212 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 3 . 585 . 1 1 9 ILE CD1 C -7.188 2.122 6.337 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 3 . 586 . 1 1 9 ILE CG1 C -6.007 2.860 5.745 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 3 . 587 . 1 1 9 ILE CG2 C -7.196 3.661 3.690 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 3 . 588 . 1 1 9 ILE H H -8.034 1.205 4.148 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 3 . 589 . 1 1 9 ILE HA H -5.588 1.479 2.643 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 3 . 590 . 1 1 9 ILE HB H -5.109 3.370 3.865 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 3 . 591 . 1 1 9 ILE HD11 H -8.080 2.359 5.775 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 3 . 592 . 1 1 9 ILE HD12 H -7.321 2.422 7.366 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 3 . 593 . 1 1 9 ILE HD13 H -7.006 1.058 6.292 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 3 . 594 . 1 1 9 ILE HG12 H -5.105 2.379 6.098 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 3 . 595 . 1 1 9 ILE HG13 H -6.036 3.880 6.108 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 3 . 596 . 1 1 9 ILE HG21 H -7.308 4.568 4.265 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 3 . 597 . 1 1 9 ILE HG22 H -8.090 3.062 3.786 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 3 . 598 . 1 1 9 ILE HG23 H -7.038 3.909 2.652 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 3 . 599 . 1 1 9 ILE N N -7.357 0.925 3.510 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 3 . 600 . 1 1 9 ILE O O -3.943 0.720 4.622 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 3 . 601 . 1 1 10 TYS C C -4.474 -2.564 5.024 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 3 . 602 . 1 1 10 TYS CA C -5.091 -1.465 5.875 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 3 . 603 . 1 1 10 TYS CB C -6.035 -2.076 6.904 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 3 . 604 . 1 1 10 TYS CD1 C -8.242 -2.066 5.817 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 3 . 605 . 1 1 10 TYS CD2 C -7.220 -4.168 6.183 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 3 . 606 . 1 1 10 TYS CE1 C -9.327 -2.670 5.250 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 3 . 607 . 1 1 10 TYS CE2 C -8.305 -4.801 5.612 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 3 . 608 . 1 1 10 TYS CG C -7.185 -2.793 6.287 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 3 . 609 . 1 1 10 TYS CZ C -9.364 -4.046 5.145 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 3 . 610 . 1 1 10 TYS H H -6.750 -0.581 4.885 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 3 . 611 . 1 1 10 TYS HA H -4.309 -0.950 6.386 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 3 . 612 . 1 1 10 TYS HB2 H -6.449 -1.292 7.514 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 3 . 613 . 1 1 10 TYS HB3 H -5.497 -2.773 7.525 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 3 . 614 . 1 1 10 TYS HD1 H -8.202 -0.993 5.898 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 3 . 615 . 1 1 10 TYS HD2 H -6.384 -4.743 6.552 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 3 . 616 . 1 1 10 TYS HE1 H -10.137 -2.065 4.894 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 3 . 617 . 1 1 10 TYS HE2 H -8.322 -5.874 5.537 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 3 . 618 . 1 1 10 TYS N N -5.787 -0.492 5.041 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 3 . 619 . 1 1 10 TYS O O -3.395 -3.071 5.333 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 3 . 620 . 1 1 10 TYS O1 O -10.942 -5.247 7.161 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 3 . 621 . 1 1 10 TYS O2 O -12.803 -4.932 5.540 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 3 . 622 . 1 1 10 TYS O3 O -11.269 -6.793 5.283 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 3 . 623 . 1 1 10 TYS OH O -10.514 -4.670 4.718 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 3 . 624 . 1 1 10 TYS S S -11.394 -5.364 5.760 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 3 . 625 . 1 1 11 ASP C C -3.707 -3.385 2.019 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 3 . 626 . 1 1 11 ASP CA C -4.677 -3.960 3.050 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 3 . 627 . 1 1 11 ASP CB C -5.851 -4.637 2.341 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 3 . 628 . 1 1 11 ASP CG C -6.404 -5.808 3.128 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 3 . 629 . 1 1 11 ASP H H -6.012 -2.482 3.754 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 3 . 630 . 1 1 11 ASP HA H -4.157 -4.693 3.645 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 3 . 631 . 1 1 11 ASP HB2 H -6.644 -3.914 2.199 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 3 . 632 . 1 1 11 ASP HB3 H -5.519 -4.999 1.376 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 3 . 633 . 1 1 11 ASP N N -5.161 -2.924 3.949 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 3 . 634 . 1 1 11 ASP O O -3.263 -4.093 1.117 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 3 . 635 . 1 1 11 ASP OD1 O -6.130 -5.889 4.344 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 3 . 636 . 1 1 11 ASP OD2 O -7.114 -6.644 2.529 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 3 . 637 . 1 1 12 ILE C C -0.999 -1.628 1.648 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 3 . 638 . 1 1 12 ILE CA C -2.456 -1.457 1.218 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 3 . 639 . 1 1 12 ILE CB C -2.763 0.044 1.047 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 3 . 640 . 1 1 12 ILE CD1 C -1.222 1.595 2.349 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 3 . 641 . 1 1 12 ILE CG1 C -2.509 0.801 2.351 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 3 . 642 . 1 1 12 ILE CG2 C -4.199 0.240 0.584 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 3 . 643 . 1 1 12 ILE H H -3.756 -1.573 2.894 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 3 . 644 . 1 1 12 ILE HA H -2.588 -1.932 0.258 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 3 . 645 . 1 1 12 ILE HB H -2.110 0.435 0.281 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 3 . 646 . 1 1 12 ILE HD11 H -1.450 2.649 2.413 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 3 . 647 . 1 1 12 ILE HD12 H -0.680 1.400 1.434 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 3 . 648 . 1 1 12 ILE HD13 H -0.618 1.304 3.194 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 3 . 649 . 1 1 12 ILE HG12 H -3.322 1.488 2.523 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 3 . 650 . 1 1 12 ILE HG13 H -2.463 0.095 3.166 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 3 . 651 . 1 1 12 ILE HG21 H -4.575 1.177 0.964 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 3 . 652 . 1 1 12 ILE HG22 H -4.810 -0.571 0.954 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 3 . 653 . 1 1 12 ILE HG23 H -4.231 0.250 -0.496 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 3 . 654 . 1 1 12 ILE N N -3.377 -2.098 2.153 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 3 . 655 . 1 1 12 ILE O O -0.104 -0.987 1.096 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 3 . 656 . 1 1 13 ASN C C 1.328 -3.738 2.264 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 3 . 657 . 1 1 13 ASN CA C 0.589 -2.736 3.126 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 3 . 658 . 1 1 13 ASN CB C 0.547 -3.211 4.573 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 3 . 659 . 1 1 13 ASN CG C 1.927 -3.485 5.140 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 3 . 660 . 1 1 13 ASN H H -1.511 -2.975 3.037 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 3 . 661 . 1 1 13 ASN HA H 1.130 -1.811 3.079 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 3 . 662 . 1 1 13 ASN HB2 H 0.077 -2.450 5.174 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 3 . 663 . 1 1 13 ASN HB3 H -0.032 -4.118 4.626 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 3 . 664 . 1 1 13 ASN HD21 H 2.355 -1.543 5.107 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 3 . 665 . 1 1 13 ASN HD22 H 3.604 -2.576 5.702 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 3 . 666 . 1 1 13 ASN N N -0.763 -2.492 2.633 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 3 . 667 . 1 1 13 ASN ND2 N 2.708 -2.428 5.337 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 3 . 668 . 1 1 13 ASN O O 2.508 -3.997 2.489 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 3 . 669 . 1 1 13 ASN OD1 O 2.287 -4.633 5.401 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 3 . 670 . 1 1 14 TYS C C 2.474 -4.543 -0.352 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 3 . 671 . 1 1 14 TYS CA C 1.313 -5.222 0.368 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 3 . 672 . 1 1 14 TYS CB C 0.331 -5.842 -0.635 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 3 . 673 . 1 1 14 TYS CD1 C -1.797 -5.335 -1.848 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 3 . 674 . 1 1 14 TYS CD2 C -0.424 -3.507 -1.205 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 3 . 675 . 1 1 14 TYS CE1 C -2.704 -4.469 -2.408 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 3 . 676 . 1 1 14 TYS CE2 C -1.327 -2.625 -1.764 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 3 . 677 . 1 1 14 TYS CG C -0.646 -4.871 -1.240 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 3 . 678 . 1 1 14 TYS CZ C -2.468 -3.110 -2.366 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 3 . 679 . 1 1 14 TYS H H -0.273 -4.026 1.102 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 3 . 680 . 1 1 14 TYS HA H 1.725 -5.998 0.986 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 3 . 681 . 1 1 14 TYS HB2 H -0.247 -6.605 -0.138 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 3 . 682 . 1 1 14 TYS HB3 H 0.887 -6.292 -1.441 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 3 . 683 . 1 1 14 TYS HD1 H -1.979 -6.399 -1.879 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 3 . 684 . 1 1 14 TYS HD2 H 0.469 -3.139 -0.727 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 3 . 685 . 1 1 14 TYS HE1 H -3.591 -4.856 -2.872 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 3 . 686 . 1 1 14 TYS HE2 H -1.136 -1.565 -1.726 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 3 . 687 . 1 1 14 TYS N N 0.658 -4.280 1.258 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 3 . 688 . 1 1 14 TYS O O 3.311 -5.204 -0.967 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 3 . 689 . 1 1 14 TYS O1 O -5.463 -3.559 -2.875 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 3 . 690 . 1 1 14 TYS O2 O -5.423 -1.162 -3.535 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 3 . 691 . 1 1 14 TYS O3 O -4.736 -1.819 -1.305 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 3 . 692 . 1 1 14 TYS OH O -3.286 -2.253 -3.067 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 3 . 693 . 1 1 14 TYS S S -4.782 -2.254 -2.752 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 3 . 694 . 1 1 15 TYR C C 4.945 -3.027 -0.297 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 3 . 695 . 1 1 15 TYR CA C 3.630 -2.455 -0.813 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 3 . 696 . 1 1 15 TYR CB C 3.473 -0.976 -0.430 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 3 . 697 . 1 1 15 TYR CD1 C 3.904 -1.137 2.054 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 3 . 698 . 1 1 15 TYR CD2 C 5.225 0.386 0.780 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 3 . 699 . 1 1 15 TYR CE1 C 4.576 -0.763 3.203 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 3 . 700 . 1 1 15 TYR CE2 C 5.901 0.763 1.924 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 3 . 701 . 1 1 15 TYR CG C 4.217 -0.569 0.825 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 3 . 702 . 1 1 15 TYR CZ C 5.573 0.186 3.133 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 3 . 703 . 1 1 15 TYR H H 1.876 -2.749 0.304 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 3 . 704 . 1 1 15 TYR HA H 3.586 -2.562 -1.886 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 3 . 705 . 1 1 15 TYR HB2 H 3.830 -0.360 -1.241 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 3 . 706 . 1 1 15 TYR HB3 H 2.421 -0.775 -0.263 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 3 . 707 . 1 1 15 TYR HD1 H 3.122 -1.883 2.104 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 3 . 708 . 1 1 15 TYR HD2 H 5.480 0.836 -0.168 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 3 . 709 . 1 1 15 TYR HE1 H 4.319 -1.216 4.149 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 3 . 710 . 1 1 15 TYR HE2 H 6.682 1.508 1.869 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 3 . 711 . 1 1 15 TYR HH H 6.166 1.509 4.397 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 3 . 712 . 1 1 15 TYR N N 2.547 -3.218 -0.227 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 3 . 713 . 1 1 15 TYR O O 5.967 -3.025 -0.980 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 3 . 714 . 1 1 15 TYR OH O 6.243 0.560 4.275 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 3 . 715 . 1 1 16 THR C C 6.053 -5.646 1.207 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 3 . 716 . 1 1 16 THR CA C 5.993 -4.173 1.586 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 3 . 717 . 1 1 16 THR CB C 5.833 -4.028 3.099 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 3 . 718 . 1 1 16 THR CG2 C 4.820 -4.986 3.695 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 3 . 719 . 1 1 16 THR H H 4.008 -3.527 1.391 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 3 . 720 . 1 1 16 THR HA H 6.899 -3.680 1.268 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 3 . 721 . 1 1 16 THR HB H 5.494 -3.028 3.312 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 3 . 722 . 1 1 16 THR HG1 H 7.673 -3.524 3.538 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 3 . 723 . 1 1 16 THR HG21 H 4.348 -4.525 4.549 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 3 . 724 . 1 1 16 THR HG22 H 5.317 -5.892 4.004 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 3 . 725 . 1 1 16 THR HG23 H 4.068 -5.220 2.954 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 3 . 726 . 1 1 16 THR N N 4.869 -3.548 0.924 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 3 . 727 . 1 1 16 THR O O 7.130 -6.231 1.083 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 3 . 728 . 1 1 16 THR OG1 O 7.067 -4.234 3.763 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 3 . 729 . 1 1 17 SER C C 5.697 -8.031 -0.461 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 3 . 730 . 1 1 17 SER CA C 4.756 -7.650 0.683 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 3 . 731 . 1 1 17 SER CB C 3.303 -7.992 0.330 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 3 . 732 . 1 1 17 SER H H 4.048 -5.703 1.163 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 3 . 733 . 1 1 17 SER HA H 5.037 -8.222 1.543 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 3 . 734 . 1 1 17 SER HB2 H 2.697 -7.941 1.222 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 3 . 735 . 1 1 17 SER HB3 H 2.935 -7.285 -0.397 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 3 . 736 . 1 1 17 SER HG H 2.959 -9.243 -1.138 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 3 . 737 . 1 1 17 SER N N 4.871 -6.237 1.036 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 3 . 738 . 1 1 17 SER O O 6.876 -8.306 -0.240 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 3 . 739 . 1 1 17 SER OG O 3.204 -9.299 -0.212 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 3 . 740 . 1 1 18 GLU C C 7.176 -7.504 -3.006 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 3 . 741 . 1 1 18 GLU CA C 5.962 -8.417 -2.850 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 3 . 742 . 1 1 18 GLU CB C 5.107 -8.372 -4.121 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 3 . 743 . 1 1 18 GLU CD C 3.041 -9.305 -5.238 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 3 . 744 . 1 1 18 GLU CG C 3.692 -8.895 -3.931 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 3 . 745 . 1 1 18 GLU H H 4.226 -7.837 -1.784 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 3 . 746 . 1 1 18 GLU HA H 6.312 -9.429 -2.706 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 3 . 747 . 1 1 18 GLU HB2 H 5.047 -7.351 -4.467 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 3 . 748 . 1 1 18 GLU HB3 H 5.587 -8.969 -4.882 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 3 . 749 . 1 1 18 GLU HG2 H 3.724 -9.754 -3.278 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 3 . 750 . 1 1 18 GLU HG3 H 3.093 -8.119 -3.475 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 3 . 751 . 1 1 18 GLU N N 5.170 -8.056 -1.677 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 3 . 752 . 1 1 18 GLU O O 8.294 -7.981 -3.203 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 3 . 753 . 1 1 18 GLU OE1 O 3.287 -10.441 -5.692 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 3 . 754 . 1 1 18 GLU OE2 O 2.287 -8.488 -5.807 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 3 . 755 . 1 1 19 PRO C C 8.928 -5.057 -1.843 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 3 . 756 . 1 1 19 PRO CA C 8.060 -5.203 -3.092 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 3 . 757 . 1 1 19 PRO CB C 7.336 -3.879 -3.384 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 3 . 758 . 1 1 19 PRO CD C 5.699 -5.503 -2.739 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 3 . 759 . 1 1 19 PRO CG C 5.886 -4.223 -3.497 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 3 . 760 . 1 1 19 PRO HA H 8.681 -5.457 -3.929 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 3 . 761 . 1 1 19 PRO HB2 H 7.512 -3.185 -2.572 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 3 . 762 . 1 1 19 PRO HB3 H 7.716 -3.465 -4.306 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 3 . 763 . 1 1 19 PRO HD2 H 5.524 -5.305 -1.693 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 3 . 764 . 1 1 19 PRO HD3 H 4.897 -6.078 -3.161 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 3 . 765 . 1 1 19 PRO HG2 H 5.288 -3.438 -3.060 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 3 . 766 . 1 1 19 PRO HG3 H 5.622 -4.361 -4.535 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 3 . 767 . 1 1 19 PRO N N 6.979 -6.173 -2.939 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 3 . 768 . 1 1 19 PRO O O 9.446 -3.975 -1.567 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 3 . 769 . 1 1 20 ALA C C 11.324 -5.665 -0.202 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 3 . 770 . 1 1 20 ALA CA C 9.906 -6.109 0.116 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 3 . 771 . 1 1 20 ALA CB C 9.909 -7.472 0.791 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 3 . 772 . 1 1 20 ALA H H 8.662 -6.976 -1.358 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 3 . 773 . 1 1 20 ALA HA H 9.467 -5.398 0.789 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 3 . 774 . 1 1 20 ALA HB1 H 10.062 -7.347 1.853 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 3 . 775 . 1 1 20 ALA HB2 H 10.707 -8.075 0.381 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 3 . 776 . 1 1 20 ALA HB3 H 8.962 -7.962 0.618 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 3 . 777 . 1 1 20 ALA N N 9.091 -6.140 -1.093 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 3 . 778 . 1 1 20 ALA O O 11.983 -5.003 0.600 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 3 . 779 . 1 1 21 GLN C C 13.097 -4.307 -2.536 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 3 . 780 . 1 1 21 GLN CA C 13.111 -5.673 -1.854 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 3 . 781 . 1 1 21 GLN CB C 13.639 -6.735 -2.819 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 3 . 782 . 1 1 21 GLN CD C 13.889 -9.218 -3.210 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 3 . 783 . 1 1 21 GLN CG C 13.811 -8.105 -2.184 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 3 . 784 . 1 1 21 GLN H H 11.189 -6.546 -1.973 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 3 . 785 . 1 1 21 GLN HA H 13.761 -5.626 -0.992 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 3 . 786 . 1 1 21 GLN HB2 H 12.950 -6.829 -3.645 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 3 . 787 . 1 1 21 GLN HE21 H 15.780 -9.577 -2.715 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 3 . 788 . 1 1 21 GLN HE22 H 15.128 -10.581 -3.961 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 3 . 789 . 1 1 21 GLN HG2 H 14.722 -8.107 -1.604 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 3 . 790 . 1 1 21 GLN N N 11.776 -6.029 -1.389 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 3 . 791 . 1 1 21 GLN NE2 N 15.049 -9.856 -3.305 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 3 . 792 . 1 1 21 GLN O O 14.119 -3.624 -2.600 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 3 . 793 . 1 1 21 GLN OE1 O 12.917 -9.501 -3.911 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 3 . 794 . 1 1 22 LYS C C 12.392 -1.500 -2.916 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 3 . 795 . 1 1 22 LYS CA C 11.776 -2.635 -3.730 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 3 . 796 . 1 1 22 LYS CB C 10.296 -2.349 -3.989 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 3 . 797 . 1 1 22 LYS CD C 9.989 -2.891 -6.422 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 3 . 798 . 1 1 22 LYS CE C 9.618 -2.347 -7.793 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 3 . 799 . 1 1 22 LYS CG C 10.017 -1.791 -5.375 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 3 . 800 . 1 1 22 LYS H H 11.153 -4.508 -2.966 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 3 . 801 . 1 1 22 LYS HA H 12.288 -2.702 -4.676 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 3 . 802 . 1 1 22 LYS HB2 H 9.738 -3.267 -3.876 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 3 . 803 . 1 1 22 LYS HB3 H 9.945 -1.634 -3.258 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 3 . 804 . 1 1 22 LYS HD2 H 10.966 -3.347 -6.480 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 3 . 805 . 1 1 22 LYS HD3 H 9.259 -3.633 -6.130 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 3 . 806 . 1 1 22 LYS HE2 H 8.905 -3.016 -8.252 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 3 . 807 . 1 1 22 LYS HE3 H 9.168 -1.372 -7.671 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 3 . 808 . 1 1 22 LYS HG2 H 9.061 -1.290 -5.366 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 3 . 809 . 1 1 22 LYS HG3 H 10.794 -1.084 -5.629 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 3 . 810 . 1 1 22 LYS HZ1 H 10.720 -1.380 -9.282 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 3 . 811 . 1 1 22 LYS HZ2 H 10.885 -3.064 -9.293 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 3 . 812 . 1 1 22 LYS HZ3 H 11.672 -2.144 -8.113 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 3 . 813 . 1 1 22 LYS N N 11.930 -3.918 -3.048 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 3 . 814 . 1 1 22 LYS NZ N 10.807 -2.225 -8.682 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 3 . 815 . 1 1 22 LYS O O 13.086 -0.640 -3.457 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 3 . 816 . 1 1 23 ILE C C 13.616 -1.081 0.301 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 3 . 817 . 1 1 23 ILE CA C 12.661 -0.478 -0.723 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 3 . 818 . 1 1 23 ILE CB C 11.529 0.262 0.018 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 3 . 819 . 1 1 23 ILE CD1 C 9.138 1.090 -0.263 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 3 . 820 . 1 1 23 ILE CG1 C 10.404 0.629 -0.952 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 3 . 821 . 1 1 23 ILE CG2 C 12.070 1.508 0.706 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 3 . 822 . 1 1 23 ILE H H 11.572 -2.219 -1.239 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 3 . 823 . 1 1 23 ILE HA H 13.199 0.240 -1.325 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 3 . 824 . 1 1 23 ILE HB H 11.138 -0.396 0.780 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 3 . 825 . 1 1 23 ILE HD11 H 8.295 0.537 -0.650 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 3 . 826 . 1 1 23 ILE HD12 H 8.992 2.145 -0.448 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 3 . 827 . 1 1 23 ILE HD13 H 9.224 0.920 0.800 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 3 . 828 . 1 1 23 ILE HG12 H 10.739 1.426 -1.598 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 3 . 829 . 1 1 23 ILE HG13 H 10.160 -0.236 -1.552 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 3 . 830 . 1 1 23 ILE HG21 H 11.677 1.564 1.710 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 3 . 831 . 1 1 23 ILE HG22 H 11.769 2.385 0.152 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 3 . 832 . 1 1 23 ILE HG23 H 13.149 1.460 0.743 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 3 . 833 . 1 1 23 ILE N N 12.132 -1.505 -1.613 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 3 . 834 . 1 1 23 ILE O O 13.726 -0.592 1.425 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 4 . 835 . 1 1 7 SER C C -10.037 0.350 5.279 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 4 . 836 . 1 1 7 SER CA C -10.948 1.451 5.800 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 4 . 837 . 1 1 7 SER CB C -12.207 0.856 6.413 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 4 . 838 . 1 1 7 SER H H -12.280 2.687 4.741 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 4 . 839 . 1 1 7 SER HA H -10.412 2.000 6.556 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 4 . 840 . 1 1 7 SER HB2 H -13.066 1.285 5.907 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 4 . 841 . 1 1 7 SER HB3 H -12.205 -0.214 6.275 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 4 . 842 . 1 1 7 SER HG H -13.172 1.484 7.999 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 4 . 843 . 1 1 7 SER N N -11.350 2.376 4.756 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 4 . 844 . 1 1 7 SER O O -9.022 0.046 5.900 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 4 . 845 . 1 1 7 SER OG O -12.296 1.147 7.797 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 4 . 846 . 1 1 8 PRO C C -8.146 -0.855 3.165 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 4 . 847 . 1 1 8 PRO CA C -9.539 -1.333 3.559 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 4 . 848 . 1 1 8 PRO CB C -10.325 -1.787 2.326 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 4 . 849 . 1 1 8 PRO CD C -11.541 0.016 3.300 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 4 . 850 . 1 1 8 PRO CG C -11.706 -1.261 2.531 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 4 . 851 . 1 1 8 PRO HA H -9.440 -2.151 4.249 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 4 . 852 . 1 1 8 PRO HB2 H -9.872 -1.374 1.436 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 4 . 853 . 1 1 8 PRO HB3 H -10.319 -2.867 2.275 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 4 . 854 . 1 1 8 PRO HD2 H -11.353 0.840 2.627 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 4 . 855 . 1 1 8 PRO HD3 H -12.410 0.209 3.911 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 4 . 856 . 1 1 8 PRO HG2 H -12.172 -1.069 1.576 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 4 . 857 . 1 1 8 PRO HG3 H -12.289 -1.970 3.100 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 4 . 858 . 1 1 8 PRO N N -10.363 -0.265 4.130 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 4 . 859 . 1 1 8 PRO O O -7.497 -1.440 2.299 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 4 . 860 . 1 1 9 ILE C C -5.319 -0.053 4.294 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 4 . 861 . 1 1 9 ILE CA C -6.390 0.759 3.586 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 4 . 862 . 1 1 9 ILE CB C -6.344 2.221 4.054 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 4 . 863 . 1 1 9 ILE CD1 C -4.102 2.592 5.221 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 4 . 864 . 1 1 9 ILE CG1 C -4.927 2.772 3.961 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 4 . 865 . 1 1 9 ILE CG2 C -6.892 2.353 5.471 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 4 . 866 . 1 1 9 ILE H H -8.244 0.605 4.503 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 4 . 867 . 1 1 9 ILE HA H -6.209 0.727 2.532 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 4 . 868 . 1 1 9 ILE HB H -6.979 2.793 3.399 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 4 . 869 . 1 1 9 ILE HD11 H -4.141 3.496 5.810 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 4 . 870 . 1 1 9 ILE HD12 H -3.076 2.381 4.953 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 4 . 871 . 1 1 9 ILE HD13 H -4.500 1.769 5.798 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 4 . 872 . 1 1 9 ILE HG12 H -4.413 2.272 3.154 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 4 . 873 . 1 1 9 ILE HG13 H -4.991 3.825 3.751 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 4 . 874 . 1 1 9 ILE HG21 H -7.957 2.520 5.431 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 4 . 875 . 1 1 9 ILE HG22 H -6.415 3.188 5.964 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 4 . 876 . 1 1 9 ILE HG23 H -6.689 1.447 6.022 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 4 . 877 . 1 1 9 ILE N N -7.692 0.198 3.825 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 4 . 878 . 1 1 9 ILE O O -4.124 0.160 4.096 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 4 . 879 . 1 1 10 TYS C C -4.343 -2.981 4.930 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 4 . 880 . 1 1 10 TYS CA C -4.804 -1.843 5.825 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 4 . 881 . 1 1 10 TYS CB C -5.371 -2.408 7.137 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 4 . 882 . 1 1 10 TYS CD1 C -6.941 -0.915 8.349 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 4 . 883 . 1 1 10 TYS CD2 C -7.878 -2.610 6.971 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 4 . 884 . 1 1 10 TYS CE1 C -8.195 -0.502 8.711 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 4 . 885 . 1 1 10 TYS CE2 C -9.147 -2.201 7.324 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 4 . 886 . 1 1 10 TYS CG C -6.761 -1.967 7.479 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 4 . 887 . 1 1 10 TYS CZ C -9.303 -1.144 8.198 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 4 . 888 . 1 1 10 TYS H H -6.719 -1.122 5.227 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 4 . 889 . 1 1 10 TYS HA H -3.947 -1.235 6.046 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 4 . 890 . 1 1 10 TYS HB2 H -4.740 -2.091 7.952 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 4 . 891 . 1 1 10 TYS HB3 H -5.374 -3.484 7.091 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 4 . 892 . 1 1 10 TYS HD1 H -6.073 -0.410 8.746 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 4 . 893 . 1 1 10 TYS HD2 H -7.747 -3.435 6.287 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 4 . 894 . 1 1 10 TYS HE1 H -8.299 0.321 9.389 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 4 . 895 . 1 1 10 TYS HE2 H -10.006 -2.707 6.918 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 4 . 896 . 1 1 10 TYS N N -5.752 -0.995 5.114 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 4 . 897 . 1 1 10 TYS O O -3.179 -3.378 4.964 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 4 . 898 . 1 1 10 TYS O1 O -9.941 -1.922 10.842 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 4 . 899 . 1 1 10 TYS O2 O -11.410 0.084 10.757 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 4 . 900 . 1 1 10 TYS O3 O -12.164 -2.015 9.802 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 4 . 901 . 1 1 10 TYS OH O -10.560 -0.801 8.641 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 4 . 902 . 1 1 10 TYS S S -10.948 -1.159 10.076 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 4 . 903 . 1 1 11 ASP C C -4.332 -4.017 1.915 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 4 . 904 . 1 1 11 ASP CA C -4.931 -4.567 3.204 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 4 . 905 . 1 1 11 ASP CB C -6.174 -5.395 2.883 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 4 . 906 . 1 1 11 ASP CG C -6.430 -6.480 3.910 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 4 . 907 . 1 1 11 ASP H H -6.164 -3.124 4.126 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 4 . 908 . 1 1 11 ASP HA H -4.202 -5.199 3.685 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 4 . 909 . 1 1 11 ASP HB2 H -7.038 -4.742 2.853 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 4 . 910 . 1 1 11 ASP HB3 H -6.043 -5.863 1.914 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 4 . 911 . 1 1 11 ASP N N -5.257 -3.489 4.118 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 4 . 912 . 1 1 11 ASP O O -3.922 -4.782 1.042 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 4 . 913 . 1 1 11 ASP OD1 O -6.122 -6.255 5.099 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 4 . 914 . 1 1 11 ASP OD2 O -6.937 -7.554 3.526 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 4 . 915 . 1 1 12 ILE C C -2.202 -1.884 0.714 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 4 . 916 . 1 1 12 ILE CA C -3.711 -2.079 0.591 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 4 . 917 . 1 1 12 ILE CB C -4.388 -0.740 0.228 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 4 . 918 . 1 1 12 ILE CD1 C -2.711 1.034 0.948 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 4 . 919 . 1 1 12 ILE CG1 C -4.031 0.352 1.233 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 4 . 920 . 1 1 12 ILE CG2 C -5.898 -0.916 0.144 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 4 . 921 . 1 1 12 ILE H H -4.606 -2.114 2.525 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 4 . 922 . 1 1 12 ILE HA H -3.891 -2.762 -0.222 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 4 . 923 . 1 1 12 ILE HB H -4.036 -0.444 -0.750 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 4 . 924 . 1 1 12 ILE HD11 H -1.919 0.517 1.469 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 4 . 925 . 1 1 12 ILE HD12 H -2.755 2.059 1.287 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 4 . 926 . 1 1 12 ILE HD13 H -2.516 1.014 -0.113 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 4 . 927 . 1 1 12 ILE HG12 H -4.801 1.103 1.215 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 4 . 928 . 1 1 12 ILE HG13 H -3.979 -0.078 2.217 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 4 . 929 . 1 1 12 ILE HG21 H -6.224 -0.745 -0.872 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 4 . 930 . 1 1 12 ILE HG22 H -6.381 -0.208 0.800 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 4 . 931 . 1 1 12 ILE HG23 H -6.162 -1.920 0.441 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 4 . 932 . 1 1 12 ILE N N -4.274 -2.688 1.792 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 4 . 933 . 1 1 12 ILE O O -1.583 -1.224 -0.120 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 4 . 934 . 1 1 13 ASN C C 0.585 -3.358 1.125 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 4 . 935 . 1 1 13 ASN CA C -0.177 -2.361 1.973 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 4 . 936 . 1 1 13 ASN CB C 0.160 -2.566 3.444 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 4 . 937 . 1 1 13 ASN CG C -0.643 -1.660 4.356 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 4 . 938 . 1 1 13 ASN H H -2.152 -2.987 2.384 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 4 . 939 . 1 1 13 ASN HA H 0.132 -1.376 1.676 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 4 . 940 . 1 1 13 ASN HB2 H -0.045 -3.591 3.712 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 4 . 941 . 1 1 13 ASN HB3 H 1.209 -2.360 3.592 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 4 . 942 . 1 1 13 ASN HD21 H 0.669 -1.935 5.825 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 4 . 943 . 1 1 13 ASN HD22 H -0.665 -0.899 6.193 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 4 . 944 . 1 1 13 ASN N N -1.612 -2.469 1.754 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 4 . 945 . 1 1 13 ASN ND2 N -0.165 -1.480 5.582 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 4 . 946 . 1 1 13 ASN O O 1.812 -3.396 1.165 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 4 . 947 . 1 1 13 ASN OD1 O -1.683 -1.129 3.966 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 4 . 948 . 1 1 14 TYS C C 1.517 -4.426 -1.463 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 4 . 949 . 1 1 14 TYS CA C 0.536 -5.121 -0.522 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 4 . 950 . 1 1 14 TYS CB C -0.471 -5.966 -1.313 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 4 . 951 . 1 1 14 TYS CD1 C -1.641 -3.839 -1.973 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 4 . 952 . 1 1 14 TYS CD2 C -2.846 -5.882 -2.096 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 4 . 953 . 1 1 14 TYS CE1 C -2.749 -3.151 -2.424 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 4 . 954 . 1 1 14 TYS CE2 C -3.958 -5.209 -2.545 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 4 . 955 . 1 1 14 TYS CG C -1.675 -5.210 -1.804 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 4 . 956 . 1 1 14 TYS CZ C -3.908 -3.841 -2.708 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 4 . 957 . 1 1 14 TYS H H -1.104 -4.081 0.327 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 4 . 958 . 1 1 14 TYS HA H 1.105 -5.762 0.120 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 4 . 959 . 1 1 14 TYS HB2 H -0.833 -6.766 -0.686 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 4 . 960 . 1 1 14 TYS HB3 H 0.022 -6.391 -2.173 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 4 . 961 . 1 1 14 TYS HD1 H -0.730 -3.310 -1.741 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 4 . 962 . 1 1 14 TYS HD2 H -2.881 -6.953 -1.966 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 4 . 963 . 1 1 14 TYS HE1 H -2.703 -2.082 -2.549 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 4 . 964 . 1 1 14 TYS HE2 H -4.856 -5.755 -2.763 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 4 . 965 . 1 1 14 TYS N N -0.127 -4.154 0.337 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 4 . 966 . 1 1 14 TYS O O 2.377 -5.071 -2.062 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 4 . 967 . 1 1 14 TYS O1 O -3.727 -2.939 -5.484 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 4 . 968 . 1 1 14 TYS O2 O -4.482 -0.962 -4.177 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 4 . 969 . 1 1 14 TYS O3 O -6.113 -2.458 -5.168 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 4 . 970 . 1 1 14 TYS OH O -4.973 -3.182 -3.278 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 4 . 971 . 1 1 14 TYS S S -4.733 -2.381 -4.557 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 4 . 972 . 1 1 15 TYR C C 3.747 -2.555 -1.844 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 4 . 973 . 1 1 15 TYR CA C 2.335 -2.324 -2.366 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 4 . 974 . 1 1 15 TYR CB C 1.962 -0.837 -2.301 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 4 . 975 . 1 1 15 TYR CD1 C 2.406 -0.484 0.159 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 4 . 976 . 1 1 15 TYR CD2 C 3.407 1.025 -1.390 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 4 . 977 . 1 1 15 TYR CE1 C 2.989 0.199 1.209 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 4 . 978 . 1 1 15 TYR CE2 C 3.993 1.714 -0.345 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 4 . 979 . 1 1 15 TYR CG C 2.604 -0.084 -1.156 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 4 . 980 . 1 1 15 TYR CZ C 3.782 1.297 0.952 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 4 . 981 . 1 1 15 TYR H H 0.743 -2.633 -1.021 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 4 . 982 . 1 1 15 TYR HA H 2.265 -2.674 -3.385 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 4 . 983 . 1 1 15 TYR HB2 H 2.261 -0.357 -3.221 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 4 . 984 . 1 1 15 TYR HB3 H 0.888 -0.754 -2.186 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 4 . 985 . 1 1 15 TYR HD1 H 1.786 -1.347 0.356 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 4 . 986 . 1 1 15 TYR HD2 H 3.570 1.349 -2.407 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 4 . 987 . 1 1 15 TYR HE1 H 2.822 -0.129 2.225 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 4 . 988 . 1 1 15 TYR HE2 H 4.614 2.575 -0.547 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 4 . 989 . 1 1 15 TYR HH H 4.701 1.354 2.640 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 4 . 990 . 1 1 15 TYR N N 1.420 -3.099 -1.548 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 4 . 991 . 1 1 15 TYR O O 4.728 -2.489 -2.583 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 4 . 992 . 1 1 15 TYR OH O 4.364 1.980 1.996 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 4 . 993 . 1 1 16 THR C C 5.381 -4.620 0.011 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 4 . 994 . 1 1 16 THR CA C 5.053 -3.137 0.138 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 4 . 995 . 1 1 16 THR CB C 4.912 -2.752 1.612 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 4 . 996 . 1 1 16 THR CG2 C 4.164 -3.780 2.440 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 4 . 997 . 1 1 16 THR H H 2.977 -2.900 -0.037 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 4 . 998 . 1 1 16 THR HA H 5.841 -2.553 -0.316 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 4 . 999 . 1 1 16 THR HB H 4.358 -1.828 1.670 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 4 . 1000 . 1 1 16 THR HG1 H 6.209 -1.688 2.624 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 4 . 1001 . 1 1 16 THR HG21 H 3.571 -3.276 3.188 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 4 . 1002 . 1 1 16 THR HG22 H 4.870 -4.439 2.921 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 4 . 1003 . 1 1 16 THR HG23 H 3.514 -4.355 1.797 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 4 . 1004 . 1 1 16 THR N N 3.810 -2.853 -0.549 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 4 . 1005 . 1 1 16 THR O O 6.546 -5.014 -0.029 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 4 . 1006 . 1 1 16 THR OG1 O 6.181 -2.554 2.210 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 4 . 1007 . 1 1 17 SER C C 5.029 -7.289 -1.517 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 4 . 1008 . 1 1 17 SER CA C 4.485 -6.881 -0.152 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 4 . 1009 . 1 1 17 SER CB C 3.152 -7.582 0.109 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 4 . 1010 . 1 1 17 SER H H 3.421 -5.047 0.008 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 4 . 1011 . 1 1 17 SER HA H 5.193 -7.187 0.597 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 4 . 1012 . 1 1 17 SER HB2 H 2.846 -7.402 1.130 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1013 . 1 1 17 SER HB3 H 2.403 -7.190 -0.564 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 4 . 1014 . 1 1 17 SER HG H 4.070 -9.300 0.313 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 4 . 1015 . 1 1 17 SER N N 4.329 -5.433 -0.041 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 4 . 1016 . 1 1 17 SER O O 5.399 -8.445 -1.724 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 4 . 1017 . 1 1 17 SER OG O 3.262 -8.980 -0.094 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 4 . 1018 . 1 1 18 GLU C C 7.120 -6.459 -3.810 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 4 . 1019 . 1 1 18 GLU CA C 5.602 -6.623 -3.779 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 4 . 1020 . 1 1 18 GLU CB C 4.940 -5.715 -4.818 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 4 . 1021 . 1 1 18 GLU CD C 3.103 -5.566 -6.546 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 4 . 1022 . 1 1 18 GLU CG C 4.089 -6.467 -5.829 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 4 . 1023 . 1 1 18 GLU H H 4.789 -5.439 -2.225 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 4 . 1024 . 1 1 18 GLU HA H 5.363 -7.651 -4.011 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 4 . 1025 . 1 1 18 GLU HB2 H 4.308 -5.004 -4.307 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1026 . 1 1 18 GLU HB3 H 5.709 -5.179 -5.356 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 4 . 1027 . 1 1 18 GLU HG2 H 4.740 -6.920 -6.562 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 4 . 1028 . 1 1 18 GLU HG3 H 3.538 -7.240 -5.312 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 4 . 1029 . 1 1 18 GLU N N 5.088 -6.342 -2.445 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 4 . 1030 . 1 1 18 GLU O O 7.844 -7.399 -4.139 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 4 . 1031 . 1 1 18 GLU OE1 O 1.999 -5.345 -6.007 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 4 . 1032 . 1 1 18 GLU OE2 O 3.436 -5.082 -7.649 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 4 . 1033 . 1 1 19 PRO C C 9.798 -5.660 -2.301 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 4 . 1034 . 1 1 19 PRO CA C 9.067 -4.980 -3.457 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 4 . 1035 . 1 1 19 PRO CB C 9.148 -3.454 -3.298 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 4 . 1036 . 1 1 19 PRO CD C 6.861 -4.081 -3.073 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 4 . 1037 . 1 1 19 PRO CG C 7.757 -2.955 -3.492 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 4 . 1038 . 1 1 19 PRO HA H 9.519 -5.267 -4.388 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 4 . 1039 . 1 1 19 PRO HB2 H 9.514 -3.212 -2.308 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1040 . 1 1 19 PRO HB3 H 9.819 -3.052 -4.045 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 4 . 1041 . 1 1 19 PRO HD2 H 6.699 -4.061 -2.008 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 4 . 1042 . 1 1 19 PRO HD3 H 5.930 -4.034 -3.604 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 4 . 1043 . 1 1 19 PRO HG2 H 7.587 -2.088 -2.871 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 4 . 1044 . 1 1 19 PRO HG3 H 7.594 -2.713 -4.531 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 4 . 1045 . 1 1 19 PRO N N 7.630 -5.259 -3.466 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 4 . 1046 . 1 1 19 PRO O O 10.633 -5.041 -1.639 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 4 . 1047 . 1 1 20 ALA C C 11.647 -7.583 -1.064 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 4 . 1048 . 1 1 20 ALA CA C 10.129 -7.677 -0.977 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 4 . 1049 . 1 1 20 ALA CB C 9.684 -9.131 -1.001 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 4 . 1050 . 1 1 20 ALA H H 8.821 -7.376 -2.611 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 4 . 1051 . 1 1 20 ALA HA H 9.813 -7.243 -0.048 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 4 . 1052 . 1 1 20 ALA HB1 H 10.236 -9.689 -0.259 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 4 . 1053 . 1 1 20 ALA HB2 H 9.872 -9.549 -1.979 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1054 . 1 1 20 ALA HB3 H 8.628 -9.188 -0.782 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 4 . 1055 . 1 1 20 ALA N N 9.490 -6.931 -2.057 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 4 . 1056 . 1 1 20 ALA O O 12.349 -7.691 -0.057 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 4 . 1057 . 1 1 21 GLN C C 14.029 -5.810 -2.323 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 4 . 1058 . 1 1 21 GLN CA C 13.572 -7.253 -2.511 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 4 . 1059 . 1 1 21 GLN CB C 13.919 -7.733 -3.921 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 4 . 1060 . 1 1 21 GLN CD C 15.458 -9.735 -3.976 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 4 . 1061 . 1 1 21 GLN CG C 14.025 -9.245 -4.040 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 4 . 1062 . 1 1 21 GLN H H 11.520 -7.292 -3.023 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 4 . 1063 . 1 1 21 GLN HA H 14.081 -7.876 -1.792 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 4 . 1064 . 1 1 21 GLN HB2 H 13.154 -7.393 -4.603 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1065 . 1 1 21 GLN HE21 H 15.046 -10.808 -2.354 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 4 . 1066 . 1 1 21 GLN HE22 H 16.676 -10.895 -2.917 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 4 . 1067 . 1 1 21 GLN HG2 H 13.471 -9.697 -3.231 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 4 . 1068 . 1 1 21 GLN N N 12.139 -7.374 -2.273 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 4 . 1069 . 1 1 21 GLN NE2 N 15.757 -10.563 -2.982 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 4 . 1070 . 1 1 21 GLN O O 15.143 -5.555 -1.865 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 4 . 1071 . 1 1 21 GLN OE1 O 16.287 -9.374 -4.811 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 4 . 1072 . 1 1 22 LYS C C 13.728 -3.081 -1.095 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 4 . 1073 . 1 1 22 LYS CA C 13.469 -3.451 -2.552 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 4 . 1074 . 1 1 22 LYS CB C 12.321 -2.605 -3.108 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 4 . 1075 . 1 1 22 LYS CD C 13.025 -0.645 -4.517 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 4 . 1076 . 1 1 22 LYS CE C 14.429 -1.107 -4.875 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 4 . 1077 . 1 1 22 LYS CG C 12.618 -1.115 -3.129 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 4 . 1078 . 1 1 22 LYS H H 12.287 -5.138 -3.039 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 4 . 1079 . 1 1 22 LYS HA H 14.360 -3.253 -3.127 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 4 . 1080 . 1 1 22 LYS HB2 H 12.113 -2.923 -4.119 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 4 . 1081 . 1 1 22 LYS HB3 H 11.444 -2.767 -2.500 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 4 . 1082 . 1 1 22 LYS HD2 H 12.330 -1.045 -5.239 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 4 . 1083 . 1 1 22 LYS HD3 H 12.992 0.435 -4.544 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 4 . 1084 . 1 1 22 LYS HE2 H 14.975 -0.271 -5.286 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 4 . 1085 . 1 1 22 LYS HE3 H 14.921 -1.451 -3.977 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 4 . 1086 . 1 1 22 LYS HG2 H 11.735 -0.577 -2.823 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 4 . 1087 . 1 1 22 LYS HG3 H 13.424 -0.909 -2.438 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 4 . 1088 . 1 1 22 LYS HZ1 H 14.318 -1.825 -6.834 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 4 . 1089 . 1 1 22 LYS HZ2 H 13.611 -2.849 -5.687 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 4 . 1090 . 1 1 22 LYS HZ3 H 15.295 -2.758 -5.816 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 4 . 1091 . 1 1 22 LYS N N 13.159 -4.870 -2.681 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 4 . 1092 . 1 1 22 LYS NZ N 14.412 -2.212 -5.873 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 4 . 1093 . 1 1 22 LYS O O 14.851 -2.740 -0.722 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 4 . 1094 . 1 1 23 ILE C C 12.943 -4.083 1.984 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 4 . 1095 . 1 1 23 ILE CA C 12.797 -2.822 1.138 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 4 . 1096 . 1 1 23 ILE CB C 11.575 -2.025 1.632 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 4 . 1097 . 1 1 23 ILE CD1 C 9.905 -0.257 0.885 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 4 . 1098 . 1 1 23 ILE CG1 C 11.273 -0.869 0.678 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 4 . 1099 . 1 1 23 ILE CG2 C 11.816 -1.507 3.042 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 4 . 1100 . 1 1 23 ILE H H 11.814 -3.429 -0.635 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 4 . 1101 . 1 1 23 ILE HA H 13.678 -2.210 1.269 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 4 . 1102 . 1 1 23 ILE HB H 10.726 -2.692 1.661 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 4 . 1103 . 1 1 23 ILE HD11 H 9.298 -0.423 0.007 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 4 . 1104 . 1 1 23 ILE HD12 H 10.009 0.806 1.055 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 4 . 1105 . 1 1 23 ILE HD13 H 9.431 -0.713 1.742 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 4 . 1106 . 1 1 23 ILE HG12 H 12.009 -0.092 0.819 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 4 . 1107 . 1 1 23 ILE HG13 H 11.326 -1.228 -0.340 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 4 . 1108 . 1 1 23 ILE HG21 H 12.873 -1.344 3.190 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 4 . 1109 . 1 1 23 ILE HG22 H 11.459 -2.232 3.758 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 4 . 1110 . 1 1 23 ILE HG23 H 11.286 -0.576 3.179 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 4 . 1111 . 1 1 23 ILE N N 12.683 -3.151 -0.278 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 4 . 1112 . 1 1 23 ILE O O 11.963 -4.595 2.525 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 5 . 1113 . 1 1 7 SER C C -10.550 0.002 5.404 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 5 . 1114 . 1 1 7 SER CA C -11.506 1.133 5.741 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 5 . 1115 . 1 1 7 SER CB C -10.784 2.208 6.541 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 5 . 1116 . 1 1 7 SER H H -12.998 1.281 7.219 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 5 . 1117 . 1 1 7 SER HA H -11.860 1.562 4.825 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 5 . 1118 . 1 1 7 SER HB2 H -11.330 2.375 7.462 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1119 . 1 1 7 SER HB3 H -9.782 1.877 6.771 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1120 . 1 1 7 SER HG H -10.226 4.075 6.332 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 5 . 1121 . 1 1 7 SER N N -12.646 0.684 6.527 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 5 . 1122 . 1 1 7 SER O O -9.627 -0.281 6.160 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 5 . 1123 . 1 1 7 SER OG O -10.716 3.427 5.820 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 5 . 1124 . 1 1 8 PRO C C -8.608 -1.156 3.127 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 5 . 1125 . 1 1 8 PRO CA C -9.863 -1.707 3.772 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 5 . 1126 . 1 1 8 PRO CB C -10.717 -2.426 2.745 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 5 . 1127 . 1 1 8 PRO CD C -11.781 -0.332 3.229 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 5 . 1128 . 1 1 8 PRO CG C -11.511 -1.330 2.127 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 5 . 1129 . 1 1 8 PRO HA H -9.597 -2.366 4.568 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 5 . 1130 . 1 1 8 PRO HB2 H -10.079 -2.918 2.022 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1131 . 1 1 8 PRO HB3 H -11.354 -3.149 3.236 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1132 . 1 1 8 PRO HD2 H -11.677 0.677 2.855 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1133 . 1 1 8 PRO HD3 H -12.767 -0.483 3.639 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 5 . 1134 . 1 1 8 PRO HG2 H -10.934 -0.870 1.341 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 5 . 1135 . 1 1 8 PRO HG3 H -12.437 -1.721 1.738 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 5 . 1136 . 1 1 8 PRO N N -10.736 -0.633 4.229 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 5 . 1137 . 1 1 8 PRO O O -7.889 -1.858 2.416 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 5 . 1138 . 1 1 9 ILE C C -5.957 0.339 3.602 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 5 . 1139 . 1 1 9 ILE CA C -7.194 0.792 2.869 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 5 . 1140 . 1 1 9 ILE CB C -7.339 2.332 2.950 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 5 . 1141 . 1 1 9 ILE CD1 C -7.574 2.433 5.492 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1142 . 1 1 9 ILE CG1 C -6.798 2.890 4.276 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 5 . 1143 . 1 1 9 ILE CG2 C -8.799 2.726 2.780 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 5 . 1144 . 1 1 9 ILE H H -8.966 0.595 3.977 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 5 . 1145 . 1 1 9 ILE HA H -7.097 0.511 1.843 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 5 . 1146 . 1 1 9 ILE HB H -6.777 2.762 2.132 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 5 . 1147 . 1 1 9 ILE HD11 H -7.027 1.651 5.997 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 5 . 1148 . 1 1 9 ILE HD12 H -8.538 2.059 5.185 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 5 . 1149 . 1 1 9 ILE HD13 H -7.710 3.267 6.165 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 5 . 1150 . 1 1 9 ILE HG12 H -5.769 2.577 4.401 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 5 . 1151 . 1 1 9 ILE HG13 H -6.839 3.972 4.243 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 5 . 1152 . 1 1 9 ILE HG21 H -9.214 2.208 1.928 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 5 . 1153 . 1 1 9 ILE HG22 H -8.870 3.792 2.625 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 5 . 1154 . 1 1 9 ILE HG23 H -9.349 2.452 3.670 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 5 . 1155 . 1 1 9 ILE N N -8.356 0.111 3.398 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 5 . 1156 . 1 1 9 ILE O O -4.847 0.406 3.083 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 5 . 1157 . 1 1 10 TYS C C -4.488 -1.912 5.029 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 5 . 1158 . 1 1 10 TYS CA C -5.049 -0.617 5.610 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 5 . 1159 . 1 1 10 TYS CB C -5.424 -0.799 7.086 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 5 . 1160 . 1 1 10 TYS CD1 C -7.447 -0.989 8.506 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1161 . 1 1 10 TYS CD2 C -7.439 -2.168 6.449 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 5 . 1162 . 1 1 10 TYS CE1 C -8.699 -1.463 8.787 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 5 . 1163 . 1 1 10 TYS CE2 C -8.702 -2.651 6.718 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 5 . 1164 . 1 1 10 TYS CG C -6.798 -1.333 7.341 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 5 . 1165 . 1 1 10 TYS CZ C -9.332 -2.297 7.893 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 5 . 1166 . 1 1 10 TYS H H -7.086 -0.163 5.157 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 5 . 1167 . 1 1 10 TYS HA H -4.280 0.126 5.544 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 5 . 1168 . 1 1 10 TYS HB2 H -5.367 0.155 7.586 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1169 . 1 1 10 TYS HB3 H -4.724 -1.476 7.546 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1170 . 1 1 10 TYS HD1 H -6.950 -0.335 9.205 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 5 . 1171 . 1 1 10 TYS HD2 H -6.945 -2.433 5.529 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1172 . 1 1 10 TYS HE1 H -9.176 -1.171 9.699 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 5 . 1173 . 1 1 10 TYS HE2 H -9.188 -3.298 6.012 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 5 . 1174 . 1 1 10 TYS N N -6.164 -0.135 4.810 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 5 . 1175 . 1 1 10 TYS O O -3.372 -2.317 5.354 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 5 . 1176 . 1 1 10 TYS O1 O -10.333 -5.136 7.010 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 5 . 1177 . 1 1 10 TYS O2 O -9.596 -4.894 9.374 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 5 . 1178 . 1 1 10 TYS O3 O -11.941 -4.662 8.803 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 5 . 1179 . 1 1 10 TYS OH O -10.504 -2.920 8.253 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 5 . 1180 . 1 1 10 TYS S S -10.531 -4.448 8.304 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 5 . 1181 . 1 1 11 ASP C C -4.040 -3.469 2.226 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 5 . 1182 . 1 1 11 ASP CA C -4.827 -3.773 3.499 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 5 . 1183 . 1 1 11 ASP CB C -6.031 -4.656 3.167 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 5 . 1184 . 1 1 11 ASP CG C -6.142 -5.852 4.094 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 5 . 1185 . 1 1 11 ASP H H -6.127 -2.166 3.910 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 5 . 1186 . 1 1 11 ASP HA H -4.185 -4.299 4.187 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 5 . 1187 . 1 1 11 ASP HB2 H -6.936 -4.070 3.255 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1188 . 1 1 11 ASP HB3 H -5.933 -5.019 2.151 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1189 . 1 1 11 ASP N N -5.258 -2.545 4.146 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 5 . 1190 . 1 1 11 ASP O O -3.515 -4.377 1.583 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 5 . 1191 . 1 1 11 ASP OD1 O -5.394 -6.832 3.890 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 5 . 1192 . 1 1 11 ASP OD2 O -6.977 -5.809 5.021 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 5 . 1193 . 1 1 12 ILE C C -1.765 -1.573 0.906 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 5 . 1194 . 1 1 12 ILE CA C -3.253 -1.792 0.645 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 5 . 1195 . 1 1 12 ILE CB C -3.860 -0.526 0.001 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 5 . 1196 . 1 1 12 ILE CD1 C -2.359 1.524 0.165 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1197 . 1 1 12 ILE CG1 C -3.485 0.730 0.790 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 5 . 1198 . 1 1 12 ILE CG2 C -5.372 -0.656 -0.108 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 5 . 1199 . 1 1 12 ILE H H -4.414 -1.501 2.399 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 5 . 1200 . 1 1 12 ILE HA H -3.354 -2.599 -0.061 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 5 . 1201 . 1 1 12 ILE HB H -3.463 -0.441 -1.001 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 5 . 1202 . 1 1 12 ILE HD11 H -2.732 2.484 -0.158 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 5 . 1203 . 1 1 12 ILE HD12 H -1.968 0.985 -0.686 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 5 . 1204 . 1 1 12 ILE HD13 H -1.573 1.668 0.891 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 5 . 1205 . 1 1 12 ILE HG12 H -4.346 1.373 0.855 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 5 . 1206 . 1 1 12 ILE HG13 H -3.180 0.446 1.785 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 5 . 1207 . 1 1 12 ILE HG21 H -5.824 0.323 -0.032 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 5 . 1208 . 1 1 12 ILE HG22 H -5.739 -1.284 0.690 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 5 . 1209 . 1 1 12 ILE HG23 H -5.628 -1.096 -1.060 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 5 . 1210 . 1 1 12 ILE N N -3.970 -2.188 1.855 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 5 . 1211 . 1 1 12 ILE O O -1.078 -0.928 0.114 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 5 . 1212 . 1 1 13 ASN C C 0.966 -3.074 1.670 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 5 . 1213 . 1 1 13 ASN CA C 0.146 -2.000 2.346 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 5 . 1214 . 1 1 13 ASN CB C 0.345 -2.067 3.852 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 5 . 1215 . 1 1 13 ASN CG C -0.262 -3.316 4.463 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 5 . 1216 . 1 1 13 ASN H H -1.851 -2.641 2.596 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 5 . 1217 . 1 1 13 ASN HA H 0.494 -1.052 1.986 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 5 . 1218 . 1 1 13 ASN HB2 H 1.402 -2.063 4.062 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1219 . 1 1 13 ASN HB3 H -0.116 -1.205 4.304 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1220 . 1 1 13 ASN HD21 H 1.516 -3.867 5.164 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 5 . 1221 . 1 1 13 ASN HD22 H 0.205 -4.935 5.518 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 5 . 1222 . 1 1 13 ASN N N -1.264 -2.127 2.006 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 5 . 1223 . 1 1 13 ASN ND2 N 0.571 -4.121 5.114 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 5 . 1224 . 1 1 13 ASN O O 2.194 -3.039 1.703 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 5 . 1225 . 1 1 13 ASN OD1 O -1.463 -3.555 4.350 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 5 . 1226 . 1 1 14 TYS C C 1.846 -4.496 -0.786 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 5 . 1227 . 1 1 14 TYS CA C 0.985 -5.073 0.333 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 5 . 1228 . 1 1 14 TYS CB C 0.002 -6.117 -0.202 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 5 . 1229 . 1 1 14 TYS CD1 C -1.797 -6.468 -1.906 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1230 . 1 1 14 TYS CD2 C -1.179 -4.231 -1.390 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 5 . 1231 . 1 1 14 TYS CE1 C -2.735 -6.009 -2.800 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 5 . 1232 . 1 1 14 TYS CE2 C -2.115 -3.761 -2.285 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 5 . 1233 . 1 1 14 TYS CG C -1.006 -5.590 -1.188 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 5 . 1234 . 1 1 14 TYS CZ C -2.894 -4.653 -2.990 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 5 . 1235 . 1 1 14 TYS H H -0.687 -3.986 1.025 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 5 . 1236 . 1 1 14 TYS HA H 1.643 -5.539 1.043 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 5 . 1237 . 1 1 14 TYS HB2 H -0.552 -6.529 0.623 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1238 . 1 1 14 TYS HB3 H 0.553 -6.906 -0.685 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1239 . 1 1 14 TYS HD1 H -1.671 -7.529 -1.756 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 5 . 1240 . 1 1 14 TYS HD2 H -0.569 -3.538 -0.836 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1241 . 1 1 14 TYS HE1 H -3.340 -6.711 -3.342 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 5 . 1242 . 1 1 14 TYS HE2 H -2.234 -2.701 -2.426 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 5 . 1243 . 1 1 14 TYS N N 0.292 -4.016 1.035 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 5 . 1244 . 1 1 14 TYS O O 2.709 -5.182 -1.330 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 5 . 1245 . 1 1 14 TYS O1 O -2.448 -3.632 -5.790 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 5 . 1246 . 1 1 14 TYS O2 O -3.429 -1.860 -4.348 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 5 . 1247 . 1 1 14 TYS O3 O -4.873 -3.269 -5.692 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 5 . 1248 . 1 1 14 TYS OH O -3.916 -4.189 -3.786 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 5 . 1249 . 1 1 14 TYS S S -3.573 -3.227 -4.923 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 5 . 1250 . 1 1 15 TYR C C 3.906 -2.630 -1.678 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 5 . 1251 . 1 1 15 TYR CA C 2.442 -2.532 -2.089 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 5 . 1252 . 1 1 15 TYR CB C 1.997 -1.067 -2.198 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 5 . 1253 . 1 1 15 TYR CD1 C 2.645 -0.309 0.123 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1254 . 1 1 15 TYR CD2 C 3.450 0.949 -1.735 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 5 . 1255 . 1 1 15 TYR CE1 C 3.293 0.550 0.991 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 5 . 1256 . 1 1 15 TYR CE2 C 4.102 1.812 -0.875 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 5 . 1257 . 1 1 15 TYR CG C 2.712 -0.125 -1.252 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 5 . 1258 . 1 1 15 TYR CZ C 4.020 1.608 0.487 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 5 . 1259 . 1 1 15 TYR H H 0.976 -2.703 -0.591 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 5 . 1260 . 1 1 15 TYR HA H 2.299 -3.029 -3.037 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 5 . 1261 . 1 1 15 TYR HB2 H 2.169 -0.717 -3.205 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1262 . 1 1 15 TYR HB3 H 0.938 -1.010 -1.976 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1263 . 1 1 15 TYR HD1 H 2.075 -1.139 0.514 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 5 . 1264 . 1 1 15 TYR HD2 H 3.512 1.106 -2.802 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1265 . 1 1 15 TYR HE1 H 3.229 0.390 2.057 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 5 . 1266 . 1 1 15 TYR HE2 H 4.671 2.640 -1.269 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 5 . 1267 . 1 1 15 TYR HH H 4.053 2.768 2.020 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 5 . 1268 . 1 1 15 TYR N N 1.644 -3.212 -1.086 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 5 . 1269 . 1 1 15 TYR O O 4.812 -2.666 -2.510 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 5 . 1270 . 1 1 15 TYR OH O 4.667 2.465 1.347 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 5 . 1271 . 1 1 16 THR C C 5.790 -4.309 0.316 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 5 . 1272 . 1 1 16 THR CA C 5.415 -2.835 0.232 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 5 . 1273 . 1 1 16 THR CB C 5.398 -2.213 1.630 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 5 . 1274 . 1 1 16 THR CG2 C 4.739 -3.089 2.679 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 5 . 1275 . 1 1 16 THR H H 3.322 -2.689 0.227 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 5 . 1276 . 1 1 16 THR HA H 6.131 -2.316 -0.388 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 5 . 1277 . 1 1 16 THR HB H 4.837 -1.293 1.584 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 5 . 1278 . 1 1 16 THR HG1 H 6.671 -1.292 2.799 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 5 . 1279 . 1 1 16 THR HG21 H 4.140 -2.476 3.336 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 5 . 1280 . 1 1 16 THR HG22 H 5.499 -3.597 3.254 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 5 . 1281 . 1 1 16 THR HG23 H 4.107 -3.818 2.195 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 5 . 1282 . 1 1 16 THR N N 4.101 -2.704 -0.365 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 5 . 1283 . 1 1 16 THR O O 6.963 -4.675 0.248 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 5 . 1284 . 1 1 16 THR OG1 O 6.710 -1.919 2.072 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 5 . 1285 . 1 1 17 SER C C 5.395 -7.206 -0.750 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 5 . 1286 . 1 1 17 SER CA C 4.972 -6.589 0.582 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 5 . 1287 . 1 1 17 SER CB C 3.701 -7.269 1.092 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 5 . 1288 . 1 1 17 SER H H 3.853 -4.783 0.537 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 5 . 1289 . 1 1 17 SER HA H 5.763 -6.751 1.293 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 5 . 1290 . 1 1 17 SER HB2 H 3.298 -6.700 1.916 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1291 . 1 1 17 SER HB3 H 2.974 -7.312 0.294 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1292 . 1 1 17 SER HG H 4.163 -9.147 0.780 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 5 . 1293 . 1 1 17 SER N N 4.770 -5.148 0.476 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 5 . 1294 . 1 1 17 SER O O 5.771 -8.378 -0.801 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 5 . 1295 . 1 1 17 SER OG O 3.970 -8.587 1.536 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 5 . 1296 . 1 1 18 GLU C C 7.244 -6.747 -3.338 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 5 . 1297 . 1 1 18 GLU CA C 5.740 -6.922 -3.135 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 5 . 1298 . 1 1 18 GLU CB C 4.968 -6.226 -4.267 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 5 . 1299 . 1 1 18 GLU CD C 2.893 -4.973 -4.977 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 5 . 1300 . 1 1 18 GLU CG C 3.705 -5.512 -3.815 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 5 . 1301 . 1 1 18 GLU H H 5.048 -5.496 -1.725 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 5 . 1302 . 1 1 18 GLU HA H 5.516 -7.978 -3.160 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 5 . 1303 . 1 1 18 GLU HB2 H 5.615 -5.502 -4.737 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1304 . 1 1 18 GLU HB3 H 4.690 -6.970 -5.000 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1305 . 1 1 18 GLU HG2 H 3.092 -6.207 -3.262 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 5 . 1306 . 1 1 18 GLU HG3 H 3.981 -4.687 -3.175 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 5 . 1307 . 1 1 18 GLU N N 5.345 -6.423 -1.821 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 5 . 1308 . 1 1 18 GLU O O 7.955 -7.716 -3.604 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 5 . 1309 . 1 1 18 GLU OE1 O 2.207 -5.775 -5.646 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 5 . 1310 . 1 1 18 GLU OE2 O 2.943 -3.748 -5.219 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 5 . 1311 . 1 1 19 PRO C C 10.046 -5.755 -2.247 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 5 . 1312 . 1 1 19 PRO CA C 9.182 -5.216 -3.387 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 5 . 1313 . 1 1 19 PRO CB C 9.249 -3.681 -3.408 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 5 . 1314 . 1 1 19 PRO CD C 7.002 -4.287 -2.915 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 5 . 1315 . 1 1 19 PRO CG C 7.839 -3.226 -3.563 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 5 . 1316 . 1 1 19 PRO HA H 9.541 -5.601 -4.323 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 5 . 1317 . 1 1 19 PRO HB2 H 9.674 -3.325 -2.478 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1318 . 1 1 19 PRO HB3 H 9.862 -3.359 -4.240 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1319 . 1 1 19 PRO HD2 H 6.939 -4.123 -1.853 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1320 . 1 1 19 PRO HD3 H 6.026 -4.319 -3.357 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 5 . 1321 . 1 1 19 PRO HG2 H 7.699 -2.280 -3.062 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 5 . 1322 . 1 1 19 PRO HG3 H 7.591 -3.141 -4.610 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 5 . 1323 . 1 1 19 PRO N N 7.757 -5.506 -3.215 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 5 . 1324 . 1 1 19 PRO O O 10.960 -5.074 -1.783 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 5 . 1325 . 1 1 20 ALA C C 12.014 -7.593 -1.035 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 5 . 1326 . 1 1 20 ALA CA C 10.526 -7.584 -0.716 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 5 . 1327 . 1 1 20 ALA CB C 10.028 -8.995 -0.444 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 5 . 1328 . 1 1 20 ALA H H 9.027 -7.475 -2.202 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 5 . 1329 . 1 1 20 ALA HA H 10.369 -6.995 0.168 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 5 . 1330 . 1 1 20 ALA HB1 H 10.444 -9.351 0.487 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 5 . 1331 . 1 1 20 ALA HB2 H 10.336 -9.647 -1.248 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1332 . 1 1 20 ALA HB3 H 8.951 -8.991 -0.378 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1333 . 1 1 20 ALA N N 9.761 -6.974 -1.799 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 5 . 1334 . 1 1 20 ALA O O 12.857 -7.601 -0.138 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 5 . 1335 . 1 1 21 GLN C C 14.232 -6.148 -2.873 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 5 . 1336 . 1 1 21 GLN CA C 13.705 -7.576 -2.782 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 5 . 1337 . 1 1 21 GLN CB C 13.814 -8.262 -4.145 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 5 . 1338 . 1 1 21 GLN CD C 12.158 -9.974 -4.992 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 5 . 1339 . 1 1 21 GLN CG C 13.379 -9.719 -4.129 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 5 . 1340 . 1 1 21 GLN H H 11.599 -7.566 -2.977 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 5 . 1341 . 1 1 21 GLN HA H 14.297 -8.122 -2.064 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 5 . 1342 . 1 1 21 GLN HB2 H 13.194 -7.731 -4.853 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1343 . 1 1 21 GLN HE21 H 10.961 -9.407 -3.508 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 5 . 1344 . 1 1 21 GLN HE22 H 10.171 -9.888 -4.966 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 5 . 1345 . 1 1 21 GLN HG2 H 14.192 -10.327 -4.496 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 5 . 1346 . 1 1 21 GLN N N 12.322 -7.580 -2.321 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 5 . 1347 . 1 1 21 GLN NE2 N 10.978 -9.732 -4.432 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 5 . 1348 . 1 1 21 GLN O O 15.418 -5.897 -2.664 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 5 . 1349 . 1 1 21 GLN OE1 O 12.273 -10.384 -6.147 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 5 . 1350 . 1 1 22 LYS C C 14.205 -3.264 -1.972 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 5 . 1351 . 1 1 22 LYS CA C 13.704 -3.809 -3.304 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 5 . 1352 . 1 1 22 LYS CB C 12.509 -2.984 -3.779 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 5 . 1353 . 1 1 22 LYS CD C 11.862 -0.561 -3.584 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 5 . 1354 . 1 1 22 LYS CE C 12.280 0.874 -3.865 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 5 . 1355 . 1 1 22 LYS CG C 12.871 -1.553 -4.141 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 5 . 1356 . 1 1 22 LYS H H 12.405 -5.478 -3.338 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 5 . 1357 . 1 1 22 LYS HA H 14.495 -3.732 -4.033 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 5 . 1358 . 1 1 22 LYS HB2 H 12.081 -3.457 -4.649 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 5 . 1359 . 1 1 22 LYS HB3 H 11.769 -2.958 -2.993 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 5 . 1360 . 1 1 22 LYS HD2 H 10.902 -0.742 -4.043 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 5 . 1361 . 1 1 22 LYS HD3 H 11.785 -0.702 -2.516 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 5 . 1362 . 1 1 22 LYS HE2 H 12.499 0.972 -4.919 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 5 . 1363 . 1 1 22 LYS HE3 H 11.461 1.530 -3.607 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 5 . 1364 . 1 1 22 LYS HG2 H 13.845 -1.326 -3.733 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 5 . 1365 . 1 1 22 LYS HG3 H 12.899 -1.460 -5.217 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 5 . 1366 . 1 1 22 LYS HZ1 H 14.017 0.420 -2.797 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 5 . 1367 . 1 1 22 LYS HZ2 H 13.199 1.789 -2.228 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 5 . 1368 . 1 1 22 LYS HZ3 H 14.101 1.875 -3.656 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 5 . 1369 . 1 1 22 LYS N N 13.337 -5.215 -3.186 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 5 . 1370 . 1 1 22 LYS NZ N 13.483 1.267 -3.081 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 5 . 1371 . 1 1 22 LYS O O 15.195 -2.535 -1.919 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 5 . 1372 . 1 1 23 ILE C C 14.111 -4.360 1.365 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 5 . 1373 . 1 1 23 ILE CA C 13.876 -3.174 0.438 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 5 . 1374 . 1 1 23 ILE CB C 12.792 -2.259 1.047 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 5 . 1375 . 1 1 23 ILE CD1 C 10.822 -3.438 2.148 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 5 . 1376 . 1 1 23 ILE CG1 C 11.398 -2.872 0.869 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 5 . 1377 . 1 1 23 ILE CG2 C 12.852 -0.877 0.413 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 5 . 1378 . 1 1 23 ILE H H 12.732 -4.208 -1.012 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 5 . 1379 . 1 1 23 ILE HA H 14.791 -2.607 0.358 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 5 . 1380 . 1 1 23 ILE HB H 12.998 -2.151 2.100 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 5 . 1381 . 1 1 23 ILE HD11 H 9.781 -3.161 2.228 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 5 . 1382 . 1 1 23 ILE HD12 H 11.365 -3.043 2.994 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 5 . 1383 . 1 1 23 ILE HD13 H 10.909 -4.515 2.136 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 5 . 1384 . 1 1 23 ILE HG12 H 10.721 -2.110 0.512 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 5 . 1385 . 1 1 23 ILE HG13 H 11.448 -3.669 0.145 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 5 . 1386 . 1 1 23 ILE HG21 H 12.004 -0.294 0.740 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 5 . 1387 . 1 1 23 ILE HG22 H 12.829 -0.972 -0.663 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 5 . 1388 . 1 1 23 ILE HG23 H 13.765 -0.383 0.711 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 5 . 1389 . 1 1 23 ILE N N 13.509 -3.624 -0.900 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 5 . 1390 . 1 1 23 ILE O O 13.257 -4.705 2.182 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 6 . 1391 . 1 1 7 SER C C -10.721 0.116 5.708 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 6 . 1392 . 1 1 7 SER CA C -11.821 1.171 5.891 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 6 . 1393 . 1 1 7 SER CB C -12.551 0.946 7.204 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 6 . 1394 . 1 1 7 SER H H -13.623 0.666 4.927 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 6 . 1395 . 1 1 7 SER HA H -11.347 2.141 5.921 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 6 . 1396 . 1 1 7 SER HB2 H -13.613 0.881 6.999 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1397 . 1 1 7 SER HB3 H -12.212 0.024 7.651 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1398 . 1 1 7 SER HG H -11.754 1.710 8.823 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 6 . 1399 . 1 1 7 SER N N -12.803 1.188 4.824 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 6 . 1400 . 1 1 7 SER O O -9.749 0.131 6.458 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 6 . 1401 . 1 1 7 SER OG O -12.322 2.012 8.110 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 6 . 1402 . 1 1 8 PRO C C -8.691 -1.276 3.585 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 6 . 1403 . 1 1 8 PRO CA C -9.774 -1.801 4.503 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 6 . 1404 . 1 1 8 PRO CB C -10.531 -2.936 3.839 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 6 . 1405 . 1 1 8 PRO CD C -11.878 -0.938 3.712 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 6 . 1406 . 1 1 8 PRO CG C -11.558 -2.244 3.014 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 6 . 1407 . 1 1 8 PRO HA H -9.340 -2.132 5.424 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 6 . 1408 . 1 1 8 PRO HB2 H -9.851 -3.516 3.227 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1409 . 1 1 8 PRO HB3 H -10.985 -3.564 4.593 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1410 . 1 1 8 PRO HD2 H -11.837 -0.123 3.006 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1411 . 1 1 8 PRO HD3 H -12.850 -0.990 4.182 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 6 . 1412 . 1 1 8 PRO HG2 H -11.156 -2.048 2.032 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 6 . 1413 . 1 1 8 PRO HG3 H -12.442 -2.857 2.942 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 6 . 1414 . 1 1 8 PRO N N -10.811 -0.803 4.716 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 6 . 1415 . 1 1 8 PRO O O -8.056 -2.028 2.846 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 6 . 1416 . 1 1 9 ILE C C -6.120 0.362 3.294 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 6 . 1417 . 1 1 9 ILE CA C -7.511 0.687 2.817 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 6 . 1418 . 1 1 9 ILE CB C -7.721 2.210 2.808 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 6 . 1419 . 1 1 9 ILE CD1 C -5.891 3.117 4.337 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1420 . 1 1 9 ILE CG1 C -7.365 2.819 4.168 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 6 . 1421 . 1 1 9 ILE CG2 C -9.163 2.526 2.453 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 6 . 1422 . 1 1 9 ILE H H -9.044 0.565 4.245 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 6 . 1423 . 1 1 9 ILE HA H -7.620 0.323 1.823 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 6 . 1424 . 1 1 9 ILE HB H -7.083 2.630 2.048 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 6 . 1425 . 1 1 9 ILE HD11 H -5.531 2.648 5.241 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 6 . 1426 . 1 1 9 ILE HD12 H -5.745 4.185 4.403 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 6 . 1427 . 1 1 9 ILE HD13 H -5.346 2.729 3.488 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 6 . 1428 . 1 1 9 ILE HG12 H -7.906 3.748 4.291 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 6 . 1429 . 1 1 9 ILE HG13 H -7.656 2.129 4.951 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 6 . 1430 . 1 1 9 ILE HG21 H -9.259 2.623 1.382 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 6 . 1431 . 1 1 9 ILE HG22 H -9.456 3.450 2.929 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 6 . 1432 . 1 1 9 ILE HG23 H -9.799 1.725 2.802 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 6 . 1433 . 1 1 9 ILE N N -8.500 0.030 3.637 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 6 . 1434 . 1 1 9 ILE O O -5.192 0.221 2.505 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 6 . 1435 . 1 1 10 TYS C C -4.196 -1.446 4.687 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 6 . 1436 . 1 1 10 TYS CA C -4.696 -0.091 5.182 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 6 . 1437 . 1 1 10 TYS CB C -4.725 -0.062 6.712 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 6 . 1438 . 1 1 10 TYS CD1 C -6.431 0.247 8.480 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1439 . 1 1 10 TYS CD2 C -6.874 -1.361 6.791 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 6 . 1440 . 1 1 10 TYS CE1 C -7.621 -0.041 9.086 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 6 . 1441 . 1 1 10 TYS CE2 C -8.079 -1.661 7.392 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 6 . 1442 . 1 1 10 TYS CG C -6.038 -0.404 7.332 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 6 . 1443 . 1 1 10 TYS CZ C -8.451 -0.998 8.544 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 6 . 1444 . 1 1 10 TYS H H -6.784 0.355 5.155 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 6 . 1445 . 1 1 10 TYS HA H -4.007 0.656 4.843 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 6 . 1446 . 1 1 10 TYS HB2 H -4.472 0.930 7.052 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1447 . 1 1 10 TYS HB3 H -3.996 -0.758 7.092 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1448 . 1 1 10 TYS HD1 H -5.779 0.996 8.902 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 6 . 1449 . 1 1 10 TYS HD2 H -6.577 -1.868 5.883 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1450 . 1 1 10 TYS HE1 H -7.899 0.487 9.974 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 6 . 1451 . 1 1 10 TYS HE2 H -8.721 -2.406 6.961 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 6 . 1452 . 1 1 10 TYS N N -5.991 0.234 4.592 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 6 . 1453 . 1 1 10 TYS O O -3.016 -1.765 4.821 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 6 . 1454 . 1 1 10 TYS O1 O -8.852 -2.692 11.060 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 6 . 1455 . 1 1 10 TYS O2 O -9.515 -0.316 11.374 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 6 . 1456 . 1 1 10 TYS O3 O -11.175 -1.968 10.746 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 6 . 1457 . 1 1 10 TYS OH O -9.672 -1.258 9.123 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 6 . 1458 . 1 1 10 TYS S S -9.719 -1.583 10.617 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 6 . 1459 . 1 1 11 ASP C C -4.071 -3.417 2.200 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 6 . 1460 . 1 1 11 ASP CA C -4.728 -3.543 3.571 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 6 . 1461 . 1 1 11 ASP CB C -5.957 -4.445 3.467 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 6 . 1462 . 1 1 11 ASP CG C -6.165 -5.288 4.709 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 6 . 1463 . 1 1 11 ASP H H -6.019 -1.930 4.008 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 6 . 1464 . 1 1 11 ASP HA H -4.023 -3.989 4.255 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 6 . 1465 . 1 1 11 ASP HB2 H -6.836 -3.831 3.320 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1466 . 1 1 11 ASP HB3 H -5.833 -5.109 2.618 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1467 . 1 1 11 ASP N N -5.094 -2.236 4.099 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 6 . 1468 . 1 1 11 ASP O O -3.572 -4.401 1.653 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 6 . 1469 . 1 1 11 ASP OD1 O -5.159 -5.692 5.328 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 6 . 1470 . 1 1 11 ASP OD2 O -7.336 -5.543 5.064 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 6 . 1471 . 1 1 12 ILE C C -1.953 -1.827 0.420 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 6 . 1472 . 1 1 12 ILE CA C -3.470 -1.977 0.333 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 6 . 1473 . 1 1 12 ILE CB C -4.073 -0.745 -0.373 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 6 . 1474 . 1 1 12 ILE CD1 C -2.409 1.180 -0.255 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1475 . 1 1 12 ILE CG1 C -3.659 0.553 0.323 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 6 . 1476 . 1 1 12 ILE CG2 C -5.589 -0.857 -0.424 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 6 . 1477 . 1 1 12 ILE H H -4.486 -1.455 2.118 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 6 . 1478 . 1 1 12 ILE HA H -3.686 -2.840 -0.272 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 6 . 1479 . 1 1 12 ILE HB H -3.707 -0.732 -1.389 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 6 . 1480 . 1 1 12 ILE HD11 H -2.295 0.874 -1.285 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 6 . 1481 . 1 1 12 ILE HD12 H -1.549 0.861 0.314 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 6 . 1482 . 1 1 12 ILE HD13 H -2.493 2.256 -0.207 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 6 . 1483 . 1 1 12 ILE HG12 H -4.459 1.265 0.230 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 6 . 1484 . 1 1 12 ILE HG13 H -3.481 0.356 1.368 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 6 . 1485 . 1 1 12 ILE HG21 H -6.026 0.127 -0.346 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 6 . 1486 . 1 1 12 ILE HG22 H -5.933 -1.470 0.396 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 6 . 1487 . 1 1 12 ILE HG23 H -5.885 -1.309 -1.360 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 6 . 1488 . 1 1 12 ILE N N -4.072 -2.205 1.642 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 6 . 1489 . 1 1 12 ILE O O -1.320 -1.302 -0.495 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 6 . 1490 . 1 1 13 ASN C C 0.784 -3.279 0.884 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 6 . 1491 . 1 1 13 ASN CA C 0.069 -2.236 1.705 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 6 . 1492 . 1 1 13 ASN CB C 0.431 -2.417 3.168 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 6 . 1493 . 1 1 13 ASN CG C -0.287 -3.589 3.812 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 6 . 1494 . 1 1 13 ASN H H -1.920 -2.724 2.206 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 6 . 1495 . 1 1 13 ASN HA H 0.407 -1.274 1.376 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 6 . 1496 . 1 1 13 ASN HB2 H 1.491 -2.589 3.238 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1497 . 1 1 13 ASN HB3 H 0.174 -1.519 3.702 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1498 . 1 1 13 ASN HD21 H 0.844 -4.871 2.796 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 6 . 1499 . 1 1 13 ASN HD22 H -0.329 -5.577 3.849 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 6 . 1500 . 1 1 13 ASN N N -1.372 -2.306 1.516 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 6 . 1501 . 1 1 13 ASN ND2 N 0.117 -4.801 3.450 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 6 . 1502 . 1 1 13 ASN O O 2.010 -3.296 0.826 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 6 . 1503 . 1 1 13 ASN OD1 O -1.189 -3.407 4.629 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 6 . 1504 . 1 1 14 TYS C C 1.506 -4.541 -1.683 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 6 . 1505 . 1 1 14 TYS CA C 0.629 -5.162 -0.594 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 6 . 1506 . 1 1 14 TYS CB C -0.437 -6.082 -1.189 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 6 . 1507 . 1 1 14 TYS CD1 C -2.726 -6.092 -2.198 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1508 . 1 1 14 TYS CD2 C -1.614 -4.003 -2.011 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 6 . 1509 . 1 1 14 TYS CE1 C -3.812 -5.471 -2.765 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 6 . 1510 . 1 1 14 TYS CE2 C -2.698 -3.368 -2.579 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 6 . 1511 . 1 1 14 TYS CG C -1.611 -5.373 -1.813 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 6 . 1512 . 1 1 14 TYS CZ C -3.800 -4.105 -2.958 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 6 . 1513 . 1 1 14 TYS H H -0.948 -4.081 0.303 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 6 . 1514 . 1 1 14 TYS HA H 1.270 -5.737 0.047 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 6 . 1515 . 1 1 14 TYS HB2 H -0.827 -6.710 -0.405 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1516 . 1 1 14 TYS HB3 H 0.013 -6.701 -1.947 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1517 . 1 1 14 TYS HD1 H -2.737 -7.160 -2.047 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 6 . 1518 . 1 1 14 TYS HD2 H -0.753 -3.431 -1.708 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1519 . 1 1 14 TYS HE1 H -4.666 -6.056 -3.052 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 6 . 1520 . 1 1 14 TYS HE2 H -2.678 -2.301 -2.724 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 6 . 1521 . 1 1 14 TYS N N 0.028 -4.139 0.233 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 6 . 1522 . 1 1 14 TYS O O 2.288 -5.235 -2.332 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 6 . 1523 . 1 1 14 TYS O1 O -6.496 -4.785 -2.416 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 6 . 1524 . 1 1 14 TYS O2 O -6.816 -4.287 -4.832 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 6 . 1525 . 1 1 14 TYS O3 O -6.745 -2.480 -3.217 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 6 . 1526 . 1 1 14 TYS OH O -4.748 -3.527 -3.773 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 6 . 1527 . 1 1 14 TYS S S -6.221 -3.861 -3.534 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 6 . 1528 . 1 1 15 TYR C C 3.687 -2.632 -2.355 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 6 . 1529 . 1 1 15 TYR CA C 2.234 -2.502 -2.794 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 6 . 1530 . 1 1 15 TYR CB C 1.805 -1.031 -2.846 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 6 . 1531 . 1 1 15 TYR CD1 C 2.376 -0.431 -0.459 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1532 . 1 1 15 TYR CD2 C 3.218 0.963 -2.199 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 6 . 1533 . 1 1 15 TYR CE1 C 2.988 0.370 0.486 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 6 . 1534 . 1 1 15 TYR CE2 C 3.833 1.770 -1.259 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 6 . 1535 . 1 1 15 TYR CG C 2.480 -0.149 -1.815 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 6 . 1536 . 1 1 15 TYR CZ C 3.715 1.469 0.081 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 6 . 1537 . 1 1 15 TYR H H 0.805 -2.713 -1.268 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 6 . 1538 . 1 1 15 TYR HA H 2.108 -2.957 -3.766 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 6 . 1539 . 1 1 15 TYR HB2 H 2.029 -0.630 -3.822 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1540 . 1 1 15 TYR HB3 H 0.738 -0.975 -2.673 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1541 . 1 1 15 TYR HD1 H 1.807 -1.295 -0.145 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 6 . 1542 . 1 1 15 TYR HD2 H 3.309 1.197 -3.249 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1543 . 1 1 15 TYR HE1 H 2.895 0.134 1.536 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 6 . 1544 . 1 1 15 TYR HE2 H 4.403 2.631 -1.577 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 6 . 1545 . 1 1 15 TYR HH H 3.739 2.387 1.770 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 6 . 1546 . 1 1 15 TYR N N 1.411 -3.221 -1.838 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 6 . 1547 . 1 1 15 TYR O O 4.613 -2.619 -3.167 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 6 . 1548 . 1 1 15 TYR OH O 4.325 2.270 1.019 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 6 . 1549 . 1 1 16 THR C C 5.564 -4.415 -0.507 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 6 . 1550 . 1 1 16 THR CA C 5.150 -2.954 -0.423 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 6 . 1551 . 1 1 16 THR CB C 5.075 -2.503 1.038 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 6 . 1552 . 1 1 16 THR CG2 C 4.424 -3.518 1.959 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 6 . 1553 . 1 1 16 THR H H 3.058 -2.804 -0.471 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 6 . 1554 . 1 1 16 THR HA H 5.865 -2.349 -0.955 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 6 . 1555 . 1 1 16 THR HB H 4.483 -1.601 1.086 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 6 . 1556 . 1 1 16 THR HG1 H 6.289 -1.890 2.449 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 6 . 1557 . 1 1 16 THR HG21 H 5.185 -4.023 2.534 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 6 . 1558 . 1 1 16 THR HG22 H 3.879 -4.240 1.369 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 6 . 1559 . 1 1 16 THR HG23 H 3.742 -3.012 2.625 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 6 . 1560 . 1 1 16 THR N N 3.851 -2.785 -1.043 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 6 . 1561 . 1 1 16 THR O O 6.750 -4.741 -0.566 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 6 . 1562 . 1 1 16 THR OG1 O 6.365 -2.220 1.549 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 6 . 1563 . 1 1 17 SER C C 5.419 -7.115 -1.930 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 6 . 1564 . 1 1 17 SER CA C 4.809 -6.727 -0.587 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 6 . 1565 . 1 1 17 SER CB C 3.510 -7.499 -0.361 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 6 . 1566 . 1 1 17 SER H H 3.635 -4.959 -0.454 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 6 . 1567 . 1 1 17 SER HA H 5.509 -6.980 0.188 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 6 . 1568 . 1 1 17 SER HB2 H 2.675 -6.881 -0.653 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1569 . 1 1 17 SER HB3 H 3.519 -8.399 -0.958 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1570 . 1 1 17 SER HG H 3.336 -8.812 1.082 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 6 . 1571 . 1 1 17 SER N N 4.565 -5.291 -0.509 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 6 . 1572 . 1 1 17 SER O O 5.940 -8.219 -2.088 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 6 . 1573 . 1 1 17 SER OG O 3.358 -7.856 1.002 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 6 . 1574 . 1 1 18 GLU C C 7.437 -6.256 -4.192 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 6 . 1575 . 1 1 18 GLU CA C 5.922 -6.457 -4.212 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 6 . 1576 . 1 1 18 GLU CB C 5.271 -5.552 -5.263 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 6 . 1577 . 1 1 18 GLU CD C 3.076 -6.640 -5.881 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 6 . 1578 . 1 1 18 GLU CG C 4.489 -6.314 -6.322 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 6 . 1579 . 1 1 18 GLU H H 4.943 -5.339 -2.704 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 6 . 1580 . 1 1 18 GLU HA H 5.716 -7.488 -4.460 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 6 . 1581 . 1 1 18 GLU HB2 H 4.593 -4.873 -4.767 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1582 . 1 1 18 GLU HB3 H 6.041 -4.979 -5.758 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1583 . 1 1 18 GLU HG2 H 4.441 -5.713 -7.217 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 6 . 1584 . 1 1 18 GLU HG3 H 5.007 -7.238 -6.537 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 6 . 1585 . 1 1 18 GLU N N 5.363 -6.202 -2.890 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 6 . 1586 . 1 1 18 GLU O O 8.191 -7.193 -4.455 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 6 . 1587 . 1 1 18 GLU OE1 O 2.436 -5.774 -5.250 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 6 . 1588 . 1 1 18 GLU OE2 O 2.609 -7.763 -6.168 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 6 . 1589 . 1 1 19 PRO C C 10.052 -5.388 -2.644 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 6 . 1590 . 1 1 19 PRO CA C 9.344 -4.727 -3.827 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 6 . 1591 . 1 1 19 PRO CB C 9.394 -3.199 -3.675 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 6 . 1592 . 1 1 19 PRO CD C 7.107 -3.849 -3.563 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 6 . 1593 . 1 1 19 PRO CG C 8.013 -2.727 -3.970 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 6 . 1594 . 1 1 19 PRO HA H 9.829 -5.011 -4.742 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 6 . 1595 . 1 1 19 PRO HB2 H 9.685 -2.946 -2.663 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1596 . 1 1 19 PRO HB3 H 10.109 -2.791 -4.375 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1597 . 1 1 19 PRO HD2 H 6.890 -3.798 -2.510 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1598 . 1 1 19 PRO HD3 H 6.205 -3.830 -4.142 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 6 . 1599 . 1 1 19 PRO HG2 H 7.795 -1.839 -3.394 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 6 . 1600 . 1 1 19 PRO HG3 H 7.910 -2.526 -5.027 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 6 . 1601 . 1 1 19 PRO N N 7.911 -5.032 -3.880 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 6 . 1602 . 1 1 19 PRO O O 10.838 -4.744 -1.949 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 6 . 1603 . 1 1 20 ALA C C 11.918 -7.391 -1.435 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 6 . 1604 . 1 1 20 ALA CA C 10.400 -7.399 -1.315 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 6 . 1605 . 1 1 20 ALA CB C 9.878 -8.827 -1.260 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 6 . 1606 . 1 1 20 ALA H H 9.147 -7.137 -2.998 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 6 . 1607 . 1 1 20 ALA HA H 10.126 -6.905 -0.400 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 6 . 1608 . 1 1 20 ALA HB1 H 8.933 -8.846 -0.738 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 6 . 1609 . 1 1 20 ALA HB2 H 10.589 -9.450 -0.737 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1610 . 1 1 20 ALA HB3 H 9.743 -9.201 -2.264 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1611 . 1 1 20 ALA N N 9.777 -6.670 -2.416 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 6 . 1612 . 1 1 20 ALA O O 12.632 -7.609 -0.456 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 6 . 1613 . 1 1 21 GLN C C 14.412 -5.719 -2.539 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 6 . 1614 . 1 1 21 GLN CA C 13.835 -7.086 -2.900 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 6 . 1615 . 1 1 21 GLN CB C 14.118 -7.399 -4.370 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 6 . 1616 . 1 1 21 GLN CD C 12.623 -8.641 -5.985 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 6 . 1617 . 1 1 21 GLN CG C 13.588 -8.750 -4.819 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 6 . 1618 . 1 1 21 GLN H H 11.778 -6.964 -3.373 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 6 . 1619 . 1 1 21 GLN HA H 14.307 -7.837 -2.284 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 6 . 1620 . 1 1 21 GLN HB2 H 13.663 -6.634 -4.983 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1621 . 1 1 21 GLN HE21 H 11.095 -8.422 -4.733 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 6 . 1622 . 1 1 21 GLN HE22 H 10.697 -8.393 -6.414 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 6 . 1623 . 1 1 21 GLN HG2 H 14.420 -9.370 -5.118 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 6 . 1624 . 1 1 21 GLN N N 12.402 -7.132 -2.640 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 6 . 1625 . 1 1 21 GLN NE2 N 11.342 -8.468 -5.680 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 6 . 1626 . 1 1 21 GLN O O 15.620 -5.574 -2.360 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 6 . 1627 . 1 1 21 GLN OE1 O 13.025 -8.710 -7.148 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 6 . 1628 . 1 1 22 LYS C C 14.851 -3.365 -0.849 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 6 . 1629 . 1 1 22 LYS CA C 13.964 -3.362 -2.092 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 6 . 1630 . 1 1 22 LYS CB C 12.747 -2.465 -1.861 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 6 . 1631 . 1 1 22 LYS CD C 12.515 -0.365 -0.489 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 6 . 1632 . 1 1 22 LYS CE C 11.265 0.447 -0.790 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 6 . 1633 . 1 1 22 LYS CG C 13.094 -0.988 -1.750 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 6 . 1634 . 1 1 22 LYS H H 12.588 -4.891 -2.586 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 6 . 1635 . 1 1 22 LYS HA H 14.531 -2.975 -2.926 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 6 . 1636 . 1 1 22 LYS HB2 H 12.060 -2.590 -2.685 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 6 . 1637 . 1 1 22 LYS HB3 H 12.257 -2.769 -0.947 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 6 . 1638 . 1 1 22 LYS HD2 H 12.262 -1.151 0.207 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 6 . 1639 . 1 1 22 LYS HD3 H 13.256 0.284 -0.046 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 6 . 1640 . 1 1 22 LYS HE2 H 11.129 1.178 -0.006 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 6 . 1641 . 1 1 22 LYS HE3 H 11.398 0.953 -1.734 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 6 . 1642 . 1 1 22 LYS HG2 H 14.169 -0.882 -1.729 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 6 . 1643 . 1 1 22 LYS HG3 H 12.697 -0.470 -2.612 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 6 . 1644 . 1 1 22 LYS HZ1 H 10.197 -1.288 -0.329 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 6 . 1645 . 1 1 22 LYS HZ2 H 9.845 -0.652 -1.857 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 6 . 1646 . 1 1 22 LYS HZ3 H 9.231 0.093 -0.468 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 6 . 1647 . 1 1 22 LYS N N 13.539 -4.717 -2.432 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 6 . 1648 . 1 1 22 LYS NZ N 10.049 -0.410 -0.866 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 6 . 1649 . 1 1 22 LYS O O 15.846 -2.643 -0.783 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 6 . 1650 . 1 1 23 ILE C C 15.371 -5.741 1.811 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 6 . 1651 . 1 1 23 ILE CA C 15.240 -4.287 1.371 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 6 . 1652 . 1 1 23 ILE CB C 14.577 -3.477 2.503 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 6 . 1653 . 1 1 23 ILE CD1 C 12.887 -4.966 3.687 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 6 . 1654 . 1 1 23 ILE CG1 C 13.111 -3.880 2.657 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 6 . 1655 . 1 1 23 ILE CG2 C 14.697 -1.986 2.229 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 6 . 1656 . 1 1 23 ILE H H 13.679 -4.733 0.015 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 6 . 1657 . 1 1 23 ILE HA H 16.226 -3.883 1.196 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 6 . 1658 . 1 1 23 ILE HB H 15.101 -3.692 3.422 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 6 . 1659 . 1 1 23 ILE HD11 H 13.558 -4.816 4.521 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 6 . 1660 . 1 1 23 ILE HD12 H 13.078 -5.931 3.241 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 6 . 1661 . 1 1 23 ILE HD13 H 11.866 -4.926 4.036 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 6 . 1662 . 1 1 23 ILE HG12 H 12.536 -3.017 2.956 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 6 . 1663 . 1 1 23 ILE HG13 H 12.741 -4.242 1.708 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 6 . 1664 . 1 1 23 ILE HG21 H 13.781 -1.628 1.782 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 6 . 1665 . 1 1 23 ILE HG22 H 15.520 -1.809 1.553 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 6 . 1666 . 1 1 23 ILE HG23 H 14.874 -1.462 3.156 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 6 . 1667 . 1 1 23 ILE N N 14.481 -4.183 0.131 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 6 . 1668 . 1 1 23 ILE O O 15.319 -6.050 3.001 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 7 . 1669 . 1 1 7 SER C C -10.355 0.553 4.353 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 7 . 1670 . 1 1 7 SER CA C -11.164 1.816 4.573 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 7 . 1671 . 1 1 7 SER CB C -10.392 2.785 5.452 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 7 . 1672 . 1 1 7 SER H H -12.776 2.209 5.866 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 7 . 1673 . 1 1 7 SER HA H -11.336 2.274 3.622 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 7 . 1674 . 1 1 7 SER HB2 H -10.955 2.938 6.367 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1675 . 1 1 7 SER HB3 H -9.426 2.369 5.688 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1676 . 1 1 7 SER HG H -11.047 4.322 4.427 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 7 . 1677 . 1 1 7 SER N N -12.443 1.558 5.213 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 7 . 1678 . 1 1 7 SER O O -9.552 0.169 5.195 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 7 . 1679 . 1 1 7 SER OG O -10.214 4.036 4.809 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 7 . 1680 . 1 1 8 PRO C C -8.277 -0.920 2.633 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 7 . 1681 . 1 1 8 PRO CA C -9.734 -1.268 2.829 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 7 . 1682 . 1 1 8 PRO CB C -10.361 -1.759 1.517 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 7 . 1683 . 1 1 8 PRO CD C -11.352 0.351 2.068 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 7 . 1684 . 1 1 8 PRO CG C -11.597 -0.938 1.338 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 7 . 1685 . 1 1 8 PRO HA H -9.818 -2.017 3.589 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 7 . 1686 . 1 1 8 PRO HB2 H -9.662 -1.602 0.704 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1687 . 1 1 8 PRO HB3 H -10.597 -2.811 1.600 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1688 . 1 1 8 PRO HD2 H -10.828 1.059 1.437 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1689 . 1 1 8 PRO HD3 H -12.279 0.772 2.428 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 7 . 1690 . 1 1 8 PRO HG2 H -11.765 -0.749 0.288 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 7 . 1691 . 1 1 8 PRO HG3 H -12.441 -1.456 1.768 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 7 . 1692 . 1 1 8 PRO N N -10.501 -0.078 3.175 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 7 . 1693 . 1 1 8 PRO O O -7.470 -1.737 2.190 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 7 . 1694 . 1 1 9 ILE C C -5.710 0.063 3.852 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 7 . 1695 . 1 1 9 ILE CA C -6.616 0.816 2.899 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 7 . 1696 . 1 1 9 ILE CB C -6.566 2.334 3.187 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 7 . 1697 . 1 1 9 ILE CD1 C -5.201 2.669 5.312 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1698 . 1 1 9 ILE CG1 C -6.581 2.611 4.695 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 7 . 1699 . 1 1 9 ILE CG2 C -7.733 3.039 2.511 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 7 . 1700 . 1 1 9 ILE H H -8.652 0.885 3.349 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 7 . 1701 . 1 1 9 ILE HA H -6.275 0.644 1.902 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 7 . 1702 . 1 1 9 ILE HB H -5.657 2.724 2.764 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 7 . 1703 . 1 1 9 ILE HD11 H -4.887 3.698 5.394 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 7 . 1704 . 1 1 9 ILE HD12 H -4.505 2.128 4.689 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 7 . 1705 . 1 1 9 ILE HD13 H -5.228 2.221 6.295 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 7 . 1706 . 1 1 9 ILE HG12 H -7.064 3.562 4.875 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 7 . 1707 . 1 1 9 ILE HG13 H -7.137 1.825 5.193 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 7 . 1708 . 1 1 9 ILE HG21 H -7.535 4.100 2.463 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 7 . 1709 . 1 1 9 ILE HG22 H -8.636 2.866 3.078 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 7 . 1710 . 1 1 9 ILE HG23 H -7.857 2.652 1.510 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 7 . 1711 . 1 1 9 ILE N N -7.958 0.309 2.993 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 7 . 1712 . 1 1 9 ILE O O -4.490 0.099 3.729 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 7 . 1713 . 1 1 10 TYS C C -4.886 -2.604 5.055 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 7 . 1714 . 1 1 10 TYS CA C -5.538 -1.417 5.751 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 7 . 1715 . 1 1 10 TYS CB C -6.348 -1.930 6.956 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 7 . 1716 . 1 1 10 TYS CD1 C -8.239 -0.540 7.755 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1717 . 1 1 10 TYS CD2 C -8.753 -2.363 6.321 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 7 . 1718 . 1 1 10 TYS CE1 C -9.571 -0.239 7.867 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 7 . 1719 . 1 1 10 TYS CE2 C -10.098 -2.065 6.415 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 7 . 1720 . 1 1 10 TYS CG C -7.808 -1.597 6.989 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 7 . 1721 . 1 1 10 TYS CZ C -10.507 -1.001 7.197 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 7 . 1722 . 1 1 10 TYS H H -7.307 -0.630 4.833 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 7 . 1723 . 1 1 10 TYS HA H -4.755 -0.773 6.113 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 7 . 1724 . 1 1 10 TYS HB2 H -5.921 -1.513 7.855 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1725 . 1 1 10 TYS HB3 H -6.266 -3.003 7.002 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1726 . 1 1 10 TYS HD1 H -7.506 0.059 8.275 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 7 . 1727 . 1 1 10 TYS HD2 H -8.427 -3.190 5.710 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1728 . 1 1 10 TYS HE1 H -9.871 0.592 8.474 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 7 . 1729 . 1 1 10 TYS HE2 H -10.820 -2.665 5.889 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 7 . 1730 . 1 1 10 TYS N N -6.322 -0.637 4.796 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 7 . 1731 . 1 1 10 TYS O O -3.776 -3.008 5.401 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 7 . 1732 . 1 1 10 TYS O1 O -11.536 -2.115 9.645 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 7 . 1733 . 1 1 10 TYS O2 O -13.647 -0.911 9.120 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 7 . 1734 . 1 1 10 TYS O3 O -12.981 -2.830 7.795 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 7 . 1735 . 1 1 10 TYS OH O -11.845 -0.830 7.470 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 7 . 1736 . 1 1 10 TYS S S -12.468 -1.655 8.595 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 7 . 1737 . 1 1 11 ASP C C -4.098 -3.888 2.241 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 7 . 1738 . 1 1 11 ASP CA C -5.081 -4.309 3.333 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 7 . 1739 . 1 1 11 ASP CB C -6.240 -5.089 2.711 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 7 . 1740 . 1 1 11 ASP CG C -7.065 -5.822 3.750 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 7 . 1741 . 1 1 11 ASP H H -6.467 -2.798 3.850 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 7 . 1742 . 1 1 11 ASP HA H -4.567 -4.950 4.032 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 7 . 1743 . 1 1 11 ASP HB2 H -6.889 -4.401 2.185 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1744 . 1 1 11 ASP HB3 H -5.843 -5.815 2.013 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1745 . 1 1 11 ASP N N -5.586 -3.162 4.076 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 7 . 1746 . 1 1 11 ASP O O -3.615 -4.729 1.483 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 7 . 1747 . 1 1 11 ASP OD1 O -6.479 -6.601 4.532 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 7 . 1748 . 1 1 11 ASP OD2 O -8.297 -5.620 3.783 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 7 . 1749 . 1 1 12 ILE C C -1.419 -2.158 1.614 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 7 . 1750 . 1 1 12 ILE CA C -2.870 -2.101 1.139 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 7 . 1751 . 1 1 12 ILE CB C -3.200 -0.659 0.700 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 7 . 1752 . 1 1 12 ILE CD1 C -1.394 0.996 1.394 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1753 . 1 1 12 ILE CG1 C -2.717 0.350 1.744 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 7 . 1754 . 1 1 12 ILE CG2 C -4.694 -0.508 0.454 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 7 . 1755 . 1 1 12 ILE H H -4.213 -1.954 2.784 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 7 . 1756 . 1 1 12 ILE HA H -2.971 -2.737 0.279 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 7 . 1757 . 1 1 12 ILE HB H -2.691 -0.469 -0.234 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 7 . 1758 . 1 1 12 ILE HD11 H -1.401 2.028 1.713 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 7 . 1759 . 1 1 12 ILE HD12 H -1.243 0.951 0.325 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 7 . 1760 . 1 1 12 ILE HD13 H -0.593 0.469 1.894 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 7 . 1761 . 1 1 12 ILE HG12 H -3.452 1.130 1.844 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 7 . 1762 . 1 1 12 ILE HG13 H -2.599 -0.153 2.692 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 7 . 1763 . 1 1 12 ILE HG21 H -4.945 0.540 0.390 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 7 . 1764 . 1 1 12 ILE HG22 H -5.239 -0.959 1.269 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 7 . 1765 . 1 1 12 ILE HG23 H -4.957 -0.999 -0.471 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 7 . 1766 . 1 1 12 ILE N N -3.800 -2.591 2.155 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 7 . 1767 . 1 1 12 ILE O O -0.535 -1.567 0.994 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 7 . 1768 . 1 1 13 ASN C C 1.041 -3.899 2.455 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 7 . 1769 . 1 1 13 ASN CA C 0.172 -2.960 3.261 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 7 . 1770 . 1 1 13 ASN CB C 0.132 -3.405 4.714 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 7 . 1771 . 1 1 13 ASN CG C -0.893 -2.644 5.532 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 7 . 1772 . 1 1 13 ASN H H -1.915 -3.300 3.180 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 7 . 1773 . 1 1 13 ASN HA H 0.620 -1.991 3.208 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 7 . 1774 . 1 1 13 ASN HB2 H -0.112 -4.453 4.751 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1775 . 1 1 13 ASN HB3 H 1.105 -3.248 5.150 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1776 . 1 1 13 ASN HD21 H -1.197 -4.239 6.680 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 7 . 1777 . 1 1 13 ASN HD22 H -2.130 -2.840 7.076 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 7 . 1778 . 1 1 13 ASN N N -1.176 -2.856 2.717 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 7 . 1779 . 1 1 13 ASN ND2 N -1.464 -3.308 6.530 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 7 . 1780 . 1 1 13 ASN O O 2.263 -3.869 2.579 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 7 . 1781 . 1 1 13 ASN OD1 O -1.168 -1.472 5.271 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 7 . 1782 . 1 1 14 TYS C C 2.085 -4.814 -0.181 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 7 . 1783 . 1 1 14 TYS CA C 1.213 -5.614 0.783 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 7 . 1784 . 1 1 14 TYS CB C 0.330 -6.617 0.029 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 7 . 1785 . 1 1 14 TYS CD1 C -1.856 -6.839 -1.160 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1786 . 1 1 14 TYS CD2 C -0.984 -4.652 -0.849 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 7 . 1787 . 1 1 14 TYS CE1 C -2.952 -6.320 -1.805 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 7 . 1788 . 1 1 14 TYS CE2 C -2.081 -4.118 -1.495 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 7 . 1789 . 1 1 14 TYS CG C -0.857 -6.018 -0.673 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 7 . 1790 . 1 1 14 TYS CZ C -3.066 -4.958 -1.973 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 7 . 1791 . 1 1 14 TYS H H -0.541 -4.682 1.529 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 7 . 1792 . 1 1 14 TYS HA H 1.870 -6.149 1.444 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 7 . 1793 . 1 1 14 TYS HB2 H -0.050 -7.346 0.726 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1794 . 1 1 14 TYS HB3 H 0.927 -7.121 -0.714 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1795 . 1 1 14 TYS HD1 H -1.766 -7.907 -1.027 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 7 . 1796 . 1 1 14 TYS HD2 H -0.213 -4.003 -0.467 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1797 . 1 1 14 TYS HE1 H -3.716 -6.982 -2.171 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 7 . 1798 . 1 1 14 TYS HE2 H -2.163 -3.052 -1.622 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 7 . 1799 . 1 1 14 TYS N N 0.432 -4.710 1.610 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 7 . 1800 . 1 1 14 TYS O O 2.983 -5.358 -0.822 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 7 . 1801 . 1 1 14 TYS O1 O -3.921 -5.593 -4.713 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 7 . 1802 . 1 1 14 TYS O2 O -3.925 -3.115 -4.514 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 7 . 1803 . 1 1 14 TYS O3 O -5.943 -4.374 -4.044 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 7 . 1804 . 1 1 14 TYS OH O -4.233 -4.425 -2.474 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 7 . 1805 . 1 1 14 TYS S S -4.433 -4.413 -3.989 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 7 . 1806 . 1 1 15 TYR C C 4.080 -2.694 -0.619 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 7 . 1807 . 1 1 15 TYR CA C 2.624 -2.609 -1.062 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 7 . 1808 . 1 1 15 TYR CB C 2.081 -1.180 -0.917 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 7 . 1809 . 1 1 15 TYR CD1 C 2.727 -0.786 1.493 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1810 . 1 1 15 TYR CD2 C 3.402 0.825 -0.130 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 7 . 1811 . 1 1 15 TYR CE1 C 3.336 -0.045 2.487 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 7 . 1812 . 1 1 15 TYR CE2 C 4.013 1.571 0.858 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 7 . 1813 . 1 1 15 TYR CG C 2.751 -0.365 0.169 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 7 . 1814 . 1 1 15 TYR CZ C 3.978 1.132 2.165 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 7 . 1815 . 1 1 15 TYR H H 1.137 -3.125 0.326 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 7 . 1816 . 1 1 15 TYR HA H 2.541 -2.929 -2.091 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 7 . 1817 . 1 1 15 TYR HB2 H 2.207 -0.656 -1.851 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1818 . 1 1 15 TYR HB3 H 1.026 -1.238 -0.676 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1819 . 1 1 15 TYR HD1 H 2.225 -1.711 1.741 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 7 . 1820 . 1 1 15 TYR HD2 H 3.428 1.166 -1.155 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1821 . 1 1 15 TYR HE1 H 3.308 -0.389 3.511 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 7 . 1822 . 1 1 15 TYR HE2 H 4.515 2.494 0.606 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 7 . 1823 . 1 1 15 TYR HH H 5.480 2.096 2.881 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 7 . 1824 . 1 1 15 TYR N N 1.841 -3.504 -0.235 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 7 . 1825 . 1 1 15 TYR O O 5.005 -2.497 -1.403 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 7 . 1826 . 1 1 15 TYR OH O 4.587 1.873 3.152 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 7 . 1827 . 1 1 16 THR C C 6.037 -4.606 1.103 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 7 . 1828 . 1 1 16 THR CA C 5.550 -3.173 1.276 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 7 . 1829 . 1 1 16 THR CB C 5.447 -2.832 2.763 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 7 . 1830 . 1 1 16 THR CG2 C 4.795 -3.924 3.588 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 7 . 1831 . 1 1 16 THR H H 3.453 -3.167 1.213 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 7 . 1832 . 1 1 16 THR HA H 6.243 -2.497 0.797 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 7 . 1833 . 1 1 16 THR HB H 4.844 -1.946 2.870 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 7 . 1834 . 1 1 16 THR HG1 H 7.338 -3.262 3.033 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 7 . 1835 . 1 1 16 THR HG21 H 5.557 -4.531 4.052 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 7 . 1836 . 1 1 16 THR HG22 H 4.184 -4.542 2.946 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 7 . 1837 . 1 1 16 THR HG23 H 4.174 -3.477 4.349 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 7 . 1838 . 1 1 16 THR N N 4.246 -3.015 0.660 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 7 . 1839 . 1 1 16 THR O O 7.237 -4.867 1.021 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 7 . 1840 . 1 1 16 THR OG1 O 6.725 -2.577 3.314 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 7 . 1841 . 1 1 17 SER C C 5.821 -7.313 -0.486 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 7 . 1842 . 1 1 17 SER CA C 5.401 -6.951 0.937 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 7 . 1843 . 1 1 17 SER CB C 4.207 -7.805 1.361 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 7 . 1844 . 1 1 17 SER H H 4.140 -5.254 1.168 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 7 . 1845 . 1 1 17 SER HA H 6.228 -7.160 1.591 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 7 . 1846 . 1 1 17 SER HB2 H 3.950 -7.577 2.386 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1847 . 1 1 17 SER HB3 H 3.364 -7.586 0.722 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1848 . 1 1 17 SER HG H 3.816 -9.630 0.768 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 7 . 1849 . 1 1 17 SER N N 5.084 -5.533 1.075 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 7 . 1850 . 1 1 17 SER O O 6.297 -8.420 -0.732 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 7 . 1851 . 1 1 17 SER OG O 4.507 -9.186 1.265 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 7 . 1852 . 1 1 18 GLU C C 7.493 -6.285 -3.048 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 7 . 1853 . 1 1 18 GLU CA C 6.025 -6.635 -2.804 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 7 . 1854 . 1 1 18 GLU CB C 5.132 -5.846 -3.766 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 7 . 1855 . 1 1 18 GLU CD C 4.657 -5.408 -6.209 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 7 . 1856 . 1 1 18 GLU CG C 5.094 -6.425 -5.174 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 7 . 1857 . 1 1 18 GLU H H 5.271 -5.519 -1.166 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 7 . 1858 . 1 1 18 GLU HA H 5.889 -7.689 -2.992 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 7 . 1859 . 1 1 18 GLU HB2 H 4.124 -5.833 -3.377 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1860 . 1 1 18 GLU HB3 H 5.497 -4.832 -3.832 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1861 . 1 1 18 GLU HG2 H 6.084 -6.775 -5.432 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 7 . 1862 . 1 1 18 GLU HG3 H 4.404 -7.256 -5.190 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 7 . 1863 . 1 1 18 GLU N N 5.650 -6.385 -1.416 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 7 . 1864 . 1 1 18 GLU O O 8.248 -7.095 -3.589 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 7 . 1865 . 1 1 18 GLU OE1 O 5.086 -4.239 -6.110 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 7 . 1866 . 1 1 18 GLU OE2 O 3.886 -5.779 -7.118 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 7 . 1867 . 1 1 19 PRO C C 10.290 -5.218 -1.887 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 7 . 1868 . 1 1 19 PRO CA C 9.291 -4.596 -2.861 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 7 . 1869 . 1 1 19 PRO CB C 9.197 -3.080 -2.618 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 7 . 1870 . 1 1 19 PRO CD C 7.097 -4.028 -2.050 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 7 . 1871 . 1 1 19 PRO CG C 7.739 -2.777 -2.558 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 7 . 1872 . 1 1 19 PRO HA H 9.615 -4.774 -3.869 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 7 . 1873 . 1 1 19 PRO HB2 H 9.685 -2.833 -1.683 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1874 . 1 1 19 PRO HB3 H 9.676 -2.556 -3.433 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1875 . 1 1 19 PRO HD2 H 7.156 -4.075 -0.977 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1876 . 1 1 19 PRO HD3 H 6.081 -4.093 -2.381 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 7 . 1877 . 1 1 19 PRO HG2 H 7.560 -1.957 -1.877 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 7 . 1878 . 1 1 19 PRO HG3 H 7.369 -2.538 -3.544 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 7 . 1879 . 1 1 19 PRO N N 7.917 -5.065 -2.669 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 7 . 1880 . 1 1 19 PRO O O 11.180 -4.532 -1.385 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 7 . 1881 . 1 1 20 ALA C C 12.509 -6.986 -1.123 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 7 . 1882 . 1 1 20 ALA CA C 11.060 -7.200 -0.708 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 7 . 1883 . 1 1 20 ALA CB C 10.734 -8.686 -0.647 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 7 . 1884 . 1 1 20 ALA H H 9.430 -7.017 -2.046 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 7 . 1885 . 1 1 20 ALA HA H 10.920 -6.782 0.268 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 7 . 1886 . 1 1 20 ALA HB1 H 11.419 -9.232 -1.278 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 7 . 1887 . 1 1 20 ALA HB2 H 9.723 -8.847 -0.991 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1888 . 1 1 20 ALA HB3 H 10.827 -9.032 0.372 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1889 . 1 1 20 ALA N N 10.151 -6.514 -1.621 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 7 . 1890 . 1 1 20 ALA O O 13.398 -6.846 -0.284 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 7 . 1891 . 1 1 21 GLN C C 14.340 -5.247 -3.127 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 7 . 1892 . 1 1 21 GLN CA C 14.055 -6.737 -2.984 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 7 . 1893 . 1 1 21 GLN CB C 14.183 -7.429 -4.343 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 7 . 1894 . 1 1 21 GLN CD C 13.094 -9.288 -5.661 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 7 . 1895 . 1 1 21 GLN CG C 13.704 -8.871 -4.339 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 7 . 1896 . 1 1 21 GLN H H 11.962 -7.057 -3.027 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 7 . 1897 . 1 1 21 GLN HA H 14.772 -7.165 -2.301 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 7 . 1898 . 1 1 21 GLN HB2 H 13.602 -6.881 -5.071 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1899 . 1 1 21 GLN HE21 H 12.595 -11.057 -4.902 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 7 . 1900 . 1 1 21 GLN HE22 H 12.162 -10.801 -6.554 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 7 . 1901 . 1 1 21 GLN HG2 H 14.544 -9.515 -4.129 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 7 . 1902 . 1 1 21 GLN N N 12.723 -6.949 -2.425 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 7 . 1903 . 1 1 21 GLN NE2 N 12.563 -10.505 -5.710 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 7 . 1904 . 1 1 21 GLN O O 15.462 -4.792 -2.901 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 7 . 1905 . 1 1 21 GLN OE1 O 13.098 -8.527 -6.628 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 7 . 1906 . 1 1 22 LYS C C 13.875 -2.384 -2.379 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 7 . 1907 . 1 1 22 LYS CA C 13.439 -3.052 -3.679 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 7 . 1908 . 1 1 22 LYS CB C 12.110 -2.459 -4.155 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 7 . 1909 . 1 1 22 LYS CD C 10.908 -2.083 -6.329 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 7 . 1910 . 1 1 22 LYS CE C 10.873 -1.248 -7.598 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 7 . 1911 . 1 1 22 LYS CG C 12.183 -1.838 -5.540 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 7 . 1912 . 1 1 22 LYS H H 12.444 -4.918 -3.666 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 7 . 1913 . 1 1 22 LYS HA H 14.192 -2.874 -4.432 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 7 . 1914 . 1 1 22 LYS HB2 H 11.367 -3.244 -4.175 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 7 . 1915 . 1 1 22 LYS HB3 H 11.796 -1.696 -3.459 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 7 . 1916 . 1 1 22 LYS HD2 H 10.856 -3.128 -6.596 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 7 . 1917 . 1 1 22 LYS HD3 H 10.059 -1.824 -5.714 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 7 . 1918 . 1 1 22 LYS HE2 H 11.880 -1.145 -7.974 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 7 . 1919 . 1 1 22 LYS HE3 H 10.265 -1.757 -8.333 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 7 . 1920 . 1 1 22 LYS HG2 H 12.331 -0.773 -5.438 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 7 . 1921 . 1 1 22 LYS HG3 H 13.016 -2.271 -6.074 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 7 . 1922 . 1 1 22 LYS HZ1 H 9.487 0.044 -6.719 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 7 . 1923 . 1 1 22 LYS HZ2 H 10.002 0.534 -8.254 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 7 . 1924 . 1 1 22 LYS HZ3 H 11.023 0.722 -6.919 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 7 . 1925 . 1 1 22 LYS N N 13.312 -4.493 -3.504 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 7 . 1926 . 1 1 22 LYS NZ N 10.306 0.107 -7.356 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 7 . 1927 . 1 1 22 LYS O O 14.792 -1.563 -2.366 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 7 . 1928 . 1 1 23 ILE C C 14.442 -3.108 0.806 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 7 . 1929 . 1 1 23 ILE CA C 13.521 -2.180 0.020 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 7 . 1930 . 1 1 23 ILE CB C 12.243 -1.922 0.842 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 7 . 1931 . 1 1 23 ILE CD1 C 9.809 -1.215 0.596 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 7 . 1932 . 1 1 23 ILE CG1 C 11.194 -1.209 -0.014 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 7 . 1933 . 1 1 23 ILE CG2 C 12.565 -1.105 2.085 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 7 . 1934 . 1 1 23 ILE H H 12.486 -3.399 -1.365 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 7 . 1935 . 1 1 23 ILE HA H 14.023 -1.236 -0.133 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 7 . 1936 . 1 1 23 ILE HB H 11.849 -2.875 1.161 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 7 . 1937 . 1 1 23 ILE HD11 H 9.615 -2.182 1.039 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 7 . 1938 . 1 1 23 ILE HD12 H 9.076 -1.018 -0.172 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 7 . 1939 . 1 1 23 ILE HD13 H 9.748 -0.452 1.357 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 7 . 1940 . 1 1 23 ILE HG12 H 11.490 -0.181 -0.153 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 7 . 1941 . 1 1 23 ILE HG13 H 11.134 -1.694 -0.978 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 7 . 1942 . 1 1 23 ILE HG21 H 13.633 -1.096 2.244 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 7 . 1943 . 1 1 23 ILE HG22 H 12.077 -1.546 2.941 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 7 . 1944 . 1 1 23 ILE HG23 H 12.213 -0.093 1.951 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 7 . 1945 . 1 1 23 ILE N N 13.208 -2.741 -1.288 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 7 . 1946 . 1 1 23 ILE O O 14.362 -3.187 2.031 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 8 . 1947 . 1 1 7 SER C C -10.564 0.542 5.004 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 8 . 1948 . 1 1 7 SER CA C -11.420 1.784 5.220 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 8 . 1949 . 1 1 7 SER CB C -12.779 1.410 5.788 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 8 . 1950 . 1 1 7 SER H H -12.440 2.368 3.474 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 8 . 1951 . 1 1 7 SER HA H -10.905 2.418 5.923 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 8 . 1952 . 1 1 7 SER HB2 H -13.543 1.886 5.184 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 8 . 1953 . 1 1 7 SER HB3 H -12.903 0.339 5.748 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 8 . 1954 . 1 1 7 SER HG H -13.062 2.792 7.147 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 8 . 1955 . 1 1 7 SER N N -11.637 2.542 4.001 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 8 . 1956 . 1 1 7 SER O O -9.693 0.252 5.814 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 8 . 1957 . 1 1 7 SER OG O -12.916 1.844 7.131 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 8 . 1958 . 1 1 8 PRO C C -8.605 -1.056 3.112 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 8 . 1959 . 1 1 8 PRO CA C -9.984 -1.404 3.623 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 8 . 1960 . 1 1 8 PRO CB C -10.786 -2.128 2.536 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 8 . 1961 . 1 1 8 PRO CD C -11.730 0.053 2.848 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 8 . 1962 . 1 1 8 PRO CG C -12.041 -1.333 2.363 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 8 . 1963 . 1 1 8 PRO HA H -9.894 -2.031 4.495 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 8 . 1964 . 1 1 8 PRO HB2 H -10.208 -2.158 1.621 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 8 . 1965 . 1 1 8 PRO HB3 H -11.002 -3.135 2.865 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 8 . 1966 . 1 1 8 PRO HD2 H -11.276 0.647 2.060 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 8 . 1967 . 1 1 8 PRO HD3 H -12.617 0.531 3.234 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 8 . 1968 . 1 1 8 PRO HG2 H -12.323 -1.314 1.323 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 8 . 1969 . 1 1 8 PRO HG3 H -12.829 -1.769 2.959 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 8 . 1970 . 1 1 8 PRO N N -10.767 -0.205 3.907 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 8 . 1971 . 1 1 8 PRO O O -8.010 -1.795 2.330 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 8 . 1972 . 1 1 9 ILE C C -5.723 -0.100 4.010 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 8 . 1973 . 1 1 9 ILE CA C -6.804 0.540 3.164 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 8 . 1974 . 1 1 9 ILE CB C -6.702 2.076 3.231 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 8 . 1975 . 1 1 9 ILE CD1 C -5.027 2.884 4.972 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 8 . 1976 . 1 1 9 ILE CG1 C -6.471 2.553 4.670 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 8 . 1977 . 1 1 9 ILE CG2 C -7.950 2.712 2.653 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 8 . 1978 . 1 1 9 ILE H H -8.634 0.612 4.183 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 8 . 1979 . 1 1 9 ILE HA H -6.659 0.238 2.149 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 8 . 1980 . 1 1 9 ILE HB H -5.875 2.376 2.619 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 8 . 1981 . 1 1 9 ILE HD11 H -4.908 3.042 6.033 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 8 . 1982 . 1 1 9 ILE HD12 H -4.744 3.782 4.440 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 8 . 1983 . 1 1 9 ILE HD13 H -4.396 2.065 4.656 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 8 . 1984 . 1 1 9 ILE HG12 H -7.058 3.445 4.845 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 8 . 1985 . 1 1 9 ILE HG13 H -6.785 1.775 5.354 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 8 . 1986 . 1 1 9 ILE HG21 H -8.001 3.742 2.968 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 8 . 1987 . 1 1 9 ILE HG22 H -8.822 2.182 3.006 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 8 . 1988 . 1 1 9 ILE HG23 H -7.912 2.666 1.574 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 8 . 1989 . 1 1 9 ILE N N -8.109 0.077 3.564 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 8 . 1990 . 1 1 9 ILE O O -4.536 0.030 3.724 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 8 . 1991 . 1 1 10 TYS C C -4.515 -2.638 5.185 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 8 . 1992 . 1 1 10 TYS CA C -5.171 -1.473 5.915 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 8 . 1993 . 1 1 10 TYS CB C -5.785 -1.985 7.229 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 8 . 1994 . 1 1 10 TYS CD1 C -7.248 -0.365 8.423 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 8 . 1995 . 1 1 10 TYS CD2 C -8.308 -2.056 7.126 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 8 . 1996 . 1 1 10 TYS CE1 C -8.468 0.119 8.806 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 8 . 1997 . 1 1 10 TYS CE2 C -9.543 -1.572 7.502 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 8 . 1998 . 1 1 10 TYS CG C -7.143 -1.453 7.581 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 8 . 1999 . 1 1 10 TYS CZ C -9.620 -0.482 8.347 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 8 . 2000 . 1 1 10 TYS H H -7.104 -0.873 5.228 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 8 . 2001 . 1 1 10 TYS HA H -4.402 -0.756 6.139 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 8 . 2002 . 1 1 10 TYS HB2 H -5.131 -1.711 8.042 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2003 . 1 1 10 TYS HB3 H -5.861 -3.058 7.189 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2004 . 1 1 10 TYS HD1 H -6.347 0.110 8.780 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 8 . 2005 . 1 1 10 TYS HD2 H -8.243 -2.907 6.463 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 8 . 2006 . 1 1 10 TYS HE1 H -8.514 0.965 9.461 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 8 . 2007 . 1 1 10 TYS HE2 H -10.439 -2.046 7.139 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 8 . 2008 . 1 1 10 TYS N N -6.137 -0.805 5.050 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 8 . 2009 . 1 1 10 TYS O O -3.307 -2.849 5.296 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 8 . 2010 . 1 1 10 TYS O1 O -12.018 -2.063 9.595 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 8 . 2011 . 1 1 10 TYS O2 O -10.819 -0.490 11.103 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 8 . 2012 . 1 1 10 TYS O3 O -12.815 0.234 9.930 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 8 . 2013 . 1 1 10 TYS OH O -10.849 0.017 8.711 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 8 . 2014 . 1 1 10 TYS S S -11.605 -0.669 9.849 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 8 . 2015 . 1 1 11 ASP C C -4.201 -4.126 2.369 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 8 . 2016 . 1 1 11 ASP CA C -4.802 -4.539 3.710 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 8 . 2017 . 1 1 11 ASP CB C -5.914 -5.564 3.483 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 8 . 2018 . 1 1 11 ASP CG C -6.127 -6.461 4.687 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 8 . 2019 . 1 1 11 ASP H H -6.269 -3.181 4.399 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 8 . 2020 . 1 1 11 ASP HA H -4.030 -4.993 4.309 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 8 . 2021 . 1 1 11 ASP HB2 H -6.840 -5.042 3.278 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2022 . 1 1 11 ASP HB3 H -5.653 -6.184 2.635 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2023 . 1 1 11 ASP N N -5.315 -3.394 4.446 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 8 . 2024 . 1 1 11 ASP O O -3.789 -4.980 1.584 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 8 . 2025 . 1 1 11 ASP OD1 O -6.270 -5.927 5.807 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 8 . 2026 . 1 1 11 ASP OD2 O -6.150 -7.698 4.508 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 8 . 2027 . 1 1 12 ILE C C -2.067 -2.154 0.923 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 8 . 2028 . 1 1 12 ILE CA C -3.577 -2.350 0.835 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 8 . 2029 . 1 1 12 ILE CB C -4.228 -1.038 0.355 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 8 . 2030 . 1 1 12 ILE CD1 C -2.681 0.979 0.441 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 8 . 2031 . 1 1 12 ILE CG1 C -3.714 0.149 1.170 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 8 . 2032 . 1 1 12 ILE CG2 C -5.742 -1.139 0.436 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 8 . 2033 . 1 1 12 ILE H H -4.481 -2.168 2.761 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 8 . 2034 . 1 1 12 ILE HA H -3.775 -3.106 0.094 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 8 . 2035 . 1 1 12 ILE HB H -3.962 -0.893 -0.682 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 8 . 2036 . 1 1 12 ILE HD11 H -2.820 2.021 0.684 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 8 . 2037 . 1 1 12 ILE HD12 H -2.793 0.839 -0.624 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 8 . 2038 . 1 1 12 ILE HD13 H -1.692 0.667 0.743 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 8 . 2039 . 1 1 12 ILE HG12 H -4.542 0.791 1.420 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 8 . 2040 . 1 1 12 ILE HG13 H -3.260 -0.219 2.078 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 8 . 2041 . 1 1 12 ILE HG21 H -6.098 -1.829 -0.313 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 8 . 2042 . 1 1 12 ILE HG22 H -6.178 -0.166 0.267 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 8 . 2043 . 1 1 12 ILE HG23 H -6.025 -1.496 1.416 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 8 . 2044 . 1 1 12 ILE N N -4.143 -2.821 2.100 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 8 . 2045 . 1 1 12 ILE O O -1.457 -1.571 0.026 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 8 . 2046 . 1 1 13 ASN C C 0.746 -3.530 1.394 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 8 . 2047 . 1 1 13 ASN CA C -0.028 -2.498 2.190 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 8 . 2048 . 1 1 13 ASN CB C 0.330 -2.604 3.665 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 8 . 2049 . 1 1 13 ASN CG C -0.548 -1.733 4.541 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 8 . 2050 . 1 1 13 ASN H H -1.996 -3.087 2.690 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 8 . 2051 . 1 1 13 ASN HA H 0.262 -1.527 1.831 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 8 . 2052 . 1 1 13 ASN HB2 H 0.218 -3.629 3.979 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2053 . 1 1 13 ASN HB3 H 1.356 -2.298 3.796 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2054 . 1 1 13 ASN HD21 H 0.423 -2.343 6.165 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 8 . 2055 . 1 1 13 ASN HD22 H -0.855 -1.213 6.435 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 8 . 2056 . 1 1 13 ASN N N -1.464 -2.634 2.003 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 8 . 2057 . 1 1 13 ASN ND2 N -0.303 -1.766 5.845 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 8 . 2058 . 1 1 13 ASN O O 1.972 -3.549 1.434 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 8 . 2059 . 1 1 13 ASN OD1 O -1.439 -1.037 4.051 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 8 . 2060 . 1 1 14 TYS C C 1.659 -4.710 -1.167 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 8 . 2061 . 1 1 14 TYS CA C 0.726 -5.375 -0.158 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 8 . 2062 . 1 1 14 TYS CB C -0.267 -6.309 -0.864 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 8 . 2063 . 1 1 14 TYS CD1 C -1.462 -4.258 -1.708 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 8 . 2064 . 1 1 14 TYS CD2 C -2.581 -6.349 -1.812 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 8 . 2065 . 1 1 14 TYS CE1 C -2.558 -3.636 -2.267 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 8 . 2066 . 1 1 14 TYS CE2 C -3.681 -5.742 -2.370 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 8 . 2067 . 1 1 14 TYS CG C -1.457 -5.620 -1.473 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 8 . 2068 . 1 1 14 TYS CZ C -3.671 -4.381 -2.598 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 8 . 2069 . 1 1 14 TYS H H -0.931 -4.317 0.633 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 8 . 2070 . 1 1 14 TYS HA H 1.333 -5.950 0.513 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 8 . 2071 . 1 1 14 TYS HB2 H -0.645 -7.026 -0.152 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2072 . 1 1 14 TYS HB3 H 0.245 -6.836 -1.653 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2073 . 1 1 14 TYS HD1 H -0.591 -3.683 -1.442 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 8 . 2074 . 1 1 14 TYS HD2 H -2.588 -7.414 -1.632 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 8 . 2075 . 1 1 14 TYS HE1 H -2.542 -2.573 -2.441 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 8 . 2076 . 1 1 14 TYS HE2 H -4.541 -6.333 -2.622 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 8 . 2077 . 1 1 14 TYS N N 0.045 -4.375 0.649 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 8 . 2078 . 1 1 14 TYS O O 2.510 -5.368 -1.765 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 8 . 2079 . 1 1 14 TYS O1 O -6.280 -3.801 -1.428 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 8 . 2080 . 1 1 14 TYS O2 O -6.947 -3.042 -3.702 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 8 . 2081 . 1 1 14 TYS O3 O -5.291 -1.797 -2.443 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 8 . 2082 . 1 1 14 TYS OH O -4.651 -3.821 -3.384 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 8 . 2083 . 1 1 14 TYS S S -5.854 -3.175 -2.697 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 8 . 2084 . 1 1 15 TYR C C 3.825 -2.781 -1.705 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 8 . 2085 . 1 1 15 TYR CA C 2.394 -2.638 -2.203 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 8 . 2086 . 1 1 15 TYR CB C 1.962 -1.165 -2.222 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 8 . 2087 . 1 1 15 TYR CD1 C 2.455 -0.644 0.201 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 8 . 2088 . 1 1 15 TYR CD2 C 3.333 0.819 -1.465 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 8 . 2089 . 1 1 15 TYR CE1 C 3.031 0.131 1.190 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 8 . 2090 . 1 1 15 TYR CE2 C 3.912 1.598 -0.481 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 8 . 2091 . 1 1 15 TYR CG C 2.596 -0.315 -1.141 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 8 . 2092 . 1 1 15 TYR CZ C 3.757 1.251 0.844 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 8 . 2093 . 1 1 15 TYR H H 0.862 -2.914 -0.788 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 8 . 2094 . 1 1 15 TYR HA H 2.314 -3.055 -3.196 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 8 . 2095 . 1 1 15 TYR HB2 H 2.220 -0.732 -3.176 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2096 . 1 1 15 TYR HB3 H 0.889 -1.118 -2.086 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2097 . 1 1 15 TYR HD1 H 1.885 -1.523 0.469 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 8 . 2098 . 1 1 15 TYR HD2 H 3.452 1.088 -2.504 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 8 . 2099 . 1 1 15 TYR HE1 H 2.910 -0.141 2.228 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 8 . 2100 . 1 1 15 TYR HE2 H 4.480 2.475 -0.754 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 8 . 2101 . 1 1 15 TYR HH H 4.680 1.459 2.519 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 8 . 2102 . 1 1 15 TYR N N 1.529 -3.392 -1.315 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 8 . 2103 . 1 1 15 TYR O O 4.785 -2.721 -2.471 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 8 . 2104 . 1 1 15 TYR OH O 4.331 2.025 1.826 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 8 . 2105 . 1 1 16 THR C C 5.583 -4.664 0.229 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 8 . 2106 . 1 1 16 THR CA C 5.197 -3.191 0.274 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 8 . 2107 . 1 1 16 THR CB C 5.073 -2.721 1.725 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 8 . 2108 . 1 1 16 THR CG2 C 4.385 -3.723 2.632 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 8 . 2109 . 1 1 16 THR H H 3.109 -3.048 0.137 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 8 . 2110 . 1 1 16 THR HA H 5.950 -2.606 -0.233 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 8 . 2111 . 1 1 16 THR HB H 4.483 -1.818 1.740 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 8 . 2112 . 1 1 16 THR HG1 H 6.750 -1.713 1.794 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 8 . 2113 . 1 1 16 THR HG21 H 5.128 -4.305 3.157 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 8 . 2114 . 1 1 16 THR HG22 H 3.765 -4.380 2.039 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 8 . 2115 . 1 1 16 THR HG23 H 3.768 -3.197 3.345 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 8 . 2116 . 1 1 16 THR N N 3.929 -2.999 -0.397 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 8 . 2117 . 1 1 16 THR O O 6.763 -5.014 0.191 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 8 . 2118 . 1 1 16 THR OG1 O 6.345 -2.437 2.278 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 8 . 2119 . 1 1 17 SER C C 5.308 -7.434 -1.136 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 8 . 2120 . 1 1 17 SER CA C 4.779 -6.965 0.216 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 8 . 2121 . 1 1 17 SER CB C 3.482 -7.702 0.554 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 8 . 2122 . 1 1 17 SER H H 3.642 -5.169 0.288 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 8 . 2123 . 1 1 17 SER HA H 5.517 -7.198 0.964 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 8 . 2124 . 1 1 17 SER HB2 H 3.147 -7.406 1.536 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2125 . 1 1 17 SER HB3 H 2.726 -7.450 -0.175 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2126 . 1 1 17 SER HG H 4.492 -9.321 1.000 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 8 . 2127 . 1 1 17 SER N N 4.565 -5.522 0.245 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 8 . 2128 . 1 1 17 SER O O 5.719 -8.585 -1.282 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 8 . 2129 . 1 1 17 SER OG O 3.675 -9.107 0.542 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 8 . 2130 . 1 1 18 GLU C C 7.311 -6.661 -3.531 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 8 . 2131 . 1 1 18 GLU CA C 5.801 -6.885 -3.447 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 8 . 2132 . 1 1 18 GLU CB C 5.076 -6.072 -4.522 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 8 . 2133 . 1 1 18 GLU CD C 3.232 -6.210 -6.245 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 8 . 2134 . 1 1 18 GLU CG C 4.383 -6.930 -5.569 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 8 . 2135 . 1 1 18 GLU H H 4.977 -5.641 -1.946 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 8 . 2136 . 1 1 18 GLU HA H 5.601 -7.935 -3.609 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 8 . 2137 . 1 1 18 GLU HB2 H 4.329 -5.452 -4.046 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2138 . 1 1 18 GLU HB3 H 5.790 -5.437 -5.024 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2139 . 1 1 18 GLU HG2 H 5.104 -7.209 -6.322 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 8 . 2140 . 1 1 18 GLU HG3 H 4.001 -7.820 -5.090 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 8 . 2141 . 1 1 18 GLU N N 5.308 -6.544 -2.119 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 8 . 2142 . 1 1 18 GLU O O 8.063 -7.588 -3.830 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 8 . 2143 . 1 1 18 GLU OE1 O 2.144 -6.129 -5.638 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 8 . 2144 . 1 1 18 GLU OE2 O 3.420 -5.728 -7.382 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 8 . 2145 . 1 1 19 PRO C C 10.001 -5.678 -2.153 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 8 . 2146 . 1 1 19 PRO CA C 9.204 -5.089 -3.317 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 8 . 2147 . 1 1 19 PRO CB C 9.226 -3.554 -3.236 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 8 . 2148 . 1 1 19 PRO CD C 6.973 -4.257 -2.916 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 8 . 2149 . 1 1 19 PRO CG C 7.812 -3.123 -3.420 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 8 . 2150 . 1 1 19 PRO HA H 9.639 -5.402 -4.247 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 8 . 2151 . 1 1 19 PRO HB2 H 9.606 -3.249 -2.268 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2152 . 1 1 19 PRO HB3 H 9.862 -3.163 -4.018 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2153 . 1 1 19 PRO HD2 H 6.837 -4.187 -1.850 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 8 . 2154 . 1 1 19 PRO HD3 H 6.028 -4.278 -3.423 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 8 . 2155 . 1 1 19 PRO HG2 H 7.621 -2.230 -2.842 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 8 . 2156 . 1 1 19 PRO HG3 H 7.614 -2.945 -4.466 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 8 . 2157 . 1 1 19 PRO N N 7.780 -5.425 -3.268 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 8 . 2158 . 1 1 19 PRO O O 10.841 -4.998 -1.564 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 8 . 2159 . 1 1 20 ALA C C 11.954 -7.576 -0.951 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 8 . 2160 . 1 1 20 ALA CA C 10.447 -7.599 -0.729 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 8 . 2161 . 1 1 20 ALA CB C 9.954 -9.029 -0.566 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 8 . 2162 . 1 1 20 ALA H H 9.067 -7.437 -2.322 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 8 . 2163 . 1 1 20 ALA HA H 10.227 -7.061 0.173 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 8 . 2164 . 1 1 20 ALA HB1 H 9.154 -9.052 0.160 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 8 . 2165 . 1 1 20 ALA HB2 H 10.767 -9.654 -0.227 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2166 . 1 1 20 ALA HB3 H 9.591 -9.395 -1.514 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2167 . 1 1 20 ALA N N 9.742 -6.940 -1.822 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 8 . 2168 . 1 1 20 ALA O O 12.737 -7.684 -0.007 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 8 . 2169 . 1 1 21 GLN C C 14.303 -5.964 -2.470 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 8 . 2170 . 1 1 21 GLN CA C 13.762 -7.386 -2.567 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 8 . 2171 . 1 1 21 GLN CB C 13.965 -7.925 -3.986 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 8 . 2172 . 1 1 21 GLN CD C 13.288 -7.764 -6.414 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 8 . 2173 . 1 1 21 GLN CG C 13.283 -7.089 -5.056 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 8 . 2174 . 1 1 21 GLN H H 11.674 -7.347 -2.905 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 8 . 2175 . 1 1 21 GLN HA H 14.302 -8.013 -1.873 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 8 . 2176 . 1 1 21 GLN HB2 H 15.022 -7.953 -4.199 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2177 . 1 1 21 GLN HE21 H 11.472 -8.501 -6.082 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 8 . 2178 . 1 1 21 GLN HE22 H 12.182 -8.908 -7.604 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 8 . 2179 . 1 1 21 GLN HG2 H 12.259 -6.915 -4.762 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 8 . 2180 . 1 1 21 GLN N N 12.350 -7.432 -2.206 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 8 . 2181 . 1 1 21 GLN NE2 N 12.205 -8.461 -6.732 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 8 . 2182 . 1 1 21 GLN O O 15.498 -5.756 -2.263 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 8 . 2183 . 1 1 21 GLN OE1 O 14.257 -7.660 -7.167 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 8 . 2184 . 1 1 22 LYS C C 14.550 -3.277 -1.260 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 8 . 2185 . 1 1 22 LYS CA C 13.800 -3.579 -2.554 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 8 . 2186 . 1 1 22 LYS CB C 12.563 -2.684 -2.659 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 8 . 2187 . 1 1 22 LYS CD C 12.752 -1.676 -4.955 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 8 . 2188 . 1 1 22 LYS CE C 13.976 -1.114 -5.661 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 8 . 2189 . 1 1 22 LYS CG C 12.799 -1.412 -3.458 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 8 . 2190 . 1 1 22 LYS H H 12.476 -5.213 -2.787 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 8 . 2191 . 1 1 22 LYS HA H 14.451 -3.374 -3.391 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 8 . 2192 . 1 1 22 LYS HB2 H 11.770 -3.241 -3.135 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 8 . 2193 . 1 1 22 LYS HB3 H 12.249 -2.406 -1.663 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 8 . 2194 . 1 1 22 LYS HD2 H 12.711 -2.742 -5.124 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 8 . 2195 . 1 1 22 LYS HD3 H 11.866 -1.211 -5.365 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 8 . 2196 . 1 1 22 LYS HE2 H 14.821 -1.176 -4.992 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 8 . 2197 . 1 1 22 LYS HE3 H 14.172 -1.708 -6.542 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 8 . 2198 . 1 1 22 LYS HG2 H 12.034 -0.694 -3.205 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 8 . 2199 . 1 1 22 LYS HG3 H 13.769 -1.013 -3.201 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 8 . 2200 . 1 1 22 LYS HZ1 H 12.776 0.488 -6.256 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 8 . 2201 . 1 1 22 LYS HZ2 H 14.330 0.510 -6.927 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 8 . 2202 . 1 1 22 LYS HZ3 H 14.100 0.941 -5.307 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 8 . 2203 . 1 1 22 LYS N N 13.414 -4.985 -2.622 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 8 . 2204 . 1 1 22 LYS NZ N 13.782 0.305 -6.066 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 8 . 2205 . 1 1 22 LYS O O 15.746 -2.985 -1.279 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 8 . 2206 . 1 1 23 ILE C C 14.844 -4.390 1.852 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 8 . 2207 . 1 1 23 ILE CA C 14.442 -3.090 1.163 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 8 . 2208 . 1 1 23 ILE CB C 13.481 -2.307 2.080 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 8 . 2209 . 1 1 23 ILE CD1 C 11.414 -0.928 1.529 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 8 . 2210 . 1 1 23 ILE CG1 C 12.907 -1.094 1.344 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 8 . 2211 . 1 1 23 ILE CG2 C 14.198 -1.872 3.350 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 8 . 2212 . 1 1 23 ILE H H 12.892 -3.592 -0.187 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 8 . 2213 . 1 1 23 ILE HA H 15.326 -2.489 1.006 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 8 . 2214 . 1 1 23 ILE HB H 12.673 -2.965 2.361 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 8 . 2215 . 1 1 23 ILE HD11 H 11.116 0.054 1.188 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 8 . 2216 . 1 1 23 ILE HD12 H 11.166 -1.036 2.574 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 8 . 2217 . 1 1 23 ILE HD13 H 10.894 -1.681 0.955 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 8 . 2218 . 1 1 23 ILE HG12 H 13.387 -0.198 1.709 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 8 . 2219 . 1 1 23 ILE HG13 H 13.101 -1.195 0.287 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 8 . 2220 . 1 1 23 ILE HG21 H 13.773 -0.944 3.704 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 8 . 2221 . 1 1 23 ILE HG22 H 15.247 -1.730 3.140 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 8 . 2222 . 1 1 23 ILE HG23 H 14.083 -2.633 4.108 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 8 . 2223 . 1 1 23 ILE N N 13.842 -3.353 -0.138 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 8 . 2224 . 1 1 23 ILE O O 14.668 -4.549 3.060 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 9 . 2225 . 1 1 7 SER C C -8.381 -4.976 3.864 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 9 . 2226 . 1 1 7 SER CA C -8.025 -5.872 5.049 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 9 . 2227 . 1 1 7 SER CB C -6.791 -5.334 5.760 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 9 . 2228 . 1 1 7 SER H H -7.002 -7.709 5.076 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 9 . 2229 . 1 1 7 SER HA H -8.848 -5.883 5.739 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 9 . 2230 . 1 1 7 SER HB2 H -6.039 -6.115 5.776 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2231 . 1 1 7 SER HB3 H -6.411 -4.477 5.226 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2232 . 1 1 7 SER HG H -6.280 -4.929 7.607 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 9 . 2233 . 1 1 7 SER N N -7.742 -7.237 4.640 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 9 . 2234 . 1 1 7 SER O O -8.088 -5.299 2.713 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 9 . 2235 . 1 1 7 SER OG O -7.090 -4.955 7.092 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 9 . 2236 . 1 1 8 PRO C C -8.269 -1.854 2.927 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 9 . 2237 . 1 1 8 PRO CA C -9.398 -2.847 3.146 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 9 . 2238 . 1 1 8 PRO CB C -10.632 -2.180 3.794 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 9 . 2239 . 1 1 8 PRO CD C -9.375 -3.342 5.472 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 9 . 2240 . 1 1 8 PRO CG C -10.703 -2.705 5.198 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 9 . 2241 . 1 1 8 PRO HA H -9.670 -3.294 2.211 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 9 . 2242 . 1 1 8 PRO HB2 H -10.501 -1.109 3.789 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2243 . 1 1 8 PRO HB3 H -11.519 -2.442 3.231 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2244 . 1 1 8 PRO HD2 H -8.666 -2.603 5.827 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2245 . 1 1 8 PRO HD3 H -9.473 -4.155 6.174 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 9 . 2246 . 1 1 8 PRO HG2 H -10.877 -1.891 5.886 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 9 . 2247 . 1 1 8 PRO HG3 H -11.494 -3.437 5.276 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 9 . 2248 . 1 1 8 PRO N N -9.006 -3.824 4.145 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 9 . 2249 . 1 1 8 PRO O O -7.131 -2.246 2.671 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 9 . 2250 . 1 1 9 ILE C C -6.368 0.225 3.822 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 9 . 2251 . 1 1 9 ILE CA C -7.570 0.467 2.913 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 9 . 2252 . 1 1 9 ILE CB C -8.121 1.889 3.197 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 9 . 2253 . 1 1 9 ILE CD1 C -9.407 1.092 5.255 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2254 . 1 1 9 ILE CG1 C -9.459 1.850 3.945 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 9 . 2255 . 1 1 9 ILE CG2 C -8.268 2.668 1.900 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 9 . 2256 . 1 1 9 ILE H H -9.487 -0.339 3.277 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 9 . 2257 . 1 1 9 ILE HA H -7.231 0.433 1.901 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 9 . 2258 . 1 1 9 ILE HB H -7.394 2.403 3.808 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 9 . 2259 . 1 1 9 ILE HD11 H -9.006 1.733 6.025 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 9 . 2260 . 1 1 9 ILE HD12 H -8.775 0.224 5.145 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 9 . 2261 . 1 1 9 ILE HD13 H -10.404 0.779 5.530 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 9 . 2262 . 1 1 9 ILE HG12 H -9.768 2.864 4.166 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 9 . 2263 . 1 1 9 ILE HG13 H -10.205 1.379 3.316 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 9 . 2264 . 1 1 9 ILE HG21 H -7.421 2.467 1.261 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 9 . 2265 . 1 1 9 ILE HG22 H -8.311 3.725 2.119 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 9 . 2266 . 1 1 9 ILE HG23 H -9.176 2.367 1.400 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 9 . 2267 . 1 1 9 ILE N N -8.574 -0.577 3.061 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 9 . 2268 . 1 1 9 ILE O O -5.364 0.931 3.735 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 9 . 2269 . 1 1 10 TYS C C -4.414 -2.055 4.897 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 9 . 2270 . 1 1 10 TYS CA C -5.368 -1.098 5.583 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 9 . 2271 . 1 1 10 TYS CB C -5.893 -1.696 6.889 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 9 . 2272 . 1 1 10 TYS CD1 C -6.478 -0.886 9.170 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2273 . 1 1 10 TYS CD2 C -7.183 0.429 7.321 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 9 . 2274 . 1 1 10 TYS CE1 C -7.048 0.009 10.034 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 9 . 2275 . 1 1 10 TYS CE2 C -7.760 1.336 8.180 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 9 . 2276 . 1 1 10 TYS CG C -6.533 -0.696 7.806 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 9 . 2277 . 1 1 10 TYS CZ C -7.693 1.125 9.541 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 9 . 2278 . 1 1 10 TYS H H -7.279 -1.313 4.712 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 9 . 2279 . 1 1 10 TYS HA H -4.839 -0.185 5.791 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 9 . 2280 . 1 1 10 TYS HB2 H -5.077 -2.140 7.437 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2281 . 1 1 10 TYS HB3 H -6.625 -2.455 6.666 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2282 . 1 1 10 TYS HD1 H -5.974 -1.759 9.558 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 9 . 2283 . 1 1 10 TYS HD2 H -7.230 0.591 6.258 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2284 . 1 1 10 TYS HE1 H -6.984 -0.167 11.088 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 9 . 2285 . 1 1 10 TYS HE2 H -8.262 2.203 7.784 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 9 . 2286 . 1 1 10 TYS N N -6.463 -0.776 4.686 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 9 . 2287 . 1 1 10 TYS O O -3.198 -1.977 5.075 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 9 . 2288 . 1 1 10 TYS O1 O -10.157 0.097 10.860 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 9 . 2289 . 1 1 10 TYS O2 O -10.423 2.413 11.725 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 9 . 2290 . 1 1 10 TYS O3 O -10.506 1.990 9.338 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 9 . 2291 . 1 1 10 TYS OH O -8.436 1.913 10.390 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 9 . 2292 . 1 1 10 TYS S S -9.896 1.534 10.644 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 9 . 2293 . 1 1 11 ASP C C -3.726 -3.281 2.023 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 9 . 2294 . 1 1 11 ASP CA C -4.175 -3.892 3.345 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 9 . 2295 . 1 1 11 ASP CB C -4.959 -5.180 3.087 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 9 . 2296 . 1 1 11 ASP CG C -4.429 -6.348 3.895 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 9 . 2297 . 1 1 11 ASP H H -5.946 -2.939 3.972 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 9 . 2298 . 1 1 11 ASP HA H -3.305 -4.121 3.938 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 9 . 2299 . 1 1 11 ASP HB2 H -5.993 -5.022 3.354 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2300 . 1 1 11 ASP HB3 H -4.889 -5.430 2.036 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2301 . 1 1 11 ASP N N -4.974 -2.941 4.088 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 9 . 2302 . 1 1 11 ASP O O -3.007 -3.917 1.254 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 9 . 2303 . 1 1 11 ASP OD1 O -3.916 -6.116 5.010 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 9 . 2304 . 1 1 11 ASP OD2 O -4.526 -7.496 3.412 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 9 . 2305 . 1 1 12 ILE C C -2.300 -0.938 0.544 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 9 . 2306 . 1 1 12 ILE CA C -3.759 -1.380 0.510 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 9 . 2307 . 1 1 12 ILE CB C -4.648 -0.167 0.172 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 9 . 2308 . 1 1 12 ILE CD1 C -3.747 2.148 0.722 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2309 . 1 1 12 ILE CG1 C -4.493 0.931 1.224 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 9 . 2310 . 1 1 12 ILE CG2 C -6.101 -0.596 0.043 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 9 . 2311 . 1 1 12 ILE H H -4.727 -1.562 2.407 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 9 . 2312 . 1 1 12 ILE HA H -3.868 -2.102 -0.283 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 9 . 2313 . 1 1 12 ILE HB H -4.333 0.220 -0.787 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 9 . 2314 . 1 1 12 ILE HD11 H -4.156 2.454 -0.230 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 9 . 2315 . 1 1 12 ILE HD12 H -2.701 1.904 0.600 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 9 . 2316 . 1 1 12 ILE HD13 H -3.849 2.953 1.434 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 9 . 2317 . 1 1 12 ILE HG12 H -5.471 1.255 1.544 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 9 . 2318 . 1 1 12 ILE HG13 H -3.953 0.537 2.072 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 9 . 2319 . 1 1 12 ILE HG21 H -6.384 -1.173 0.908 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 9 . 2320 . 1 1 12 ILE HG22 H -6.221 -1.197 -0.847 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 9 . 2321 . 1 1 12 ILE HG23 H -6.730 0.280 -0.028 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 9 . 2322 . 1 1 12 ILE N N -4.148 -2.039 1.755 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 9 . 2323 . 1 1 12 ILE O O -1.780 -0.422 -0.441 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 9 . 2324 . 1 1 13 ASN C C 0.664 -1.801 1.101 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 9 . 2325 . 1 1 13 ASN CA C -0.229 -0.805 1.815 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 9 . 2326 . 1 1 13 ASN CB C 0.150 -0.729 3.293 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 9 . 2327 . 1 1 13 ASN CG C 1.036 0.460 3.604 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 9 . 2328 . 1 1 13 ASN H H -2.093 -1.593 2.421 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 9 . 2329 . 1 1 13 ASN HA H -0.076 0.157 1.366 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 9 . 2330 . 1 1 13 ASN HB2 H -0.750 -0.649 3.882 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2331 . 1 1 13 ASN HB3 H 0.677 -1.631 3.567 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2332 . 1 1 13 ASN HD21 H 1.566 -0.358 5.338 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 9 . 2333 . 1 1 13 ASN HD22 H 2.271 1.180 4.986 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 9 . 2334 . 1 1 13 ASN N N -1.634 -1.164 1.673 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 9 . 2335 . 1 1 13 ASN ND2 N 1.691 0.424 4.759 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 9 . 2336 . 1 1 13 ASN O O 1.849 -1.906 1.406 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 9 . 2337 . 1 1 13 ASN OD1 O 1.132 1.400 2.816 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 9 . 2338 . 1 1 14 TYS C C 2.041 -2.845 -1.333 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 9 . 2339 . 1 1 14 TYS CA C 0.871 -3.494 -0.607 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 9 . 2340 . 1 1 14 TYS CB C -0.010 -4.275 -1.587 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 9 . 2341 . 1 1 14 TYS CD1 C -0.840 -2.045 -2.430 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2342 . 1 1 14 TYS CD2 C -1.994 -4.015 -3.089 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 9 . 2343 . 1 1 14 TYS CE1 C -1.722 -1.277 -3.160 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 9 . 2344 . 1 1 14 TYS CE2 C -2.880 -3.261 -3.820 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 9 . 2345 . 1 1 14 TYS CG C -0.963 -3.424 -2.384 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 9 . 2346 . 1 1 14 TYS CZ C -2.744 -1.890 -3.854 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 9 . 2347 . 1 1 14 TYS H H -0.844 -2.402 -0.068 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 9 . 2348 . 1 1 14 TYS HA H 1.278 -4.168 0.111 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 9 . 2349 . 1 1 14 TYS HB2 H -0.603 -4.987 -1.039 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2350 . 1 1 14 TYS HB3 H 0.619 -4.802 -2.285 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2351 . 1 1 14 TYS HD1 H -0.040 -1.575 -1.876 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 9 . 2352 . 1 1 14 TYS HD2 H -2.099 -5.089 -3.060 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2353 . 1 1 14 TYS HE1 H -1.612 -0.206 -3.183 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 9 . 2354 . 1 1 14 TYS HE2 H -3.673 -3.747 -4.356 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 9 . 2355 . 1 1 14 TYS N N 0.100 -2.524 0.141 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 9 . 2356 . 1 1 14 TYS O O 2.931 -3.539 -1.823 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 9 . 2357 . 1 1 14 TYS O1 O -2.845 -1.617 -7.018 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 9 . 2358 . 1 1 14 TYS O2 O -1.886 0.258 -5.695 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 9 . 2359 . 1 1 14 TYS O3 O -4.221 0.301 -6.346 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 9 . 2360 . 1 1 14 TYS OH O -3.591 -1.136 -4.633 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 9 . 2361 . 1 1 14 TYS S S -3.071 -0.603 -5.968 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 9 . 2362 . 1 1 15 TYR C C 4.462 -1.341 -1.322 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 9 . 2363 . 1 1 15 TYR CA C 3.191 -0.812 -1.967 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 9 . 2364 . 1 1 15 TYR CB C 3.083 0.698 -1.738 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 9 . 2365 . 1 1 15 TYR CD1 C 0.592 1.055 -1.452 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2366 . 1 1 15 TYR CD2 C 1.692 2.146 -3.266 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 9 . 2367 . 1 1 15 TYR CE1 C -0.608 1.626 -1.836 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 9 . 2368 . 1 1 15 TYR CE2 C 0.497 2.720 -3.652 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 9 . 2369 . 1 1 15 TYR CG C 1.763 1.306 -2.162 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 9 . 2370 . 1 1 15 TYR CZ C -0.649 2.458 -2.934 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 9 . 2371 . 1 1 15 TYR H H 1.369 -1.012 -0.913 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 9 . 2372 . 1 1 15 TYR HA H 3.200 -1.030 -3.025 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 9 . 2373 . 1 1 15 TYR HB2 H 3.213 0.902 -0.684 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2374 . 1 1 15 TYR HB3 H 3.868 1.192 -2.295 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2375 . 1 1 15 TYR HD1 H 0.627 0.396 -0.591 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 9 . 2376 . 1 1 15 TYR HD2 H 2.593 2.349 -3.828 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2377 . 1 1 15 TYR HE1 H -1.506 1.426 -1.272 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 9 . 2378 . 1 1 15 TYR HE2 H 0.465 3.370 -4.514 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 9 . 2379 . 1 1 15 TYR HH H -1.910 3.018 -4.273 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 9 . 2380 . 1 1 15 TYR N N 2.075 -1.517 -1.353 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 9 . 2381 . 1 1 15 TYR O O 5.503 -1.488 -1.960 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 9 . 2382 . 1 1 15 TYR OH O -1.842 3.029 -3.316 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 9 . 2383 . 1 1 16 THR C C 5.380 -3.731 0.645 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 9 . 2384 . 1 1 16 THR CA C 5.385 -2.213 0.769 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 9 . 2385 . 1 1 16 THR CB C 5.175 -1.802 2.227 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 9 . 2386 . 1 1 16 THR CG2 C 4.139 -2.641 2.950 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 9 . 2387 . 1 1 16 THR H H 3.445 -1.526 0.381 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 9 . 2388 . 1 1 16 THR HA H 6.330 -1.827 0.414 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 9 . 2389 . 1 1 16 THR HB H 4.830 -0.781 2.244 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 9 . 2390 . 1 1 16 THR HG1 H 7.052 -1.337 2.533 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 9 . 2391 . 1 1 16 THR HG21 H 4.617 -3.499 3.399 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 9 . 2392 . 1 1 16 THR HG22 H 3.391 -2.975 2.245 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 9 . 2393 . 1 1 16 THR HG23 H 3.667 -2.047 3.718 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 9 . 2394 . 1 1 16 THR N N 4.320 -1.655 -0.037 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 9 . 2395 . 1 1 16 THR O O 6.427 -4.378 0.676 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 9 . 2396 . 1 1 16 THR OG1 O 6.385 -1.881 2.958 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 9 . 2397 . 1 1 17 SER C C 4.460 -6.251 -0.968 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 9 . 2398 . 1 1 17 SER CA C 4.022 -5.741 0.402 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 9 . 2399 . 1 1 17 SER CB C 2.573 -6.149 0.673 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 9 . 2400 . 1 1 17 SER H H 3.372 -3.716 0.513 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 9 . 2401 . 1 1 17 SER HA H 4.655 -6.194 1.146 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 9 . 2402 . 1 1 17 SER HB2 H 2.171 -5.533 1.464 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2403 . 1 1 17 SER HB3 H 1.989 -6.008 -0.225 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2404 . 1 1 17 SER HG H 3.178 -7.699 1.707 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 9 . 2405 . 1 1 17 SER N N 4.177 -4.294 0.518 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 9 . 2406 . 1 1 17 SER O O 4.542 -7.458 -1.189 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 9 . 2407 . 1 1 17 SER OG O 2.490 -7.508 1.064 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 9 . 2408 . 1 1 18 GLU C C 6.694 -5.982 -3.219 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 9 . 2409 . 1 1 18 GLU CA C 5.191 -5.712 -3.218 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 9 . 2410 . 1 1 18 GLU CB C 4.839 -4.623 -4.236 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 9 . 2411 . 1 1 18 GLU CD C 2.496 -5.030 -5.089 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 9 . 2412 . 1 1 18 GLU CG C 3.980 -5.119 -5.388 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 9 . 2413 . 1 1 18 GLU H H 4.677 -4.386 -1.651 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 9 . 2414 . 1 1 18 GLU HA H 4.676 -6.624 -3.487 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 9 . 2415 . 1 1 18 GLU HB2 H 4.302 -3.834 -3.730 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2416 . 1 1 18 GLU HB3 H 5.752 -4.218 -4.646 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2417 . 1 1 18 GLU HG2 H 4.192 -4.522 -6.262 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 9 . 2418 . 1 1 18 GLU HG3 H 4.230 -6.151 -5.588 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 9 . 2419 . 1 1 18 GLU N N 4.751 -5.334 -1.882 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 9 . 2420 . 1 1 18 GLU O O 7.134 -7.071 -3.586 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 9 . 2421 . 1 1 18 GLU OE1 O 1.899 -3.969 -5.366 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 9 . 2422 . 1 1 18 GLU OE2 O 1.932 -6.020 -4.579 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 9 . 2423 . 1 1 19 PRO C C 9.448 -6.101 -1.682 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 9 . 2424 . 1 1 19 PRO CA C 8.966 -5.121 -2.755 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 9 . 2425 . 1 1 19 PRO CB C 9.450 -3.704 -2.412 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 9 . 2426 . 1 1 19 PRO CD C 7.079 -3.660 -2.367 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 9 . 2427 . 1 1 19 PRO CG C 8.281 -2.821 -2.670 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 9 . 2428 . 1 1 19 PRO HA H 9.362 -5.411 -3.712 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 9 . 2429 . 1 1 19 PRO HB2 H 9.745 -3.663 -1.371 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2430 . 1 1 19 PRO HB3 H 10.289 -3.446 -3.044 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2431 . 1 1 19 PRO HD2 H 6.865 -3.649 -1.313 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2432 . 1 1 19 PRO HD3 H 6.232 -3.321 -2.933 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 9 . 2433 . 1 1 19 PRO HG2 H 8.316 -1.961 -2.016 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 9 . 2434 . 1 1 19 PRO HG3 H 8.273 -2.511 -3.704 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 9 . 2435 . 1 1 19 PRO N N 7.506 -4.991 -2.805 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 9 . 2436 . 1 1 19 PRO O O 10.427 -5.830 -0.986 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 9 . 2437 . 1 1 20 ALA C C 10.600 -8.661 -0.738 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 9 . 2438 . 1 1 20 ALA CA C 9.149 -8.239 -0.559 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 9 . 2439 . 1 1 20 ALA CB C 8.227 -9.445 -0.643 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 9 . 2440 . 1 1 20 ALA H H 8.001 -7.407 -2.126 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 9 . 2441 . 1 1 20 ALA HA H 9.038 -7.797 0.412 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 9 . 2442 . 1 1 20 ALA HB1 H 7.230 -9.120 -0.900 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 9 . 2443 . 1 1 20 ALA HB2 H 8.207 -9.950 0.311 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2444 . 1 1 20 ALA HB3 H 8.591 -10.124 -1.401 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2445 . 1 1 20 ALA N N 8.768 -7.237 -1.549 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 9 . 2446 . 1 1 20 ALA O O 11.262 -9.084 0.211 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 9 . 2447 . 1 1 21 GLN C C 13.390 -7.698 -2.031 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 9 . 2448 . 1 1 21 GLN CA C 12.463 -8.881 -2.285 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 9 . 2449 . 1 1 21 GLN CB C 12.568 -9.327 -3.745 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 9 . 2450 . 1 1 21 GLN CD C 12.219 -11.302 -5.280 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 9 . 2451 . 1 1 21 GLN CG C 11.708 -10.536 -4.076 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 9 . 2452 . 1 1 21 GLN H H 10.504 -8.178 -2.662 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 9 . 2453 . 1 1 21 GLN HA H 12.757 -9.699 -1.644 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 9 . 2454 . 1 1 21 GLN HB2 H 12.263 -8.510 -4.381 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2455 . 1 1 21 GLN HE21 H 11.601 -9.853 -6.494 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 9 . 2456 . 1 1 21 GLN HE22 H 12.364 -11.201 -7.261 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 9 . 2457 . 1 1 21 GLN HG2 H 11.699 -11.200 -3.223 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 9 . 2458 . 1 1 21 GLN N N 11.086 -8.530 -1.960 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 9 . 2459 . 1 1 21 GLN NE2 N 12.043 -10.728 -6.464 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 9 . 2460 . 1 1 21 GLN O O 14.558 -7.874 -1.683 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 9 . 2461 . 1 1 21 GLN OE1 O 12.765 -12.397 -5.148 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 9 . 2462 . 1 1 22 LYS C C 14.074 -5.153 -0.546 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 9 . 2463 . 1 1 22 LYS CA C 13.633 -5.274 -2.001 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 9 . 2464 . 1 1 22 LYS CB C 12.809 -4.049 -2.400 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 9 . 2465 . 1 1 22 LYS CD C 13.951 -2.576 -4.085 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 9 . 2466 . 1 1 22 LYS CE C 14.980 -1.473 -4.281 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 9 . 2467 . 1 1 22 LYS CG C 13.646 -2.797 -2.613 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 9 . 2468 . 1 1 22 LYS H H 11.923 -6.419 -2.487 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 9 . 2469 . 1 1 22 LYS HA H 14.510 -5.327 -2.629 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 9 . 2470 . 1 1 22 LYS HB2 H 12.285 -4.265 -3.318 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 9 . 2471 . 1 1 22 LYS HB3 H 12.088 -3.846 -1.622 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 9 . 2472 . 1 1 22 LYS HD2 H 14.338 -3.492 -4.505 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 9 . 2473 . 1 1 22 LYS HD3 H 13.040 -2.300 -4.595 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 9 . 2474 . 1 1 22 LYS HE2 H 15.041 -0.890 -3.375 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 9 . 2475 . 1 1 22 LYS HE3 H 15.940 -1.926 -4.482 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 9 . 2476 . 1 1 22 LYS HG2 H 13.101 -1.943 -2.237 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 9 . 2477 . 1 1 22 LYS HG3 H 14.575 -2.901 -2.072 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 9 . 2478 . 1 1 22 LYS HZ1 H 14.009 -1.074 -6.087 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 9 . 2479 . 1 1 22 LYS HZ2 H 15.482 -0.261 -5.907 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 9 . 2480 . 1 1 22 LYS HZ3 H 14.117 0.263 -5.057 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 9 . 2481 . 1 1 22 LYS N N 12.859 -6.492 -2.210 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 9 . 2482 . 1 1 22 LYS NZ N 14.622 -0.573 -5.413 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 9 . 2483 . 1 1 22 LYS O O 15.249 -4.919 -0.260 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 9 . 2484 . 1 1 23 ILE C C 13.269 -6.581 2.473 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 9 . 2485 . 1 1 23 ILE CA C 13.412 -5.221 1.795 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 9 . 2486 . 1 1 23 ILE CB C 12.482 -4.208 2.492 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 9 . 2487 . 1 1 23 ILE CD1 C 11.021 -2.499 1.297 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 9 . 2488 . 1 1 23 ILE CG1 C 12.424 -2.900 1.697 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 9 . 2489 . 1 1 23 ILE CG2 C 12.953 -3.950 3.917 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 9 . 2490 . 1 1 23 ILE H H 12.206 -5.497 0.079 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 9 . 2491 . 1 1 23 ILE HA H 14.431 -4.879 1.908 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 9 . 2492 . 1 1 23 ILE HB H 11.492 -4.636 2.540 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 9 . 2493 . 1 1 23 ILE HD11 H 11.002 -2.256 0.244 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 9 . 2494 . 1 1 23 ILE HD12 H 10.714 -1.637 1.871 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 9 . 2495 . 1 1 23 ILE HD13 H 10.344 -3.319 1.489 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 9 . 2496 . 1 1 23 ILE HG12 H 12.837 -2.101 2.296 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 9 . 2497 . 1 1 23 ILE HG13 H 13.008 -3.006 0.795 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 9 . 2498 . 1 1 23 ILE HG21 H 12.840 -4.851 4.501 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 9 . 2499 . 1 1 23 ILE HG22 H 12.360 -3.160 4.353 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 9 . 2500 . 1 1 23 ILE HG23 H 13.992 -3.656 3.905 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 9 . 2501 . 1 1 23 ILE N N 13.124 -5.313 0.369 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 9 . 2502 . 1 1 23 ILE O O 12.456 -6.753 3.382 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 1 . 10 . 2503 . 1 1 7 SER C C -9.711 1.273 4.264 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c17395_2l87 1 . 10 . 2504 . 1 1 7 SER CA C -10.271 2.651 4.631 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c17395_2l87 1 . 10 . 2505 . 1 1 7 SER CB C -11.479 2.504 5.543 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c17395_2l87 1 . 10 . 2506 . 1 1 7 SER H H -11.617 3.473 3.241 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c17395_2l87 1 . 10 . 2507 . 1 1 7 SER HA H -9.502 3.187 5.162 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c17395_2l87 1 . 10 . 2508 . 1 1 7 SER HB2 H -12.286 3.105 5.141 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2509 . 1 1 7 SER HB3 H -11.782 1.469 5.574 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2510 . 1 1 7 SER HG H -10.981 2.184 7.411 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c17395_2l87 1 . 10 . 2511 . 1 1 7 SER N N -10.673 3.452 3.490 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c17395_2l87 1 . 10 . 2512 . 1 1 7 SER O O -9.142 0.610 5.128 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c17395_2l87 1 . 10 . 2513 . 1 1 7 SER OG O -11.189 2.942 6.859 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c17395_2l87 1 . 10 . 2514 . 1 1 8 PRO C C -7.746 -0.437 2.490 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c17395_2l87 1 . 10 . 2515 . 1 1 8 PRO CA C -9.253 -0.495 2.630 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c17395_2l87 1 . 10 . 2516 . 1 1 8 PRO CB C -9.891 -0.821 1.276 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c17395_2l87 1 . 10 . 2517 . 1 1 8 PRO CD C -10.403 1.471 1.842 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c17395_2l87 1 . 10 . 2518 . 1 1 8 PRO CG C -10.794 0.326 0.949 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c17395_2l87 1 . 10 . 2519 . 1 1 8 PRO HA H -9.512 -1.249 3.351 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c17395_2l87 1 . 10 . 2520 . 1 1 8 PRO HB2 H -9.111 -0.931 0.531 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2521 . 1 1 8 PRO HB3 H -10.446 -1.745 1.361 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2522 . 1 1 8 PRO HD2 H -9.675 2.105 1.353 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2523 . 1 1 8 PRO HD3 H -11.277 2.034 2.125 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c17395_2l87 1 . 10 . 2524 . 1 1 8 PRO HG2 H -10.668 0.604 -0.086 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c17395_2l87 1 . 10 . 2525 . 1 1 8 PRO HG3 H -11.821 0.042 1.135 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c17395_2l87 1 . 10 . 2526 . 1 1 8 PRO N N -9.807 0.803 2.999 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c17395_2l87 1 . 10 . 2527 . 1 1 8 PRO O O -7.143 -1.217 1.751 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c17395_2l87 1 . 10 . 2528 . 1 1 9 ILE C C -5.016 -0.420 3.983 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17395_2l87 1 . 10 . 2529 . 1 1 9 ILE CA C -5.706 0.663 3.172 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17395_2l87 1 . 10 . 2530 . 1 1 9 ILE CB C -5.273 2.068 3.660 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17395_2l87 1 . 10 . 2531 . 1 1 9 ILE CD1 C -6.201 1.643 5.997 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2532 . 1 1 9 ILE CG1 C -5.012 2.084 5.172 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17395_2l87 1 . 10 . 2533 . 1 1 9 ILE CG2 C -6.319 3.107 3.297 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17395_2l87 1 . 10 . 2534 . 1 1 9 ILE H H -7.679 1.075 3.774 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17395_2l87 1 . 10 . 2535 . 1 1 9 ILE HA H -5.403 0.553 2.150 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17395_2l87 1 . 10 . 2536 . 1 1 9 ILE HB H -4.367 2.329 3.143 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17395_2l87 1 . 10 . 2537 . 1 1 9 ILE HD11 H -6.718 0.846 5.485 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17395_2l87 1 . 10 . 2538 . 1 1 9 ILE HD12 H -6.872 2.477 6.135 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17395_2l87 1 . 10 . 2539 . 1 1 9 ILE HD13 H -5.860 1.292 6.959 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17395_2l87 1 . 10 . 2540 . 1 1 9 ILE HG12 H -4.188 1.420 5.396 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17395_2l87 1 . 10 . 2541 . 1 1 9 ILE HG13 H -4.753 3.092 5.473 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17395_2l87 1 . 10 . 2542 . 1 1 9 ILE HG21 H -6.839 2.797 2.403 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17395_2l87 1 . 10 . 2543 . 1 1 9 ILE HG22 H -5.837 4.057 3.122 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17395_2l87 1 . 10 . 2544 . 1 1 9 ILE HG23 H -7.025 3.204 4.108 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17395_2l87 1 . 10 . 2545 . 1 1 9 ILE N N -7.143 0.493 3.207 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17395_2l87 1 . 10 . 2546 . 1 1 9 ILE O O -3.801 -0.585 3.911 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17395_2l87 1 . 10 . 2547 . 1 1 10 TYS C C -4.552 -3.264 4.631 . . . 1.0 . . . . . . . . . . . . A . 10 TYS C . . . . . . . . . c17395_2l87 1 . 10 . 2548 . 1 1 10 TYS CA C -5.222 -2.247 5.543 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CA . . . . . . . . . c17395_2l87 1 . 10 . 2549 . 1 1 10 TYS CB C -6.253 -2.961 6.434 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CB . . . . . . . . . c17395_2l87 1 . 10 . 2550 . 1 1 10 TYS CD1 C -8.582 -2.489 5.590 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2551 . 1 1 10 TYS CD2 C -7.885 -1.533 7.651 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CD2 . . . . . . . . . c17395_2l87 1 . 10 . 2552 . 1 1 10 TYS CE1 C -9.825 -1.909 5.738 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE1 . . . . . . . . . c17395_2l87 1 . 10 . 2553 . 1 1 10 TYS CE2 C -9.111 -0.947 7.806 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CE2 . . . . . . . . . c17395_2l87 1 . 10 . 2554 . 1 1 10 TYS CG C -7.596 -2.306 6.546 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CG . . . . . . . . . c17395_2l87 1 . 10 . 2555 . 1 1 10 TYS CZ C -10.087 -1.135 6.850 . . . 1.0 . . . . . . . . . . . . A . 10 TYS CZ . . . . . . . . . c17395_2l87 1 . 10 . 2556 . 1 1 10 TYS H H -6.763 -0.994 4.753 . . . 1.0 . . . . . . . . . . . . A . 10 TYS H . . . . . . . . . c17395_2l87 1 . 10 . 2557 . 1 1 10 TYS HA H -4.460 -1.809 6.165 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HA . . . . . . . . . c17395_2l87 1 . 10 . 2558 . 1 1 10 TYS HB2 H -5.859 -3.022 7.437 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2559 . 1 1 10 TYS HB3 H -6.412 -3.960 6.062 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2560 . 1 1 10 TYS HD1 H -8.368 -3.092 4.719 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD1 . . . . . . . . . c17395_2l87 1 . 10 . 2561 . 1 1 10 TYS HD2 H -7.119 -1.384 8.398 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2562 . 1 1 10 TYS HE1 H -10.582 -2.061 4.987 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE1 . . . . . . . . . c17395_2l87 1 . 10 . 2563 . 1 1 10 TYS HE2 H -9.302 -0.351 8.677 . . . 1.0 . . . . . . . . . . . . A . 10 TYS HE2 . . . . . . . . . c17395_2l87 1 . 10 . 2564 . 1 1 10 TYS N N -5.796 -1.169 4.744 . . . 1.0 . . . . . . . . . . . . A . 10 TYS N . . . . . . . . . c17395_2l87 1 . 10 . 2565 . 1 1 10 TYS O O -3.482 -3.787 4.942 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O . . . . . . . . . c17395_2l87 1 . 10 . 2566 . 1 1 10 TYS O1 O -12.499 -2.406 8.066 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O1 . . . . . . . . . c17395_2l87 1 . 10 . 2567 . 1 1 10 TYS O2 O -11.964 -0.313 9.297 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O2 . . . . . . . . . c17395_2l87 1 . 10 . 2568 . 1 1 10 TYS O3 O -13.544 -0.271 7.458 . . . 1.0 . . . . . . . . . . . . A . 10 TYS O3 . . . . . . . . . c17395_2l87 1 . 10 . 2569 . 1 1 10 TYS OH O -11.285 -0.466 6.953 . . . 1.0 . . . . . . . . . . . . A . 10 TYS OH . . . . . . . . . c17395_2l87 1 . 10 . 2570 . 1 1 10 TYS S S -12.301 -0.946 7.990 . . . 1.0 . . . . . . . . . . . . A . 10 TYS S . . . . . . . . . c17395_2l87 1 . 10 . 2571 . 1 1 11 ASP C C -3.689 -3.780 1.565 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . c17395_2l87 1 . 10 . 2572 . 1 1 11 ASP CA C -4.651 -4.471 2.528 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . c17395_2l87 1 . 10 . 2573 . 1 1 11 ASP CB C -5.787 -5.130 1.744 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . c17395_2l87 1 . 10 . 2574 . 1 1 11 ASP CG C -6.483 -6.218 2.539 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . c17395_2l87 1 . 10 . 2575 . 1 1 11 ASP H H -6.031 -3.074 3.302 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . c17395_2l87 1 . 10 . 2576 . 1 1 11 ASP HA H -4.114 -5.232 3.072 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . c17395_2l87 1 . 10 . 2577 . 1 1 11 ASP HB2 H -6.521 -4.378 1.483 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2578 . 1 1 11 ASP HB3 H -5.385 -5.571 0.841 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2579 . 1 1 11 ASP N N -5.186 -3.529 3.496 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . c17395_2l87 1 . 10 . 2580 . 1 1 11 ASP O O -3.241 -4.384 0.589 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . c17395_2l87 1 . 10 . 2581 . 1 1 11 ASP OD1 O -5.852 -7.267 2.786 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . c17395_2l87 1 . 10 . 2582 . 1 1 11 ASP OD2 O -7.657 -6.020 2.915 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . c17395_2l87 1 . 10 . 2583 . 1 1 12 ILE C C -1.001 -2.004 1.342 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . c17395_2l87 1 . 10 . 2584 . 1 1 12 ILE CA C -2.458 -1.767 0.965 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . c17395_2l87 1 . 10 . 2585 . 1 1 12 ILE CB C -2.766 -0.249 0.974 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . c17395_2l87 1 . 10 . 2586 . 1 1 12 ILE CD1 C -0.760 0.579 -0.389 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2587 . 1 1 12 ILE CG1 C -2.265 0.406 -0.321 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . c17395_2l87 1 . 10 . 2588 . 1 1 12 ILE CG2 C -2.165 0.438 2.199 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . c17395_2l87 1 . 10 . 2589 . 1 1 12 ILE H H -3.756 -2.071 2.626 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . c17395_2l87 1 . 10 . 2590 . 1 1 12 ILE HA H -2.602 -2.132 -0.031 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . c17395_2l87 1 . 10 . 2591 . 1 1 12 ILE HB H -3.837 -0.130 1.026 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . c17395_2l87 1 . 10 . 2592 . 1 1 12 ILE HD11 H -0.527 1.562 -0.768 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . c17395_2l87 1 . 10 . 2593 . 1 1 12 ILE HD12 H -0.341 -0.169 -1.046 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . c17395_2l87 1 . 10 . 2594 . 1 1 12 ILE HD13 H -0.338 0.465 0.600 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . c17395_2l87 1 . 10 . 2595 . 1 1 12 ILE HG12 H -2.562 -0.204 -1.161 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . c17395_2l87 1 . 10 . 2596 . 1 1 12 ILE HG13 H -2.714 1.382 -0.418 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . c17395_2l87 1 . 10 . 2597 . 1 1 12 ILE HG21 H -2.916 1.057 2.666 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . c17395_2l87 1 . 10 . 2598 . 1 1 12 ILE HG22 H -1.330 1.052 1.899 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . c17395_2l87 1 . 10 . 2599 . 1 1 12 ILE HG23 H -1.828 -0.309 2.902 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . c17395_2l87 1 . 10 . 2600 . 1 1 12 ILE N N -3.370 -2.512 1.833 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . c17395_2l87 1 . 10 . 2601 . 1 1 12 ILE O O -0.090 -1.738 0.560 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . c17395_2l87 1 . 10 . 2602 . 1 1 13 ASN C C 1.219 -3.903 2.258 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . c17395_2l87 1 . 10 . 2603 . 1 1 13 ASN CA C 0.553 -2.782 3.024 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . c17395_2l87 1 . 10 . 2604 . 1 1 13 ASN CB C 0.516 -3.098 4.507 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . c17395_2l87 1 . 10 . 2605 . 1 1 13 ASN CG C -0.135 -4.435 4.809 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . c17395_2l87 1 . 10 . 2606 . 1 1 13 ASN H H -1.557 -2.705 3.115 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . c17395_2l87 1 . 10 . 2607 . 1 1 13 ASN HA H 1.140 -1.899 2.874 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . c17395_2l87 1 . 10 . 2608 . 1 1 13 ASN HB2 H 1.525 -3.114 4.882 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2609 . 1 1 13 ASN HB3 H -0.042 -2.324 5.005 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2610 . 1 1 13 ASN HD21 H 0.559 -4.382 6.671 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . c17395_2l87 1 . 10 . 2611 . 1 1 13 ASN HD22 H -0.378 -5.774 6.258 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . c17395_2l87 1 . 10 . 2612 . 1 1 13 ASN N N -0.790 -2.510 2.540 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . c17395_2l87 1 . 10 . 2613 . 1 1 13 ASN ND2 N 0.032 -4.913 6.037 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . c17395_2l87 1 . 10 . 2614 . 1 1 13 ASN O O 2.426 -4.099 2.365 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . c17395_2l87 1 . 10 . 2615 . 1 1 13 ASN OD1 O -0.781 -5.032 3.948 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . c17395_2l87 1 . 10 . 2616 . 1 1 14 TYS C C 2.078 -5.147 -0.273 . . . 1.0 . . . . . . . . . . . . A . 14 TYS C . . . . . . . . . c17395_2l87 1 . 10 . 2617 . 1 1 14 TYS CA C 1.009 -5.693 0.667 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CA . . . . . . . . . c17395_2l87 1 . 10 . 2618 . 1 1 14 TYS CB C -0.086 -6.431 -0.105 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CB . . . . . . . . . c17395_2l87 1 . 10 . 2619 . 1 1 14 TYS CD1 C -1.270 -6.281 -2.309 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2620 . 1 1 14 TYS CD2 C -0.665 -4.261 -1.217 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CD2 . . . . . . . . . c17395_2l87 1 . 10 . 2621 . 1 1 14 TYS CE1 C -1.833 -5.564 -3.339 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE1 . . . . . . . . . c17395_2l87 1 . 10 . 2622 . 1 1 14 TYS CE2 C -1.224 -3.531 -2.243 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CE2 . . . . . . . . . c17395_2l87 1 . 10 . 2623 . 1 1 14 TYS CG C -0.679 -5.642 -1.236 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CG . . . . . . . . . c17395_2l87 1 . 10 . 2624 . 1 1 14 TYS CZ C -1.809 -4.186 -3.306 . . . 1.0 . . . . . . . . . . . . A . 14 TYS CZ . . . . . . . . . c17395_2l87 1 . 10 . 2625 . 1 1 14 TYS H H -0.504 -4.409 1.398 . . . 1.0 . . . . . . . . . . . . A . 14 TYS H . . . . . . . . . c17395_2l87 1 . 10 . 2626 . 1 1 14 TYS HA H 1.483 -6.371 1.347 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HA . . . . . . . . . c17395_2l87 1 . 10 . 2627 . 1 1 14 TYS HB2 H -0.890 -6.669 0.569 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2628 . 1 1 14 TYS HB3 H 0.318 -7.342 -0.514 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2629 . 1 1 14 TYS HD1 H -1.285 -7.361 -2.332 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD1 . . . . . . . . . c17395_2l87 1 . 10 . 2630 . 1 1 14 TYS HD2 H -0.204 -3.755 -0.382 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2631 . 1 1 14 TYS HE1 H -2.289 -6.084 -4.161 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE1 . . . . . . . . . c17395_2l87 1 . 10 . 2632 . 1 1 14 TYS HE2 H -1.201 -2.457 -2.207 . . . 1.0 . . . . . . . . . . . . A . 14 TYS HE2 . . . . . . . . . c17395_2l87 1 . 10 . 2633 . 1 1 14 TYS N N 0.448 -4.619 1.464 . . . 1.0 . . . . . . . . . . . . A . 14 TYS N . . . . . . . . . c17395_2l87 1 . 10 . 2634 . 1 1 14 TYS O O 2.894 -5.897 -0.808 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O . . . . . . . . . c17395_2l87 1 . 10 . 2635 . 1 1 14 TYS O1 O -3.971 -1.842 -2.902 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O1 . . . . . . . . . c17395_2l87 1 . 10 . 2636 . 1 1 14 TYS O2 O -4.725 -4.160 -3.393 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O2 . . . . . . . . . c17395_2l87 1 . 10 . 2637 . 1 1 14 TYS O3 O -4.443 -2.566 -5.198 . . . 1.0 . . . . . . . . . . . . A . 14 TYS O3 . . . . . . . . . c17395_2l87 1 . 10 . 2638 . 1 1 14 TYS OH O -2.534 -3.470 -4.231 . . . 1.0 . . . . . . . . . . . . A . 14 TYS OH . . . . . . . . . c17395_2l87 1 . 10 . 2639 . 1 1 14 TYS S S -3.930 -2.982 -3.839 . . . 1.0 . . . . . . . . . . . . A . 14 TYS S . . . . . . . . . c17395_2l87 1 . 10 . 2640 . 1 1 15 TYR C C 4.478 -3.543 -0.722 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . c17395_2l87 1 . 10 . 2641 . 1 1 15 TYR CA C 3.098 -3.165 -1.249 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . c17395_2l87 1 . 10 . 2642 . 1 1 15 TYR CB C 2.884 -1.646 -1.196 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . c17395_2l87 1 . 10 . 2643 . 1 1 15 TYR CD1 C 3.426 -1.299 1.247 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2644 . 1 1 15 TYR CD2 C 4.551 0.059 -0.357 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . c17395_2l87 1 . 10 . 2645 . 1 1 15 TYR CE1 C 4.107 -0.664 2.269 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . c17395_2l87 1 . 10 . 2646 . 1 1 15 TYR CE2 C 5.238 0.698 0.659 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . c17395_2l87 1 . 10 . 2647 . 1 1 15 TYR CG C 3.636 -0.948 -0.080 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . c17395_2l87 1 . 10 . 2648 . 1 1 15 TYR CZ C 5.011 0.332 1.970 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . c17395_2l87 1 . 10 . 2649 . 1 1 15 TYR H H 1.449 -3.276 0.052 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . c17395_2l87 1 . 10 . 2650 . 1 1 15 TYR HA H 2.992 -3.513 -2.266 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . c17395_2l87 1 . 10 . 2651 . 1 1 15 TYR HB2 H 3.200 -1.210 -2.131 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2652 . 1 1 15 TYR HB3 H 1.829 -1.451 -1.047 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2653 . 1 1 15 TYR HD1 H 2.717 -2.081 1.477 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . c17395_2l87 1 . 10 . 2654 . 1 1 15 TYR HD2 H 4.727 0.343 -1.384 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2655 . 1 1 15 TYR HE1 H 3.930 -0.951 3.295 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . c17395_2l87 1 . 10 . 2656 . 1 1 15 TYR HE2 H 5.946 1.479 0.424 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . c17395_2l87 1 . 10 . 2657 . 1 1 15 TYR HH H 5.101 1.108 3.728 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . c17395_2l87 1 . 10 . 2658 . 1 1 15 TYR N N 2.098 -3.824 -0.429 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . c17395_2l87 1 . 10 . 2659 . 1 1 15 TYR O O 5.461 -3.592 -1.460 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . c17395_2l87 1 . 10 . 2660 . 1 1 15 TYR OH O 5.691 0.967 2.985 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . c17395_2l87 1 . 10 . 2661 . 1 1 16 THR C C 5.894 -5.744 1.145 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . c17395_2l87 1 . 10 . 2662 . 1 1 16 THR CA C 5.722 -4.236 1.259 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . c17395_2l87 1 . 10 . 2663 . 1 1 16 THR CB C 5.635 -3.821 2.730 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . c17395_2l87 1 . 10 . 2664 . 1 1 16 THR CG2 C 4.778 -4.745 3.574 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . c17395_2l87 1 . 10 . 2665 . 1 1 16 THR H H 3.680 -3.781 1.090 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . c17395_2l87 1 . 10 . 2666 . 1 1 16 THR HA H 6.560 -3.743 0.794 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . c17395_2l87 1 . 10 . 2667 . 1 1 16 THR HB H 5.195 -2.837 2.780 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . c17395_2l87 1 . 10 . 2668 . 1 1 16 THR HG1 H 7.431 -3.063 2.909 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . c17395_2l87 1 . 10 . 2669 . 1 1 16 THR HG21 H 5.403 -5.489 4.044 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . c17395_2l87 1 . 10 . 2670 . 1 1 16 THR HG22 H 4.046 -5.232 2.947 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . c17395_2l87 1 . 10 . 2671 . 1 1 16 THR HG23 H 4.270 -4.169 4.334 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . c17395_2l87 1 . 10 . 2672 . 1 1 16 THR N N 4.511 -3.830 0.575 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . c17395_2l87 1 . 10 . 2673 . 1 1 16 THR O O 7.012 -6.255 1.066 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . c17395_2l87 1 . 10 . 2674 . 1 1 16 THR OG1 O 6.922 -3.767 3.318 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . c17395_2l87 1 . 10 . 2675 . 1 1 17 SER C C 5.603 -8.387 -0.134 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17395_2l87 1 . 10 . 2676 . 1 1 17 SER CA C 4.765 -7.904 1.046 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17395_2l87 1 . 10 . 2677 . 1 1 17 SER CB C 3.331 -8.430 0.940 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17395_2l87 1 . 10 . 2678 . 1 1 17 SER H H 3.904 -5.969 1.216 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17395_2l87 1 . 10 . 2679 . 1 1 17 SER HA H 5.205 -8.290 1.942 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17395_2l87 1 . 10 . 2680 . 1 1 17 SER HB2 H 2.703 -7.669 0.503 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2681 . 1 1 17 SER HB3 H 3.318 -9.309 0.313 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2682 . 1 1 17 SER HG H 1.937 -9.147 2.115 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17395_2l87 1 . 10 . 2683 . 1 1 17 SER N N 4.765 -6.448 1.144 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17395_2l87 1 . 10 . 2684 . 1 1 17 SER O O 6.806 -8.610 -0.004 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17395_2l87 1 . 10 . 2685 . 1 1 17 SER OG O 2.815 -8.770 2.214 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17395_2l87 1 . 10 . 2686 . 1 1 18 GLU C C 6.841 -8.129 -2.811 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c17395_2l87 1 . 10 . 2687 . 1 1 18 GLU CA C 5.641 -9.016 -2.481 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c17395_2l87 1 . 10 . 2688 . 1 1 18 GLU CB C 4.670 -9.062 -3.665 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c17395_2l87 1 . 10 . 2689 . 1 1 18 GLU CD C 5.566 -11.083 -4.888 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c17395_2l87 1 . 10 . 2690 . 1 1 18 GLU CG C 4.385 -10.471 -4.161 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c17395_2l87 1 . 10 . 2691 . 1 1 18 GLU H H 4.003 -8.362 -1.310 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c17395_2l87 1 . 10 . 2692 . 1 1 18 GLU HA H 5.998 -10.017 -2.287 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c17395_2l87 1 . 10 . 2693 . 1 1 18 GLU HB2 H 3.736 -8.613 -3.367 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2694 . 1 1 18 GLU HB3 H 5.089 -8.494 -4.483 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2695 . 1 1 18 GLU HG2 H 4.140 -11.093 -3.315 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c17395_2l87 1 . 10 . 2696 . 1 1 18 GLU HG3 H 3.543 -10.436 -4.837 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c17395_2l87 1 . 10 . 2697 . 1 1 18 GLU N N 4.959 -8.551 -1.278 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c17395_2l87 1 . 10 . 2698 . 1 1 18 GLU O O 7.964 -8.620 -2.930 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c17395_2l87 1 . 10 . 2699 . 1 1 18 GLU OE1 O 6.460 -10.323 -5.316 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c17395_2l87 1 . 10 . 2700 . 1 1 18 GLU OE2 O 5.598 -12.324 -5.028 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c17395_2l87 1 . 10 . 2701 . 1 1 19 PRO C C 8.617 -5.565 -2.115 . . . 1.0 . . . . . . . . . . . . A . 19 PRO C . . . . . . . . . c17395_2l87 1 . 10 . 2702 . 1 1 19 PRO CA C 7.696 -5.866 -3.298 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CA . . . . . . . . . c17395_2l87 1 . 10 . 2703 . 1 1 19 PRO CB C 6.950 -4.589 -3.718 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CB . . . . . . . . . c17395_2l87 1 . 10 . 2704 . 1 1 19 PRO CD C 5.336 -6.130 -2.874 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CD . . . . . . . . . c17395_2l87 1 . 10 . 2705 . 1 1 19 PRO CG C 5.513 -4.976 -3.814 . . . 1.0 . . . . . . . . . . . . A . 19 PRO CG . . . . . . . . . c17395_2l87 1 . 10 . 2706 . 1 1 19 PRO HA H 8.279 -6.224 -4.124 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HA . . . . . . . . . c17395_2l87 1 . 10 . 2707 . 1 1 19 PRO HB2 H 7.101 -3.820 -2.970 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2708 . 1 1 19 PRO HB3 H 7.331 -4.252 -4.671 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2709 . 1 1 19 PRO HD2 H 5.158 -5.779 -1.869 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2710 . 1 1 19 PRO HD3 H 4.540 -6.767 -3.206 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HD3 . . . . . . . . . c17395_2l87 1 . 10 . 2711 . 1 1 19 PRO HG2 H 4.887 -4.148 -3.516 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG2 . . . . . . . . . c17395_2l87 1 . 10 . 2712 . 1 1 19 PRO HG3 H 5.280 -5.278 -4.825 . . . 1.0 . . . . . . . . . . . . A . 19 PRO HG3 . . . . . . . . . c17395_2l87 1 . 10 . 2713 . 1 1 19 PRO N N 6.626 -6.810 -2.972 . . . 1.0 . . . . . . . . . . . . A . 19 PRO N . . . . . . . . . c17395_2l87 1 . 10 . 2714 . 1 1 19 PRO O O 9.071 -4.434 -1.950 . . . 1.0 . . . . . . . . . . . . A . 19 PRO O . . . . . . . . . c17395_2l87 1 . 10 . 2715 . 1 1 20 ALA C C 11.166 -5.962 -0.566 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . c17395_2l87 1 . 10 . 2716 . 1 1 20 ALA CA C 9.769 -6.399 -0.142 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . c17395_2l87 1 . 10 . 2717 . 1 1 20 ALA CB C 9.836 -7.682 0.673 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . c17395_2l87 1 . 10 . 2718 . 1 1 20 ALA H H 8.514 -7.456 -1.475 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . c17395_2l87 1 . 10 . 2719 . 1 1 20 ALA HA H 9.342 -5.630 0.475 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . c17395_2l87 1 . 10 . 2720 . 1 1 20 ALA HB1 H 10.831 -7.801 1.077 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . c17395_2l87 1 . 10 . 2721 . 1 1 20 ALA HB2 H 9.602 -8.525 0.039 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2722 . 1 1 20 ALA HB3 H 9.123 -7.632 1.482 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2723 . 1 1 20 ALA N N 8.897 -6.576 -1.298 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . c17395_2l87 1 . 10 . 2724 . 1 1 20 ALA O O 11.926 -5.411 0.229 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . c17395_2l87 1 . 10 . 2725 . 1 1 21 GLN C C 12.785 -4.407 -2.900 . . . 1.0 . . . . . . . . . . . . A . 21 GLN C . . . . . . . . . c17395_2l87 1 . 10 . 2726 . 1 1 21 GLN CA C 12.792 -5.842 -2.372 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CA . . . . . . . . . c17395_2l87 1 . 10 . 2727 . 1 1 21 GLN CB C 13.187 -6.805 -3.491 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CB . . . . . . . . . c17395_2l87 1 . 10 . 2728 . 1 1 21 GLN CD C 12.820 -6.034 -5.868 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CD . . . . . . . . . c17395_2l87 1 . 10 . 2729 . 1 1 21 GLN CG C 12.242 -6.778 -4.681 . . . 1.0 . . . . . . . . . . . . A . 21 GLN CG . . . . . . . . . c17395_2l87 1 . 10 . 2730 . 1 1 21 GLN H H 10.839 -6.646 -2.405 . . . 1.0 . . . . . . . . . . . . A . 21 GLN H . . . . . . . . . c17395_2l87 1 . 10 . 2731 . 1 1 21 GLN HA H 13.517 -5.915 -1.575 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HA . . . . . . . . . c17395_2l87 1 . 10 . 2732 . 1 1 21 GLN HB2 H 14.177 -6.549 -3.840 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2733 . 1 1 21 GLN HE21 H 14.479 -7.125 -5.777 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE21 . . . . . . . . . c17395_2l87 1 . 10 . 2734 . 1 1 21 GLN HE22 H 14.430 -5.938 -7.032 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HE22 . . . . . . . . . c17395_2l87 1 . 10 . 2735 . 1 1 21 GLN HG2 H 12.031 -7.794 -4.981 . . . 1.0 . . . . . . . . . . . . A . 21 GLN HG2 . . . . . . . . . c17395_2l87 1 . 10 . 2736 . 1 1 21 GLN N N 11.491 -6.209 -1.827 . . . 1.0 . . . . . . . . . . . . A . 21 GLN N . . . . . . . . . c17395_2l87 1 . 10 . 2737 . 1 1 21 GLN NE2 N 14.033 -6.402 -6.266 . . . 1.0 . . . . . . . . . . . . A . 21 GLN NE2 . . . . . . . . . c17395_2l87 1 . 10 . 2738 . 1 1 21 GLN O O 13.823 -3.886 -3.308 . . . 1.0 . . . . . . . . . . . . A . 21 GLN O . . . . . . . . . c17395_2l87 1 . 10 . 2739 . 1 1 21 GLN OE1 O 12.184 -5.137 -6.423 . . . 1.0 . . . . . . . . . . . . A . 21 GLN OE1 . . . . . . . . . c17395_2l87 1 . 10 . 2740 . 1 1 22 LYS C C 12.582 -1.512 -2.787 . . . 1.0 . . . . . . . . . . . . A . 22 LYS C . . . . . . . . . c17395_2l87 1 . 10 . 2741 . 1 1 22 LYS CA C 11.482 -2.396 -3.367 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CA . . . . . . . . . c17395_2l87 1 . 10 . 2742 . 1 1 22 LYS CB C 10.110 -1.833 -2.994 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CB . . . . . . . . . c17395_2l87 1 . 10 . 2743 . 1 1 22 LYS CD C 8.260 -0.284 -3.698 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CD . . . . . . . . . c17395_2l87 1 . 10 . 2744 . 1 1 22 LYS CE C 7.898 0.954 -4.502 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CE . . . . . . . . . c17395_2l87 1 . 10 . 2745 . 1 1 22 LYS CG C 9.756 -0.551 -3.731 . . . 1.0 . . . . . . . . . . . . A . 22 LYS CG . . . . . . . . . c17395_2l87 1 . 10 . 2746 . 1 1 22 LYS H H 10.819 -4.233 -2.554 . . . 1.0 . . . . . . . . . . . . A . 22 LYS H . . . . . . . . . c17395_2l87 1 . 10 . 2747 . 1 1 22 LYS HA H 11.575 -2.408 -4.444 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HA . . . . . . . . . c17395_2l87 1 . 10 . 2748 . 1 1 22 LYS HB2 H 9.356 -2.572 -3.220 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB2 . . . . . . . . . c17395_2l87 1 . 10 . 2749 . 1 1 22 LYS HB3 H 10.094 -1.628 -1.933 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HB3 . . . . . . . . . c17395_2l87 1 . 10 . 2750 . 1 1 22 LYS HD2 H 7.744 -1.135 -4.116 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD2 . . . . . . . . . c17395_2l87 1 . 10 . 2751 . 1 1 22 LYS HD3 H 7.952 -0.141 -2.673 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HD3 . . . . . . . . . c17395_2l87 1 . 10 . 2752 . 1 1 22 LYS HE2 H 8.348 0.877 -5.480 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE2 . . . . . . . . . c17395_2l87 1 . 10 . 2753 . 1 1 22 LYS HE3 H 6.823 1.000 -4.603 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HE3 . . . . . . . . . c17395_2l87 1 . 10 . 2754 . 1 1 22 LYS HG2 H 10.269 0.276 -3.263 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG2 . . . . . . . . . c17395_2l87 1 . 10 . 2755 . 1 1 22 LYS HG3 H 10.075 -0.639 -4.760 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HG3 . . . . . . . . . c17395_2l87 1 . 10 . 2756 . 1 1 22 LYS HZ1 H 8.522 2.946 -4.557 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ1 . . . . . . . . . c17395_2l87 1 . 10 . 2757 . 1 1 22 LYS HZ2 H 9.279 2.025 -3.356 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ2 . . . . . . . . . c17395_2l87 1 . 10 . 2758 . 1 1 22 LYS HZ3 H 7.678 2.532 -3.151 . . . 1.0 . . . . . . . . . . . . A . 22 LYS HZ3 . . . . . . . . . c17395_2l87 1 . 10 . 2759 . 1 1 22 LYS N N 11.613 -3.770 -2.890 . . . 1.0 . . . . . . . . . . . . A . 22 LYS N . . . . . . . . . c17395_2l87 1 . 10 . 2760 . 1 1 22 LYS NZ N 8.378 2.202 -3.846 . . . 1.0 . . . . . . . . . . . . A . 22 LYS NZ . . . . . . . . . c17395_2l87 1 . 10 . 2761 . 1 1 22 LYS O O 13.040 -0.566 -3.429 . . . 1.0 . . . . . . . . . . . . A . 22 LYS O . . . . . . . . . c17395_2l87 1 . 10 . 2762 . 1 1 23 ILE C C 15.190 -2.017 -0.478 . . . 1.0 . . . . . . . . . . . . A . 23 ILE C . . . . . . . . . c17395_2l87 1 . 10 . 2763 . 1 1 23 ILE CA C 14.058 -1.088 -0.897 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CA . . . . . . . . . c17395_2l87 1 . 10 . 2764 . 1 1 23 ILE CB C 13.522 -0.351 0.346 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CB . . . . . . . . . c17395_2l87 1 . 10 . 2765 . 1 1 23 ILE CD1 C 11.084 0.073 0.946 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CD1 . . . . . . . . . c17395_2l87 1 . 10 . 2766 . 1 1 23 ILE CG1 C 12.228 0.397 0.011 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG1 . . . . . . . . . c17395_2l87 1 . 10 . 2767 . 1 1 23 ILE CG2 C 14.573 0.608 0.890 . . . 1.0 . . . . . . . . . . . . A . 23 ILE CG2 . . . . . . . . . c17395_2l87 1 . 10 . 2768 . 1 1 23 ILE H H 12.603 -2.607 -1.117 . . . 1.0 . . . . . . . . . . . . A . 23 ILE H . . . . . . . . . c17395_2l87 1 . 10 . 2769 . 1 1 23 ILE HA H 14.443 -0.354 -1.590 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HA . . . . . . . . . c17395_2l87 1 . 10 . 2770 . 1 1 23 ILE HB H 13.315 -1.087 1.110 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HB . . . . . . . . . c17395_2l87 1 . 10 . 2771 . 1 1 23 ILE HD11 H 10.246 0.719 0.728 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD11 . . . . . . . . . c17395_2l87 1 . 10 . 2772 . 1 1 23 ILE HD12 H 11.399 0.226 1.967 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD12 . . . . . . . . . c17395_2l87 1 . 10 . 2773 . 1 1 23 ILE HD13 H 10.789 -0.957 0.810 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HD13 . . . . . . . . . c17395_2l87 1 . 10 . 2774 . 1 1 23 ILE HG12 H 12.410 1.460 0.067 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG12 . . . . . . . . . c17395_2l87 1 . 10 . 2775 . 1 1 23 ILE HG13 H 11.920 0.142 -0.993 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG13 . . . . . . . . . c17395_2l87 1 . 10 . 2776 . 1 1 23 ILE HG21 H 14.277 1.624 0.678 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG21 . . . . . . . . . c17395_2l87 1 . 10 . 2777 . 1 1 23 ILE HG22 H 15.524 0.404 0.421 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG22 . . . . . . . . . c17395_2l87 1 . 10 . 2778 . 1 1 23 ILE HG23 H 14.662 0.475 1.958 . . . 1.0 . . . . . . . . . . . . A . 23 ILE HG23 . . . . . . . . . c17395_2l87 1 . 10 . 2779 . 1 1 23 ILE N N 13.005 -1.837 -1.571 . . . 1.0 . . . . . . . . . . . . A . 23 ILE N . . . . . . . . . c17395_2l87 1 . 10 . 2780 . 1 1 23 ILE O O 15.832 -1.810 0.551 . . . 1.0 . . . . . . . . . . . . A . 23 ILE O . . . . . . . . . c17395_2l87 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 c17395_2l87 _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 2l87.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c17395_2l87 1 1 2l87.mr . . XPLOR/CNS 2 distance NOE simple 383 c17395_2l87 1 1 2l87.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c17395_2l87 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 c17395_2l87 _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 . . . . c17395_2l87 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 10 10 TYS HA H . . . 1 1 10 10 TYS H H . . . . . 2.783 1.8 3.6179 . . . . . A . 10 TYS HA . . A . 10 TYS H . . . 10 . HA . . . . . 10 . HN . . c17395_2l87 1 2 1 . . 1 1 10 10 TYS HA H . . . 1 1 12 12 ILE H H . . . . . 2.657 1.8 3.4541 . . . . . A . 10 TYS HA . . A . 12 ILE H . . . 10 . HA . . . . . 12 . HN . . c17395_2l87 1 3 1 . . 1 1 10 10 TYS H H . . . 1 1 10 10 TYS HB3 H . . . . . 3.286 1.8 4.2718 . . . . . A . 10 TYS H . . A . 10 TYS HB3 . . . 10 . HN . . . . . 10 . HB1 . . c17395_2l87 1 4 1 . . 1 1 10 10 TYS HB3 H . . . 1 1 11 11 ASP H H . . . . . 3.538 1.8 4.5994 . . . . . A . 10 TYS HB3 . . A . 11 ASP H . . . 10 . HB1 . . . . . 11 . HN . . c17395_2l87 1 5 1 . . 1 1 12 12 ILE H H . . . 1 1 10 10 TYS HB3 H . . . . . 4.806 1.8 6.2478 . . . . . A . 12 ILE H . . A . 10 TYS HB3 . . . 12 . HN . . . . . 10 . HB1 . . c17395_2l87 1 6 1 . . 1 1 10 10 TYS HB3 H . . . 1 1 10 10 TYS HB2 H . . . . . 2.317 1.8 3.0121 . . . . . A . 10 TYS HB3 . . A . 10 TYS HB2 . . . 10 . HB1 . . . . . 10 . HB2 . . c17395_2l87 1 7 1 . . 1 1 10 10 TYS H H . . . 1 1 10 10 TYS HB2 H . . . . . 2.957 1.8 3.8441 . . . . . A . 10 TYS H . . A . 10 TYS HB2 . . . 10 . HN . . . . . 10 . HB2 . . c17395_2l87 1 8 1 . . 1 1 10 10 TYS H H . . . 1 1 11 11 ASP H H . . . . . 3.727 1.8 4.8451 . . . . . A . 10 TYS H . . A . 11 ASP H . . . 10 . HN . . . . . 11 . HN . . c17395_2l87 1 9 1 . . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HA H . . . . . 2.200 1.8 2.8600 . . . . . A . 11 ASP H . . A . 11 ASP HA . . . 11 . HN . . . . . 11 . HA . . c17395_2l87 1 10 1 . . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HB3 H . . . . . 3.178 1.8 4.1314 . . . . . A . 11 ASP H . . A . 11 ASP HB3 . . . 11 . HN . . . . . 11 . HB1 . . c17395_2l87 1 11 1 . . 1 1 12 12 ILE H H . . . 1 1 11 11 ASP HB3 H . . . . . 3.477 1.8 4.5201 . . . . . A . 12 ILE H . . A . 11 ASP HB3 . . . 12 . HN . . . . . 11 . HB1 . . c17395_2l87 1 12 1 . . 1 1 11 11 ASP HB3 H . . . 1 1 13 13 ASN H H . . . . . 4.943 1.8 6.4259 . . . . . A . 11 ASP HB3 . . A . 13 ASN H . . . 11 . HB1 . . . . . 13 . HN . . c17395_2l87 1 13 1 . . 1 1 11 11 ASP HB3 H . . . 1 1 14 14 TYS H H . . . . . 4.186 1.8 5.4418 . . . . . A . 11 ASP HB3 . . A . 14 TYS H . . . 11 . HB1 . . . . . 14 . HN . . c17395_2l87 1 14 1 . . 1 1 10 10 TYS H H . . . 1 1 11 11 ASP HB2 H . . . . . 5.088 1.8 6.6144 . . . . . A . 10 TYS H . . A . 11 ASP HB2 . . . 10 . HN . . . . . 11 . HB2 . . c17395_2l87 1 15 1 . . 1 1 11 11 ASP HB3 H . . . 1 1 11 11 ASP HB2 H . . . . . 2.200 1.8 2.8600 . . . . . A . 11 ASP HB3 . . A . 11 ASP HB2 . . . 11 . HB1 . . . . . 11 . HB2 . . c17395_2l87 1 16 1 . . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HB2 H . . . . . 3.109 1.8 4.0417 . . . . . A . 11 ASP H . . A . 11 ASP HB2 . . . 11 . HN . . . . . 11 . HB2 . . c17395_2l87 1 17 1 . . 1 1 12 12 ILE H H . . . 1 1 11 11 ASP HB2 H . . . . . 3.442 1.8 4.4746 . . . . . A . 12 ILE H . . A . 11 ASP HB2 . . . 12 . HN . . . . . 11 . HB2 . . c17395_2l87 1 18 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE HA H . . . . . 2.638 1.8 3.4294 . . . . . A . 12 ILE H . . A . 12 ILE HA . . . 12 . HN . . . . . 12 . HA . . c17395_2l87 1 19 1 . . 1 1 13 13 ASN H H . . . 1 1 12 12 ILE HA H . . . . . 2.488 1.8 3.2344 . . . . . A . 13 ASN H . . A . 12 ILE HA . . . 13 . HN . . . . . 12 . HA . . c17395_2l87 1 20 1 . . 1 1 12 12 ILE HA H . . . 1 1 15 15 TYR H H . . . . . 4.111 1.8 5.3443 . . . . . A . 12 ILE HA . . A . 15 TYR H . . . 12 . HA . . . . . 15 . HN . . c17395_2l87 1 21 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HB H . . . . . 2.623 1.8 3.4099 . . . . . A . 12 ILE HA . . A . 12 ILE HB . . . 12 . HA . . . . . 12 . HB . . c17395_2l87 1 22 1 . . 1 1 13 13 ASN H H . . . 1 1 12 12 ILE HB H . . . . . 3.751 1.8 4.8763 . . . . . A . 13 ASN H . . A . 12 ILE HB . . . 13 . HN . . . . . 12 . HB . . c17395_2l87 1 23 1 OR . 1 1 12 12 ILE MD H . . . 1 1 13 13 ASN HB2 H . . . . . 3.461 1.8 4.4993 . . . . . A . 12 ILE MD . . A . 13 ASN HB2 . . . 12 . HD1# . . . . . 13 . HB# . . c17395_2l87 1 23 2 OR . 1 1 12 12 ILE MD H . . . 1 1 13 13 ASN HB3 H . . . . . 3.461 1.8 4.4993 . . . . . A . 12 ILE MD . . A . 13 ASN HB3 . . . 12 . HD1# . . . . . 13 . HB# . . c17395_2l87 1 24 1 OR . 1 1 12 12 ILE MD H . . . 1 1 13 13 ASN HD21 H . . . . . 5.502 1.8 7.1526 . . . . . A . 12 ILE MD . . A . 13 ASN HD21 . . . 12 . HD1# . . . . . 13 . HD2# . . c17395_2l87 1 24 2 OR . 1 1 12 12 ILE MD H . . . 1 1 13 13 ASN HD22 H . . . . . 5.502 1.8 7.1526 . . . . . A . 12 ILE MD . . A . 13 ASN HD22 . . . 12 . HD1# . . . . . 13 . HD2# . . c17395_2l87 1 25 1 . . 1 1 13 13 ASN H H . . . 1 1 12 12 ILE MD H . . . . . 3.878 1.8 5.0414 . . . . . A . 13 ASN H . . A . 12 ILE MD . . . 13 . HN . . . . . 12 . HD1# . . c17395_2l87 1 26 1 . . 1 1 12 12 ILE MD H . . . 1 1 15 15 TYR QD H . . . . . 4.241 1.8 5.5133 . . . . . A . 12 ILE MD . . A . 15 TYR QD . . . 12 . HD1# . . . . . 15 . HD# . . c17395_2l87 1 27 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HG13 H . . . . . 3.301 1.8 4.2913 . . . . . A . 12 ILE HA . . A . 12 ILE HG13 . . . 12 . HA . . . . . 12 . HG11 . . c17395_2l87 1 28 1 . . 1 1 13 13 ASN H H . . . 1 1 12 12 ILE HG13 H . . . . . 4.601 1.8 5.9813 . . . . . A . 13 ASN H . . A . 12 ILE HG13 . . . 13 . HN . . . . . 12 . HG11 . . c17395_2l87 1 29 1 . . 1 1 15 15 TYR H H . . . 1 1 12 12 ILE HG13 H . . . . . 4.807 1.8 6.2491 . . . . . A . 15 TYR H . . A . 12 ILE HG13 . . . 15 . HN . . . . . 12 . HG11 . . c17395_2l87 1 30 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HG12 H . . . . . 3.173 1.8 4.1249 . . . . . A . 12 ILE HA . . A . 12 ILE HG12 . . . 12 . HA . . . . . 12 . HG12 . . c17395_2l87 1 31 1 . . 1 1 13 13 ASN H H . . . 1 1 12 12 ILE HG12 H . . . . . 4.772 1.8 6.2036 . . . . . A . 13 ASN H . . A . 12 ILE HG12 . . . 13 . HN . . . . . 12 . HG12 . . c17395_2l87 1 32 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 12 12 ILE MG H . . . . . 3.036 1.8 3.9468 . . . . . A . 12 ILE HG12 . . A . 12 ILE MG . . . 12 . HG12 . . . . . 12 . HG2# . . c17395_2l87 1 33 1 . . 1 1 12 12 ILE H H . . . 1 1 11 11 ASP H H . . . . . 3.388 1.8 4.4044 . . . . . A . 12 ILE H . . A . 11 ASP H . . . 12 . HN . . . . . 11 . HN . . c17395_2l87 1 34 1 . . 1 1 12 12 ILE H H . . . 1 1 13 13 ASN H H . . . . . 3.551 1.8 4.6163 . . . . . A . 12 ILE H . . A . 13 ASN H . . . 12 . HN . . . . . 13 . HN . . c17395_2l87 1 35 1 OR . 1 1 13 13 ASN HA H . . . 1 1 13 13 ASN HD21 H . . . . . 3.457 1.8 4.4941 . . . . . A . 13 ASN HA . . A . 13 ASN HD21 . . . 13 . HA . . . . . 13 . HD2# . . c17395_2l87 1 35 2 OR . 1 1 13 13 ASN HA H . . . 1 1 13 13 ASN HD22 H . . . . . 3.457 1.8 4.4941 . . . . . A . 13 ASN HA . . A . 13 ASN HD22 . . . 13 . HA . . . . . 13 . HD2# . . c17395_2l87 1 36 1 . . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HA H . . . . . 2.787 1.8 3.6231 . . . . . A . 13 ASN H . . A . 13 ASN HA . . . 13 . HN . . . . . 13 . HA . . c17395_2l87 1 37 1 . . 1 1 14 14 TYS H H . . . 1 1 13 13 ASN HA H . . . . . 2.479 1.8 3.2227 . . . . . A . 14 TYS H . . A . 13 ASN HA . . . 14 . HN . . . . . 13 . HA . . c17395_2l87 1 38 1 . . 1 1 13 13 ASN HA H . . . 1 1 16 16 THR H H . . . . . 4.165 1.8 5.4145 . . . . . A . 13 ASN HA . . A . 16 THR H . . . 13 . HA . . . . . 16 . HN . . c17395_2l87 1 39 1 . . 1 1 13 13 ASN HA H . . . 1 1 17 17 SER H H . . . . . 3.844 1.8 4.9972 . . . . . A . 13 ASN HA . . A . 17 SER H . . . 13 . HA . . . . . 17 . HN . . c17395_2l87 1 40 1 OR . 1 1 13 13 ASN HB3 H . . . 1 1 13 13 ASN HD21 H . . . . . 2.623 1.8 3.4099 . . . . . A . 13 ASN HB3 . . A . 13 ASN HD21 . . . 13 . HB# . . . . . 13 . HD2# . . c17395_2l87 1 40 2 OR . 1 1 13 13 ASN HB2 H . . . 1 1 13 13 ASN HD21 H . . . . . 2.623 1.8 3.4099 . . . . . A . 13 ASN HB2 . . A . 13 ASN HD21 . . . 13 . HB# . . . . . 13 . HD2# . . c17395_2l87 1 40 3 OR . 1 1 13 13 ASN HB3 H . . . 1 1 13 13 ASN HD22 H . . . . . 2.623 1.8 3.4099 . . . . . A . 13 ASN HB3 . . A . 13 ASN HD22 . . . 13 . HB# . . . . . 13 . HD2# . . c17395_2l87 1 40 4 OR . 1 1 13 13 ASN HD22 H . . . 1 1 13 13 ASN HB2 H . . . . . 2.623 1.8 3.4099 . . . . . A . 13 ASN HD22 . . A . 13 ASN HB2 . . . 13 . HD2# . . . . . 13 . HB# . . c17395_2l87 1 41 1 OR . 1 1 13 13 ASN HD22 H . . . 1 1 13 13 ASN HB2 H . . . . . 2.835 1.8 3.6855 . . . . . A . 13 ASN HD22 . . A . 13 ASN HB2 . . . 13 . HD22 . . . . . 13 . HB# . . c17395_2l87 1 41 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 13 13 ASN HD22 H . . . . . 2.835 1.8 3.6855 . . . . . A . 13 ASN HB3 . . A . 13 ASN HD22 . . . 13 . HB# . . . . . 13 . HD22 . . c17395_2l87 1 42 1 OR . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HB2 H . . . . . 2.654 1.8 3.4502 . . . . . A . 13 ASN H . . A . 13 ASN HB2 . . . 13 . HN . . . . . 13 . HB# . . c17395_2l87 1 42 2 OR . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HB3 H . . . . . 2.654 1.8 3.4502 . . . . . A . 13 ASN H . . A . 13 ASN HB3 . . . 13 . HN . . . . . 13 . HB# . . c17395_2l87 1 43 1 OR . 1 1 14 14 TYS H H . . . 1 1 13 13 ASN HB2 H . . . . . 3.143 1.8 4.0859 . . . . . A . 14 TYS H . . A . 13 ASN HB2 . . . 14 . HN . . . . . 13 . HB# . . c17395_2l87 1 43 2 OR . 1 1 14 14 TYS H H . . . 1 1 13 13 ASN HB3 H . . . . . 3.143 1.8 4.0859 . . . . . A . 14 TYS H . . A . 13 ASN HB3 . . . 14 . HN . . . . . 13 . HB# . . c17395_2l87 1 44 1 OR . 1 1 15 15 TYR QD H . . . 1 1 13 13 ASN HB2 H . . . . . 4.197 1.8 5.4561 . . . . . A . 15 TYR QD . . A . 13 ASN HB2 . . . 15 . HD# . . . . . 13 . HB# . . c17395_2l87 1 44 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 15 15 TYR QD H . . . . . 4.197 1.8 5.4561 . . . . . A . 13 ASN HB3 . . A . 15 TYR QD . . . 13 . HB# . . . . . 15 . HD# . . c17395_2l87 1 45 1 OR . 1 1 15 15 TYR QE H . . . 1 1 13 13 ASN HB2 H . . . . . 3.935 1.8 5.1155 . . . . . A . 15 TYR QE . . A . 13 ASN HB2 . . . 15 . HE# . . . . . 13 . HB# . . c17395_2l87 1 45 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 15 15 TYR QE H . . . . . 3.935 1.8 5.1155 . . . . . A . 13 ASN HB3 . . A . 15 TYR QE . . . 13 . HB# . . . . . 15 . HE# . . c17395_2l87 1 46 1 OR . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HD21 H . . . . . 4.332 1.8 5.6316 . . . . . A . 13 ASN H . . A . 13 ASN HD21 . . . 13 . HN . . . . . 13 . HD2# . . c17395_2l87 1 46 2 OR . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HD22 H . . . . . 4.332 1.8 5.6316 . . . . . A . 13 ASN H . . A . 13 ASN HD22 . . . 13 . HN . . . . . 13 . HD2# . . c17395_2l87 1 47 1 . . 1 1 13 13 ASN HD22 H . . . 1 1 13 13 ASN HD21 H . . . . . 2.200 1.8 2.8600 . . . . . A . 13 ASN HD22 . . A . 13 ASN HD21 . . . 13 . HD22 . . . . . 13 . HD2# . . c17395_2l87 1 48 1 . . 1 1 13 13 ASN H H . . . 1 1 14 14 TYS HA H . . . . . 4.774 1.8 6.2062 . . . . . A . 13 ASN H . . A . 14 TYS HA . . . 13 . HN . . . . . 14 . HA . . c17395_2l87 1 49 1 . . 1 1 14 14 TYS H H . . . 1 1 14 14 TYS HA H . . . . . 2.773 1.8 3.6049 . . . . . A . 14 TYS H . . A . 14 TYS HA . . . 14 . HN . . . . . 14 . HA . . c17395_2l87 1 50 1 . . 1 1 15 15 TYR QD H . . . 1 1 14 14 TYS HA H . . . . . 3.390 1.8 4.4070 . . . . . A . 15 TYR QD . . A . 14 TYS HA . . . 15 . HD# . . . . . 14 . HA . . c17395_2l87 1 51 1 . . 1 1 15 15 TYR H H . . . 1 1 14 14 TYS HA H . . . . . 2.520 1.8 3.2760 . . . . . A . 15 TYR H . . A . 14 TYS HA . . . 15 . HN . . . . . 14 . HA . . c17395_2l87 1 52 1 . . 1 1 16 16 THR H H . . . 1 1 14 14 TYS HA H . . . . . 4.866 1.8 6.3258 . . . . . A . 16 THR H . . A . 14 TYS HA . . . 16 . HN . . . . . 14 . HA . . c17395_2l87 1 53 1 . . 1 1 14 14 TYS HA H . . . 1 1 14 14 TYS HB3 H . . . . . 3.093 1.8 4.0209 . . . . . A . 14 TYS HA . . A . 14 TYS HB3 . . . 14 . HA . . . . . 14 . HB1 . . c17395_2l87 1 54 1 . . 1 1 14 14 TYS H H . . . 1 1 14 14 TYS HB3 H . . . . . 3.043 1.8 3.9559 . . . . . A . 14 TYS H . . A . 14 TYS HB3 . . . 14 . HN . . . . . 14 . HB1 . . c17395_2l87 1 55 1 . . 1 1 14 14 TYS HA H . . . 1 1 14 14 TYS HB2 H . . . . . 3.209 1.8 4.1717 . . . . . A . 14 TYS HA . . A . 14 TYS HB2 . . . 14 . HA . . . . . 14 . HB2 . . c17395_2l87 1 56 1 . . 1 1 14 14 TYS H H . . . 1 1 14 14 TYS HB2 H . . . . . 3.007 1.8 3.9091 . . . . . A . 14 TYS H . . A . 14 TYS HB2 . . . 14 . HN . . . . . 14 . HB2 . . c17395_2l87 1 57 1 . . 1 1 13 13 ASN H H . . . 1 1 14 14 TYS H H . . . . . 3.806 1.8 4.9478 . . . . . A . 13 ASN H . . A . 14 TYS H . . . 13 . HN . . . . . 14 . HN . . c17395_2l87 1 58 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HA H . . . . . 2.835 1.8 3.6855 . . . . . A . 15 TYR H . . A . 15 TYR HA . . . 15 . HN . . . . . 15 . HA . . c17395_2l87 1 59 1 . . 1 1 16 16 THR H H . . . 1 1 15 15 TYR HA H . . . . . 2.782 1.8 3.6166 . . . . . A . 16 THR H . . A . 15 TYR HA . . . 16 . HN . . . . . 15 . HA . . c17395_2l87 1 60 1 . . 1 1 15 15 TYR QD H . . . 1 1 15 15 TYR HB3 H . . . . . 2.639 1.8 3.4307 . . . . . A . 15 TYR QD . . A . 15 TYR HB3 . . . 15 . HD# . . . . . 15 . HB1 . . c17395_2l87 1 61 1 . . 1 1 15 15 TYR QE H . . . 1 1 15 15 TYR HB3 H . . . . . 3.742 1.8 4.8646 . . . . . A . 15 TYR QE . . A . 15 TYR HB3 . . . 15 . HE# . . . . . 15 . HB1 . . c17395_2l87 1 62 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HB3 H . . . . . 3.153 1.8 4.0989 . . . . . A . 15 TYR H . . A . 15 TYR HB3 . . . 15 . HN . . . . . 15 . HB1 . . c17395_2l87 1 63 1 . . 1 1 16 16 THR H H . . . 1 1 15 15 TYR HB3 H . . . . . 4.256 1.8 5.5328 . . . . . A . 16 THR H . . A . 15 TYR HB3 . . . 16 . HN . . . . . 15 . HB1 . . c17395_2l87 1 64 1 . . 1 1 15 15 TYR QE H . . . 1 1 15 15 TYR HB2 H . . . . . 3.495 1.8 4.5435 . . . . . A . 15 TYR QE . . A . 15 TYR HB2 . . . 15 . HE# . . . . . 15 . HB2 . . c17395_2l87 1 65 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HB2 H . . . . . 2.917 1.8 3.7921 . . . . . A . 15 TYR H . . A . 15 TYR HB2 . . . 15 . HN . . . . . 15 . HB2 . . c17395_2l87 1 66 1 . . 1 1 16 16 THR H H . . . 1 1 15 15 TYR HB2 H . . . . . 4.223 1.8 5.4899 . . . . . A . 16 THR H . . A . 15 TYR HB2 . . . 16 . HN . . . . . 15 . HB2 . . c17395_2l87 1 67 1 . . 1 1 15 15 TYR QD H . . . 1 1 16 16 THR H H . . . . . 4.562 1.8 5.9306 . . . . . A . 15 TYR QD . . A . 16 THR H . . . 15 . HD# . . . . . 16 . HN . . c17395_2l87 1 68 1 . . 1 1 15 15 TYR QD H . . . 1 1 15 15 TYR QE H . . . . . 2.200 1.8 2.8600 . . . . . A . 15 TYR QD . . A . 15 TYR QE . . . 15 . HD# . . . . . 15 . HE# . . c17395_2l87 1 69 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR QE H . . . . . 4.302 1.8 5.5926 . . . . . A . 15 TYR H . . A . 15 TYR QE . . . 15 . HN . . . . . 15 . HE# . . c17395_2l87 1 70 1 . . 1 1 16 16 THR H H . . . 1 1 16 16 THR HA H . . . . . 3.086 1.8 4.0118 . . . . . A . 16 THR H . . A . 16 THR HA . . . 16 . HN . . . . . 16 . HA . . c17395_2l87 1 71 1 . . 1 1 17 17 SER H H . . . 1 1 16 16 THR HA H . . . . . 2.903 1.8 3.7739 . . . . . A . 17 SER H . . A . 16 THR HA . . . 17 . HN . . . . . 16 . HA . . c17395_2l87 1 72 1 . . 1 1 16 16 THR H H . . . 1 1 16 16 THR HB H . . . . . 3.765 1.8 4.8945 . . . . . A . 16 THR H . . A . 16 THR HB . . . 16 . HN . . . . . 16 . HB . . c17395_2l87 1 73 1 . . 1 1 17 17 SER H H . . . 1 1 16 16 THR HB H . . . . . 4.023 1.8 5.2299 . . . . . A . 17 SER H . . A . 16 THR HB . . . 17 . HN . . . . . 16 . HB . . c17395_2l87 1 74 1 OR . 1 1 16 16 THR MG H . . . 1 1 13 13 ASN HB2 H . . . . . 3.948 1.8 5.1324 . . . . . A . 16 THR MG . . A . 13 ASN HB2 . . . 16 . HG2# . . . . . 13 . HB# . . c17395_2l87 1 74 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 16 16 THR MG H . . . . . 3.948 1.8 5.1324 . . . . . A . 13 ASN HB3 . . A . 16 THR MG . . . 13 . HB# . . . . . 16 . HG2# . . c17395_2l87 1 75 1 OR . 1 1 13 13 ASN HD22 H . . . 1 1 16 16 THR MG H . . . . . 5.890 1.8 7.6570 . . . . . A . 13 ASN HD22 . . A . 16 THR MG . . . 13 . HD2# . . . . . 16 . HG2# . . c17395_2l87 1 75 2 OR . 1 1 16 16 THR MG H . . . 1 1 13 13 ASN HD21 H . . . . . 5.890 1.8 7.6570 . . . . . A . 16 THR MG . . A . 13 ASN HD21 . . . 16 . HG2# . . . . . 13 . HD2# . . c17395_2l87 1 76 1 . . 1 1 15 15 TYR HB2 H . . . 1 1 16 16 THR MG H . . . . . 4.737 1.8 6.1581 . . . . . A . 15 TYR HB2 . . A . 16 THR MG . . . 15 . HB2 . . . . . 16 . HG2# . . c17395_2l87 1 77 1 . . 1 1 15 15 TYR QD H . . . 1 1 16 16 THR MG H . . . . . 3.816 1.8 4.9608 . . . . . A . 15 TYR QD . . A . 16 THR MG . . . 15 . HD# . . . . . 16 . HG2# . . c17395_2l87 1 78 1 . . 1 1 15 15 TYR H H . . . 1 1 16 16 THR MG H . . . . . 5.182 1.8 6.7366 . . . . . A . 15 TYR H . . A . 16 THR MG . . . 15 . HN . . . . . 16 . HG2# . . c17395_2l87 1 79 1 . . 1 1 16 16 THR HB H . . . 1 1 16 16 THR MG H . . . . . 2.827 1.8 3.6751 . . . . . A . 16 THR HB . . A . 16 THR MG . . . 16 . HB . . . . . 16 . HG2# . . c17395_2l87 1 80 1 . . 1 1 16 16 THR H H . . . 1 1 16 16 THR MG H . . . . . 4.164 1.8 5.4132 . . . . . A . 16 THR H . . A . 16 THR MG . . . 16 . HN . . . . . 16 . HG2# . . c17395_2l87 1 81 1 . . 1 1 17 17 SER H H . . . 1 1 16 16 THR MG H . . . . . 4.995 1.8 6.4935 . . . . . A . 17 SER H . . A . 16 THR MG . . . 17 . HN . . . . . 16 . HG2# . . c17395_2l87 1 82 1 . . 1 1 18 18 GLU H H . . . 1 1 16 16 THR MG H . . . . . 5.182 1.8 6.7366 . . . . . A . 18 GLU H . . A . 16 THR MG . . . 18 . HN . . . . . 16 . HG2# . . c17395_2l87 1 83 1 . . 1 1 17 17 SER H H . . . 1 1 17 17 SER HA H . . . . . 3.608 1.8 4.6904 . . . . . A . 17 SER H . . A . 17 SER HA . . . 17 . HN . . . . . 17 . HA . . c17395_2l87 1 84 1 . . 1 1 18 18 GLU H H . . . 1 1 17 17 SER HA H . . . . . 2.498 1.8 3.2474 . . . . . A . 18 GLU H . . A . 17 SER HA . . . 18 . HN . . . . . 17 . HA . . c17395_2l87 1 85 1 OR . 1 1 17 17 SER H H . . . 1 1 17 17 SER HB2 H . . . . . 3.600 1.8 4.6800 . . . . . A . 17 SER H . . A . 17 SER HB2 . . . 17 . HN . . . . . 17 . HB# . . c17395_2l87 1 85 2 OR . 1 1 17 17 SER H H . . . 1 1 17 17 SER HB3 H . . . . . 3.600 1.8 4.6800 . . . . . A . 17 SER H . . A . 17 SER HB3 . . . 17 . HN . . . . . 17 . HB# . . c17395_2l87 1 86 1 OR . 1 1 18 18 GLU H H . . . 1 1 17 17 SER HB2 H . . . . . 3.233 1.8 4.2029 . . . . . A . 18 GLU H . . A . 17 SER HB2 . . . 18 . HN . . . . . 17 . HB# . . c17395_2l87 1 86 2 OR . 1 1 18 18 GLU H H . . . 1 1 17 17 SER HB3 H . . . . . 3.233 1.8 4.2029 . . . . . A . 18 GLU H . . A . 17 SER HB3 . . . 18 . HN . . . . . 17 . HB# . . c17395_2l87 1 87 1 . . 1 1 17 17 SER H H . . . 1 1 18 18 GLU H H . . . . . 4.476 1.8 5.8188 . . . . . A . 17 SER H . . A . 18 GLU H . . . 17 . HN . . . . . 18 . HN . . c17395_2l87 1 88 1 . . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HA H . . . . . 3.159 1.8 4.1067 . . . . . A . 18 GLU H . . A . 18 GLU HA . . . 18 . HN . . . . . 18 . HA . . c17395_2l87 1 89 1 . . 1 1 19 19 PRO HA H . . . 1 1 20 20 ALA H H . . . . . 4.270 1.8 5.5510 . . . . . A . 19 PRO HA . . A . 20 ALA H . . . 19 . HA . . . . . 20 . HN . . c17395_2l87 1 90 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HD3 H . . . . . 3.394 1.8 4.4122 . . . . . A . 19 PRO HB3 . . A . 19 PRO HD3 . . . 19 . HB1 . . . . . 19 . HD1 . . c17395_2l87 1 91 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HD2 H . . . . . 3.356 1.8 4.3628 . . . . . A . 19 PRO HB3 . . A . 19 PRO HD2 . . . 19 . HB1 . . . . . 19 . HD2 . . c17395_2l87 1 92 1 . . 1 1 20 20 ALA H H . . . 1 1 19 19 PRO HB3 H . . . . . 3.559 1.8 4.6267 . . . . . A . 20 ALA H . . A . 19 PRO HB3 . . . 20 . HN . . . . . 19 . HB1 . . c17395_2l87 1 93 1 . . 1 1 19 19 PRO HB2 H . . . 1 1 19 19 PRO HD3 H . . . . . 3.418 1.8 4.4434 . . . . . A . 19 PRO HB2 . . A . 19 PRO HD3 . . . 19 . HB2 . . . . . 19 . HD1 . . c17395_2l87 1 94 1 . . 1 1 19 19 PRO HB2 H . . . 1 1 19 19 PRO HD2 H . . . . . 3.247 1.8 4.2211 . . . . . A . 19 PRO HB2 . . A . 19 PRO HD2 . . . 19 . HB2 . . . . . 19 . HD2 . . c17395_2l87 1 95 1 . . 1 1 20 20 ALA H H . . . 1 1 19 19 PRO HD3 H . . . . . 5.166 1.8 6.7158 . . . . . A . 20 ALA H . . A . 19 PRO HD3 . . . 20 . HN . . . . . 19 . HD1 . . c17395_2l87 1 96 1 . . 1 1 18 18 GLU H H . . . 1 1 19 19 PRO HD2 H . . . . . 4.525 1.8 5.8825 . . . . . A . 18 GLU H . . A . 19 PRO HD2 . . . 18 . HN . . . . . 19 . HD2 . . c17395_2l87 1 97 1 . . 1 1 20 20 ALA H H . . . 1 1 19 19 PRO HD2 H . . . . . 4.609 1.8 5.9917 . . . . . A . 20 ALA H . . A . 19 PRO HD2 . . . 20 . HN . . . . . 19 . HD2 . . c17395_2l87 1 98 1 OR . 1 1 19 19 PRO HG3 H . . . 1 1 19 19 PRO HD3 H . . . . . 3.034 1.8 3.9442 . . . . . A . 19 PRO HG3 . . A . 19 PRO HD3 . . . 19 . HG# . . . . . 19 . HD1 . . c17395_2l87 1 98 2 OR . 1 1 19 19 PRO HD3 H . . . 1 1 19 19 PRO HG2 H . . . . . 3.034 1.8 3.9442 . . . . . A . 19 PRO HD3 . . A . 19 PRO HG2 . . . 19 . HD1 . . . . . 19 . HG# . . c17395_2l87 1 99 1 OR . 1 1 19 19 PRO HG3 H . . . 1 1 19 19 PRO HD2 H . . . . . 2.775 1.8 3.6075 . . . . . A . 19 PRO HG3 . . A . 19 PRO HD2 . . . 19 . HG# . . . . . 19 . HD2 . . c17395_2l87 1 99 2 OR . 1 1 19 19 PRO HD2 H . . . 1 1 19 19 PRO HG2 H . . . . . 2.775 1.8 3.6075 . . . . . A . 19 PRO HD2 . . A . 19 PRO HG2 . . . 19 . HD2 . . . . . 19 . HG# . . c17395_2l87 1 100 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP H H . . . . . 3.540 1.8 4.6020 . . . . . . . . . . . . . . . . . . . . 2 . HA . . . . . 2 . HN . . c17395_2l87 1 101 1 . . 1 1 20 20 ALA H H . . . 1 1 20 20 ALA HA H . . . . . 3.021 1.8 3.9273 . . . . . A . 20 ALA H . . A . 20 ALA HA . . . 20 . HN . . . . . 20 . HA . . c17395_2l87 1 102 1 . . 1 1 20 20 ALA HA H . . . 1 1 21 21 GLN H H . . . . . 2.514 1.8 3.2682 . . . . . A . 20 ALA HA . . A . 21 GLN H . . . 20 . HA . . . . . 21 . HN . . c17395_2l87 1 103 1 . . 1 1 20 20 ALA H H . . . 1 1 20 20 ALA MB H . . . . . 3.088 1.8 4.0144 . . . . . A . 20 ALA H . . A . 20 ALA MB . . . 20 . HN . . . . . 20 . HB# . . c17395_2l87 1 104 1 . . 1 1 21 21 GLN H H . . . 1 1 20 20 ALA MB H . . . . . 3.992 1.8 5.1896 . . . . . A . 21 GLN H . . A . 20 ALA MB . . . 21 . HN . . . . . 20 . HB# . . c17395_2l87 1 105 1 . . 1 1 21 21 GLN H H . . . 1 1 21 21 GLN HA H . . . . . 3.483 1.8 4.5279 . . . . . A . 21 GLN H . . A . 21 GLN HA . . . 21 . HN . . . . . 21 . HA . . c17395_2l87 1 106 1 . . 1 1 21 21 GLN H H . . . 1 1 21 21 GLN HB3 H . . . . . 3.776 1.8 4.9088 . . . . . A . 21 GLN H . . A . 21 GLN HB3 . . . 21 . HN . . . . . 21 . HB1 . . c17395_2l87 1 107 1 . . 1 1 21 21 GLN H H . . . 1 1 21 21 GLN HB2 H . . . . . 3.374 1.8 4.3862 . . . . . A . 21 GLN H . . A . 21 GLN HB2 . . . 21 . HN . . . . . 21 . HB2 . . c17395_2l87 1 108 1 OR . 1 1 21 21 GLN HA H . . . 1 1 21 21 GLN HG2 H . . . . . 3.151 1.8 4.0963 . . . . . A . 21 GLN HA . . A . 21 GLN HG2 . . . 21 . HA . . . . . 21 . HG# . . c17395_2l87 1 108 2 OR . 1 1 21 21 GLN HA H . . . 1 1 21 21 GLN HG3 H . . . . . 3.151 1.8 4.0963 . . . . . A . 21 GLN HA . . A . 21 GLN HG3 . . . 21 . HA . . . . . 21 . HG# . . c17395_2l87 1 109 1 OR . 1 1 21 21 GLN H H . . . 1 1 21 21 GLN HG2 H . . . . . 3.854 1.8 5.0102 . . . . . A . 21 GLN H . . A . 21 GLN HG2 . . . 21 . HN . . . . . 21 . HG# . . c17395_2l87 1 109 2 OR . 1 1 21 21 GLN H H . . . 1 1 21 21 GLN HG3 H . . . . . 3.854 1.8 5.0102 . . . . . A . 21 GLN H . . A . 21 GLN HG3 . . . 21 . HN . . . . . 21 . HG# . . c17395_2l87 1 110 1 OR . 1 1 22 22 LYS H H . . . 1 1 21 21 GLN HG2 H . . . . . 5.067 1.8 6.5871 . . . . . A . 22 LYS H . . A . 21 GLN HG2 . . . 22 . HN . . . . . 21 . HG# . . c17395_2l87 1 110 2 OR . 1 1 21 21 GLN HG3 H . . . 1 1 22 22 LYS H H . . . . . 5.067 1.8 6.5871 . . . . . A . 21 GLN HG3 . . A . 22 LYS H . . . 21 . HG# . . . . . 22 . HN . . c17395_2l87 1 111 1 . . 1 1 20 20 ALA H H . . . 1 1 21 21 GLN H H . . . . . 3.843 1.8 4.9959 . . . . . A . 20 ALA H . . A . 21 GLN H . . . 20 . HN . . . . . 21 . HN . . c17395_2l87 1 112 1 . . 1 1 22 22 LYS H H . . . 1 1 22 22 LYS HA H . . . . . 2.795 1.8 3.6335 . . . . . A . 22 LYS H . . A . 22 LYS HA . . . 22 . HN . . . . . 22 . HA . . c17395_2l87 1 113 1 . . 1 1 22 22 LYS H H . . . 1 1 22 22 LYS HB3 H . . . . . 4.636 1.8 6.0268 . . . . . A . 22 LYS H . . A . 22 LYS HB3 . . . 22 . HN . . . . . 22 . HB1 . . c17395_2l87 1 114 1 . . 1 1 22 22 LYS H H . . . 1 1 22 22 LYS HB2 H . . . . . 4.002 1.8 5.2026 . . . . . A . 22 LYS H . . A . 22 LYS HB2 . . . 22 . HN . . . . . 22 . HB2 . . c17395_2l87 1 115 1 OR . 1 1 22 22 LYS HB2 H . . . 1 1 22 22 LYS HG2 H . . . . . 2.913 1.8 3.7869 . . . . . A . 22 LYS HB2 . . A . 22 LYS HG2 . . . 22 . HB2 . . . . . 22 . HG# . . c17395_2l87 1 115 2 OR . 1 1 22 22 LYS HB2 H . . . 1 1 22 22 LYS HG3 H . . . . . 2.913 1.8 3.7869 . . . . . A . 22 LYS HB2 . . A . 22 LYS HG3 . . . 22 . HB2 . . . . . 22 . HG# . . c17395_2l87 1 116 1 OR . 1 1 22 22 LYS H H . . . 1 1 22 22 LYS HG2 H . . . . . 4.336 1.8 5.6368 . . . . . A . 22 LYS H . . A . 22 LYS HG2 . . . 22 . HN . . . . . 22 . HG# . . c17395_2l87 1 116 2 OR . 1 1 22 22 LYS H H . . . 1 1 22 22 LYS HG3 H . . . . . 4.336 1.8 5.6368 . . . . . A . 22 LYS H . . A . 22 LYS HG3 . . . 22 . HN . . . . . 22 . HG# . . c17395_2l87 1 117 1 OR . 1 1 24 24 ASN H H . . . 1 1 22 22 LYS HG2 H . . . . . 4.279 1.8 5.5627 . . . . . . . . . . . . A . 22 LYS HG2 . . . 24 . HN . . . . . 22 . HG# . . c17395_2l87 1 117 2 OR . 1 1 22 22 LYS HG3 H . . . 1 1 24 24 ASN H H . . . . . 4.279 1.8 5.5627 . . . . . A . 22 LYS HG3 . . . . . . . . . . 22 . HG# . . . . . 24 . HN . . c17395_2l87 1 118 1 . . 1 1 23 23 ILE HA H . . . 1 1 23 23 ILE H H . . . . . 2.834 1.8 3.6842 . . . . . A . 23 ILE HA . . A . 23 ILE H . . . 23 . HA . . . . . 23 . HN . . c17395_2l87 1 119 1 . . 1 1 24 24 ASN H H . . . 1 1 23 23 ILE HA H . . . . . 3.013 1.8 3.9169 . . . . . . . . . . . . A . 23 ILE HA . . . 24 . HN . . . . . 23 . HA . . c17395_2l87 1 120 1 OR . 1 1 24 24 ASN HB3 H . . . 1 1 24 24 ASN HD21 H . . . . . 4.138 1.8 5.3794 . . . . . . . . . . . . . . . . . . . . 24 . HB1 . . . . . 24 . HD2# . . c17395_2l87 1 120 2 OR . 1 1 24 24 ASN HB3 H . . . 1 1 24 24 ASN HD22 H . . . . . 4.138 1.8 5.3794 . . . . . . . . . . . . . . . . . . . . 24 . HB1 . . . . . 24 . HD2# . . c17395_2l87 1 121 1 . . 1 1 24 24 ASN H H . . . 1 1 24 24 ASN HB3 H . . . . . 4.615 1.8 5.9995 . . . . . . . . . . . . . . . . . . . . 24 . HN . . . . . 24 . HB1 . . c17395_2l87 1 122 1 OR . 1 1 24 24 ASN HB2 H . . . 1 1 24 24 ASN HD21 H . . . . . 3.794 1.8 4.9322 . . . . . . . . . . . . . . . . . . . . 24 . HB2 . . . . . 24 . HD2# . . c17395_2l87 1 122 2 OR . 1 1 24 24 ASN HB2 H . . . 1 1 24 24 ASN HD22 H . . . . . 3.794 1.8 4.9322 . . . . . . . . . . . . . . . . . . . . 24 . HB2 . . . . . 24 . HD2# . . c17395_2l87 1 123 1 . . 1 1 24 24 ASN HB2 H . . . 1 1 24 24 ASN HD22 H . . . . . 4.087 1.8 5.3131 . . . . . . . . . . . . . . . . . . . . 24 . HB2 . . . . . 24 . HD22 . . c17395_2l87 1 124 1 . . 1 1 24 24 ASN H H . . . 1 1 24 24 ASN HB2 H . . . . . 4.463 1.8 5.8019 . . . . . . . . . . . . . . . . . . . . 24 . HN . . . . . 24 . HB2 . . c17395_2l87 1 125 1 . . 1 1 24 24 ASN HD22 H . . . 1 1 24 24 ASN HD21 H . . . . . 2.200 1.8 2.8600 . . . . . . . . . . . . . . . . . . . . 24 . HD22 . . . . . 24 . HD2# . . c17395_2l87 1 126 1 . . 1 1 25 25 VAL HB H . . . 1 1 25 25 VAL H H . . . . . 3.566 1.8 4.6358 . . . . . . . . . . . . . . . . . . . . 25 . HB . . . . . 25 . HN . . c17395_2l87 1 127 1 OR . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL MG1 H . . . . . 3.389 1.8 4.4057 . . . . . . . . . . . . . . . . . . . . 25 . HN . . . . . 25 . HG## . . c17395_2l87 1 127 2 OR . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL MG2 H . . . . . 3.389 1.8 4.4057 . . . . . . . . . . . . . . . . . . . . 25 . HN . . . . . 25 . HG## . . c17395_2l87 1 128 1 OR . 1 1 26 26 LYS H H . . . 1 1 25 25 VAL MG1 H . . . . . 4.082 1.8 5.3066 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 25 . HG## . . c17395_2l87 1 128 2 OR . 1 1 25 25 VAL MG2 H . . . 1 1 26 26 LYS H H . . . . . 4.082 1.8 5.3066 . . . . . . . . . . . . . . . . . . . . 25 . HG## . . . . . 26 . HN . . c17395_2l87 1 129 1 . . 1 1 26 26 LYS H H . . . 1 1 26 26 LYS HA H . . . . . 2.235 1.8 2.9055 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 26 . HA . . c17395_2l87 1 130 1 . . 1 1 26 26 LYS HA H . . . 1 1 27 27 GLN H H . . . . . 2.457 1.8 3.1941 . . . . . . . . . . . . . . . . . . . . 26 . HA . . . . . 27 . HN . . c17395_2l87 1 131 1 . . 1 1 26 26 LYS H H . . . 1 1 26 26 LYS HB3 H . . . . . 3.945 1.8 5.1285 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 26 . HB1 . . c17395_2l87 1 132 1 . . 1 1 27 27 GLN H H . . . 1 1 26 26 LYS HB3 H . . . . . 4.027 1.8 5.2351 . . . . . . . . . . . . . . . . . . . . 27 . HN . . . . . 26 . HB1 . . c17395_2l87 1 133 1 . . 1 1 26 26 LYS HA H . . . 1 1 26 26 LYS HB2 H . . . . . 2.964 1.8 3.8532 . . . . . . . . . . . . . . . . . . . . 26 . HA . . . . . 26 . HB2 . . c17395_2l87 1 134 1 . . 1 1 26 26 LYS H H . . . 1 1 26 26 LYS HB2 H . . . . . 3.747 1.8 4.8711 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 26 . HB2 . . c17395_2l87 1 135 1 OR . 1 1 26 26 LYS H H . . . 1 1 26 26 LYS HG2 H . . . . . 4.674 1.8 6.0762 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 26 . HG# . . c17395_2l87 1 135 2 OR . 1 1 26 26 LYS H H . . . 1 1 26 26 LYS HG3 H . . . . . 4.674 1.8 6.0762 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 26 . HG# . . c17395_2l87 1 136 1 . . 1 1 26 26 LYS H H . . . 1 1 27 27 GLN H H . . . . . 4.361 1.8 5.6693 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 27 . HN . . c17395_2l87 1 137 1 . . 1 1 3 3 TYR HA H . . . 1 1 3 3 TYR QE H . . . . . 3.574 1.8 4.6462 . . . . . . . . . . . . . . . . . . . . 3 . HA . . . . . 3 . HE# . . c17395_2l87 1 138 1 . . 1 1 3 3 TYR HA H . . . 1 1 3 3 TYR H H . . . . . 3.164 1.8 4.1132 . . . . . . . . . . . . . . . . . . . . 3 . HA . . . . . 3 . HN . . c17395_2l87 1 139 1 . . 1 1 3 3 TYR HA H . . . 1 1 4 4 GLN H H . . . . . 2.566 1.8 3.3358 . . . . . . . . . . . . . . . . . . . . 3 . HA . . . . . 4 . HN . . c17395_2l87 1 140 1 . . 1 1 3 3 TYR HA H . . . 1 1 3 3 TYR HB3 H . . . . . 3.701 1.8 4.8113 . . . . . . . . . . . . . . . . . . . . 3 . HA . . . . . 3 . HB1 . . c17395_2l87 1 141 1 . . 1 1 3 3 TYR HB3 H . . . 1 1 3 3 TYR QD H . . . . . 2.728 1.8 3.5464 . . . . . . . . . . . . . . . . . . . . 3 . HB1 . . . . . 3 . HD# . . c17395_2l87 1 142 1 . . 1 1 3 3 TYR QE H . . . 1 1 3 3 TYR HB3 H . . . . . 3.716 1.8 4.8308 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 3 . HB1 . . c17395_2l87 1 143 1 . . 1 1 3 3 TYR H H . . . 1 1 3 3 TYR HB3 H . . . . . 3.454 1.8 4.4902 . . . . . . . . . . . . . . . . . . . . 3 . HN . . . . . 3 . HB1 . . c17395_2l87 1 144 1 . . 1 1 4 4 GLN H H . . . 1 1 3 3 TYR HB3 H . . . . . 4.038 1.8 5.2494 . . . . . . . . . . . . . . . . . . . . 4 . HN . . . . . 3 . HB1 . . c17395_2l87 1 145 1 . . 1 1 3 3 TYR HA H . . . 1 1 3 3 TYR HB2 H . . . . . 3.348 1.8 4.3524 . . . . . . . . . . . . . . . . . . . . 3 . HA . . . . . 3 . HB2 . . c17395_2l87 1 146 1 . . 1 1 3 3 TYR H H . . . 1 1 3 3 TYR HB2 H . . . . . 2.881 1.8 3.7453 . . . . . . . . . . . . . . . . . . . . 3 . HN . . . . . 3 . HB2 . . c17395_2l87 1 147 1 . . 1 1 4 4 GLN H H . . . 1 1 3 3 TYR HB2 H . . . . . 4.048 1.8 5.2624 . . . . . . . . . . . . . . . . . . . . 4 . HN . . . . . 3 . HB2 . . c17395_2l87 1 148 1 . . 1 1 3 3 TYR H H . . . 1 1 3 3 TYR QD H . . . . . 3.800 1.8 4.9400 . . . . . . . . . . . . . . . . . . . . 3 . HN . . . . . 3 . HD# . . c17395_2l87 1 149 1 . . 1 1 3 3 TYR QE H . . . 1 1 3 3 TYR QD H . . . . . 2.200 1.8 2.8600 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 3 . HD# . . c17395_2l87 1 150 1 . . 1 1 3 3 TYR H H . . . 1 1 4 4 GLN H H . . . . . 3.515 1.8 4.5695 . . . . . . . . . . . . . . . . . . . . 3 . HN . . . . . 4 . HN . . c17395_2l87 1 151 1 OR . 1 1 3 3 TYR QE H . . . 1 1 4 4 GLN HG2 H . . . . . 3.451 1.8 4.4863 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 4 . HG# . . c17395_2l87 1 151 2 OR . 1 1 3 3 TYR QE H . . . 1 1 4 4 GLN HG3 H . . . . . 3.451 1.8 4.4863 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 4 . HG# . . c17395_2l87 1 152 1 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG2 H . . . . . 3.142 1.8 4.0846 . . . . . . . . . . . . . . . . . . . . 4 . HN . . . . . 4 . HG# . . c17395_2l87 1 152 2 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG3 H . . . . . 3.142 1.8 4.0846 . . . . . . . . . . . . . . . . . . . . 4 . HN . . . . . 4 . HG# . . c17395_2l87 1 153 1 OR . 1 1 5 5 VAL H H . . . 1 1 4 4 GLN HG2 H . . . . . 3.976 1.8 5.1688 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 4 . HG# . . c17395_2l87 1 153 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL H H . . . . . 3.976 1.8 5.1688 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HN . . c17395_2l87 1 154 1 . . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL HA H . . . . . 2.891 1.8 3.7583 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 5 . HA . . c17395_2l87 1 155 1 . . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL HB H . . . . . 3.144 1.8 4.0872 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 5 . HB . . c17395_2l87 1 156 1 OR . 1 1 3 3 TYR QD H . . . 1 1 5 5 VAL MG1 H . . . . . 3.675 1.8 4.7775 . . . . . . . . . . . . . . . . . . . . 3 . HD# . . . . . 5 . HG## . . c17395_2l87 1 156 2 OR . 1 1 3 3 TYR QD H . . . 1 1 5 5 VAL MG2 H . . . . . 3.675 1.8 4.7775 . . . . . . . . . . . . . . . . . . . . 3 . HD# . . . . . 5 . HG## . . c17395_2l87 1 157 1 OR . 1 1 3 3 TYR QE H . . . 1 1 5 5 VAL MG1 H . . . . . 3.655 1.8 4.7515 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 5 . HG## . . c17395_2l87 1 157 2 OR . 1 1 3 3 TYR QE H . . . 1 1 5 5 VAL MG2 H . . . . . 3.655 1.8 4.7515 . . . . . . . . . . . . . . . . . . . . 3 . HE# . . . . . 5 . HG## . . c17395_2l87 1 158 1 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL MG1 H . . . . . 3.970 1.8 5.1610 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 1 158 2 OR . 1 1 4 4 GLN HG2 H . . . 1 1 5 5 VAL MG2 H . . . . . 3.970 1.8 5.1610 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 1 158 3 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL MG2 H . . . . . 3.970 1.8 5.1610 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 1 158 4 OR . 1 1 5 5 VAL MG1 H . . . 1 1 4 4 GLN HG2 H . . . . . 3.970 1.8 5.1610 . . . . . . . . . . . . . . . . . . . . 5 . HG## . . . . . 4 . HG# . . c17395_2l87 1 159 1 OR . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL MG1 H . . . . . 2.904 1.8 3.7752 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 5 . HG## . . c17395_2l87 1 159 2 OR . 1 1 5 5 VAL H H . . . 1 1 5 5 VAL MG2 H . . . . . 2.904 1.8 3.7752 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 5 . HG## . . c17395_2l87 1 160 1 . . 1 1 4 4 GLN H H . . . 1 1 5 5 VAL H H . . . . . 3.958 1.8 5.1454 . . . . . . . . . . . . . . . . . . . . 4 . HN . . . . . 5 . HN . . c17395_2l87 1 161 1 . . 1 1 5 5 VAL H H . . . 1 1 6 6 SER H H . . . . . 4.230 1.8 5.4990 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 6 . HN . . c17395_2l87 1 162 1 . . 1 1 6 6 SER H H . . . 1 1 6 6 SER HA H . . . . . 4.458 1.8 5.7954 . . . . . . . . . . . . . . . . . . . . 6 . HN . . . . . 6 . HA . . c17395_2l87 1 163 1 . . 1 1 6 6 SER HA H . . . 1 1 7 7 SER H H . . . . . 2.902 1.8 3.7726 . . . . . . . . . . . . A . 7 SER H . . . 6 . HA . . . . . 7 . HN . . c17395_2l87 1 164 1 OR . 1 1 5 5 VAL H H . . . 1 1 6 6 SER HB2 H . . . . . 3.882 1.8 5.0466 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 6 . HB# . . c17395_2l87 1 164 2 OR . 1 1 5 5 VAL H H . . . 1 1 6 6 SER HB3 H . . . . . 3.882 1.8 5.0466 . . . . . . . . . . . . . . . . . . . . 5 . HN . . . . . 6 . HB# . . c17395_2l87 1 165 1 OR . 1 1 6 6 SER H H . . . 1 1 6 6 SER HB2 H . . . . . 3.635 1.8 4.7255 . . . . . . . . . . . . . . . . . . . . 6 . HN . . . . . 6 . HB# . . c17395_2l87 1 165 2 OR . 1 1 6 6 SER H H . . . 1 1 6 6 SER HB3 H . . . . . 3.635 1.8 4.7255 . . . . . . . . . . . . . . . . . . . . 6 . HN . . . . . 6 . HB# . . c17395_2l87 1 166 1 OR . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 3.248 1.8 4.2224 . . . . . A . 7 SER H . . A . 7 SER HB3 . . . 7 . HN . . . . . 7 . HB# . . c17395_2l87 1 166 2 OR . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 3.248 1.8 4.2224 . . . . . A . 7 SER H . . A . 7 SER HB2 . . . 7 . HN . . . . . 7 . HB# . . c17395_2l87 1 167 1 OR . 1 1 9 9 ILE H H . . . 1 1 7 7 SER HB3 H . . . . . 4.126 1.8 5.3638 . . . . . A . 9 ILE H . . A . 7 SER HB3 . . . 9 . HN . . . . . 7 . HB# . . c17395_2l87 1 167 2 OR . 1 1 7 7 SER HB2 H . . . 1 1 9 9 ILE H H . . . . . 4.126 1.8 5.3638 . . . . . A . 7 SER HB2 . . A . 9 ILE H . . . 7 . HB# . . . . . 9 . HN . . c17395_2l87 1 168 1 . . 1 1 10 10 TYS H H . . . 1 1 7 7 SER HB3 H . . . . . 4.585 1.8 5.9605 . . . . . A . 10 TYS H . . A . 7 SER HB3 . . . 10 . HN . . . . . 7 . HB1 . . c17395_2l87 1 169 1 . . 1 1 10 10 TYS H H . . . 1 1 8 8 PRO HA H . . . . . 3.882 1.8 5.0466 . . . . . A . 10 TYS H . . A . 8 PRO HA . . . 10 . HN . . . . . 8 . HA . . c17395_2l87 1 170 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HD3 H . . . . . 3.591 1.8 4.6683 . . . . . A . 8 PRO HA . . A . 8 PRO HD3 . . . 8 . HA . . . . . 8 . HD1 . . c17395_2l87 1 171 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HD2 H . . . . . 3.493 1.8 4.5409 . . . . . A . 8 PRO HA . . A . 8 PRO HD2 . . . 8 . HA . . . . . 8 . HD2 . . c17395_2l87 1 172 1 . . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HA H . . . . . 2.200 1.8 2.8600 . . . . . A . 9 ILE H . . A . 8 PRO HA . . . 9 . HN . . . . . 8 . HA . . c17395_2l87 1 173 1 . . 1 1 10 10 TYS H H . . . 1 1 8 8 PRO HB3 H . . . . . 4.985 1.8 6.4805 . . . . . A . 10 TYS H . . A . 8 PRO HB3 . . . 10 . HN . . . . . 8 . HB1 . . c17395_2l87 1 174 1 . . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HB3 H . . . . . 3.765 1.8 4.8945 . . . . . A . 8 PRO HD3 . . A . 8 PRO HB3 . . . 8 . HD1 . . . . . 8 . HB1 . . c17395_2l87 1 175 1 . . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HB3 H . . . . . 3.947 1.8 5.1311 . . . . . A . 8 PRO HD2 . . A . 8 PRO HB3 . . . 8 . HD2 . . . . . 8 . HB1 . . c17395_2l87 1 176 1 . . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HB3 H . . . . . 3.513 1.8 4.5669 . . . . . A . 9 ILE H . . A . 8 PRO HB3 . . . 9 . HN . . . . . 8 . HB1 . . c17395_2l87 1 177 1 . . 1 1 12 12 ILE H H . . . 1 1 8 8 PRO HB2 H . . . . . 4.459 1.8 5.7967 . . . . . A . 12 ILE H . . A . 8 PRO HB2 . . . 12 . HN . . . . . 8 . HB2 . . c17395_2l87 1 178 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HB2 H . . . . . 2.927 1.8 3.8051 . . . . . A . 8 PRO HA . . A . 8 PRO HB2 . . . 8 . HA . . . . . 8 . HB2 . . c17395_2l87 1 179 1 . . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HB2 H . . . . . 2.350 1.8 3.0550 . . . . . A . 8 PRO HB3 . . A . 8 PRO HB2 . . . 8 . HB1 . . . . . 8 . HB2 . . c17395_2l87 1 180 1 . . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HB2 H . . . . . 3.903 1.8 5.0739 . . . . . A . 8 PRO HD3 . . A . 8 PRO HB2 . . . 8 . HD1 . . . . . 8 . HB2 . . c17395_2l87 1 181 1 . . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HB2 H . . . . . 3.649 1.8 4.7437 . . . . . A . 8 PRO HD2 . . A . 8 PRO HB2 . . . 8 . HD2 . . . . . 8 . HB2 . . c17395_2l87 1 182 1 . . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HD3 H . . . . . 4.497 1.8 5.8461 . . . . . A . 9 ILE H . . A . 8 PRO HD3 . . . 9 . HN . . . . . 8 . HD1 . . c17395_2l87 1 183 1 . . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HD2 H . . . . . 4.001 1.8 5.2013 . . . . . A . 9 ILE H . . A . 8 PRO HD2 . . . 9 . HN . . . . . 8 . HD2 . . c17395_2l87 1 184 1 OR . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HG2 H . . . . . 3.094 1.8 4.0222 . . . . . A . 8 PRO HA . . A . 8 PRO HG2 . . . 8 . HA . . . . . 8 . HG# . . c17395_2l87 1 184 2 OR . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HG3 H . . . . . 3.094 1.8 4.0222 . . . . . A . 8 PRO HA . . A . 8 PRO HG3 . . . 8 . HA . . . . . 8 . HG# . . c17395_2l87 1 185 1 OR . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HG2 H . . . . . 2.430 1.8 3.1590 . . . . . A . 8 PRO HB3 . . A . 8 PRO HG2 . . . 8 . HB1 . . . . . 8 . HG# . . c17395_2l87 1 185 2 OR . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HG3 H . . . . . 2.430 1.8 3.1590 . . . . . A . 8 PRO HB3 . . A . 8 PRO HG3 . . . 8 . HB1 . . . . . 8 . HG# . . c17395_2l87 1 186 1 OR . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HG2 H . . . . . 2.431 1.8 3.1603 . . . . . A . 8 PRO HD3 . . A . 8 PRO HG2 . . . 8 . HD1 . . . . . 8 . HG# . . c17395_2l87 1 186 2 OR . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HG3 H . . . . . 2.431 1.8 3.1603 . . . . . A . 8 PRO HD3 . . A . 8 PRO HG3 . . . 8 . HD1 . . . . . 8 . HG# . . c17395_2l87 1 187 1 OR . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HG2 H . . . . . 2.584 1.8 3.3592 . . . . . A . 8 PRO HD2 . . A . 8 PRO HG2 . . . 8 . HD2 . . . . . 8 . HG# . . c17395_2l87 1 187 2 OR . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HG3 H . . . . . 2.584 1.8 3.3592 . . . . . A . 8 PRO HD2 . . A . 8 PRO HG3 . . . 8 . HD2 . . . . . 8 . HG# . . c17395_2l87 1 188 1 OR . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HG2 H . . . . . 3.704 1.8 4.8152 . . . . . A . 9 ILE H . . A . 8 PRO HG2 . . . 9 . HN . . . . . 8 . HG# . . c17395_2l87 1 188 2 OR . 1 1 9 9 ILE H H . . . 1 1 8 8 PRO HG3 H . . . . . 3.704 1.8 4.8152 . . . . . A . 9 ILE H . . A . 8 PRO HG3 . . . 9 . HN . . . . . 8 . HG# . . c17395_2l87 1 189 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE HA H . . . . . 2.376 1.8 3.0888 . . . . . A . 10 TYS H . . A . 9 ILE HA . . . 10 . HN . . . . . 9 . HA . . c17395_2l87 1 190 1 . . 1 1 11 11 ASP H H . . . 1 1 9 9 ILE HA H . . . . . 3.455 1.8 4.4915 . . . . . A . 11 ASP H . . A . 9 ILE HA . . . 11 . HN . . . . . 9 . HA . . c17395_2l87 1 191 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HA H . . . . . 2.962 1.8 3.8506 . . . . . A . 9 ILE H . . A . 9 ILE HA . . . 9 . HN . . . . . 9 . HA . . c17395_2l87 1 192 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE HB H . . . . . 3.658 1.8 4.7554 . . . . . A . 10 TYS H . . A . 9 ILE HB . . . 10 . HN . . . . . 9 . HB . . c17395_2l87 1 193 1 . . 1 1 8 8 PRO HD2 H . . . 1 1 9 9 ILE HB H . . . . . 4.217 1.8 5.4821 . . . . . A . 8 PRO HD2 . . A . 9 ILE HB . . . 8 . HD2 . . . . . 9 . HB . . c17395_2l87 1 194 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE HB H . . . . . 2.957 1.8 3.8441 . . . . . A . 9 ILE HA . . A . 9 ILE HB . . . 9 . HA . . . . . 9 . HB . . c17395_2l87 1 195 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HB H . . . . . 2.869 1.8 3.7297 . . . . . A . 9 ILE H . . A . 9 ILE HB . . . 9 . HN . . . . . 9 . HB . . c17395_2l87 1 196 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE MD H . . . . . 3.886 1.8 5.0518 . . . . . A . 10 TYS H . . A . 9 ILE MD . . . 10 . HN . . . . . 9 . HD1# . . c17395_2l87 1 197 1 . . 1 1 11 11 ASP H H . . . 1 1 9 9 ILE MD H . . . . . 4.764 1.8 6.1932 . . . . . A . 11 ASP H . . A . 9 ILE MD . . . 11 . HN . . . . . 9 . HD1# . . c17395_2l87 1 198 1 . . 1 1 12 12 ILE H H . . . 1 1 9 9 ILE MD H . . . . . 5.270 1.8 6.8510 . . . . . A . 12 ILE H . . A . 9 ILE MD . . . 12 . HN . . . . . 9 . HD1# . . c17395_2l87 1 199 1 . . 1 1 9 9 ILE MD H . . . 1 1 9 9 ILE HG13 H . . . . . 3.956 1.8 5.1428 . . . . . A . 9 ILE MD . . A . 9 ILE HG13 . . . 9 . HD1# . . . . . 9 . HG11 . . c17395_2l87 1 200 1 . . 1 1 9 9 ILE MD H . . . 1 1 9 9 ILE HG12 H . . . . . 3.912 1.8 5.0856 . . . . . A . 9 ILE MD . . A . 9 ILE HG12 . . . 9 . HD1# . . . . . 9 . HG12 . . c17395_2l87 1 201 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE MD H . . . . . 3.825 1.8 4.9725 . . . . . A . 9 ILE H . . A . 9 ILE MD . . . 9 . HN . . . . . 9 . HD1# . . c17395_2l87 1 202 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE HG13 H . . . . . 4.458 1.8 5.7954 . . . . . A . 10 TYS H . . A . 9 ILE HG13 . . . 10 . HN . . . . . 9 . HG11 . . c17395_2l87 1 203 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE HG13 H . . . . . 3.627 1.8 4.7151 . . . . . A . 9 ILE HA . . A . 9 ILE HG13 . . . 9 . HA . . . . . 9 . HG11 . . c17395_2l87 1 204 1 . . 1 1 9 9 ILE HB H . . . 1 1 9 9 ILE HG13 H . . . . . 3.217 1.8 4.1821 . . . . . A . 9 ILE HB . . A . 9 ILE HG13 . . . 9 . HB . . . . . 9 . HG11 . . c17395_2l87 1 205 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG13 H . . . . . 3.389 1.8 4.4057 . . . . . A . 9 ILE H . . A . 9 ILE HG13 . . . 9 . HN . . . . . 9 . HG11 . . c17395_2l87 1 206 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE HG12 H . . . . . 4.622 1.8 6.0086 . . . . . A . 10 TYS H . . A . 9 ILE HG12 . . . 10 . HN . . . . . 9 . HG12 . . c17395_2l87 1 207 1 . . 1 1 9 9 ILE HG13 H . . . 1 1 9 9 ILE HG12 H . . . . . 2.505 1.8 3.2565 . . . . . A . 9 ILE HG13 . . A . 9 ILE HG12 . . . 9 . HG11 . . . . . 9 . HG12 . . c17395_2l87 1 208 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG12 H . . . . . 3.303 1.8 4.2939 . . . . . A . 9 ILE H . . A . 9 ILE HG12 . . . 9 . HN . . . . . 9 . HG12 . . c17395_2l87 1 209 1 . . 1 1 9 9 ILE HB H . . . 1 1 9 9 ILE MG H . . . . . 3.692 1.8 4.7996 . . . . . A . 9 ILE HB . . A . 9 ILE MG . . . 9 . HB . . . . . 9 . HG2# . . c17395_2l87 1 210 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE MG H . . . . . 4.486 1.8 5.8318 . . . . . A . 9 ILE H . . A . 9 ILE MG . . . 9 . HN . . . . . 9 . HG2# . . c17395_2l87 1 211 1 . . 1 1 14 14 TYS H H . . . 1 1 12 12 ILE HA H . . . . . 4.419 1.8 5.7447 . . . . . A . 14 TYS H . . A . 12 ILE HA . . . 14 . HN . . . . . 12 . HA . . c17395_2l87 1 212 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE HB H . . . . . 3.267 1.8 4.2471 . . . . . A . 12 ILE H . . A . 12 ILE HB . . . 12 . HN . . . . . 12 . HB . . c17395_2l87 1 213 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE HG12 H . . . . . 3.861 1.8 5.0193 . . . . . A . 12 ILE H . . A . 12 ILE HG12 . . . 12 . HN . . . . . 12 . HG12 . . c17395_2l87 1 214 1 . . 1 1 15 15 TYR H H . . . 1 1 13 13 ASN HA H . . . . . 2.893 1.8 3.7609 . . . . . A . 15 TYR H . . A . 13 ASN HA . . . 15 . HN . . . . . 13 . HA . . c17395_2l87 1 215 1 . . 1 1 17 17 SER H H . . . 1 1 15 15 TYR HA H . . . . . 4.182 1.8 5.4366 . . . . . A . 17 SER H . . A . 15 TYR HA . . . 17 . HN . . . . . 15 . HA . . c17395_2l87 1 216 1 . . 1 1 18 18 GLU HA H . . . 1 1 20 20 ALA H H . . . . . 5.426 1.8 7.0538 . . . . . A . 18 GLU HA . . A . 20 ALA H . . . 18 . HA . . . . . 20 . HN . . c17395_2l87 1 217 1 . . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HB3 H . . . . . 3.847 1.8 5.0011 . . . . . A . 18 GLU H . . A . 18 GLU HB3 . . . 18 . HN . . . . . 18 . HB1 . . c17395_2l87 1 218 1 . . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HB2 H . . . . . 3.462 1.8 4.5006 . . . . . A . 18 GLU H . . A . 18 GLU HB2 . . . 18 . HN . . . . . 18 . HB2 . . c17395_2l87 1 219 1 . . 1 1 23 23 ILE HA H . . . 1 1 26 26 LYS H H . . . . . 4.939 1.8 6.4207 . . . . . A . 23 ILE HA . . . . . . . . . . 23 . HA . . . . . 26 . HN . . c17395_2l87 1 220 1 . . 1 1 23 23 ILE H H . . . 1 1 23 23 ILE HB H . . . . . 3.388 1.8 4.4044 . . . . . A . 23 ILE H . . A . 23 ILE HB . . . 23 . HN . . . . . 23 . HB . . c17395_2l87 1 221 1 . . 1 1 24 24 ASN H H . . . 1 1 23 23 ILE HB H . . . . . 4.522 1.8 5.8786 . . . . . . . . . . . . A . 23 ILE HB . . . 24 . HN . . . . . 23 . HB . . c17395_2l87 1 222 1 . . 1 1 23 23 ILE H H . . . 1 1 23 23 ILE MD H . . . . . 4.764 1.8 6.1932 . . . . . A . 23 ILE H . . A . 23 ILE MD . . . 23 . HN . . . . . 23 . HD1# . . c17395_2l87 1 223 1 . . 1 1 24 24 ASN H H . . . 1 1 23 23 ILE MD H . . . . . 4.972 1.8 6.4636 . . . . . . . . . . . . A . 23 ILE MD . . . 24 . HN . . . . . 23 . HD1# . . c17395_2l87 1 224 1 . . 1 1 25 25 VAL H H . . . 1 1 24 24 ASN HA H . . . . . 2.736 1.8 3.5568 . . . . . . . . . . . . . . . . . . . . 25 . HN . . . . . 24 . HA . . c17395_2l87 1 225 1 . . 1 1 26 26 LYS H H . . . 1 1 24 24 ASN HA H . . . . . 5.220 1.8 6.7860 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 24 . HA . . c17395_2l87 1 226 1 . . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL HA H . . . . . 3.563 1.8 4.6319 . . . . . . . . . . . . . . . . . . . . 25 . HN . . . . . 25 . HA . . c17395_2l87 1 227 1 . . 1 1 26 26 LYS H H . . . 1 1 25 25 VAL HA H . . . . . 2.317 1.8 3.0121 . . . . . . . . . . . . . . . . . . . . 26 . HN . . . . . 25 . HA . . c17395_2l87 1 228 1 . . 1 1 27 27 GLN H H . . . 1 1 27 27 GLN HA H . . . . . 3.545 1.8 4.6085 . . . . . . . . . . . . . . . . . . . . 27 . HN . . . . . 27 . HA . . c17395_2l87 1 229 1 . . 1 1 27 27 GLN H H . . . 1 1 27 27 GLN HB2 H . . . . . 4.249 1.8 5.5237 . . . . . . . . . . . . . . . . . . . . 27 . HN . . . . . 27 . HB2 . . c17395_2l87 1 230 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 3.570 1.8 4.6410 . . . . . A . 7 SER H . . A . 7 SER HA . . . 7 . HN . . . . . 7 . HA . . c17395_2l87 1 231 1 . . 1 1 21 21 GLN H H . . . 1 1 24 24 ASN HA H . . . . . 4.708 1.8 6.1204 . . . . . A . 21 GLN H . . . . . . . . . . 21 . HN . . . . . 24 . HA . . c17395_2l87 1 232 1 . . 1 1 10 10 TYS H H . . . 1 1 9 9 ILE H H . . . . . 3.420 1.8 4.4460 . . . . . A . 10 TYS H . . A . 9 ILE H . . . 10 . HN . . . . . 9 . HN . . c17395_2l87 1 233 1 . . 1 1 15 15 TYR H H . . . 1 1 16 16 THR H H . . . . . 3.611 1.8 4.6943 . . . . . A . 15 TYR H . . A . 16 THR H . . . 15 . HN . . . . . 16 . HN . . c17395_2l87 1 234 1 . . 1 1 24 24 ASN H H . . . 1 1 23 23 ILE H H . . . . . 4.781 1.8 6.2153 . . . . . . . . . . . . A . 23 ILE H . . . 24 . HN . . . . . 23 . HN . . c17395_2l87 1 235 1 . . 1 1 24 24 ASN H H . . . 1 1 25 25 VAL H H . . . . . 4.606 1.8 5.9878 . . . . . . . . . . . . . . . . . . . . 24 . HN . . . . . 25 . HN . . c17395_2l87 1 236 1 . . 1 1 25 25 VAL H H . . . 1 1 26 26 LYS H H . . . . . 3.569 1.8 4.6397 . . . . . . . . . . . . . . . . . . . . 25 . HN . . . . . 26 . HN . . c17395_2l87 1 237 1 . . 1 1 10 10 TYS HB3 H . . . 1 1 10 10 TYS HB2 H . . . . . 2.609 1.8 3.3917 . . . . . A . 10 TYS HB3 . . A . 10 TYS HB2 . . . 10 . HB1 . . . . . 10 . HB2 . . c17395_2l87 1 238 1 . . 1 1 11 11 ASP HB3 H . . . 1 1 11 11 ASP HB2 H . . . . . 2.414 1.8 3.1382 . . . . . A . 11 ASP HB3 . . A . 11 ASP HB2 . . . 11 . HB1 . . . . . 11 . HB2 . . c17395_2l87 1 239 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HB H . . . . . 3.182 1.8 4.1366 . . . . . A . 12 ILE HA . . A . 12 ILE HB . . . 12 . HA . . . . . 12 . HB . . c17395_2l87 1 240 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE MD H . . . . . 3.945 1.8 5.1285 . . . . . A . 12 ILE HA . . A . 12 ILE MD . . . 12 . HA . . . . . 12 . HD1# . . c17395_2l87 1 241 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HG13 H . . . . . 3.995 1.8 5.1935 . . . . . A . 12 ILE HA . . A . 12 ILE HG13 . . . 12 . HA . . . . . 12 . HG11 . . c17395_2l87 1 242 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HG12 H . . . . . 4.018 1.8 5.2234 . . . . . A . 12 ILE HA . . A . 12 ILE HG12 . . . 12 . HA . . . . . 12 . HG12 . . c17395_2l87 1 243 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE MG H . . . . . 4.575 1.8 5.9475 . . . . . A . 12 ILE HA . . A . 12 ILE MG . . . 12 . HA . . . . . 12 . HG2# . . c17395_2l87 1 244 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE MD H . . . . . 3.810 1.8 4.9530 . . . . . A . 12 ILE HB . . A . 12 ILE MD . . . 12 . HB . . . . . 12 . HD1# . . c17395_2l87 1 245 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE MG H . . . . . 3.948 1.8 5.1324 . . . . . A . 12 ILE HB . . A . 12 ILE MG . . . 12 . HB . . . . . 12 . HG2# . . c17395_2l87 1 246 1 OR . 1 1 14 14 TYS HA H . . . 1 1 14 14 TYS HB2 H . . . . . 3.337 1.8 4.3381 . . . . . A . 14 TYS HA . . A . 14 TYS HB2 . . . 14 . HA . . . . . 14 . HB# . . c17395_2l87 1 246 2 OR . 1 1 14 14 TYS HA H . . . 1 1 14 14 TYS HB3 H . . . . . 3.337 1.8 4.3381 . . . . . A . 14 TYS HA . . A . 14 TYS HB3 . . . 14 . HA . . . . . 14 . HB# . . c17395_2l87 1 247 1 OR . 1 1 13 13 ASN HB2 H . . . 1 1 14 14 TYS HB2 H . . . . . 3.936 1.8 5.1168 . . . . . A . 13 ASN HB2 . . A . 14 TYS HB2 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 247 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 14 14 TYS HB2 H . . . . . 3.936 1.8 5.1168 . . . . . A . 13 ASN HB3 . . A . 14 TYS HB2 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 247 3 OR . 1 1 14 14 TYS HB3 H . . . 1 1 13 13 ASN HB2 H . . . . . 3.936 1.8 5.1168 . . . . . A . 14 TYS HB3 . . A . 13 ASN HB2 . . . 14 . HB# . . . . . 13 . HB# . . c17395_2l87 1 247 4 OR . 1 1 13 13 ASN HB3 H . . . 1 1 14 14 TYS HB3 H . . . . . 3.936 1.8 5.1168 . . . . . A . 13 ASN HB3 . . A . 14 TYS HB3 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 248 1 . . 1 1 15 15 TYR HA H . . . 1 1 14 14 TYS HB3 H . . . . . 4.209 1.8 5.4717 . . . . . A . 15 TYR HA . . A . 14 TYS HB3 . . . 15 . HA . . . . . 14 . HB1 . . c17395_2l87 1 249 1 . . 1 1 15 15 TYR HB2 H . . . 1 1 15 15 TYR HB3 H . . . . . 2.606 1.8 3.3878 . . . . . A . 15 TYR HB2 . . A . 15 TYR HB3 . . . 15 . HB2 . . . . . 15 . HB1 . . c17395_2l87 1 250 1 . . 1 1 16 16 THR HA H . . . 1 1 16 16 THR HB H . . . . . 2.615 1.8 3.3995 . . . . . A . 16 THR HA . . A . 16 THR HB . . . 16 . HA . . . . . 16 . HB . . c17395_2l87 1 251 1 . . 1 1 16 16 THR HA H . . . 1 1 16 16 THR HB H . . . . . 3.937 1.8 5.1181 . . . . . A . 16 THR HA . . A . 16 THR HB . . . 16 . HA . . . . . 16 . HB . . c17395_2l87 1 252 1 . . 1 1 16 16 THR HA H . . . 1 1 16 16 THR MG H . . . . . 3.542 1.8 4.6046 . . . . . A . 16 THR HA . . A . 16 THR MG . . . 16 . HA . . . . . 16 . HG2# . . c17395_2l87 1 253 1 . . 1 1 16 16 THR HA H . . . 1 1 19 19 PRO HB2 H . . . . . 3.236 1.8 4.2068 . . . . . A . 16 THR HA . . A . 19 PRO HB2 . . . 16 . HA . . . . . 19 . HB2 . . c17395_2l87 1 254 1 . . 1 1 16 16 THR HB H . . . 1 1 16 16 THR MG H . . . . . 3.698 1.8 4.8074 . . . . . A . 16 THR HB . . A . 16 THR MG . . . 16 . HB . . . . . 16 . HG2# . . c17395_2l87 1 255 1 OR . 1 1 17 17 SER HA H . . . 1 1 17 17 SER HB2 H . . . . . 2.628 1.8 3.4164 . . . . . A . 17 SER HA . . A . 17 SER HB2 . . . 17 . HA . . . . . 17 . HB# . . c17395_2l87 1 255 2 OR . 1 1 17 17 SER HA H . . . 1 1 17 17 SER HB3 H . . . . . 2.628 1.8 3.4164 . . . . . A . 17 SER HA . . A . 17 SER HB3 . . . 17 . HA . . . . . 17 . HB# . . c17395_2l87 1 256 1 OR . 1 1 19 19 PRO HD2 H . . . 1 1 17 17 SER HB2 H . . . . . 3.988 1.8 5.1844 . . . . . A . 19 PRO HD2 . . A . 17 SER HB2 . . . 19 . HD2 . . . . . 17 . HB# . . c17395_2l87 1 256 2 OR . 1 1 17 17 SER HB3 H . . . 1 1 19 19 PRO HD2 H . . . . . 3.988 1.8 5.1844 . . . . . A . 17 SER HB3 . . A . 19 PRO HD2 . . . 17 . HB# . . . . . 19 . HD2 . . c17395_2l87 1 257 1 . . 1 1 19 19 PRO HA H . . . 1 1 19 19 PRO HB3 H . . . . . 3.635 1.8 4.7255 . . . . . A . 19 PRO HA . . A . 19 PRO HB3 . . . 19 . HA . . . . . 19 . HB1 . . c17395_2l87 1 258 1 . . 1 1 19 19 PRO HA H . . . 1 1 19 19 PRO HD3 H . . . . . 2.886 1.8 3.7518 . . . . . A . 19 PRO HA . . A . 19 PRO HD3 . . . 19 . HA . . . . . 19 . HD1 . . c17395_2l87 1 259 1 . . 1 1 19 19 PRO HA H . . . 1 1 19 19 PRO HD2 H . . . . . 2.945 1.8 3.8285 . . . . . A . 19 PRO HA . . A . 19 PRO HD2 . . . 19 . HA . . . . . 19 . HD2 . . c17395_2l87 1 260 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HB2 H . . . . . 2.717 1.8 3.5321 . . . . . A . 19 PRO HB3 . . A . 19 PRO HB2 . . . 19 . HB1 . . . . . 19 . HB2 . . c17395_2l87 1 261 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HB2 H . . . . . 3.254 1.8 4.2302 . . . . . A . 19 PRO HB3 . . A . 19 PRO HB2 . . . 19 . HB1 . . . . . 19 . HB2 . . c17395_2l87 1 262 1 OR . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HG2 H . . . . . 2.781 1.8 3.6153 . . . . . A . 19 PRO HB3 . . A . 19 PRO HG2 . . . 19 . HB1 . . . . . 19 . HG# . . c17395_2l87 1 262 2 OR . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HG3 H . . . . . 2.781 1.8 3.6153 . . . . . A . 19 PRO HB3 . . A . 19 PRO HG3 . . . 19 . HB1 . . . . . 19 . HG# . . c17395_2l87 1 263 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HD3 H . . . . . 4.234 1.8 5.5042 . . . . . A . 19 PRO HB3 . . A . 19 PRO HD3 . . . 19 . HB1 . . . . . 19 . HD1 . . c17395_2l87 1 264 1 OR . 1 1 19 19 PRO HG3 H . . . 1 1 19 19 PRO HD3 H . . . . . 3.633 1.8 4.7229 . . . . . A . 19 PRO HG3 . . A . 19 PRO HD3 . . . 19 . HG# . . . . . 19 . HD1 . . c17395_2l87 1 264 2 OR . 1 1 19 19 PRO HD3 H . . . 1 1 19 19 PRO HG2 H . . . . . 3.633 1.8 4.7229 . . . . . A . 19 PRO HD3 . . A . 19 PRO HG2 . . . 19 . HD1 . . . . . 19 . HG# . . c17395_2l87 1 265 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 19 19 PRO HD2 H . . . . . 4.274 1.8 5.5562 . . . . . A . 19 PRO HB3 . . A . 19 PRO HD2 . . . 19 . HB1 . . . . . 19 . HD2 . . c17395_2l87 1 266 1 . . 1 1 19 19 PRO HB2 H . . . 1 1 19 19 PRO HD2 H . . . . . 3.954 1.8 5.1402 . . . . . A . 19 PRO HB2 . . A . 19 PRO HD2 . . . 19 . HB2 . . . . . 19 . HD2 . . c17395_2l87 1 267 1 OR . 1 1 19 19 PRO HG3 H . . . 1 1 19 19 PRO HD2 H . . . . . 3.395 1.8 4.4135 . . . . . A . 19 PRO HG3 . . A . 19 PRO HD2 . . . 19 . HG# . . . . . 19 . HD2 . . c17395_2l87 1 267 2 OR . 1 1 19 19 PRO HD2 H . . . 1 1 19 19 PRO HG2 H . . . . . 3.395 1.8 4.4135 . . . . . A . 19 PRO HD2 . . A . 19 PRO HG2 . . . 19 . HD2 . . . . . 19 . HG# . . c17395_2l87 1 268 1 OR . 1 1 19 19 PRO HB2 H . . . 1 1 19 19 PRO HG2 H . . . . . 2.680 1.8 3.4840 . . . . . A . 19 PRO HB2 . . A . 19 PRO HG2 . . . 19 . HB2 . . . . . 19 . HG# . . c17395_2l87 1 268 2 OR . 1 1 19 19 PRO HB2 H . . . 1 1 19 19 PRO HG3 H . . . . . 2.680 1.8 3.4840 . . . . . A . 19 PRO HB2 . . A . 19 PRO HG3 . . . 19 . HB2 . . . . . 19 . HG# . . c17395_2l87 1 269 1 . . 1 1 20 20 ALA HA H . . . 1 1 20 20 ALA MB H . . . . . 3.638 1.8 4.7294 . . . . . A . 20 ALA HA . . A . 20 ALA MB . . . 20 . HA . . . . . 20 . HB# . . c17395_2l87 1 270 1 . . 1 1 20 20 ALA HA H . . . 1 1 20 20 ALA MB H . . . . . 3.643 1.8 4.7359 . . . . . A . 20 ALA HA . . A . 20 ALA MB . . . 20 . HA . . . . . 20 . HB# . . c17395_2l87 1 271 1 . . 1 1 20 20 ALA HA H . . . 1 1 20 20 ALA MB H . . . . . 3.823 1.8 4.9699 . . . . . A . 20 ALA HA . . A . 20 ALA MB . . . 20 . HA . . . . . 20 . HB# . . c17395_2l87 1 272 1 . . 1 1 20 20 ALA HA H . . . 1 1 20 20 ALA MB H . . . . . 4.835 1.8 6.2855 . . . . . A . 20 ALA HA . . A . 20 ALA MB . . . 20 . HA . . . . . 20 . HB# . . c17395_2l87 1 273 1 OR . 1 1 21 21 GLN HB3 H . . . 1 1 21 21 GLN HG2 H . . . . . 3.168 1.8 4.1184 . . . . . A . 21 GLN HB3 . . A . 21 GLN HG2 . . . 21 . HB1 . . . . . 21 . HG# . . c17395_2l87 1 273 2 OR . 1 1 21 21 GLN HB3 H . . . 1 1 21 21 GLN HG3 H . . . . . 3.168 1.8 4.1184 . . . . . A . 21 GLN HB3 . . A . 21 GLN HG3 . . . 21 . HB1 . . . . . 21 . HG# . . c17395_2l87 1 274 1 OR . 1 1 21 21 GLN HB2 H . . . 1 1 21 21 GLN HG2 H . . . . . 3.483 1.8 4.5279 . . . . . A . 21 GLN HB2 . . A . 21 GLN HG2 . . . 21 . HB2 . . . . . 21 . HG# . . c17395_2l87 1 274 2 OR . 1 1 21 21 GLN HB2 H . . . 1 1 21 21 GLN HG3 H . . . . . 3.483 1.8 4.5279 . . . . . A . 21 GLN HB2 . . A . 21 GLN HG3 . . . 21 . HB2 . . . . . 21 . HG# . . c17395_2l87 1 275 1 OR . 1 1 21 21 GLN HB2 H . . . 1 1 21 21 GLN HG2 H . . . . . 3.845 1.8 4.9985 . . . . . A . 21 GLN HB2 . . A . 21 GLN HG2 . . . 21 . HB2 . . . . . 21 . HG# . . c17395_2l87 1 275 2 OR . 1 1 21 21 GLN HB2 H . . . 1 1 21 21 GLN HG3 H . . . . . 3.845 1.8 4.9985 . . . . . A . 21 GLN HB2 . . A . 21 GLN HG3 . . . 21 . HB2 . . . . . 21 . HG# . . c17395_2l87 1 276 1 . . 1 1 19 19 PRO HB3 H . . . 1 1 22 22 LYS HA H . . . . . 3.553 1.8 4.6189 . . . . . A . 19 PRO HB3 . . A . 22 LYS HA . . . 19 . HB1 . . . . . 22 . HA . . c17395_2l87 1 277 1 . . 1 1 22 22 LYS HA H . . . 1 1 22 22 LYS HB3 H . . . . . 3.569 1.8 4.6397 . . . . . A . 22 LYS HA . . A . 22 LYS HB3 . . . 22 . HA . . . . . 22 . HB1 . . c17395_2l87 1 278 1 . . 1 1 22 22 LYS HA H . . . 1 1 22 22 LYS HB2 H . . . . . 3.550 1.8 4.6150 . . . . . A . 22 LYS HA . . A . 22 LYS HB2 . . . 22 . HA . . . . . 22 . HB2 . . c17395_2l87 1 279 1 OR . 1 1 22 22 LYS HA H . . . 1 1 22 22 LYS HG2 H . . . . . 3.944 1.8 5.1272 . . . . . A . 22 LYS HA . . A . 22 LYS HG2 . . . 22 . HA . . . . . 22 . HG# . . c17395_2l87 1 279 2 OR . 1 1 22 22 LYS HA H . . . 1 1 22 22 LYS HG3 H . . . . . 3.944 1.8 5.1272 . . . . . A . 22 LYS HA . . A . 22 LYS HG3 . . . 22 . HA . . . . . 22 . HG# . . c17395_2l87 1 280 1 . . 1 1 22 22 LYS HA H . . . 1 1 23 23 ILE HA H . . . . . 4.226 1.8 5.4938 . . . . . A . 22 LYS HA . . A . 23 ILE HA . . . 22 . HA . . . . . 23 . HA . . c17395_2l87 1 281 1 . . 1 1 22 22 LYS HA H . . . 1 1 23 23 ILE HG13 H . . . . . 3.975 1.8 5.1675 . . . . . A . 22 LYS HA . . A . 23 ILE HG13 . . . 22 . HA . . . . . 23 . HG11 . . c17395_2l87 1 282 1 OR . 1 1 22 22 LYS HB3 H . . . 1 1 22 22 LYS HG2 H . . . . . 4.394 1.8 5.7122 . . . . . A . 22 LYS HB3 . . A . 22 LYS HG2 . . . 22 . HB1 . . . . . 22 . HG# . . c17395_2l87 1 282 2 OR . 1 1 22 22 LYS HB3 H . . . 1 1 22 22 LYS HG3 H . . . . . 4.394 1.8 5.7122 . . . . . A . 22 LYS HB3 . . A . 22 LYS HG3 . . . 22 . HB1 . . . . . 22 . HG# . . c17395_2l87 1 283 1 OR . 1 1 22 22 LYS HB3 H . . . 1 1 22 22 LYS HG2 H . . . . . 4.631 1.8 6.0203 . . . . . A . 22 LYS HB3 . . A . 22 LYS HG2 . . . 22 . HB1 . . . . . 22 . HG# . . c17395_2l87 1 283 2 OR . 1 1 22 22 LYS HB3 H . . . 1 1 22 22 LYS HG3 H . . . . . 4.631 1.8 6.0203 . . . . . A . 22 LYS HB3 . . A . 22 LYS HG3 . . . 22 . HB1 . . . . . 22 . HG# . . c17395_2l87 1 284 1 . . 1 1 22 22 LYS HB2 H . . . 1 1 23 23 ILE HG13 H . . . . . 3.709 1.8 4.8217 . . . . . A . 22 LYS HB2 . . A . 23 ILE HG13 . . . 22 . HB2 . . . . . 23 . HG11 . . c17395_2l87 1 285 1 . . 1 1 23 23 ILE HA H . . . 1 1 23 23 ILE HG13 H . . . . . 4.421 1.8 5.7473 . . . . . A . 23 ILE HA . . A . 23 ILE HG13 . . . 23 . HA . . . . . 23 . HG11 . . c17395_2l87 1 286 1 . . 1 1 23 23 ILE HA H . . . 1 1 23 23 ILE HG12 H . . . . . 3.996 1.8 5.1948 . . . . . A . 23 ILE HA . . A . 23 ILE HG12 . . . 23 . HA . . . . . 23 . HG12 . . c17395_2l87 1 287 1 . . 1 1 23 23 ILE HA H . . . 1 1 23 23 ILE MG H . . . . . 4.323 1.8 5.6199 . . . . . A . 23 ILE HA . . A . 23 ILE MG . . . 23 . HA . . . . . 23 . HG2# . . c17395_2l87 1 288 1 . . 1 1 23 23 ILE MD H . . . 1 1 23 23 ILE HG12 H . . . . . 3.847 1.8 5.0011 . . . . . A . 23 ILE MD . . A . 23 ILE HG12 . . . 23 . HD1# . . . . . 23 . HG12 . . c17395_2l87 1 289 1 . . 1 1 23 23 ILE HG12 H . . . 1 1 23 23 ILE MG H . . . . . 4.080 1.8 5.3040 . . . . . A . 23 ILE HG12 . . A . 23 ILE MG . . . 23 . HG12 . . . . . 23 . HG2# . . c17395_2l87 1 290 1 . . 1 1 25 25 VAL HB H . . . 1 1 25 25 VAL HA H . . . . . 3.551 1.8 4.6163 . . . . . . . . . . . . . . . . . . . . 25 . HB . . . . . 25 . HA . . c17395_2l87 1 291 1 . . 1 1 26 26 LYS HA H . . . 1 1 25 25 VAL HA H . . . . . 4.128 1.8 5.3664 . . . . . . . . . . . . . . . . . . . . 26 . HA . . . . . 25 . HA . . c17395_2l87 1 292 1 . . 1 1 26 26 LYS HA H . . . 1 1 26 26 LYS HB3 H . . . . . 3.677 1.8 4.7801 . . . . . . . . . . . . . . . . . . . . 26 . HA . . . . . 26 . HB1 . . c17395_2l87 1 293 1 . . 1 1 26 26 LYS HA H . . . 1 1 26 26 LYS HB2 H . . . . . 3.686 1.8 4.7918 . . . . . . . . . . . . . . . . . . . . 26 . HA . . . . . 26 . HB2 . . c17395_2l87 1 294 1 OR . 1 1 26 26 LYS HB2 H . . . 1 1 26 26 LYS HG2 H . . . . . 3.694 1.8 4.8022 . . . . . . . . . . . . . . . . . . . . 26 . HB2 . . . . . 26 . HG# . . c17395_2l87 1 294 2 OR . 1 1 26 26 LYS HB2 H . . . 1 1 26 26 LYS HG3 H . . . . . 3.694 1.8 4.8022 . . . . . . . . . . . . . . . . . . . . 26 . HB2 . . . . . 26 . HG# . . c17395_2l87 1 295 1 OR . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HG2 H . . . . . 3.145 1.8 4.0885 . . . . . . . . . . . . . . . . . . . . 4 . HA . . . . . 4 . HG# . . c17395_2l87 1 295 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 4 4 GLN HA H . . . . . 3.145 1.8 4.0885 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 4 . HA . . c17395_2l87 1 296 1 OR . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HG2 H . . . . . 3.690 1.8 4.7970 . . . . . . . . . . . . . . . . . . . . 4 . HA . . . . . 4 . HG# . . c17395_2l87 1 296 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 4 4 GLN HA H . . . . . 3.690 1.8 4.7970 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 4 . HA . . c17395_2l87 1 297 1 OR . 1 1 5 5 VAL HB H . . . 1 1 4 4 GLN HG2 H . . . . . 3.519 1.8 4.5747 . . . . . . . . . . . . . . . . . . . . 5 . HB . . . . . 4 . HG# . . c17395_2l87 1 297 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL HB H . . . . . 3.519 1.8 4.5747 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HB . . c17395_2l87 1 298 1 OR . 1 1 5 5 VAL HA H . . . 1 1 5 5 VAL MG1 H . . . . . 3.079 1.8 4.0027 . . . . . . . . . . . . . . . . . . . . 5 . HA . . . . . 5 . HG## . . c17395_2l87 1 298 2 OR . 1 1 5 5 VAL HA H . . . 1 1 5 5 VAL MG2 H . . . . . 3.079 1.8 4.0027 . . . . . . . . . . . . . . . . . . . . 5 . HA . . . . . 5 . HG## . . c17395_2l87 1 299 1 OR . 1 1 5 5 VAL HB H . . . 1 1 5 5 VAL MG1 H . . . . . 3.010 1.8 3.9130 . . . . . . . . . . . . . . . . . . . . 5 . HB . . . . . 5 . HG## . . c17395_2l87 1 299 2 OR . 1 1 5 5 VAL HB H . . . 1 1 5 5 VAL MG2 H . . . . . 3.010 1.8 3.9130 . . . . . . . . . . . . . . . . . . . . 5 . HB . . . . . 5 . HG## . . c17395_2l87 1 300 1 OR . 1 1 6 6 SER HA H . . . 1 1 7 7 SER HB3 H . . . . . 2.695 1.8 3.5035 . . . . . . . . . . . . A . 7 SER HB3 . . . 6 . HA . . . . . 7 . HB# . . c17395_2l87 1 300 2 OR . 1 1 6 6 SER HA H . . . 1 1 7 7 SER HB2 H . . . . . 2.695 1.8 3.5035 . . . . . . . . . . . . A . 7 SER HB2 . . . 6 . HA . . . . . 7 . HB# . . c17395_2l87 1 301 1 OR . 1 1 8 8 PRO HD2 H . . . 1 1 7 7 SER HB3 H . . . . . 3.329 1.8 4.3277 . . . . . A . 8 PRO HD2 . . A . 7 SER HB3 . . . 8 . HD2 . . . . . 7 . HB# . . c17395_2l87 1 301 2 OR . 1 1 7 7 SER HB2 H . . . 1 1 8 8 PRO HD2 H . . . . . 3.329 1.8 4.3277 . . . . . A . 7 SER HB2 . . A . 8 PRO HD2 . . . 7 . HB# . . . . . 8 . HD2 . . c17395_2l87 1 302 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HB3 H . . . . . 3.212 1.8 4.1756 . . . . . A . 8 PRO HA . . A . 8 PRO HB3 . . . 8 . HA . . . . . 8 . HB1 . . c17395_2l87 1 303 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HB3 H . . . . . 3.248 1.8 4.2224 . . . . . A . 8 PRO HA . . A . 8 PRO HB3 . . . 8 . HA . . . . . 8 . HB1 . . c17395_2l87 1 304 1 . . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HB2 H . . . . . 3.136 1.8 4.0768 . . . . . A . 8 PRO HA . . A . 8 PRO HB2 . . . 8 . HA . . . . . 8 . HB2 . . c17395_2l87 1 305 1 OR . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HG2 H . . . . . 3.730 1.8 4.8490 . . . . . A . 8 PRO HA . . A . 8 PRO HG2 . . . 8 . HA . . . . . 8 . HG# . . c17395_2l87 1 305 2 OR . 1 1 8 8 PRO HA H . . . 1 1 8 8 PRO HG3 H . . . . . 3.730 1.8 4.8490 . . . . . A . 8 PRO HA . . A . 8 PRO HG3 . . . 8 . HA . . . . . 8 . HG# . . c17395_2l87 1 306 1 . . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HB2 H . . . . . 3.020 1.8 3.9260 . . . . . A . 8 PRO HB3 . . A . 8 PRO HB2 . . . 8 . HB1 . . . . . 8 . HB2 . . c17395_2l87 1 307 1 OR . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HG2 H . . . . . 3.611 1.8 4.6943 . . . . . A . 8 PRO HB3 . . A . 8 PRO HG2 . . . 8 . HB1 . . . . . 8 . HG# . . c17395_2l87 1 307 2 OR . 1 1 8 8 PRO HB3 H . . . 1 1 8 8 PRO HG3 H . . . . . 3.611 1.8 4.6943 . . . . . A . 8 PRO HB3 . . A . 8 PRO HG3 . . . 8 . HB1 . . . . . 8 . HG# . . c17395_2l87 1 308 1 . . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HB3 H . . . . . 4.467 1.8 5.8071 . . . . . A . 8 PRO HD3 . . A . 8 PRO HB3 . . . 8 . HD1 . . . . . 8 . HB1 . . c17395_2l87 1 309 1 . . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HB2 H . . . . . 4.633 1.8 6.0229 . . . . . A . 8 PRO HD3 . . A . 8 PRO HB2 . . . 8 . HD1 . . . . . 8 . HB2 . . c17395_2l87 1 310 1 OR . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HG2 H . . . . . 2.924 1.8 3.8012 . . . . . A . 8 PRO HD3 . . A . 8 PRO HG2 . . . 8 . HD1 . . . . . 8 . HG# . . c17395_2l87 1 310 2 OR . 1 1 8 8 PRO HD3 H . . . 1 1 8 8 PRO HG3 H . . . . . 2.924 1.8 3.8012 . . . . . A . 8 PRO HD3 . . A . 8 PRO HG3 . . . 8 . HD1 . . . . . 8 . HG# . . c17395_2l87 1 311 1 . . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HB2 H . . . . . 4.645 1.8 6.0385 . . . . . A . 8 PRO HD2 . . A . 8 PRO HB2 . . . 8 . HD2 . . . . . 8 . HB2 . . c17395_2l87 1 312 1 OR . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HG2 H . . . . . 3.250 1.8 4.2250 . . . . . A . 8 PRO HD2 . . A . 8 PRO HG2 . . . 8 . HD2 . . . . . 8 . HG# . . c17395_2l87 1 312 2 OR . 1 1 8 8 PRO HD2 H . . . 1 1 8 8 PRO HG3 H . . . . . 3.250 1.8 4.2250 . . . . . A . 8 PRO HD2 . . A . 8 PRO HG3 . . . 8 . HD2 . . . . . 8 . HG# . . c17395_2l87 1 313 1 OR . 1 1 8 8 PRO HB2 H . . . 1 1 8 8 PRO HG2 H . . . . . 3.451 1.8 4.4863 . . . . . A . 8 PRO HB2 . . A . 8 PRO HG2 . . . 8 . HB2 . . . . . 8 . HG# . . c17395_2l87 1 313 2 OR . 1 1 8 8 PRO HB2 H . . . 1 1 8 8 PRO HG3 H . . . . . 3.451 1.8 4.4863 . . . . . A . 8 PRO HB2 . . A . 8 PRO HG3 . . . 8 . HB2 . . . . . 8 . HG# . . c17395_2l87 1 314 1 . . 1 1 8 8 PRO HD2 H . . . 1 1 9 9 ILE HA H . . . . . 3.932 1.8 5.1116 . . . . . A . 8 PRO HD2 . . A . 9 ILE HA . . . 8 . HD2 . . . . . 9 . HA . . c17395_2l87 1 315 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE HB H . . . . . 3.459 1.8 4.4967 . . . . . A . 9 ILE HA . . A . 9 ILE HB . . . 9 . HA . . . . . 9 . HB . . c17395_2l87 1 316 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE MD H . . . . . 3.924 1.8 5.1012 . . . . . A . 9 ILE HA . . A . 9 ILE MD . . . 9 . HA . . . . . 9 . HD1# . . c17395_2l87 1 317 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE HG13 H . . . . . 4.277 1.8 5.5601 . . . . . A . 9 ILE HA . . A . 9 ILE HG13 . . . 9 . HA . . . . . 9 . HG11 . . c17395_2l87 1 318 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE HG12 H . . . . . 4.132 1.8 5.3716 . . . . . A . 9 ILE HA . . A . 9 ILE HG12 . . . 9 . HA . . . . . 9 . HG12 . . c17395_2l87 1 319 1 . . 1 1 9 9 ILE HA H . . . 1 1 9 9 ILE MG H . . . . . 4.347 1.8 5.6511 . . . . . A . 9 ILE HA . . A . 9 ILE MG . . . 9 . HA . . . . . 9 . HG2# . . c17395_2l87 1 320 1 . . 1 1 12 12 ILE HG13 H . . . 1 1 9 9 ILE HB H . . . . . 3.251 1.8 4.2263 . . . . . A . 12 ILE HG13 . . A . 9 ILE HB . . . 12 . HG11 . . . . . 9 . HB . . c17395_2l87 1 321 1 . . 1 1 9 9 ILE HB H . . . 1 1 9 9 ILE MD H . . . . . 3.974 1.8 5.1662 . . . . . A . 9 ILE HB . . A . 9 ILE MD . . . 9 . HB . . . . . 9 . HD1# . . c17395_2l87 1 322 1 . . 1 1 9 9 ILE HB H . . . 1 1 9 9 ILE HG13 H . . . . . 3.660 1.8 4.7580 . . . . . A . 9 ILE HB . . A . 9 ILE HG13 . . . 9 . HB . . . . . 9 . HG11 . . c17395_2l87 1 323 1 . . 1 1 9 9 ILE HB H . . . 1 1 9 9 ILE MG H . . . . . 4.898 1.8 6.3674 . . . . . A . 9 ILE HB . . A . 9 ILE MG . . . 9 . HB . . . . . 9 . HG2# . . c17395_2l87 1 324 1 . . 1 1 9 9 ILE HG13 H . . . 1 1 9 9 ILE HG12 H . . . . . 3.036 1.8 3.9468 . . . . . A . 9 ILE HG13 . . A . 9 ILE HG12 . . . 9 . HG11 . . . . . 9 . HG12 . . c17395_2l87 1 325 1 . . 1 1 9 9 ILE HG13 H . . . 1 1 9 9 ILE MG H . . . . . 4.145 1.8 5.3885 . . . . . A . 9 ILE HG13 . . A . 9 ILE MG . . . 9 . HG11 . . . . . 9 . HG2# . . c17395_2l87 1 326 1 . . 1 1 9 9 ILE HG12 H . . . 1 1 9 9 ILE MG H . . . . . 4.241 1.8 5.5133 . . . . . A . 9 ILE HG12 . . A . 9 ILE MG . . . 9 . HG12 . . . . . 9 . HG2# . . c17395_2l87 1 327 1 . . 1 1 5 5 VAL HA H . . . 1 1 4 4 GLN HA H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 5 . HA . . . . . 4 . HA . . c17395_2l87 1 328 1 . . 1 1 4 4 GLN HA H . . . 1 1 5 5 VAL MG1 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 4 . HA . . . . . 5 . HG1 . . c17395_2l87 1 329 1 . . 1 1 5 5 VAL HA H . . . 1 1 6 6 SER HA H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 5 . HA . . . . . 6 . HA . . c17395_2l87 1 330 1 OR . 1 1 6 6 SER HA H . . . 1 1 4 4 GLN HG2 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 6 . HA . . . . . 4 . HG# . . c17395_2l87 1 330 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 6 6 SER HA H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 6 . HA . . c17395_2l87 1 331 1 OR . 1 1 5 5 VAL MG1 H . . . 1 1 6 6 SER HB2 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 5 . HG# . . . . . 6 . HB# . . c17395_2l87 1 331 2 OR . 1 1 5 5 VAL MG2 H . . . 1 1 6 6 SER HB2 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 5 . HG# . . . . . 6 . HB# . . c17395_2l87 1 331 3 OR . 1 1 6 6 SER HB3 H . . . 1 1 5 5 VAL MG2 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 6 . HB# . . . . . 5 . HG# . . c17395_2l87 1 331 4 OR . 1 1 6 6 SER HB3 H . . . 1 1 5 5 VAL MG1 H . . . . . 4.000 1.8 5.2000 . . . . . . . . . . . . . . . . . . . . 6 . HB# . . . . . 5 . HG# . . c17395_2l87 1 332 1 . . 1 1 8 8 PRO HA H . . . 1 1 9 9 ILE HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 8 PRO HA . . A . 9 ILE HA . . . 8 . HA . . . . . 9 . HA . . c17395_2l87 1 333 1 . . 1 1 10 10 TYS HA H . . . 1 1 9 9 ILE HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 10 TYS HA . . A . 9 ILE HA . . . 10 . HA . . . . . 9 . HA . . c17395_2l87 1 334 1 . . 1 1 11 11 ASP HA H . . . 1 1 9 9 ILE MD H . . . . . 5.000 1.8 6.5000 . . . . . A . 11 ASP HA . . A . 9 ILE MD . . . 11 . HA . . . . . 9 . HD1# . . c17395_2l87 1 335 1 . . 1 1 11 11 ASP HA H . . . 1 1 12 12 ILE HB H . . . . . 5.000 1.8 6.5000 . . . . . A . 11 ASP HA . . A . 12 ILE HB . . . 11 . HA . . . . . 12 . HB . . c17395_2l87 1 336 1 OR . 1 1 12 12 ILE HA H . . . 1 1 13 13 ASN HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 12 ILE HA . . A . 13 ASN HB2 . . . 12 . HA . . . . . 13 . HB# . . c17395_2l87 1 336 2 OR . 1 1 12 12 ILE HA H . . . 1 1 13 13 ASN HB3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 12 ILE HA . . A . 13 ASN HB3 . . . 12 . HA . . . . . 13 . HB# . . c17395_2l87 1 337 1 . . 1 1 13 13 ASN HA H . . . 1 1 14 14 TYS HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HA . . A . 14 TYS HA . . . 13 . HA . . . . . 14 . HA . . c17395_2l87 1 338 1 . . 1 1 12 12 ILE HA H . . . 1 1 13 13 ASN HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 12 ILE HA . . A . 13 ASN HA . . . 12 . HA . . . . . 13 . HA . . c17395_2l87 1 339 1 OR . 1 1 13 13 ASN HA H . . . 1 1 16 16 THR MG H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HA . . A . 16 THR MG . . . 13 . HA . . . . . 16 . HG# . . c17395_2l87 1 339 2 OR . 1 1 13 13 ASN HA H . . . 1 1 16 16 THR HG1 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HA . . A . 16 THR HG1 . . . 13 . HA . . . . . 16 . HG# . . c17395_2l87 1 340 1 OR . 1 1 14 14 TYS HA H . . . 1 1 16 16 THR MG H . . . . . 4.000 1.8 5.2000 . . . . . A . 14 TYS HA . . A . 16 THR MG . . . 14 . HA . . . . . 16 . HG# . . c17395_2l87 1 340 2 OR . 1 1 14 14 TYS HA H . . . 1 1 16 16 THR HG1 H . . . . . 4.000 1.8 5.2000 . . . . . A . 14 TYS HA . . A . 16 THR HG1 . . . 14 . HA . . . . . 16 . HG# . . c17395_2l87 1 341 1 OR . 1 1 13 13 ASN HB2 H . . . 1 1 14 14 TYS HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB2 . . A . 14 TYS HB2 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 341 2 OR . 1 1 13 13 ASN HB3 H . . . 1 1 14 14 TYS HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB3 . . A . 14 TYS HB2 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 341 3 OR . 1 1 14 14 TYS HB3 H . . . 1 1 13 13 ASN HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 14 TYS HB3 . . A . 13 ASN HB2 . . . 14 . HB# . . . . . 13 . HB# . . c17395_2l87 1 341 4 OR . 1 1 13 13 ASN HB3 H . . . 1 1 14 14 TYS HB3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB3 . . A . 14 TYS HB3 . . . 13 . HB# . . . . . 14 . HB# . . c17395_2l87 1 342 1 OR . 1 1 13 13 ASN HB3 H . . . 1 1 15 15 TYR HB3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB3 . . A . 15 TYR HB3 . . . 13 . HB# . . . . . 15 . HB# . . c17395_2l87 1 342 2 OR . 1 1 13 13 ASN HB2 H . . . 1 1 15 15 TYR HB3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB2 . . A . 15 TYR HB3 . . . 13 . HB# . . . . . 15 . HB# . . c17395_2l87 1 342 3 OR . 1 1 15 15 TYR HB2 H . . . 1 1 13 13 ASN HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 15 TYR HB2 . . A . 13 ASN HB2 . . . 15 . HB# . . . . . 13 . HB# . . c17395_2l87 1 342 4 OR . 1 1 13 13 ASN HB3 H . . . 1 1 15 15 TYR HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 13 ASN HB3 . . A . 15 TYR HB2 . . . 13 . HB# . . . . . 15 . HB# . . c17395_2l87 1 343 1 OR . 1 1 15 15 TYR HA H . . . 1 1 19 19 PRO HD3 H . . . . . 5.000 1.8 6.5000 . . . . . A . 15 TYR HA . . A . 19 PRO HD3 . . . 15 . HA . . . . . 19 . HD# . . c17395_2l87 1 343 2 OR . 1 1 15 15 TYR HA H . . . 1 1 19 19 PRO HD2 H . . . . . 5.000 1.8 6.5000 . . . . . A . 15 TYR HA . . A . 19 PRO HD2 . . . 15 . HA . . . . . 19 . HD# . . c17395_2l87 1 344 1 . . 1 1 14 14 TYS HA H . . . 1 1 16 16 THR HB H . . . . . 4.000 1.8 5.2000 . . . . . A . 14 TYS HA . . A . 16 THR HB . . . 14 . HA . . . . . 16 . HB . . c17395_2l87 1 345 1 . . 1 1 15 15 TYR HA H . . . 1 1 16 16 THR HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 15 TYR HA . . A . 16 THR HA . . . 15 . HA . . . . . 16 . HA . . c17395_2l87 1 346 1 OR . 1 1 16 16 THR HA H . . . 1 1 17 17 SER HB2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 16 THR HA . . A . 17 SER HB2 . . . 16 . HA . . . . . 17 . HB# . . c17395_2l87 1 346 2 OR . 1 1 16 16 THR HA H . . . 1 1 17 17 SER HB3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 16 THR HA . . A . 17 SER HB3 . . . 16 . HA . . . . . 17 . HB# . . c17395_2l87 1 347 1 . . 1 1 17 17 SER HA H . . . 1 1 18 18 GLU HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 17 SER HA . . A . 18 GLU HA . . . 17 . HA . . . . . 18 . HA . . c17395_2l87 1 348 1 . . 1 1 16 16 THR HA H . . . 1 1 17 17 SER HA H . . . . . 4.000 1.8 5.2000 . . . . . A . 16 THR HA . . A . 17 SER HA . . . 16 . HA . . . . . 17 . HA . . c17395_2l87 1 349 1 OR . 1 1 20 20 ALA HA H . . . 1 1 21 21 GLN HG2 H . . . . . 4.000 1.8 5.2000 . . . . . A . 20 ALA HA . . A . 21 GLN HG2 . . . 20 . HA . . . . . 21 . HG# . . c17395_2l87 1 349 2 OR . 1 1 20 20 ALA HA H . . . 1 1 21 21 GLN HG3 H . . . . . 4.000 1.8 5.2000 . . . . . A . 20 ALA HA . . A . 21 GLN HG3 . . . 20 . HA . . . . . 21 . HG# . . c17395_2l87 1 350 1 OR . 1 1 4 4 GLN HA H . . . 1 1 5 5 VAL MG1 H . . . . . 3.647 1.8 4.7410 . . . . . . . . . . . . . . . . . . . . 4 . HA . . . . . 5 . HG## . . c17395_2l87 1 350 2 OR . 1 1 4 4 GLN HA H . . . 1 1 5 5 VAL MG2 H . . . . . 3.647 1.8 4.7410 . . . . . . . . . . . . . . . . . . . . 4 . HA . . . . . 5 . HG## . . c17395_2l87 1 351 1 OR . 1 1 4 4 GLN HG3 H . . . 1 1 6 6 SER HB2 H . . . . . 4.046 1.8 5.2600 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 6 . HB# . . c17395_2l87 1 351 2 OR . 1 1 4 4 GLN HG2 H . . . 1 1 6 6 SER HB2 H . . . . . 4.046 1.8 5.2600 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 6 . HB# . . c17395_2l87 1 351 3 OR . 1 1 6 6 SER HB3 H . . . 1 1 4 4 GLN HG2 H . . . . . 4.046 1.8 5.2600 . . . . . . . . . . . . . . . . . . . . 6 . HB# . . . . . 4 . HG# . . c17395_2l87 1 351 4 OR . 1 1 4 4 GLN HG3 H . . . 1 1 6 6 SER HB3 H . . . . . 4.046 1.8 5.2600 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 6 . HB# . . c17395_2l87 1 352 1 OR . 1 1 5 5 VAL MG1 H . . . 1 1 4 4 GLN HG2 H . . . . . 4.186 1.8 5.4420 . . . . . . . . . . . . . . . . . . . . 5 . HG## . . . . . 4 . HG# . . c17395_2l87 1 352 2 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL MG1 H . . . . . 4.186 1.8 5.4420 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 1 352 3 OR . 1 1 4 4 GLN HG2 H . . . 1 1 5 5 VAL MG2 H . . . . . 4.186 1.8 5.4420 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 1 352 4 OR . 1 1 4 4 GLN HG3 H . . . 1 1 5 5 VAL MG2 H . . . . . 4.186 1.8 5.4420 . . . . . . . . . . . . . . . . . . . . 4 . HG# . . . . . 5 . HG## . . c17395_2l87 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 noesy_T1r_19_03_09_LR_NNN.346 1 74 1 105 c17395_2l87 1 2 noesy_T1r_19_03_09_LR_NNN.192 2 73 2 104 c17395_2l87 1 3 noesy_T1r_19_03_09_LR_NNN.162 3 73 3 104 c17395_2l87 1 4 noesy_T1r_19_03_09_LR_NNN.308 4 73 4 104 c17395_2l87 1 5 noesy_T1r_19_03_09_LR_NNN.316 5 75 5 106 c17395_2l87 1 6 noesy_T1r_19_03_09_LR_NNN.186 6 74 6 105 c17395_2l87 1 7 noesy_T1r_19_03_09_LR_NNN.124 7 74 7 105 c17395_2l87 1 8 noesy_T1r_19_03_09_LR_NNN.171 8 74 8 105 c17395_2l87 1 9 noesy_T1r_19_03_09_LR_NNN.505 9 75 9 106 c17395_2l87 1 10 noesy_T1r_19_03_09_LR_NNN.309 10 75 10 106 c17395_2l87 1 11 noesy_T1r_19_03_09_LR_NNN.320 11 75 11 106 c17395_2l87 1 12 noesy_T1r_19_03_09_LR_NNN.194 12 74 12 105 c17395_2l87 1 13 noesy_T1r_19_03_09_LR_NNN.558 13 74 13 105 c17395_2l87 1 14 noesy_T1r_19_03_09_LR_NNN.556 14 74 14 105 c17395_2l87 1 15 noesy_T1r_19_03_09_LR_NNN.394 15 73 15 104 c17395_2l87 1 16 noesy_T1r_19_03_09_LR_NNN.119 16 69 16 100 c17395_2l87 1 17 noesy_T1r_19_03_09_LR_NNN.127 17 74 17 105 c17395_2l87 1 18 noesy_T1r_19_03_09_LR_NNN.172 18 74 18 105 c17395_2l87 1 19 noesy_T1r_19_03_09_LR_NNN.27 19 74 19 104 c17395_2l87 1 20 noesy_T1r_19_03_09_LR_NNN.342 20 73 20 104 c17395_2l87 1 21 noesy_T1r_19_03_09_LR_NNN.210 21 74 21 105 c17395_2l87 1 22 noesy_T1r_19_03_09_LR_NNN.195 22 74 22 105 c17395_2l87 1 23 noesy_T1r_19_03_09_LR_NNN.512 23 71 23 102 c17395_2l87 1 24 noesy_T1r_19_03_09_LR_NNN.129 24 74 24 105 c17395_2l87 1 25 noesy_T1r_19_03_09_LR_NNN.174 25 74 25 105 c17395_2l87 1 26 noesy_T1r_19_03_09_LR_NNN.170 26 73 26 104 c17395_2l87 1 27 noesy_T1r_19_03_09_LR_NNN.26 27 73 27 103 c17395_2l87 1 28 noesy_T1r_19_03_09_LR_NNN.232 28 73 28 104 c17395_2l87 1 29 noesy_T1r_19_03_09_LR_NNN.431 29 73 29 104 c17395_2l87 1 30 noesy_T1r_19_03_09_LR_NNN.29 30 73 30 103 c17395_2l87 1 31 noesy_T1r_19_03_09_LR_NNN.489 31 76 31 107 c17395_2l87 1 32 noesy_T1r_19_03_09_LR_NNN.549 32 77 32 108 c17395_2l87 1 33 noesy_T1r_19_03_09_LR_NNN.33 33 75 33 105 c17395_2l87 1 34 noesy_T1r_19_03_09_LR_NNN.345 34 76 34 107 c17395_2l87 1 35 noesy_T1r_19_03_09_LR_NNN.330 35 74 35 105 c17395_2l87 1 36 noesy_T1r_19_03_09_LR_NNN.333 36 76 36 107 c17395_2l87 1 37 noesy_T1r_19_03_09_LR_NNN.463 37 75 37 106 c17395_2l87 1 38 noesy_T1r_19_03_09_LR_NNN.31 38 75 38 105 c17395_2l87 1 39 noesy_T1r_19_03_09_LR_NNN.228 39 75 39 106 c17395_2l87 1 40 noesy_T1r_19_03_09_LR_NNN.464 40 75 40 106 c17395_2l87 1 41 noesy_T1r_19_03_09_LR_NNN.32 41 75 41 105 c17395_2l87 1 42 noesy_T1r_19_03_09_LR_NNN.482 42 77 42 108 c17395_2l87 1 43 noesy_T1r_19_03_09_LR_NNN.389 43 73 43 104 c17395_2l87 1 44 noesy_T1r_19_03_09_LR_NNN.383 44 73 44 104 c17395_2l87 1 45 noesy_T1r_19_03_09_LR_NNN.555 45 75 45 106 c17395_2l87 1 46 noesy_T1r_19_03_09_LR_NNN.24 46 73 46 103 c17395_2l87 1 47 noesy_T1r_19_03_09_LR_NNN.357 47 74 47 105 c17395_2l87 1 48 noesy_T1r_19_03_09_LR_NNN.205 48 73 48 104 c17395_2l87 1 49 noesy_T1r_19_03_09_LR_NNN.272 49 73 49 104 c17395_2l87 1 50 noesy_T1r_19_03_09_LR_NNN.140 50 73 50 105 c17395_2l87 1 51 noesy_T1r_19_03_09_LR_NNN.547 51 76 51 107 c17395_2l87 1 52 noesy_T1r_19_03_09_LR_NNN.361 52 76 52 107 c17395_2l87 1 53 noesy_T1r_19_03_09_LR_NNN.28 53 74 53 104 c17395_2l87 1 54 noesy_T1r_19_03_09_LR_NNN.343 54 75 54 106 c17395_2l87 1 55 noesy_T1r_19_03_09_LR_NNN.211 55 74 55 105 c17395_2l87 1 56 noesy_T1r_19_03_09_LR_NNN.336 56 75 56 106 c17395_2l87 1 57 noesy_T1r_19_03_09_LR_NNN.367 57 75 57 107 c17395_2l87 1 58 noesy_T1r_19_03_09_LR_NNN.576 58 75 58 106 c17395_2l87 1 59 noesy_T1r_19_03_09_LR_NNN.564 59 73 59 104 c17395_2l87 1 60 noesy_T1r_19_03_09_LR_NNN.25 60 73 60 103 c17395_2l87 1 61 noesy_T1r_19_03_09_LR_NNN.359 61 74 61 105 c17395_2l87 1 62 noesy_T1r_19_03_09_LR_NNN.206 62 73 62 104 c17395_2l87 1 63 noesy_T1r_19_03_09_LR_NNN.352 63 72 63 103 c17395_2l87 1 64 noesy_T1r_19_03_09_LR_NNN.231 64 71 64 102 c17395_2l87 1 65 noesy_T1r_19_03_09_LR_NNN.274 65 73 65 104 c17395_2l87 1 66 noesy_T1r_19_03_09_LR_NNN.437 66 74 66 105 c17395_2l87 1 67 noesy_T1r_19_03_09_LR_NNN.340 67 75 67 106 c17395_2l87 1 68 noesy_T1r_19_03_09_LR_NNN.324 68 75 68 106 c17395_2l87 1 69 noesy_T1r_19_03_09_LR_NNN.207 69 74 69 105 c17395_2l87 1 70 noesy_T1r_19_03_09_LR_NNN.438 70 74 70 105 c17395_2l87 1 71 noesy_T1r_19_03_09_LR_NNN.341 71 75 71 106 c17395_2l87 1 72 noesy_T1r_19_03_09_LR_NNN.325 72 75 72 106 c17395_2l87 1 73 noesy_T1r_19_03_09_LR_NNN.208 73 74 73 105 c17395_2l87 1 74 noesy_T1r_19_03_09_LR_NNN.395 74 71 74 102 c17395_2l87 1 75 noesy_T1r_19_03_09_LR_NNN.559 75 74 75 105 c17395_2l87 1 76 noesy_T1r_19_03_09_LR_NNN.561 76 74 76 105 c17395_2l87 1 77 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noesy_T1r_22_07_09_no2_newZnew.44 327 70 327 105 c17395_2l87 1 328 noesy_T1r_22_07_09_no2_newZnew.96 328 72 328 108 c17395_2l87 1 329 noesy_T1r_22_07_09_no2_newZnew.28 329 73 329 108 c17395_2l87 1 330 noesy_T1r_22_07_09_no2_newZnew.60 330 71 330 106 c17395_2l87 1 331 noesy_T1r_22_07_09_no2_newZnew.2 331 72 331 107 c17395_2l87 1 332 noesy_T1r_22_07_09_no2_newZnew.120 332 73 332 110 c17395_2l87 1 333 noesy_T1r_22_07_09_no2_newZnew.48 333 72 333 107 c17395_2l87 1 334 noesy_T1r_22_07_09_no2_newZnew.46 334 72 334 107 c17395_2l87 1 335 noesy_T1r_22_07_09_no2_newZnew.37 335 72 335 107 c17395_2l87 1 336 noesy_T1r_22_07_09_no2_newZnew.47 336 70 336 105 c17395_2l87 1 337 noesy_T1r_22_07_09_no2_newZnew.87 337 71 337 106 c17395_2l87 1 338 noesy_T1r_22_07_09_no2_newZnew.88 338 73 338 108 c17395_2l87 1 339 noesy_T1r_22_07_09_no2_newZnew.142 339 73 339 109 c17395_2l87 1 340 noesy_T1r_22_07_09_no2_newZnew.143 340 73 340 109 c17395_2l87 1 341 noesy_T1r_22_07_09_no2_newZnew.11 341 73 341 108 c17395_2l87 1 342 noesy_T1r_22_07_09_no2_newZnew.144 342 73 342 109 c17395_2l87 1 343 noesy_T1r_22_07_09_no2_newZnew.13 343 71 343 106 c17395_2l87 1 344 noesy_T1r_22_07_09_no2_newZnew.86 344 73 344 108 c17395_2l87 1 345 noesy_T1r_22_07_09_no2_newZnew.54 345 72 345 108 c17395_2l87 1 346 noesy_T1r_22_07_09_no2_newZnew.17 346 71 346 106 c17395_2l87 1 347 noesy_T1r_22_07_09_no2_newZnew.35 347 73 347 108 c17395_2l87 1 348 noesy_T1r_22_07_09_no2_newZnew.111 348 73 348 109 c17395_2l87 1 349 noesy_T1r_22_07_09_no2_newZnew.33 349 73 349 108 c17395_2l87 1 350 noesy_T1r_22_07_09_no2_newZnew.34 350 73 350 108 c17395_2l87 1 351 noesy_T1r_22_07_09_no2_newZnew.81 351 74 351 110 c17395_2l87 1 352 noesy_T1r_22_07_09_no2_newZnew.64 352 73 352 108 c17395_2l87 1 353 noesy_T1r_22_07_09_no2_newZnew.79 353 71 353 106 c17395_2l87 1 354 noesy_T1r_22_07_09_no2_newZnew.63 354 73 354 108 c17395_2l87 1 355 noesy_T1r_22_07_09_no2_newZnew.75 355 75 355 110 c17395_2l87 1 356 noesy_T1r_22_07_09_no2_newZnew.74 356 75 356 110 c17395_2l87 1 357 noesy_T1r_22_07_09_no2_newZnew.67 357 75 357 110 c17395_2l87 1 358 ! 362 66 362 69 c17395_2l87 1 359 noesy_T1r_14_10_09_LR.162 381 72 381 101 c17395_2l87 1 360 noesy_T1r_14_10_09_LR.182 382 72 382 101 c17395_2l87 1 361 noesy_T1r_14_10_09_LR.185 383 73 383 102 c17395_2l87 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) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 2 2 4 1 "Not handling restraint 4, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 3 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 4 2 10 1 "Not handling restraint 10, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 5 2 11 1 "Not handling restraint 11, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 6 2 13 1 "Not handling restraint 13, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 7 2 14 1 "Not handling restraint 14, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 8 2 20 1 "Not handling restraint 20, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 9 2 34 1 "Not handling restraint 34, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 10 2 35 1 "Not handling restraint 35, item 1, resonance(s) ' .14.HE#' (nmrStar names) not linked" c17395_2l87 1 11 2 47 1 "Not handling restraint 47, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 12 2 54 1 "Not handling restraint 54, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 13 2 54 1 "Not handling restraint 54, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 14 2 61 1 "Not handling restraint 61, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 15 2 67 1 "Not handling restraint 67, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 16 2 68 1 "Not handling restraint 68, item 1, resonance(s) ' .14.HE#' (nmrStar names) not linked" c17395_2l87 1 17 2 71 1 "Not handling restraint 71, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 18 2 72 1 "Not handling restraint 72, item 1, resonance(s) ' .14.HE#' (nmrStar names) not linked" c17395_2l87 1 19 2 74 1 "Not handling restraint 74, item 1, resonance(s) ' .14.HD#' (nmrStar names),' .14.HE#' (nmrStar names) not linked" c17395_2l87 1 20 2 75 1 "Not handling restraint 75, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 21 2 76 1 "Not handling restraint 76, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 22 2 78 1 "Not handling restraint 78, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 23 2 79 1 "Not handling restraint 79, item 1, resonance(s) ' .14.HE#' (nmrStar names) not linked" c17395_2l87 1 24 2 98 1 "Not handling restraint 98, item 1, resonance(s) ' .14.HD#' (nmrStar names) not linked" c17395_2l87 1 25 2 200 1 "Not handling restraint 200, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 26 2 201 1 "Not handling restraint 201, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 27 2 209 1 "Not handling restraint 209, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 28 2 209 1 "Not handling restraint 209, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 29 2 210 1 "Not handling restraint 210, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 30 2 210 1 "Not handling restraint 210, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 31 2 223 1 "Not handling restraint 223, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 32 2 224 1 "Not handling restraint 224, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 1 33 2 238 1 "Not handling restraint 238, item 1, resonance(s) ' .10.HD#' (nmrStar names) not linked" c17395_2l87 1 34 2 239 1 "Not handling restraint 239, item 1, resonance(s) ' .10.HE#' (nmrStar names) not linked" c17395_2l87 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 c17395_2l87 _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 SIGNALING PROTEIN 06-JAN-11 2L87 *TITLE THE 27-RESIDUE N-TERMINUS CCR5-PEPTIDE IN A TERNARY COMPLEX WITH HIV-1 *TITLE 2 GP120 AND A CD4-MIMIC PEPTIDE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: C-C CHEMOKINE RECEPTOR TYPE 5; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: N-TERMINAL DOMAIN, RESIDUES 1-27; *COMPND 5 SYNONYM: CCR5, C-C CKR-5, CC-CKR-5, CCR5, CHEMR13, HIV-1 FUSION *COMPND 6 CORECEPTOR; *COMPND 7 ENGINEERED: YES; *COMPND 8 MUTATION: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606; *SOURCE 6 OTHER_DETAILS: CHEMICAL SYNTHESIS *KEYWDS HELIX, HIV CO-RECEPTOR, SIGNALING PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR E.SCHNUR, E.NOAH, I.AYZENSHTAT, H.SARGSYAN, T.INUI, F.X.DING, *AUTHOR 2 B.ARSHAVA, Y.SAGI, N.KESSLER, R.LEVY, T.SCHERF, F.NAIDER, *AUTHOR 3 J.ANGLISTER *REVDAT 1 27-JUL-11 2L87 0 ; save_