data_18047 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18047 _Entry.Title ; NMR structure of the protein NP_814968.1 from Enterococcus faecalis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-11-08 _Entry.Accession_date 2011-11-08 _Entry.Last_release_date 2011-11-28 _Entry.Original_release_date 2011-11-28 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Details . _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 Lukas Susac . . . 18047 2 Pedro Serrano . . . 18047 3 Michael Geralt . . . 18047 4 Biswarajan Mohanty . . . 18047 5 JCSG JCSG . . . 18047 6 Kurt Wuthrich . . . 18047 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 'PSI, Protein Structure Initiative' 'Joint Center for Structural Genomics' . 18047 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Gut microbiome secreted protein' . 18047 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18047 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 484 18047 '15N chemical shifts' 147 18047 '1H chemical shifts' 986 18047 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-11-28 2011-11-08 original author . 18047 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LLG 'BMRB Entry Tracking System' 18047 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18047 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR structure of the protein NP_814968.1 from Enterococcus faecalis' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lukas Susac . . . 18047 1 2 Pedro Serrano . . . 18047 1 3 Michael Geralt . . . 18047 1 4 Biswarajan Mohanty . . . 18047 1 5 Kurt Wuthrich . . . 18047 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18047 _Assembly.ID 1 _Assembly.Name NP_814968.1 _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 NP_814968.1 1 $NP_814968.1 A . yes native no no . . . 18047 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NP_814968.1 _Entity.Sf_category entity _Entity.Sf_framecode NP_814968.1 _Entity.Entry_ID 18047 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NP_814968.1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MDEVLATSIGTYENRTLLVP DGRLALTALHKGKDYQGKPM FYVLFELTNTTEKTQNIQLM IQSFMEVSQTVHGKAQNLQY AVLTDSPFQDKLDRLADEIN PGETIQGAYPYEFINENKPV HFKFRDRLLSLDEPIASEEI TIT ; _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 no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 143 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16330.557 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _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 1 no PDB 2LLG . "Nmr Structure Of The Protein Np_814968.1 From Enterococcus Faecalis" . . . . . 100.00 143 100.00 100.00 7.53e-100 . . . . 18047 1 2 no EMBL CBL31422 . "hypothetical protein ENT_06730 [Enterococcus sp. 7L76]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 3 no EMBL CCO72142 . "conserved hypothetical protein [Enterococcus faecalis str. Symbioflor 1]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 4 no EMBL CPW23431 . "Uncharacterised protein [Mycobacterium abscessus]" . . . . . 99.30 183 100.00 100.00 2.65e-99 . . . . 18047 1 5 no EMBL CRH64002 . "Uncharacterised protein [Chlamydia trachomatis]" . . . . . 99.30 183 100.00 100.00 2.65e-99 . . . . 18047 1 6 no GB AAO81038 . "hypothetical protein EF_1241 [Enterococcus faecalis V583]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 7 no GB ADX79912 . "hypothetical protein EF62_1685 [Enterococcus faecalis 62]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 8 no GB AEA93699 . "hypothetical protein OG1RF_11012 [Enterococcus faecalis OG1RF]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 9 no GB AFO43932 . "hypothetical protein EFD32_1042 [Enterococcus faecalis D32]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 10 no GB AHI40381 . "Hypothetical protein DENG_01387 [Enterococcus faecalis DENG1]" . . . . . 99.30 176 99.30 100.00 5.66e-99 . . . . 18047 1 11 no REF NP_814968 . "hypothetical protein EF1241 [Enterococcus faecalis V583]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 12 no REF WP_002384665 . "MULTISPECIES: hypothetical protein [Enterococcus]" . . . . . 99.30 176 100.00 100.00 1.21e-99 . . . . 18047 1 13 no REF WP_002395822 . "hypothetical protein [Enterococcus faecalis]" . . . . . 99.30 176 100.00 100.00 1.54e-99 . . . . 18047 1 14 no REF WP_002397838 . "hypothetical protein [Enterococcus faecalis]" . . . . . 99.30 176 100.00 100.00 1.20e-99 . . . . 18047 1 15 no REF WP_002419155 . "hypothetical protein [Enterococcus faecalis]" . . . . . 99.30 176 99.30 99.30 7.85e-99 . . . . 18047 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 . 18047 1 2 . ASP . 18047 1 3 . GLU . 18047 1 4 . VAL . 18047 1 5 . LEU . 18047 1 6 . ALA . 18047 1 7 . THR . 18047 1 8 . SER . 18047 1 9 . ILE . 18047 1 10 . GLY . 18047 1 11 . THR . 18047 1 12 . TYR . 18047 1 13 . GLU . 18047 1 14 . ASN . 18047 1 15 . ARG . 18047 1 16 . THR . 18047 1 17 . LEU . 18047 1 18 . LEU . 18047 1 19 . VAL . 18047 1 20 . PRO . 18047 1 21 . ASP . 18047 1 22 . GLY . 18047 1 23 . ARG . 18047 1 24 . LEU . 18047 1 25 . ALA . 18047 1 26 . LEU . 18047 1 27 . THR . 18047 1 28 . ALA . 18047 1 29 . LEU . 18047 1 30 . HIS . 18047 1 31 . LYS . 18047 1 32 . GLY . 18047 1 33 . LYS . 18047 1 34 . ASP . 18047 1 35 . TYR . 18047 1 36 . GLN . 18047 1 37 . GLY . 18047 1 38 . LYS . 18047 1 39 . PRO . 18047 1 40 . MET . 18047 1 41 . PHE . 18047 1 42 . TYR . 18047 1 43 . VAL . 18047 1 44 . LEU . 18047 1 45 . PHE . 18047 1 46 . GLU . 18047 1 47 . LEU . 18047 1 48 . THR . 18047 1 49 . ASN . 18047 1 50 . THR . 18047 1 51 . THR . 18047 1 52 . GLU . 18047 1 53 . LYS . 18047 1 54 . THR . 18047 1 55 . GLN . 18047 1 56 . ASN . 18047 1 57 . ILE . 18047 1 58 . GLN . 18047 1 59 . LEU . 18047 1 60 . MET . 18047 1 61 . ILE . 18047 1 62 . GLN . 18047 1 63 . SER . 18047 1 64 . PHE . 18047 1 65 . MET . 18047 1 66 . GLU . 18047 1 67 . VAL . 18047 1 68 . SER . 18047 1 69 . GLN . 18047 1 70 . THR . 18047 1 71 . VAL . 18047 1 72 . HIS . 18047 1 73 . GLY . 18047 1 74 . LYS . 18047 1 75 . ALA . 18047 1 76 . GLN . 18047 1 77 . ASN . 18047 1 78 . LEU . 18047 1 79 . GLN . 18047 1 80 . TYR . 18047 1 81 . ALA . 18047 1 82 . VAL . 18047 1 83 . LEU . 18047 1 84 . THR . 18047 1 85 . ASP . 18047 1 86 . SER . 18047 1 87 . PRO . 18047 1 88 . PHE . 18047 1 89 . GLN . 18047 1 90 . ASP . 18047 1 91 . LYS . 18047 1 92 . LEU . 18047 1 93 . ASP . 18047 1 94 . ARG . 18047 1 95 . LEU . 18047 1 96 . ALA . 18047 1 97 . ASP . 18047 1 98 . GLU . 18047 1 99 . ILE . 18047 1 100 . ASN . 18047 1 101 . PRO . 18047 1 102 . GLY . 18047 1 103 . GLU . 18047 1 104 . THR . 18047 1 105 . ILE . 18047 1 106 . GLN . 18047 1 107 . GLY . 18047 1 108 . ALA . 18047 1 109 . TYR . 18047 1 110 . PRO . 18047 1 111 . TYR . 18047 1 112 . GLU . 18047 1 113 . PHE . 18047 1 114 . ILE . 18047 1 115 . ASN . 18047 1 116 . GLU . 18047 1 117 . ASN . 18047 1 118 . LYS . 18047 1 119 . PRO . 18047 1 120 . VAL . 18047 1 121 . HIS . 18047 1 122 . PHE . 18047 1 123 . LYS . 18047 1 124 . PHE . 18047 1 125 . ARG . 18047 1 126 . ASP . 18047 1 127 . ARG . 18047 1 128 . LEU . 18047 1 129 . LEU . 18047 1 130 . SER . 18047 1 131 . LEU . 18047 1 132 . ASP . 18047 1 133 . GLU . 18047 1 134 . PRO . 18047 1 135 . ILE . 18047 1 136 . ALA . 18047 1 137 . SER . 18047 1 138 . GLU . 18047 1 139 . GLU . 18047 1 140 . ILE . 18047 1 141 . THR . 18047 1 142 . ILE . 18047 1 143 . THR . 18047 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 18047 1 . ASP 2 2 18047 1 . GLU 3 3 18047 1 . VAL 4 4 18047 1 . LEU 5 5 18047 1 . ALA 6 6 18047 1 . THR 7 7 18047 1 . SER 8 8 18047 1 . ILE 9 9 18047 1 . GLY 10 10 18047 1 . THR 11 11 18047 1 . TYR 12 12 18047 1 . GLU 13 13 18047 1 . ASN 14 14 18047 1 . ARG 15 15 18047 1 . THR 16 16 18047 1 . LEU 17 17 18047 1 . LEU 18 18 18047 1 . VAL 19 19 18047 1 . PRO 20 20 18047 1 . ASP 21 21 18047 1 . GLY 22 22 18047 1 . ARG 23 23 18047 1 . LEU 24 24 18047 1 . ALA 25 25 18047 1 . LEU 26 26 18047 1 . THR 27 27 18047 1 . ALA 28 28 18047 1 . LEU 29 29 18047 1 . HIS 30 30 18047 1 . LYS 31 31 18047 1 . GLY 32 32 18047 1 . LYS 33 33 18047 1 . ASP 34 34 18047 1 . TYR 35 35 18047 1 . GLN 36 36 18047 1 . GLY 37 37 18047 1 . LYS 38 38 18047 1 . PRO 39 39 18047 1 . MET 40 40 18047 1 . PHE 41 41 18047 1 . TYR 42 42 18047 1 . VAL 43 43 18047 1 . LEU 44 44 18047 1 . PHE 45 45 18047 1 . GLU 46 46 18047 1 . LEU 47 47 18047 1 . THR 48 48 18047 1 . ASN 49 49 18047 1 . THR 50 50 18047 1 . THR 51 51 18047 1 . GLU 52 52 18047 1 . LYS 53 53 18047 1 . THR 54 54 18047 1 . GLN 55 55 18047 1 . ASN 56 56 18047 1 . ILE 57 57 18047 1 . GLN 58 58 18047 1 . LEU 59 59 18047 1 . MET 60 60 18047 1 . ILE 61 61 18047 1 . GLN 62 62 18047 1 . SER 63 63 18047 1 . PHE 64 64 18047 1 . MET 65 65 18047 1 . GLU 66 66 18047 1 . VAL 67 67 18047 1 . SER 68 68 18047 1 . GLN 69 69 18047 1 . THR 70 70 18047 1 . VAL 71 71 18047 1 . HIS 72 72 18047 1 . GLY 73 73 18047 1 . LYS 74 74 18047 1 . ALA 75 75 18047 1 . GLN 76 76 18047 1 . ASN 77 77 18047 1 . LEU 78 78 18047 1 . GLN 79 79 18047 1 . TYR 80 80 18047 1 . ALA 81 81 18047 1 . VAL 82 82 18047 1 . LEU 83 83 18047 1 . THR 84 84 18047 1 . ASP 85 85 18047 1 . SER 86 86 18047 1 . PRO 87 87 18047 1 . PHE 88 88 18047 1 . GLN 89 89 18047 1 . ASP 90 90 18047 1 . LYS 91 91 18047 1 . LEU 92 92 18047 1 . ASP 93 93 18047 1 . ARG 94 94 18047 1 . LEU 95 95 18047 1 . ALA 96 96 18047 1 . ASP 97 97 18047 1 . GLU 98 98 18047 1 . ILE 99 99 18047 1 . ASN 100 100 18047 1 . PRO 101 101 18047 1 . GLY 102 102 18047 1 . GLU 103 103 18047 1 . THR 104 104 18047 1 . ILE 105 105 18047 1 . GLN 106 106 18047 1 . GLY 107 107 18047 1 . ALA 108 108 18047 1 . TYR 109 109 18047 1 . PRO 110 110 18047 1 . TYR 111 111 18047 1 . GLU 112 112 18047 1 . PHE 113 113 18047 1 . ILE 114 114 18047 1 . ASN 115 115 18047 1 . GLU 116 116 18047 1 . ASN 117 117 18047 1 . LYS 118 118 18047 1 . PRO 119 119 18047 1 . VAL 120 120 18047 1 . HIS 121 121 18047 1 . PHE 122 122 18047 1 . LYS 123 123 18047 1 . PHE 124 124 18047 1 . ARG 125 125 18047 1 . ASP 126 126 18047 1 . ARG 127 127 18047 1 . LEU 128 128 18047 1 . LEU 129 129 18047 1 . SER 130 130 18047 1 . LEU 131 131 18047 1 . ASP 132 132 18047 1 . GLU 133 133 18047 1 . PRO 134 134 18047 1 . ILE 135 135 18047 1 . ALA 136 136 18047 1 . SER 137 137 18047 1 . GLU 138 138 18047 1 . GLU 139 139 18047 1 . ILE 140 140 18047 1 . THR 141 141 18047 1 . ILE 142 142 18047 1 . THR 143 143 18047 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 18047 _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 $NP_814968.1 . 1351 organism . 'Enterococcus faecalis' 'Enterococcus faecalis' . . Bacteria . Enterococcus faecalis . V583 . . . . . . . . . . . . . . . . . . . 18047 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 18047 _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 $NP_814968.1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pSpeedET . . . . . . 18047 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18047 _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 NP_814968.1 '[U-95% 13C; U-95% 15N]' . . 1 $NP_814968.1 . . 1.2 . . mM . . . . 18047 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 18047 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18047 1 4 'sodium azide' 'natural abundance' . . . . . . 5 . . mM . . . . 18047 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 18047 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 18047 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18047 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.083 . M 18047 1 pH 6.0 . pH 18047 1 pressure 1 . atm 18047 1 temperature 298 . K 18047 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18047 _Software.ID 1 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'G??ntert P.' . . 18047 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18047 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18047 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18047 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 18047 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 18047 1 2 spectrometer_2 Bruker Avance . 800 . . . 18047 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 18047 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18047 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18047 1 3 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18047 1 4 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18047 1 5 '4D APSY HACANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18047 1 6 '5D APSY CBCACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18047 1 7 '5D APSY HACACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18047 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18047 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18047 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18047 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18047 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 18047 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _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-15N HSQC' . . . 18047 1 2 '3D 1H-15N NOESY' . . . 18047 1 3 '3D 1H-13C NOESY aliphatic' . . . 18047 1 4 '3D 1H-13C NOESY aromatic' . . . 18047 1 5 '4D APSY HACANH' . . . 18047 1 6 '5D APSY CBCACONH' . . . 18047 1 7 '5D APSY HACACONH' . . . 18047 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 HA H 1 4.495 0.003 . 1 . . . A 2 ASP HA . 18047 1 2 . 1 1 2 2 ASP HB2 H 1 2.625 0.003 . 2 . . . A 2 ASP HB2 . 18047 1 3 . 1 1 2 2 ASP HB3 H 1 2.607 0.003 . 2 . . . A 2 ASP HB3 . 18047 1 4 . 1 1 2 2 ASP CA C 13 54.610 0.160 . 1 . . . A 2 ASP CA . 18047 1 5 . 1 1 2 2 ASP CB C 13 41.142 0.160 . 1 . . . A 2 ASP CB . 18047 1 6 . 1 1 3 3 GLU H H 1 8.438 0.003 . 1 . . . A 3 GLU H . 18047 1 7 . 1 1 3 3 GLU HA H 1 4.120 0.003 . 1 . . . A 3 GLU HA . 18047 1 8 . 1 1 3 3 GLU HB2 H 1 1.805 0.003 . 2 . . . A 3 GLU HB2 . 18047 1 9 . 1 1 3 3 GLU HB3 H 1 1.871 0.003 . 2 . . . A 3 GLU HB3 . 18047 1 10 . 1 1 3 3 GLU HG2 H 1 2.126 0.003 . 2 . . . A 3 GLU QG . 18047 1 11 . 1 1 3 3 GLU HG3 H 1 2.126 0.003 . 2 . . . A 3 GLU QG . 18047 1 12 . 1 1 3 3 GLU CA C 13 56.797 0.160 . 1 . . . A 3 GLU CA . 18047 1 13 . 1 1 3 3 GLU CB C 13 30.364 0.160 . 1 . . . A 3 GLU CB . 18047 1 14 . 1 1 3 3 GLU CG C 13 36.376 0.160 . 1 . . . A 3 GLU CG . 18047 1 15 . 1 1 3 3 GLU N N 15 120.353 0.130 . 1 . . . A 3 GLU N . 18047 1 16 . 1 1 4 4 VAL H H 1 8.157 0.003 . 1 . . . A 4 VAL H . 18047 1 17 . 1 1 4 4 VAL HA H 1 3.930 0.003 . 1 . . . A 4 VAL HA . 18047 1 18 . 1 1 4 4 VAL HB H 1 1.910 0.003 . 1 . . . A 4 VAL HB . 18047 1 19 . 1 1 4 4 VAL HG11 H 1 0.778 0.003 . 1 . . . A 4 VAL QG1 . 18047 1 20 . 1 1 4 4 VAL HG12 H 1 0.778 0.003 . 1 . . . A 4 VAL QG1 . 18047 1 21 . 1 1 4 4 VAL HG13 H 1 0.778 0.003 . 1 . . . A 4 VAL QG1 . 18047 1 22 . 1 1 4 4 VAL HG21 H 1 0.807 0.003 . 1 . . . A 4 VAL QG2 . 18047 1 23 . 1 1 4 4 VAL HG22 H 1 0.807 0.003 . 1 . . . A 4 VAL QG2 . 18047 1 24 . 1 1 4 4 VAL HG23 H 1 0.807 0.003 . 1 . . . A 4 VAL QG2 . 18047 1 25 . 1 1 4 4 VAL CA C 13 62.266 0.160 . 1 . . . A 4 VAL CA . 18047 1 26 . 1 1 4 4 VAL CB C 13 32.737 0.160 . 1 . . . A 4 VAL CB . 18047 1 27 . 1 1 4 4 VAL CG1 C 13 21.175 0.160 . 2 . . . A 4 VAL CG1 . 18047 1 28 . 1 1 4 4 VAL CG2 C 13 20.853 0.160 . 2 . . . A 4 VAL CG2 . 18047 1 29 . 1 1 4 4 VAL N N 15 120.733 0.130 . 1 . . . A 4 VAL N . 18047 1 30 . 1 1 5 5 LEU H H 1 8.214 0.003 . 1 . . . A 5 LEU H . 18047 1 31 . 1 1 5 5 LEU HA H 1 4.253 0.003 . 1 . . . A 5 LEU HA . 18047 1 32 . 1 1 5 5 LEU HB2 H 1 1.503 0.003 . 2 . . . A 5 LEU HB2 . 18047 1 33 . 1 1 5 5 LEU HB3 H 1 1.445 0.003 . 2 . . . A 5 LEU HB3 . 18047 1 34 . 1 1 5 5 LEU HG H 1 1.489 0.003 . 1 . . . A 5 LEU HG . 18047 1 35 . 1 1 5 5 LEU HD11 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 36 . 1 1 5 5 LEU HD12 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 37 . 1 1 5 5 LEU HD13 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 38 . 1 1 5 5 LEU HD21 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 39 . 1 1 5 5 LEU HD22 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 40 . 1 1 5 5 LEU HD23 H 1 0.724 0.003 . 1 . . . A 5 LEU QQD . 18047 1 41 . 1 1 5 5 LEU CA C 13 54.692 0.160 . 1 . . . A 5 LEU CA . 18047 1 42 . 1 1 5 5 LEU CB C 13 42.510 0.160 . 1 . . . A 5 LEU CB . 18047 1 43 . 1 1 5 5 LEU CG C 13 27.003 0.160 . 1 . . . A 5 LEU CG . 18047 1 44 . 1 1 5 5 LEU CD2 C 13 23.530 0.160 . 2 . . . A 5 LEU CD2 . 18047 1 45 . 1 1 5 5 LEU N N 15 125.359 0.130 . 1 . . . A 5 LEU N . 18047 1 46 . 1 1 6 6 ALA H H 1 8.256 0.003 . 1 . . . A 6 ALA H . 18047 1 47 . 1 1 6 6 ALA HA H 1 4.239 0.003 . 1 . . . A 6 ALA HA . 18047 1 48 . 1 1 6 6 ALA HB1 H 1 1.277 0.003 . 1 . . . A 6 ALA QB . 18047 1 49 . 1 1 6 6 ALA HB2 H 1 1.277 0.003 . 1 . . . A 6 ALA QB . 18047 1 50 . 1 1 6 6 ALA HB3 H 1 1.277 0.003 . 1 . . . A 6 ALA QB . 18047 1 51 . 1 1 6 6 ALA CA C 13 52.477 0.160 . 1 . . . A 6 ALA CA . 18047 1 52 . 1 1 6 6 ALA CB C 13 19.385 0.160 . 1 . . . A 6 ALA CB . 18047 1 53 . 1 1 6 6 ALA N N 15 124.193 0.130 . 1 . . . A 6 ALA N . 18047 1 54 . 1 1 7 7 THR H H 1 7.925 0.003 . 1 . . . A 7 THR H . 18047 1 55 . 1 1 7 7 THR HA H 1 4.218 0.003 . 1 . . . A 7 THR HA . 18047 1 56 . 1 1 7 7 THR HB H 1 4.103 0.003 . 1 . . . A 7 THR HB . 18047 1 57 . 1 1 7 7 THR HG21 H 1 1.073 0.003 . 1 . . . A 7 THR QG2 . 18047 1 58 . 1 1 7 7 THR HG22 H 1 1.073 0.003 . 1 . . . A 7 THR QG2 . 18047 1 59 . 1 1 7 7 THR HG23 H 1 1.073 0.003 . 1 . . . A 7 THR QG2 . 18047 1 60 . 1 1 7 7 THR CA C 13 61.477 0.160 . 1 . . . A 7 THR CA . 18047 1 61 . 1 1 7 7 THR CB C 13 69.698 0.160 . 1 . . . A 7 THR CB . 18047 1 62 . 1 1 7 7 THR CG2 C 13 21.662 0.160 . 1 . . . A 7 THR CG2 . 18047 1 63 . 1 1 7 7 THR N N 15 111.422 0.130 . 1 . . . A 7 THR N . 18047 1 64 . 1 1 8 8 SER H H 1 8.149 0.003 . 1 . . . A 8 SER H . 18047 1 65 . 1 1 8 8 SER HA H 1 4.415 0.003 . 1 . . . A 8 SER HA . 18047 1 66 . 1 1 8 8 SER HB2 H 1 3.740 0.003 . 2 . . . A 8 SER QB . 18047 1 67 . 1 1 8 8 SER HB3 H 1 3.740 0.003 . 2 . . . A 8 SER QB . 18047 1 68 . 1 1 8 8 SER CA C 13 58.044 0.160 . 1 . . . A 8 SER CA . 18047 1 69 . 1 1 8 8 SER CB C 13 63.794 0.160 . 1 . . . A 8 SER CB . 18047 1 70 . 1 1 8 8 SER N N 15 116.615 0.130 . 1 . . . A 8 SER N . 18047 1 71 . 1 1 9 9 ILE H H 1 8.089 0.003 . 1 . . . A 9 ILE H . 18047 1 72 . 1 1 9 9 ILE HA H 1 4.077 0.003 . 1 . . . A 9 ILE HA . 18047 1 73 . 1 1 9 9 ILE HB H 1 1.766 0.003 . 1 . . . A 9 ILE HB . 18047 1 74 . 1 1 9 9 ILE HG12 H 1 1.326 0.003 . 2 . . . A 9 ILE HG12 . 18047 1 75 . 1 1 9 9 ILE HG13 H 1 1.090 0.003 . 2 . . . A 9 ILE HG13 . 18047 1 76 . 1 1 9 9 ILE HG21 H 1 0.786 0.003 . 1 . . . A 9 ILE QG2 . 18047 1 77 . 1 1 9 9 ILE HG22 H 1 0.786 0.003 . 1 . . . A 9 ILE QG2 . 18047 1 78 . 1 1 9 9 ILE HG23 H 1 0.786 0.003 . 1 . . . A 9 ILE QG2 . 18047 1 79 . 1 1 9 9 ILE HD11 H 1 0.732 0.003 . 1 . . . A 9 ILE QD1 . 18047 1 80 . 1 1 9 9 ILE HD12 H 1 0.732 0.003 . 1 . . . A 9 ILE QD1 . 18047 1 81 . 1 1 9 9 ILE HD13 H 1 0.732 0.003 . 1 . . . A 9 ILE QD1 . 18047 1 82 . 1 1 9 9 ILE CA C 13 61.296 0.160 . 1 . . . A 9 ILE CA . 18047 1 83 . 1 1 9 9 ILE CB C 13 39.032 0.160 . 1 . . . A 9 ILE CB . 18047 1 84 . 1 1 9 9 ILE CG1 C 13 27.313 0.160 . 1 . . . A 9 ILE CG1 . 18047 1 85 . 1 1 9 9 ILE CG2 C 13 17.741 0.160 . 1 . . . A 9 ILE CG2 . 18047 1 86 . 1 1 9 9 ILE CD1 C 13 13.301 0.160 . 1 . . . A 9 ILE CD1 . 18047 1 87 . 1 1 9 9 ILE N N 15 120.442 0.130 . 1 . . . A 9 ILE N . 18047 1 88 . 1 1 10 10 GLY H H 1 8.076 0.003 . 1 . . . A 10 GLY H . 18047 1 89 . 1 1 10 10 GLY HA2 H 1 3.948 0.003 . 2 . . . A 10 GLY HA2 . 18047 1 90 . 1 1 10 10 GLY HA3 H 1 4.338 0.003 . 2 . . . A 10 GLY HA3 . 18047 1 91 . 1 1 10 10 GLY CA C 13 45.422 0.160 . 1 . . . A 10 GLY CA . 18047 1 92 . 1 1 10 10 GLY N N 15 108.657 0.130 . 1 . . . A 10 GLY N . 18047 1 93 . 1 1 11 11 THR H H 1 8.485 0.003 . 1 . . . A 11 THR H . 18047 1 94 . 1 1 11 11 THR HA H 1 4.481 0.003 . 1 . . . A 11 THR HA . 18047 1 95 . 1 1 11 11 THR HB H 1 3.931 0.003 . 1 . . . A 11 THR HB . 18047 1 96 . 1 1 11 11 THR HG21 H 1 0.987 0.003 . 1 . . . A 11 THR QG2 . 18047 1 97 . 1 1 11 11 THR HG22 H 1 0.987 0.003 . 1 . . . A 11 THR QG2 . 18047 1 98 . 1 1 11 11 THR HG23 H 1 0.987 0.003 . 1 . . . A 11 THR QG2 . 18047 1 99 . 1 1 11 11 THR CA C 13 60.114 0.160 . 1 . . . A 11 THR CA . 18047 1 100 . 1 1 11 11 THR CB C 13 72.694 0.160 . 1 . . . A 11 THR CB . 18047 1 101 . 1 1 11 11 THR CG2 C 13 21.734 0.160 . 1 . . . A 11 THR CG2 . 18047 1 102 . 1 1 11 11 THR N N 15 110.380 0.130 . 1 . . . A 11 THR N . 18047 1 103 . 1 1 12 12 TYR H H 1 8.371 0.003 . 1 . . . A 12 TYR H . 18047 1 104 . 1 1 12 12 TYR HA H 1 5.113 0.003 . 1 . . . A 12 TYR HA . 18047 1 105 . 1 1 12 12 TYR HB2 H 1 2.368 0.003 . 2 . . . A 12 TYR HB2 . 18047 1 106 . 1 1 12 12 TYR HB3 H 1 2.150 0.003 . 2 . . . A 12 TYR HB3 . 18047 1 107 . 1 1 12 12 TYR HD1 H 1 6.131 0.003 . 3 . . . A 12 TYR QD . 18047 1 108 . 1 1 12 12 TYR HD2 H 1 6.131 0.003 . 3 . . . A 12 TYR QD . 18047 1 109 . 1 1 12 12 TYR CA C 13 56.585 0.160 . 1 . . . A 12 TYR CA . 18047 1 110 . 1 1 12 12 TYR CB C 13 41.380 0.160 . 1 . . . A 12 TYR CB . 18047 1 111 . 1 1 12 12 TYR CD1 C 13 131.005 0.160 . 3 . . . A 12 TYR CD1 . 18047 1 112 . 1 1 12 12 TYR CD2 C 13 131.005 0.160 . 3 . . . A 12 TYR CD2 . 18047 1 113 . 1 1 12 12 TYR N N 15 121.121 0.130 . 1 . . . A 12 TYR N . 18047 1 114 . 1 1 13 13 GLU H H 1 7.606 0.003 . 1 . . . A 13 GLU H . 18047 1 115 . 1 1 13 13 GLU HA H 1 3.980 0.003 . 1 . . . A 13 GLU HA . 18047 1 116 . 1 1 13 13 GLU HB2 H 1 1.637 0.003 . 2 . . . A 13 GLU HB2 . 18047 1 117 . 1 1 13 13 GLU HB3 H 1 1.747 0.003 . 2 . . . A 13 GLU HB3 . 18047 1 118 . 1 1 13 13 GLU HG2 H 1 1.950 0.003 . 2 . . . A 13 GLU QG . 18047 1 119 . 1 1 13 13 GLU HG3 H 1 1.950 0.003 . 2 . . . A 13 GLU QG . 18047 1 120 . 1 1 13 13 GLU CA C 13 54.655 0.160 . 1 . . . A 13 GLU CA . 18047 1 121 . 1 1 13 13 GLU CB C 13 32.322 0.160 . 1 . . . A 13 GLU CB . 18047 1 122 . 1 1 13 13 GLU CG C 13 35.164 0.160 . 1 . . . A 13 GLU CG . 18047 1 123 . 1 1 13 13 GLU N N 15 123.546 0.130 . 1 . . . A 13 GLU N . 18047 1 124 . 1 1 14 14 ASN H H 1 9.101 0.003 . 1 . . . A 14 ASN H . 18047 1 125 . 1 1 14 14 ASN HA H 1 4.042 0.003 . 1 . . . A 14 ASN HA . 18047 1 126 . 1 1 14 14 ASN HB2 H 1 2.422 0.003 . 2 . . . A 14 ASN HB2 . 18047 1 127 . 1 1 14 14 ASN HB3 H 1 2.707 0.003 . 2 . . . A 14 ASN HB3 . 18047 1 128 . 1 1 14 14 ASN HD21 H 1 7.454 0.003 . 2 . . . A 14 ASN HD21 . 18047 1 129 . 1 1 14 14 ASN HD22 H 1 6.669 0.003 . 2 . . . A 14 ASN HD22 . 18047 1 130 . 1 1 14 14 ASN CA C 13 54.164 0.160 . 1 . . . A 14 ASN CA . 18047 1 131 . 1 1 14 14 ASN CB C 13 37.106 0.160 . 1 . . . A 14 ASN CB . 18047 1 132 . 1 1 14 14 ASN N N 15 122.345 0.130 . 1 . . . A 14 ASN N . 18047 1 133 . 1 1 14 14 ASN ND2 N 15 112.147 0.130 . 1 . . . A 14 ASN ND2 . 18047 1 134 . 1 1 15 15 ARG H H 1 8.341 0.003 . 1 . . . A 15 ARG H . 18047 1 135 . 1 1 15 15 ARG HA H 1 3.663 0.003 . 1 . . . A 15 ARG HA . 18047 1 136 . 1 1 15 15 ARG HB2 H 1 1.259 0.003 . 2 . . . A 15 ARG HB2 . 18047 1 137 . 1 1 15 15 ARG HB3 H 1 1.645 0.003 . 2 . . . A 15 ARG HB3 . 18047 1 138 . 1 1 15 15 ARG HD2 H 1 2.895 0.003 . 2 . . . A 15 ARG HD2 . 18047 1 139 . 1 1 15 15 ARG HD3 H 1 2.812 0.003 . 2 . . . A 15 ARG HD3 . 18047 1 140 . 1 1 15 15 ARG HE H 1 7.712 0.003 . 1 . . . A 15 ARG HE . 18047 1 141 . 1 1 15 15 ARG CA C 13 56.613 0.160 . 1 . . . A 15 ARG CA . 18047 1 142 . 1 1 15 15 ARG CB C 13 27.468 0.160 . 1 . . . A 15 ARG CB . 18047 1 143 . 1 1 15 15 ARG CD C 13 42.963 0.160 . 1 . . . A 15 ARG CD . 18047 1 144 . 1 1 15 15 ARG N N 15 109.965 0.130 . 1 . . . A 15 ARG N . 18047 1 145 . 1 1 15 15 ARG NE N 15 85.501 0.130 . 1 . . . A 15 ARG NE . 18047 1 146 . 1 1 16 16 THR H H 1 6.798 0.003 . 1 . . . A 16 THR H . 18047 1 147 . 1 1 16 16 THR HA H 1 4.854 0.003 . 1 . . . A 16 THR HA . 18047 1 148 . 1 1 16 16 THR HB H 1 3.910 0.003 . 1 . . . A 16 THR HB . 18047 1 149 . 1 1 16 16 THR HG21 H 1 0.764 0.003 . 1 . . . A 16 THR QG2 . 18047 1 150 . 1 1 16 16 THR HG22 H 1 0.764 0.003 . 1 . . . A 16 THR QG2 . 18047 1 151 . 1 1 16 16 THR HG23 H 1 0.764 0.003 . 1 . . . A 16 THR QG2 . 18047 1 152 . 1 1 16 16 THR CA C 13 61.606 0.160 . 1 . . . A 16 THR CA . 18047 1 153 . 1 1 16 16 THR CB C 13 70.614 0.160 . 1 . . . A 16 THR CB . 18047 1 154 . 1 1 16 16 THR CG2 C 13 20.425 0.160 . 1 . . . A 16 THR CG2 . 18047 1 155 . 1 1 16 16 THR N N 15 111.186 0.130 . 1 . . . A 16 THR N . 18047 1 156 . 1 1 17 17 LEU H H 1 9.474 0.003 . 1 . . . A 17 LEU H . 18047 1 157 . 1 1 17 17 LEU HA H 1 4.786 0.003 . 1 . . . A 17 LEU HA . 18047 1 158 . 1 1 17 17 LEU HB2 H 1 1.933 0.003 . 2 . . . A 17 LEU HB2 . 18047 1 159 . 1 1 17 17 LEU HB3 H 1 0.888 0.003 . 2 . . . A 17 LEU HB3 . 18047 1 160 . 1 1 17 17 LEU HG H 1 1.147 0.003 . 1 . . . A 17 LEU HG . 18047 1 161 . 1 1 17 17 LEU HD11 H 1 0.625 0.003 . 1 . . . A 17 LEU QD1 . 18047 1 162 . 1 1 17 17 LEU HD12 H 1 0.625 0.003 . 1 . . . A 17 LEU QD1 . 18047 1 163 . 1 1 17 17 LEU HD13 H 1 0.625 0.003 . 1 . . . A 17 LEU QD1 . 18047 1 164 . 1 1 17 17 LEU CA C 13 53.360 0.160 . 1 . . . A 17 LEU CA . 18047 1 165 . 1 1 17 17 LEU CB C 13 45.303 0.160 . 1 . . . A 17 LEU CB . 18047 1 166 . 1 1 17 17 LEU CG C 13 27.591 0.160 . 1 . . . A 17 LEU CG . 18047 1 167 . 1 1 17 17 LEU CD1 C 13 23.352 0.160 . 2 . . . A 17 LEU CD1 . 18047 1 168 . 1 1 17 17 LEU N N 15 130.576 0.130 . 1 . . . A 17 LEU N . 18047 1 169 . 1 1 18 18 LEU H H 1 8.818 0.003 . 1 . . . A 18 LEU H . 18047 1 170 . 1 1 18 18 LEU HA H 1 4.814 0.003 . 1 . . . A 18 LEU HA . 18047 1 171 . 1 1 18 18 LEU HB2 H 1 1.643 0.003 . 2 . . . A 18 LEU HB2 . 18047 1 172 . 1 1 18 18 LEU HB3 H 1 1.151 0.003 . 2 . . . A 18 LEU HB3 . 18047 1 173 . 1 1 18 18 LEU HG H 1 1.226 0.003 . 1 . . . A 18 LEU HG . 18047 1 174 . 1 1 18 18 LEU HD11 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 175 . 1 1 18 18 LEU HD12 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 176 . 1 1 18 18 LEU HD13 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 177 . 1 1 18 18 LEU HD21 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 178 . 1 1 18 18 LEU HD22 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 179 . 1 1 18 18 LEU HD23 H 1 0.683 0.003 . 1 . . . A 18 LEU QQD . 18047 1 180 . 1 1 18 18 LEU CA C 13 54.527 0.160 . 1 . . . A 18 LEU CA . 18047 1 181 . 1 1 18 18 LEU CB C 13 44.038 0.160 . 1 . . . A 18 LEU CB . 18047 1 182 . 1 1 18 18 LEU CG C 13 27.389 0.160 . 1 . . . A 18 LEU CG . 18047 1 183 . 1 1 18 18 LEU CD2 C 13 25.056 0.160 . 2 . . . A 18 LEU CD2 . 18047 1 184 . 1 1 18 18 LEU N N 15 128.353 0.130 . 1 . . . A 18 LEU N . 18047 1 185 . 1 1 19 19 VAL H H 1 8.453 0.003 . 1 . . . A 19 VAL H . 18047 1 186 . 1 1 19 19 VAL HA H 1 4.723 0.003 . 1 . . . A 19 VAL HA . 18047 1 187 . 1 1 19 19 VAL HB H 1 2.472 0.003 . 1 . . . A 19 VAL HB . 18047 1 188 . 1 1 19 19 VAL HG21 H 1 0.289 0.003 . 1 . . . A 19 VAL QG2 . 18047 1 189 . 1 1 19 19 VAL HG22 H 1 0.289 0.003 . 1 . . . A 19 VAL QG2 . 18047 1 190 . 1 1 19 19 VAL HG23 H 1 0.289 0.003 . 1 . . . A 19 VAL QG2 . 18047 1 191 . 1 1 19 19 VAL CA C 13 58.097 0.160 . 1 . . . A 19 VAL CA . 18047 1 192 . 1 1 19 19 VAL CB C 13 33.060 0.160 . 1 . . . A 19 VAL CB . 18047 1 193 . 1 1 19 19 VAL CG1 C 13 23.637 0.160 . 2 . . . A 19 VAL CG1 . 18047 1 194 . 1 1 19 19 VAL CG2 C 13 19.101 0.160 . 2 . . . A 19 VAL CG2 . 18047 1 195 . 1 1 19 19 VAL N N 15 117.630 0.130 . 1 . . . A 19 VAL N . 18047 1 196 . 1 1 20 20 PRO HA H 1 4.052 0.003 . 1 . . . A 20 PRO HA . 18047 1 197 . 1 1 20 20 PRO HB2 H 1 1.711 0.003 . 2 . . . A 20 PRO HB2 . 18047 1 198 . 1 1 20 20 PRO HB3 H 1 2.263 0.003 . 2 . . . A 20 PRO HB3 . 18047 1 199 . 1 1 20 20 PRO HG2 H 1 2.063 0.003 . 2 . . . A 20 PRO HG2 . 18047 1 200 . 1 1 20 20 PRO HG3 H 1 1.874 0.003 . 2 . . . A 20 PRO HG3 . 18047 1 201 . 1 1 20 20 PRO HD2 H 1 3.747 0.003 . 2 . . . A 20 PRO HD2 . 18047 1 202 . 1 1 20 20 PRO HD3 H 1 3.597 0.003 . 2 . . . A 20 PRO HD3 . 18047 1 203 . 1 1 20 20 PRO CA C 13 66.244 0.160 . 1 . . . A 20 PRO CA . 18047 1 204 . 1 1 20 20 PRO CB C 13 31.738 0.160 . 1 . . . A 20 PRO CB . 18047 1 205 . 1 1 20 20 PRO CG C 13 28.412 0.160 . 1 . . . A 20 PRO CG . 18047 1 206 . 1 1 20 20 PRO CD C 13 50.397 0.160 . 1 . . . A 20 PRO CD . 18047 1 207 . 1 1 21 21 ASP HA H 1 4.315 0.003 . 1 . . . A 21 ASP HA . 18047 1 208 . 1 1 21 21 ASP HB2 H 1 2.675 0.003 . 2 . . . A 21 ASP QB . 18047 1 209 . 1 1 21 21 ASP HB3 H 1 2.675 0.003 . 2 . . . A 21 ASP QB . 18047 1 210 . 1 1 21 21 ASP CA C 13 54.850 0.160 . 1 . . . A 21 ASP CA . 18047 1 211 . 1 1 21 21 ASP CB C 13 42.022 0.160 . 1 . . . A 21 ASP CB . 18047 1 212 . 1 1 22 22 GLY H H 1 7.496 0.003 . 1 . . . A 22 GLY H . 18047 1 213 . 1 1 22 22 GLY HA2 H 1 4.020 0.003 . 2 . . . A 22 GLY HA2 . 18047 1 214 . 1 1 22 22 GLY HA3 H 1 4.523 0.003 . 2 . . . A 22 GLY HA3 . 18047 1 215 . 1 1 22 22 GLY CA C 13 47.252 0.160 . 1 . . . A 22 GLY CA . 18047 1 216 . 1 1 22 22 GLY N N 15 106.832 0.130 . 1 . . . A 22 GLY N . 18047 1 217 . 1 1 23 23 ARG H H 1 7.883 0.003 . 1 . . . A 23 ARG H . 18047 1 218 . 1 1 23 23 ARG HA H 1 5.346 0.003 . 1 . . . A 23 ARG HA . 18047 1 219 . 1 1 23 23 ARG HB2 H 1 1.504 0.003 . 2 . . . A 23 ARG QB . 18047 1 220 . 1 1 23 23 ARG HB3 H 1 1.504 0.003 . 2 . . . A 23 ARG QB . 18047 1 221 . 1 1 23 23 ARG HG2 H 1 1.174 0.003 . 2 . . . A 23 ARG HG2 . 18047 1 222 . 1 1 23 23 ARG HG3 H 1 1.348 0.003 . 2 . . . A 23 ARG HG3 . 18047 1 223 . 1 1 23 23 ARG HD2 H 1 2.955 0.003 . 2 . . . A 23 ARG QD . 18047 1 224 . 1 1 23 23 ARG HD3 H 1 2.955 0.003 . 2 . . . A 23 ARG QD . 18047 1 225 . 1 1 23 23 ARG HE H 1 7.179 0.003 . 1 . . . A 23 ARG HE . 18047 1 226 . 1 1 23 23 ARG CA C 13 52.996 0.160 . 1 . . . A 23 ARG CA . 18047 1 227 . 1 1 23 23 ARG CB C 13 34.254 0.160 . 1 . . . A 23 ARG CB . 18047 1 228 . 1 1 23 23 ARG CG C 13 28.800 0.160 . 1 . . . A 23 ARG CG . 18047 1 229 . 1 1 23 23 ARG CD C 13 43.716 0.160 . 1 . . . A 23 ARG CD . 18047 1 230 . 1 1 23 23 ARG N N 15 115.061 0.130 . 1 . . . A 23 ARG N . 18047 1 231 . 1 1 23 23 ARG NE N 15 83.215 0.130 . 1 . . . A 23 ARG NE . 18047 1 232 . 1 1 24 24 LEU H H 1 9.178 0.003 . 1 . . . A 24 LEU H . 18047 1 233 . 1 1 24 24 LEU HA H 1 5.380 0.003 . 1 . . . A 24 LEU HA . 18047 1 234 . 1 1 24 24 LEU HB2 H 1 1.159 0.003 . 2 . . . A 24 LEU HB2 . 18047 1 235 . 1 1 24 24 LEU HB3 H 1 1.858 0.003 . 2 . . . A 24 LEU HB3 . 18047 1 236 . 1 1 24 24 LEU HG H 1 1.405 0.003 . 1 . . . A 24 LEU HG . 18047 1 237 . 1 1 24 24 LEU HD11 H 1 0.980 0.003 . 1 . . . A 24 LEU QD1 . 18047 1 238 . 1 1 24 24 LEU HD12 H 1 0.980 0.003 . 1 . . . A 24 LEU QD1 . 18047 1 239 . 1 1 24 24 LEU HD13 H 1 0.980 0.003 . 1 . . . A 24 LEU QD1 . 18047 1 240 . 1 1 24 24 LEU HD21 H 1 0.726 0.003 . 1 . . . A 24 LEU QD2 . 18047 1 241 . 1 1 24 24 LEU HD22 H 1 0.726 0.003 . 1 . . . A 24 LEU QD2 . 18047 1 242 . 1 1 24 24 LEU HD23 H 1 0.726 0.003 . 1 . . . A 24 LEU QD2 . 18047 1 243 . 1 1 24 24 LEU CA C 13 53.067 0.160 . 1 . . . A 24 LEU CA . 18047 1 244 . 1 1 24 24 LEU CB C 13 45.975 0.160 . 1 . . . A 24 LEU CB . 18047 1 245 . 1 1 24 24 LEU CG C 13 28.170 0.160 . 1 . . . A 24 LEU CG . 18047 1 246 . 1 1 24 24 LEU CD1 C 13 22.632 0.160 . 2 . . . A 24 LEU CD1 . 18047 1 247 . 1 1 24 24 LEU CD2 C 13 25.194 0.160 . 2 . . . A 24 LEU CD2 . 18047 1 248 . 1 1 24 24 LEU N N 15 127.899 0.130 . 1 . . . A 24 LEU N . 18047 1 249 . 1 1 25 25 ALA H H 1 9.285 0.003 . 1 . . . A 25 ALA H . 18047 1 250 . 1 1 25 25 ALA HA H 1 5.253 0.003 . 1 . . . A 25 ALA HA . 18047 1 251 . 1 1 25 25 ALA HB1 H 1 1.228 0.003 . 1 . . . A 25 ALA QB . 18047 1 252 . 1 1 25 25 ALA HB2 H 1 1.228 0.003 . 1 . . . A 25 ALA QB . 18047 1 253 . 1 1 25 25 ALA HB3 H 1 1.228 0.003 . 1 . . . A 25 ALA QB . 18047 1 254 . 1 1 25 25 ALA CA C 13 49.903 0.160 . 1 . . . A 25 ALA CA . 18047 1 255 . 1 1 25 25 ALA CB C 13 21.479 0.160 . 1 . . . A 25 ALA CB . 18047 1 256 . 1 1 25 25 ALA N N 15 128.627 0.130 . 1 . . . A 25 ALA N . 18047 1 257 . 1 1 26 26 LEU H H 1 8.780 0.003 . 1 . . . A 26 LEU H . 18047 1 258 . 1 1 26 26 LEU HA H 1 4.721 0.003 . 1 . . . A 26 LEU HA . 18047 1 259 . 1 1 26 26 LEU HB2 H 1 1.831 0.003 . 2 . . . A 26 LEU HB2 . 18047 1 260 . 1 1 26 26 LEU HB3 H 1 1.173 0.003 . 2 . . . A 26 LEU HB3 . 18047 1 261 . 1 1 26 26 LEU HG H 1 1.645 0.003 . 1 . . . A 26 LEU HG . 18047 1 262 . 1 1 26 26 LEU HD11 H 1 0.773 0.003 . 1 . . . A 26 LEU QD1 . 18047 1 263 . 1 1 26 26 LEU HD12 H 1 0.773 0.003 . 1 . . . A 26 LEU QD1 . 18047 1 264 . 1 1 26 26 LEU HD13 H 1 0.773 0.003 . 1 . . . A 26 LEU QD1 . 18047 1 265 . 1 1 26 26 LEU HD21 H 1 0.717 0.003 . 1 . . . A 26 LEU QD2 . 18047 1 266 . 1 1 26 26 LEU HD22 H 1 0.717 0.003 . 1 . . . A 26 LEU QD2 . 18047 1 267 . 1 1 26 26 LEU HD23 H 1 0.717 0.003 . 1 . . . A 26 LEU QD2 . 18047 1 268 . 1 1 26 26 LEU CA C 13 54.460 0.160 . 1 . . . A 26 LEU CA . 18047 1 269 . 1 1 26 26 LEU CB C 13 40.440 0.160 . 1 . . . A 26 LEU CB . 18047 1 270 . 1 1 26 26 LEU CG C 13 28.424 0.160 . 1 . . . A 26 LEU CG . 18047 1 271 . 1 1 26 26 LEU CD1 C 13 24.656 0.160 . 2 . . . A 26 LEU CD1 . 18047 1 272 . 1 1 26 26 LEU CD2 C 13 23.998 0.160 . 2 . . . A 26 LEU CD2 . 18047 1 273 . 1 1 26 26 LEU N N 15 122.462 0.130 . 1 . . . A 26 LEU N . 18047 1 274 . 1 1 27 27 THR H H 1 8.890 0.003 . 1 . . . A 27 THR H . 18047 1 275 . 1 1 27 27 THR HA H 1 4.003 0.003 . 1 . . . A 27 THR HA . 18047 1 276 . 1 1 27 27 THR HB H 1 3.954 0.003 . 1 . . . A 27 THR HB . 18047 1 277 . 1 1 27 27 THR HG21 H 1 0.982 0.003 . 1 . . . A 27 THR QG2 . 18047 1 278 . 1 1 27 27 THR HG22 H 1 0.982 0.003 . 1 . . . A 27 THR QG2 . 18047 1 279 . 1 1 27 27 THR HG23 H 1 0.982 0.003 . 1 . . . A 27 THR QG2 . 18047 1 280 . 1 1 27 27 THR CA C 13 63.523 0.160 . 1 . . . A 27 THR CA . 18047 1 281 . 1 1 27 27 THR CB C 13 68.499 0.160 . 1 . . . A 27 THR CB . 18047 1 282 . 1 1 27 27 THR CG2 C 13 21.830 0.160 . 1 . . . A 27 THR CG2 . 18047 1 283 . 1 1 27 27 THR N N 15 118.381 0.130 . 1 . . . A 27 THR N . 18047 1 284 . 1 1 28 28 ALA H H 1 7.552 0.003 . 1 . . . A 28 ALA H . 18047 1 285 . 1 1 28 28 ALA HA H 1 4.245 0.003 . 1 . . . A 28 ALA HA . 18047 1 286 . 1 1 28 28 ALA HB1 H 1 1.176 0.003 . 1 . . . A 28 ALA QB . 18047 1 287 . 1 1 28 28 ALA HB2 H 1 1.176 0.003 . 1 . . . A 28 ALA QB . 18047 1 288 . 1 1 28 28 ALA HB3 H 1 1.176 0.003 . 1 . . . A 28 ALA QB . 18047 1 289 . 1 1 28 28 ALA CA C 13 52.520 0.160 . 1 . . . A 28 ALA CA . 18047 1 290 . 1 1 28 28 ALA CB C 13 22.603 0.160 . 1 . . . A 28 ALA CB . 18047 1 291 . 1 1 28 28 ALA N N 15 119.157 0.130 . 1 . . . A 28 ALA N . 18047 1 292 . 1 1 29 29 LEU H H 1 8.008 0.003 . 1 . . . A 29 LEU H . 18047 1 293 . 1 1 29 29 LEU HA H 1 5.486 0.003 . 1 . . . A 29 LEU HA . 18047 1 294 . 1 1 29 29 LEU HB2 H 1 1.657 0.003 . 2 . . . A 29 LEU HB2 . 18047 1 295 . 1 1 29 29 LEU HB3 H 1 1.244 0.003 . 2 . . . A 29 LEU HB3 . 18047 1 296 . 1 1 29 29 LEU HG H 1 1.600 0.003 . 1 . . . A 29 LEU HG . 18047 1 297 . 1 1 29 29 LEU HD11 H 1 0.947 0.003 . 1 . . . A 29 LEU QD1 . 18047 1 298 . 1 1 29 29 LEU HD12 H 1 0.947 0.003 . 1 . . . A 29 LEU QD1 . 18047 1 299 . 1 1 29 29 LEU HD13 H 1 0.947 0.003 . 1 . . . A 29 LEU QD1 . 18047 1 300 . 1 1 29 29 LEU HD21 H 1 0.710 0.003 . 1 . . . A 29 LEU QD2 . 18047 1 301 . 1 1 29 29 LEU HD22 H 1 0.710 0.003 . 1 . . . A 29 LEU QD2 . 18047 1 302 . 1 1 29 29 LEU HD23 H 1 0.710 0.003 . 1 . . . A 29 LEU QD2 . 18047 1 303 . 1 1 29 29 LEU CA C 13 53.939 0.160 . 1 . . . A 29 LEU CA . 18047 1 304 . 1 1 29 29 LEU CB C 13 44.287 0.160 . 1 . . . A 29 LEU CB . 18047 1 305 . 1 1 29 29 LEU CG C 13 28.086 0.160 . 1 . . . A 29 LEU CG . 18047 1 306 . 1 1 29 29 LEU CD1 C 13 26.928 0.160 . 2 . . . A 29 LEU CD1 . 18047 1 307 . 1 1 29 29 LEU CD2 C 13 26.131 0.160 . 2 . . . A 29 LEU CD2 . 18047 1 308 . 1 1 29 29 LEU N N 15 118.420 0.130 . 1 . . . A 29 LEU N . 18047 1 309 . 1 1 30 30 HIS H H 1 8.579 0.003 . 1 . . . A 30 HIS H . 18047 1 310 . 1 1 30 30 HIS HA H 1 5.233 0.003 . 1 . . . A 30 HIS HA . 18047 1 311 . 1 1 30 30 HIS HB2 H 1 2.709 0.003 . 2 . . . A 30 HIS HB2 . 18047 1 312 . 1 1 30 30 HIS HB3 H 1 3.234 0.003 . 2 . . . A 30 HIS HB3 . 18047 1 313 . 1 1 30 30 HIS HD2 H 1 6.405 0.003 . 1 . . . A 30 HIS HD2 . 18047 1 314 . 1 1 30 30 HIS HE1 H 1 8.022 0.003 . 1 . . . A 30 HIS HE1 . 18047 1 315 . 1 1 30 30 HIS CA C 13 54.100 0.160 . 1 . . . A 30 HIS CA . 18047 1 316 . 1 1 30 30 HIS CB C 13 34.595 0.160 . 1 . . . A 30 HIS CB . 18047 1 317 . 1 1 30 30 HIS CD2 C 13 119.472 0.160 . 1 . . . A 30 HIS CD2 . 18047 1 318 . 1 1 30 30 HIS CE1 C 13 137.964 0.160 . 1 . . . A 30 HIS CE1 . 18047 1 319 . 1 1 30 30 HIS N N 15 117.771 0.130 . 1 . . . A 30 HIS N . 18047 1 320 . 1 1 31 31 LYS H H 1 9.542 0.003 . 1 . . . A 31 LYS H . 18047 1 321 . 1 1 31 31 LYS HA H 1 4.822 0.003 . 1 . . . A 31 LYS HA . 18047 1 322 . 1 1 31 31 LYS HB2 H 1 2.159 0.003 . 2 . . . A 31 LYS HB2 . 18047 1 323 . 1 1 31 31 LYS HB3 H 1 1.781 0.003 . 2 . . . A 31 LYS HB3 . 18047 1 324 . 1 1 31 31 LYS HG2 H 1 1.855 0.003 . 2 . . . A 31 LYS HG2 . 18047 1 325 . 1 1 31 31 LYS HG3 H 1 1.592 0.003 . 2 . . . A 31 LYS HG3 . 18047 1 326 . 1 1 31 31 LYS HD2 H 1 1.722 0.003 . 2 . . . A 31 LYS QD . 18047 1 327 . 1 1 31 31 LYS HD3 H 1 1.722 0.003 . 2 . . . A 31 LYS QD . 18047 1 328 . 1 1 31 31 LYS HE2 H 1 2.808 0.003 . 2 . . . A 31 LYS HE2 . 18047 1 329 . 1 1 31 31 LYS HE3 H 1 3.044 0.003 . 2 . . . A 31 LYS HE3 . 18047 1 330 . 1 1 31 31 LYS CA C 13 57.744 0.160 . 1 . . . A 31 LYS CA . 18047 1 331 . 1 1 31 31 LYS CB C 13 34.158 0.160 . 1 . . . A 31 LYS CB . 18047 1 332 . 1 1 31 31 LYS CG C 13 27.051 0.160 . 1 . . . A 31 LYS CG . 18047 1 333 . 1 1 31 31 LYS CD C 13 29.948 0.160 . 1 . . . A 31 LYS CD . 18047 1 334 . 1 1 31 31 LYS CE C 13 42.005 0.160 . 1 . . . A 31 LYS CE . 18047 1 335 . 1 1 31 31 LYS N N 15 125.291 0.130 . 1 . . . A 31 LYS N . 18047 1 336 . 1 1 32 32 GLY H H 1 8.734 0.003 . 1 . . . A 32 GLY H . 18047 1 337 . 1 1 32 32 GLY HA2 H 1 3.973 0.003 . 2 . . . A 32 GLY HA2 . 18047 1 338 . 1 1 32 32 GLY HA3 H 1 4.527 0.003 . 2 . . . A 32 GLY HA3 . 18047 1 339 . 1 1 32 32 GLY CA C 13 46.179 0.160 . 1 . . . A 32 GLY CA . 18047 1 340 . 1 1 32 32 GLY N N 15 110.657 0.130 . 1 . . . A 32 GLY N . 18047 1 341 . 1 1 33 33 LYS H H 1 7.886 0.003 . 1 . . . A 33 LYS H . 18047 1 342 . 1 1 33 33 LYS HA H 1 5.120 0.003 . 1 . . . A 33 LYS HA . 18047 1 343 . 1 1 33 33 LYS HB2 H 1 1.650 0.003 . 2 . . . A 33 LYS HB2 . 18047 1 344 . 1 1 33 33 LYS HB3 H 1 1.475 0.003 . 2 . . . A 33 LYS HB3 . 18047 1 345 . 1 1 33 33 LYS HG2 H 1 1.333 0.003 . 2 . . . A 33 LYS HG2 . 18047 1 346 . 1 1 33 33 LYS HG3 H 1 1.167 0.003 . 2 . . . A 33 LYS HG3 . 18047 1 347 . 1 1 33 33 LYS HD2 H 1 1.542 0.003 . 2 . . . A 33 LYS HD2 . 18047 1 348 . 1 1 33 33 LYS HD3 H 1 1.449 0.003 . 2 . . . A 33 LYS HD3 . 18047 1 349 . 1 1 33 33 LYS HE2 H 1 2.871 0.003 . 2 . . . A 33 LYS QE . 18047 1 350 . 1 1 33 33 LYS HE3 H 1 2.871 0.003 . 2 . . . A 33 LYS QE . 18047 1 351 . 1 1 33 33 LYS CA C 13 54.426 0.160 . 1 . . . A 33 LYS CA . 18047 1 352 . 1 1 33 33 LYS CB C 13 37.121 0.160 . 1 . . . A 33 LYS CB . 18047 1 353 . 1 1 33 33 LYS CG C 13 25.346 0.160 . 1 . . . A 33 LYS CG . 18047 1 354 . 1 1 33 33 LYS CD C 13 29.391 0.160 . 1 . . . A 33 LYS CD . 18047 1 355 . 1 1 33 33 LYS CE C 13 42.359 0.160 . 1 . . . A 33 LYS CE . 18047 1 356 . 1 1 33 33 LYS N N 15 119.230 0.130 . 1 . . . A 33 LYS N . 18047 1 357 . 1 1 34 34 ASP H H 1 9.153 0.003 . 1 . . . A 34 ASP H . 18047 1 358 . 1 1 34 34 ASP HA H 1 4.546 0.003 . 1 . . . A 34 ASP HA . 18047 1 359 . 1 1 34 34 ASP HB2 H 1 2.229 0.003 . 2 . . . A 34 ASP HB2 . 18047 1 360 . 1 1 34 34 ASP HB3 H 1 3.823 0.003 . 2 . . . A 34 ASP HB3 . 18047 1 361 . 1 1 34 34 ASP CA C 13 52.177 0.160 . 1 . . . A 34 ASP CA . 18047 1 362 . 1 1 34 34 ASP CB C 13 40.827 0.160 . 1 . . . A 34 ASP CB . 18047 1 363 . 1 1 34 34 ASP N N 15 121.332 0.130 . 1 . . . A 34 ASP N . 18047 1 364 . 1 1 35 35 TYR H H 1 8.833 0.003 . 1 . . . A 35 TYR H . 18047 1 365 . 1 1 35 35 TYR HA H 1 4.448 0.003 . 1 . . . A 35 TYR HA . 18047 1 366 . 1 1 35 35 TYR HB2 H 1 3.052 0.003 . 2 . . . A 35 TYR HB2 . 18047 1 367 . 1 1 35 35 TYR HB3 H 1 2.729 0.003 . 2 . . . A 35 TYR HB3 . 18047 1 368 . 1 1 35 35 TYR HD1 H 1 7.031 0.003 . 3 . . . A 35 TYR QD . 18047 1 369 . 1 1 35 35 TYR HD2 H 1 7.031 0.003 . 3 . . . A 35 TYR QD . 18047 1 370 . 1 1 35 35 TYR HE1 H 1 6.679 0.003 . 3 . . . A 35 TYR QE . 18047 1 371 . 1 1 35 35 TYR HE2 H 1 6.679 0.003 . 3 . . . A 35 TYR QE . 18047 1 372 . 1 1 35 35 TYR CA C 13 59.552 0.160 . 1 . . . A 35 TYR CA . 18047 1 373 . 1 1 35 35 TYR CB C 13 37.710 0.160 . 1 . . . A 35 TYR CB . 18047 1 374 . 1 1 35 35 TYR CD1 C 13 133.044 0.160 . 3 . . . A 35 TYR CD1 . 18047 1 375 . 1 1 35 35 TYR CD2 C 13 133.044 0.160 . 3 . . . A 35 TYR CD2 . 18047 1 376 . 1 1 35 35 TYR CE1 C 13 117.165 0.160 . 3 . . . A 35 TYR CE1 . 18047 1 377 . 1 1 35 35 TYR CE2 C 13 117.165 0.160 . 3 . . . A 35 TYR CE2 . 18047 1 378 . 1 1 35 35 TYR N N 15 115.225 0.130 . 1 . . . A 35 TYR N . 18047 1 379 . 1 1 36 36 GLN H H 1 7.969 0.003 . 1 . . . A 36 GLN H . 18047 1 380 . 1 1 36 36 GLN HA H 1 4.226 0.003 . 1 . . . A 36 GLN HA . 18047 1 381 . 1 1 36 36 GLN HB2 H 1 1.580 0.003 . 2 . . . A 36 GLN HB2 . 18047 1 382 . 1 1 36 36 GLN HB3 H 1 1.680 0.003 . 2 . . . A 36 GLN HB3 . 18047 1 383 . 1 1 36 36 GLN HG2 H 1 1.446 0.003 . 2 . . . A 36 GLN HG2 . 18047 1 384 . 1 1 36 36 GLN HG3 H 1 1.018 0.003 . 2 . . . A 36 GLN HG3 . 18047 1 385 . 1 1 36 36 GLN HE21 H 1 7.265 0.003 . 2 . . . A 36 GLN HE21 . 18047 1 386 . 1 1 36 36 GLN HE22 H 1 6.654 0.003 . 2 . . . A 36 GLN HE22 . 18047 1 387 . 1 1 36 36 GLN CA C 13 54.111 0.160 . 1 . . . A 36 GLN CA . 18047 1 388 . 1 1 36 36 GLN CB C 13 29.617 0.160 . 1 . . . A 36 GLN CB . 18047 1 389 . 1 1 36 36 GLN CG C 13 33.204 0.160 . 1 . . . A 36 GLN CG . 18047 1 390 . 1 1 36 36 GLN N N 15 119.307 0.130 . 1 . . . A 36 GLN N . 18047 1 391 . 1 1 36 36 GLN NE2 N 15 110.770 0.130 . 1 . . . A 36 GLN NE2 . 18047 1 392 . 1 1 37 37 GLY H H 1 8.183 0.003 . 1 . . . A 37 GLY H . 18047 1 393 . 1 1 37 37 GLY HA2 H 1 3.483 0.003 . 2 . . . A 37 GLY HA2 . 18047 1 394 . 1 1 37 37 GLY HA3 H 1 4.117 0.003 . 2 . . . A 37 GLY HA3 . 18047 1 395 . 1 1 37 37 GLY CA C 13 45.817 0.160 . 1 . . . A 37 GLY CA . 18047 1 396 . 1 1 37 37 GLY N N 15 107.990 0.130 . 1 . . . A 37 GLY N . 18047 1 397 . 1 1 38 38 LYS H H 1 8.644 0.003 . 1 . . . A 38 LYS H . 18047 1 398 . 1 1 38 38 LYS HA H 1 4.465 0.003 . 1 . . . A 38 LYS HA . 18047 1 399 . 1 1 38 38 LYS HB2 H 1 1.803 0.003 . 2 . . . A 38 LYS QB . 18047 1 400 . 1 1 38 38 LYS HB3 H 1 1.803 0.003 . 2 . . . A 38 LYS QB . 18047 1 401 . 1 1 38 38 LYS HG2 H 1 1.248 0.003 . 2 . . . A 38 LYS HG2 . 18047 1 402 . 1 1 38 38 LYS HG3 H 1 1.351 0.003 . 2 . . . A 38 LYS HG3 . 18047 1 403 . 1 1 38 38 LYS HD2 H 1 1.606 0.003 . 2 . . . A 38 LYS QD . 18047 1 404 . 1 1 38 38 LYS HD3 H 1 1.606 0.003 . 2 . . . A 38 LYS QD . 18047 1 405 . 1 1 38 38 LYS HE2 H 1 2.867 0.003 . 2 . . . A 38 LYS QE . 18047 1 406 . 1 1 38 38 LYS HE3 H 1 2.867 0.003 . 2 . . . A 38 LYS QE . 18047 1 407 . 1 1 38 38 LYS CA C 13 54.404 0.160 . 1 . . . A 38 LYS CA . 18047 1 408 . 1 1 38 38 LYS CB C 13 34.126 0.160 . 1 . . . A 38 LYS CB . 18047 1 409 . 1 1 38 38 LYS CG C 13 25.112 0.160 . 1 . . . A 38 LYS CG . 18047 1 410 . 1 1 38 38 LYS CD C 13 28.740 0.160 . 1 . . . A 38 LYS CD . 18047 1 411 . 1 1 38 38 LYS CE C 13 41.759 0.160 . 1 . . . A 38 LYS CE . 18047 1 412 . 1 1 38 38 LYS N N 15 122.006 0.130 . 1 . . . A 38 LYS N . 18047 1 413 . 1 1 39 39 PRO HA H 1 4.705 0.003 . 1 . . . A 39 PRO HA . 18047 1 414 . 1 1 39 39 PRO HB2 H 1 2.294 0.003 . 2 . . . A 39 PRO HB2 . 18047 1 415 . 1 1 39 39 PRO HB3 H 1 1.909 0.003 . 2 . . . A 39 PRO HB3 . 18047 1 416 . 1 1 39 39 PRO HG2 H 1 1.719 0.003 . 2 . . . A 39 PRO HG2 . 18047 1 417 . 1 1 39 39 PRO HG3 H 1 1.851 0.003 . 2 . . . A 39 PRO HG3 . 18047 1 418 . 1 1 39 39 PRO HD2 H 1 3.827 0.003 . 2 . . . A 39 PRO HD2 . 18047 1 419 . 1 1 39 39 PRO HD3 H 1 3.584 0.003 . 2 . . . A 39 PRO HD3 . 18047 1 420 . 1 1 39 39 PRO CA C 13 63.889 0.160 . 1 . . . A 39 PRO CA . 18047 1 421 . 1 1 39 39 PRO CB C 13 32.917 0.160 . 1 . . . A 39 PRO CB . 18047 1 422 . 1 1 39 39 PRO CG C 13 30.571 0.160 . 1 . . . A 39 PRO CG . 18047 1 423 . 1 1 39 39 PRO CD C 13 50.327 0.160 . 1 . . . A 39 PRO CD . 18047 1 424 . 1 1 40 40 MET H H 1 8.782 0.003 . 1 . . . A 40 MET H . 18047 1 425 . 1 1 40 40 MET HA H 1 4.768 0.003 . 1 . . . A 40 MET HA . 18047 1 426 . 1 1 40 40 MET HB2 H 1 1.792 0.003 . 2 . . . A 40 MET QB . 18047 1 427 . 1 1 40 40 MET HB3 H 1 1.792 0.003 . 2 . . . A 40 MET QB . 18047 1 428 . 1 1 40 40 MET HG2 H 1 2.030 0.003 . 2 . . . A 40 MET QG . 18047 1 429 . 1 1 40 40 MET HG3 H 1 2.030 0.003 . 2 . . . A 40 MET QG . 18047 1 430 . 1 1 40 40 MET HE1 H 1 0.428 0.003 . 1 . . . A 40 MET QE . 18047 1 431 . 1 1 40 40 MET HE2 H 1 0.428 0.003 . 1 . . . A 40 MET QE . 18047 1 432 . 1 1 40 40 MET HE3 H 1 0.428 0.003 . 1 . . . A 40 MET QE . 18047 1 433 . 1 1 40 40 MET CA C 13 53.101 0.160 . 1 . . . A 40 MET CA . 18047 1 434 . 1 1 40 40 MET CB C 13 30.509 0.160 . 1 . . . A 40 MET CB . 18047 1 435 . 1 1 40 40 MET CG C 13 30.933 0.160 . 1 . . . A 40 MET CG . 18047 1 436 . 1 1 40 40 MET CE C 13 15.719 0.160 . 1 . . . A 40 MET CE . 18047 1 437 . 1 1 40 40 MET N N 15 119.492 0.130 . 1 . . . A 40 MET N . 18047 1 438 . 1 1 41 41 PHE H H 1 8.972 0.003 . 1 . . . A 41 PHE H . 18047 1 439 . 1 1 41 41 PHE HA H 1 5.179 0.003 . 1 . . . A 41 PHE HA . 18047 1 440 . 1 1 41 41 PHE HB2 H 1 2.806 0.003 . 2 . . . A 41 PHE HB2 . 18047 1 441 . 1 1 41 41 PHE HB3 H 1 2.594 0.003 . 2 . . . A 41 PHE HB3 . 18047 1 442 . 1 1 41 41 PHE HD1 H 1 5.879 0.003 . 3 . . . A 41 PHE QD . 18047 1 443 . 1 1 41 41 PHE HD2 H 1 5.879 0.003 . 3 . . . A 41 PHE QD . 18047 1 444 . 1 1 41 41 PHE HE1 H 1 6.422 0.003 . 3 . . . A 41 PHE QE . 18047 1 445 . 1 1 41 41 PHE HE2 H 1 6.422 0.003 . 3 . . . A 41 PHE QE . 18047 1 446 . 1 1 41 41 PHE HZ H 1 6.799 0.003 . 1 . . . A 41 PHE HZ . 18047 1 447 . 1 1 41 41 PHE CA C 13 56.816 0.160 . 1 . . . A 41 PHE CA . 18047 1 448 . 1 1 41 41 PHE CB C 13 41.614 0.160 . 1 . . . A 41 PHE CB . 18047 1 449 . 1 1 41 41 PHE CD1 C 13 131.392 0.160 . 3 . . . A 41 PHE CD1 . 18047 1 450 . 1 1 41 41 PHE CD2 C 13 131.399 0.160 . 3 . . . A 41 PHE CD2 . 18047 1 451 . 1 1 41 41 PHE CE1 C 13 129.273 0.160 . 3 . . . A 41 PHE CE1 . 18047 1 452 . 1 1 41 41 PHE CE2 C 13 129.277 0.160 . 3 . . . A 41 PHE CE2 . 18047 1 453 . 1 1 41 41 PHE CZ C 13 127.181 0.160 . 1 . . . A 41 PHE CZ . 18047 1 454 . 1 1 41 41 PHE N N 15 111.715 0.130 . 1 . . . A 41 PHE N . 18047 1 455 . 1 1 42 42 TYR H H 1 9.607 0.003 . 1 . . . A 42 TYR H . 18047 1 456 . 1 1 42 42 TYR HA H 1 4.863 0.003 . 1 . . . A 42 TYR HA . 18047 1 457 . 1 1 42 42 TYR HB2 H 1 2.227 0.003 . 2 . . . A 42 TYR HB2 . 18047 1 458 . 1 1 42 42 TYR HB3 H 1 2.493 0.003 . 2 . . . A 42 TYR HB3 . 18047 1 459 . 1 1 42 42 TYR HD1 H 1 6.708 0.003 . 3 . . . A 42 TYR QD . 18047 1 460 . 1 1 42 42 TYR HD2 H 1 6.708 0.003 . 3 . . . A 42 TYR QD . 18047 1 461 . 1 1 42 42 TYR HE1 H 1 6.680 0.003 . 3 . . . A 42 TYR QE . 18047 1 462 . 1 1 42 42 TYR HE2 H 1 6.680 0.003 . 3 . . . A 42 TYR QE . 18047 1 463 . 1 1 42 42 TYR CA C 13 56.522 0.160 . 1 . . . A 42 TYR CA . 18047 1 464 . 1 1 42 42 TYR CB C 13 41.597 0.160 . 1 . . . A 42 TYR CB . 18047 1 465 . 1 1 42 42 TYR CD1 C 13 132.293 0.160 . 3 . . . A 42 TYR CD1 . 18047 1 466 . 1 1 42 42 TYR CD2 C 13 132.293 0.160 . 3 . . . A 42 TYR CD2 . 18047 1 467 . 1 1 42 42 TYR CE1 C 13 118.053 0.160 . 3 . . . A 42 TYR CE1 . 18047 1 468 . 1 1 42 42 TYR CE2 C 13 118.053 0.160 . 3 . . . A 42 TYR CE2 . 18047 1 469 . 1 1 42 42 TYR N N 15 116.245 0.130 . 1 . . . A 42 TYR N . 18047 1 470 . 1 1 43 43 VAL H H 1 8.946 0.003 . 1 . . . A 43 VAL H . 18047 1 471 . 1 1 43 43 VAL HA H 1 4.697 0.003 . 1 . . . A 43 VAL HA . 18047 1 472 . 1 1 43 43 VAL HB H 1 2.422 0.003 . 1 . . . A 43 VAL HB . 18047 1 473 . 1 1 43 43 VAL HG11 H 1 1.441 0.003 . 1 . . . A 43 VAL QG1 . 18047 1 474 . 1 1 43 43 VAL HG12 H 1 1.441 0.003 . 1 . . . A 43 VAL QG1 . 18047 1 475 . 1 1 43 43 VAL HG13 H 1 1.441 0.003 . 1 . . . A 43 VAL QG1 . 18047 1 476 . 1 1 43 43 VAL HG21 H 1 1.144 0.003 . 1 . . . A 43 VAL QG2 . 18047 1 477 . 1 1 43 43 VAL HG22 H 1 1.144 0.003 . 1 . . . A 43 VAL QG2 . 18047 1 478 . 1 1 43 43 VAL HG23 H 1 1.144 0.003 . 1 . . . A 43 VAL QG2 . 18047 1 479 . 1 1 43 43 VAL CA C 13 61.821 0.160 . 1 . . . A 43 VAL CA . 18047 1 480 . 1 1 43 43 VAL CB C 13 33.676 0.160 . 1 . . . A 43 VAL CB . 18047 1 481 . 1 1 43 43 VAL CG1 C 13 22.837 0.160 . 2 . . . A 43 VAL CG1 . 18047 1 482 . 1 1 43 43 VAL CG2 C 13 22.536 0.160 . 2 . . . A 43 VAL CG2 . 18047 1 483 . 1 1 43 43 VAL N N 15 120.036 0.130 . 1 . . . A 43 VAL N . 18047 1 484 . 1 1 44 44 LEU H H 1 8.904 0.003 . 1 . . . A 44 LEU H . 18047 1 485 . 1 1 44 44 LEU HA H 1 4.807 0.003 . 1 . . . A 44 LEU HA . 18047 1 486 . 1 1 44 44 LEU HB2 H 1 1.576 0.003 . 2 . . . A 44 LEU HB2 . 18047 1 487 . 1 1 44 44 LEU HB3 H 1 1.429 0.003 . 2 . . . A 44 LEU HB3 . 18047 1 488 . 1 1 44 44 LEU HG H 1 1.218 0.003 . 1 . . . A 44 LEU HG . 18047 1 489 . 1 1 44 44 LEU HD11 H 1 0.271 0.003 . 1 . . . A 44 LEU QD1 . 18047 1 490 . 1 1 44 44 LEU HD12 H 1 0.271 0.003 . 1 . . . A 44 LEU QD1 . 18047 1 491 . 1 1 44 44 LEU HD13 H 1 0.271 0.003 . 1 . . . A 44 LEU QD1 . 18047 1 492 . 1 1 44 44 LEU HD21 H 1 0.235 0.003 . 1 . . . A 44 LEU QD2 . 18047 1 493 . 1 1 44 44 LEU HD22 H 1 0.235 0.003 . 1 . . . A 44 LEU QD2 . 18047 1 494 . 1 1 44 44 LEU HD23 H 1 0.235 0.003 . 1 . . . A 44 LEU QD2 . 18047 1 495 . 1 1 44 44 LEU CA C 13 54.638 0.160 . 1 . . . A 44 LEU CA . 18047 1 496 . 1 1 44 44 LEU CB C 13 40.502 0.160 . 1 . . . A 44 LEU CB . 18047 1 497 . 1 1 44 44 LEU CG C 13 29.478 0.160 . 1 . . . A 44 LEU CG . 18047 1 498 . 1 1 44 44 LEU CD1 C 13 24.604 0.160 . 2 . . . A 44 LEU CD1 . 18047 1 499 . 1 1 44 44 LEU CD2 C 13 24.463 0.160 . 2 . . . A 44 LEU CD2 . 18047 1 500 . 1 1 44 44 LEU N N 15 128.688 0.130 . 1 . . . A 44 LEU N . 18047 1 501 . 1 1 45 45 PHE H H 1 7.680 0.003 . 1 . . . A 45 PHE H . 18047 1 502 . 1 1 45 45 PHE HA H 1 5.997 0.003 . 1 . . . A 45 PHE HA . 18047 1 503 . 1 1 45 45 PHE HB2 H 1 3.091 0.003 . 2 . . . A 45 PHE HB2 . 18047 1 504 . 1 1 45 45 PHE HB3 H 1 2.613 0.003 . 2 . . . A 45 PHE HB3 . 18047 1 505 . 1 1 45 45 PHE HD1 H 1 6.880 0.003 . 3 . . . A 45 PHE QD . 18047 1 506 . 1 1 45 45 PHE HD2 H 1 6.880 0.003 . 3 . . . A 45 PHE QD . 18047 1 507 . 1 1 45 45 PHE HE1 H 1 6.931 0.003 . 3 . . . A 45 PHE QE . 18047 1 508 . 1 1 45 45 PHE HE2 H 1 6.931 0.003 . 3 . . . A 45 PHE QE . 18047 1 509 . 1 1 45 45 PHE CA C 13 55.167 0.160 . 1 . . . A 45 PHE CA . 18047 1 510 . 1 1 45 45 PHE CB C 13 43.712 0.160 . 1 . . . A 45 PHE CB . 18047 1 511 . 1 1 45 45 PHE CD1 C 13 131.898 0.160 . 3 . . . A 45 PHE CD1 . 18047 1 512 . 1 1 45 45 PHE CD2 C 13 131.898 0.160 . 3 . . . A 45 PHE CD2 . 18047 1 513 . 1 1 45 45 PHE CE1 C 13 129.480 0.160 . 3 . . . A 45 PHE CE1 . 18047 1 514 . 1 1 45 45 PHE CE2 C 13 129.480 0.160 . 3 . . . A 45 PHE CE2 . 18047 1 515 . 1 1 45 45 PHE N N 15 115.417 0.130 . 1 . . . A 45 PHE N . 18047 1 516 . 1 1 46 46 GLU H H 1 9.210 0.003 . 1 . . . A 46 GLU H . 18047 1 517 . 1 1 46 46 GLU HA H 1 5.140 0.003 . 1 . . . A 46 GLU HA . 18047 1 518 . 1 1 46 46 GLU HB2 H 1 1.907 0.003 . 2 . . . A 46 GLU HB2 . 18047 1 519 . 1 1 46 46 GLU HB3 H 1 1.802 0.003 . 2 . . . A 46 GLU HB3 . 18047 1 520 . 1 1 46 46 GLU HG2 H 1 2.067 0.003 . 2 . . . A 46 GLU QG . 18047 1 521 . 1 1 46 46 GLU HG3 H 1 2.067 0.003 . 2 . . . A 46 GLU QG . 18047 1 522 . 1 1 46 46 GLU CA C 13 54.955 0.160 . 1 . . . A 46 GLU CA . 18047 1 523 . 1 1 46 46 GLU CB C 13 33.072 0.160 . 1 . . . A 46 GLU CB . 18047 1 524 . 1 1 46 46 GLU CG C 13 37.347 0.160 . 1 . . . A 46 GLU CG . 18047 1 525 . 1 1 46 46 GLU N N 15 119.543 0.130 . 1 . . . A 46 GLU N . 18047 1 526 . 1 1 47 47 LEU H H 1 9.138 0.003 . 1 . . . A 47 LEU H . 18047 1 527 . 1 1 47 47 LEU HA H 1 5.695 0.003 . 1 . . . A 47 LEU HA . 18047 1 528 . 1 1 47 47 LEU HB2 H 1 1.834 0.003 . 2 . . . A 47 LEU HB2 . 18047 1 529 . 1 1 47 47 LEU HB3 H 1 1.426 0.003 . 2 . . . A 47 LEU HB3 . 18047 1 530 . 1 1 47 47 LEU HG H 1 0.939 0.003 . 1 . . . A 47 LEU HG . 18047 1 531 . 1 1 47 47 LEU HD21 H 1 0.981 0.003 . 1 . . . A 47 LEU QD2 . 18047 1 532 . 1 1 47 47 LEU HD22 H 1 0.981 0.003 . 1 . . . A 47 LEU QD2 . 18047 1 533 . 1 1 47 47 LEU HD23 H 1 0.981 0.003 . 1 . . . A 47 LEU QD2 . 18047 1 534 . 1 1 47 47 LEU CA C 13 53.073 0.160 . 1 . . . A 47 LEU CA . 18047 1 535 . 1 1 47 47 LEU CB C 13 47.358 0.160 . 1 . . . A 47 LEU CB . 18047 1 536 . 1 1 47 47 LEU CG C 13 28.127 0.160 . 1 . . . A 47 LEU CG . 18047 1 537 . 1 1 47 47 LEU CD2 C 13 22.686 0.160 . 2 . . . A 47 LEU CD2 . 18047 1 538 . 1 1 47 47 LEU N N 15 127.871 0.130 . 1 . . . A 47 LEU N . 18047 1 539 . 1 1 48 48 THR H H 1 9.346 0.003 . 1 . . . A 48 THR H . 18047 1 540 . 1 1 48 48 THR HA H 1 5.631 0.003 . 1 . . . A 48 THR HA . 18047 1 541 . 1 1 48 48 THR HB H 1 3.707 0.003 . 1 . . . A 48 THR HB . 18047 1 542 . 1 1 48 48 THR HG21 H 1 0.962 0.003 . 1 . . . A 48 THR QG2 . 18047 1 543 . 1 1 48 48 THR HG22 H 1 0.962 0.003 . 1 . . . A 48 THR QG2 . 18047 1 544 . 1 1 48 48 THR HG23 H 1 0.962 0.003 . 1 . . . A 48 THR QG2 . 18047 1 545 . 1 1 48 48 THR CA C 13 61.022 0.160 . 1 . . . A 48 THR CA . 18047 1 546 . 1 1 48 48 THR CB C 13 71.321 0.160 . 1 . . . A 48 THR CB . 18047 1 547 . 1 1 48 48 THR CG2 C 13 21.514 0.160 . 1 . . . A 48 THR CG2 . 18047 1 548 . 1 1 48 48 THR N N 15 121.524 0.130 . 1 . . . A 48 THR N . 18047 1 549 . 1 1 49 49 ASN H H 1 7.464 0.003 . 1 . . . A 49 ASN H . 18047 1 550 . 1 1 49 49 ASN HA H 1 4.899 0.003 . 1 . . . A 49 ASN HA . 18047 1 551 . 1 1 49 49 ASN HB2 H 1 3.279 0.003 . 2 . . . A 49 ASN HB2 . 18047 1 552 . 1 1 49 49 ASN HB3 H 1 2.553 0.003 . 2 . . . A 49 ASN HB3 . 18047 1 553 . 1 1 49 49 ASN HD21 H 1 7.778 0.003 . 2 . . . A 49 ASN HD21 . 18047 1 554 . 1 1 49 49 ASN HD22 H 1 6.278 0.003 . 2 . . . A 49 ASN HD22 . 18047 1 555 . 1 1 49 49 ASN CA C 13 51.532 0.160 . 1 . . . A 49 ASN CA . 18047 1 556 . 1 1 49 49 ASN CB C 13 39.518 0.160 . 1 . . . A 49 ASN CB . 18047 1 557 . 1 1 49 49 ASN N N 15 121.340 0.130 . 1 . . . A 49 ASN N . 18047 1 558 . 1 1 49 49 ASN ND2 N 15 109.420 0.130 . 1 . . . A 49 ASN ND2 . 18047 1 559 . 1 1 50 50 THR H H 1 8.412 0.003 . 1 . . . A 50 THR H . 18047 1 560 . 1 1 50 50 THR HA H 1 4.829 0.003 . 1 . . . A 50 THR HA . 18047 1 561 . 1 1 50 50 THR HB H 1 4.586 0.003 . 1 . . . A 50 THR HB . 18047 1 562 . 1 1 50 50 THR HG21 H 1 0.881 0.003 . 1 . . . A 50 THR QG2 . 18047 1 563 . 1 1 50 50 THR HG22 H 1 0.881 0.003 . 1 . . . A 50 THR QG2 . 18047 1 564 . 1 1 50 50 THR HG23 H 1 0.881 0.003 . 1 . . . A 50 THR QG2 . 18047 1 565 . 1 1 50 50 THR CA C 13 60.820 0.160 . 1 . . . A 50 THR CA . 18047 1 566 . 1 1 50 50 THR CB C 13 67.094 0.160 . 1 . . . A 50 THR CB . 18047 1 567 . 1 1 50 50 THR CG2 C 13 20.410 0.160 . 1 . . . A 50 THR CG2 . 18047 1 568 . 1 1 50 50 THR N N 15 117.728 0.130 . 1 . . . A 50 THR N . 18047 1 569 . 1 1 51 51 THR H H 1 7.893 0.003 . 1 . . . A 51 THR H . 18047 1 570 . 1 1 51 51 THR HA H 1 4.811 0.003 . 1 . . . A 51 THR HA . 18047 1 571 . 1 1 51 51 THR HB H 1 4.452 0.003 . 1 . . . A 51 THR HB . 18047 1 572 . 1 1 51 51 THR HG21 H 1 1.491 0.003 . 1 . . . A 51 THR QG2 . 18047 1 573 . 1 1 51 51 THR HG22 H 1 1.491 0.003 . 1 . . . A 51 THR QG2 . 18047 1 574 . 1 1 51 51 THR HG23 H 1 1.491 0.003 . 1 . . . A 51 THR QG2 . 18047 1 575 . 1 1 51 51 THR CA C 13 61.545 0.160 . 1 . . . A 51 THR CA . 18047 1 576 . 1 1 51 51 THR CB C 13 71.102 0.160 . 1 . . . A 51 THR CB . 18047 1 577 . 1 1 51 51 THR CG2 C 13 22.028 0.160 . 1 . . . A 51 THR CG2 . 18047 1 578 . 1 1 51 51 THR N N 15 111.759 0.130 . 1 . . . A 51 THR N . 18047 1 579 . 1 1 52 52 GLU H H 1 8.429 0.003 . 1 . . . A 52 GLU H . 18047 1 580 . 1 1 52 52 GLU HA H 1 4.293 0.003 . 1 . . . A 52 GLU HA . 18047 1 581 . 1 1 52 52 GLU HB2 H 1 2.183 0.003 . 2 . . . A 52 GLU HB2 . 18047 1 582 . 1 1 52 52 GLU HB3 H 1 1.813 0.003 . 2 . . . A 52 GLU HB3 . 18047 1 583 . 1 1 52 52 GLU HG2 H 1 2.126 0.003 . 2 . . . A 52 GLU HG2 . 18047 1 584 . 1 1 52 52 GLU HG3 H 1 2.232 0.003 . 2 . . . A 52 GLU HG3 . 18047 1 585 . 1 1 52 52 GLU CA C 13 55.785 0.160 . 1 . . . A 52 GLU CA . 18047 1 586 . 1 1 52 52 GLU CB C 13 30.000 0.160 . 1 . . . A 52 GLU CB . 18047 1 587 . 1 1 52 52 GLU CG C 13 36.439 0.160 . 1 . . . A 52 GLU CG . 18047 1 588 . 1 1 52 52 GLU N N 15 113.104 0.130 . 1 . . . A 52 GLU N . 18047 1 589 . 1 1 53 53 LYS H H 1 8.082 0.003 . 1 . . . A 53 LYS H . 18047 1 590 . 1 1 53 53 LYS HA H 1 4.734 0.003 . 1 . . . A 53 LYS HA . 18047 1 591 . 1 1 53 53 LYS HB2 H 1 1.532 0.003 . 2 . . . A 53 LYS HB2 . 18047 1 592 . 1 1 53 53 LYS HB3 H 1 1.696 0.003 . 2 . . . A 53 LYS HB3 . 18047 1 593 . 1 1 53 53 LYS HG2 H 1 1.235 0.003 . 2 . . . A 53 LYS QG . 18047 1 594 . 1 1 53 53 LYS HG3 H 1 1.235 0.003 . 2 . . . A 53 LYS QG . 18047 1 595 . 1 1 53 53 LYS CA C 13 54.257 0.160 . 1 . . . A 53 LYS CA . 18047 1 596 . 1 1 53 53 LYS CB C 13 36.559 0.160 . 1 . . . A 53 LYS CB . 18047 1 597 . 1 1 53 53 LYS CG C 13 24.099 0.160 . 1 . . . A 53 LYS CG . 18047 1 598 . 1 1 53 53 LYS N N 15 117.761 0.130 . 1 . . . A 53 LYS N . 18047 1 599 . 1 1 54 54 THR H H 1 8.456 0.003 . 1 . . . A 54 THR H . 18047 1 600 . 1 1 54 54 THR HA H 1 4.148 0.003 . 1 . . . A 54 THR HA . 18047 1 601 . 1 1 54 54 THR HG21 H 1 1.083 0.003 . 1 . . . A 54 THR QG2 . 18047 1 602 . 1 1 54 54 THR HG22 H 1 1.083 0.003 . 1 . . . A 54 THR QG2 . 18047 1 603 . 1 1 54 54 THR HG23 H 1 1.083 0.003 . 1 . . . A 54 THR QG2 . 18047 1 604 . 1 1 54 54 THR CA C 13 64.263 0.160 . 1 . . . A 54 THR CA . 18047 1 605 . 1 1 54 54 THR CG2 C 13 22.668 0.160 . 1 . . . A 54 THR CG2 . 18047 1 606 . 1 1 54 54 THR N N 15 117.683 0.130 . 1 . . . A 54 THR N . 18047 1 607 . 1 1 55 55 GLN H H 1 7.808 0.003 . 1 . . . A 55 GLN H . 18047 1 608 . 1 1 55 55 GLN HA H 1 4.706 0.003 . 1 . . . A 55 GLN HA . 18047 1 609 . 1 1 55 55 GLN HB2 H 1 1.426 0.003 . 2 . . . A 55 GLN HB2 . 18047 1 610 . 1 1 55 55 GLN HB3 H 1 1.957 0.003 . 2 . . . A 55 GLN HB3 . 18047 1 611 . 1 1 55 55 GLN HG2 H 1 2.209 0.003 . 2 . . . A 55 GLN HG2 . 18047 1 612 . 1 1 55 55 GLN HG3 H 1 2.344 0.003 . 2 . . . A 55 GLN HG3 . 18047 1 613 . 1 1 55 55 GLN HE21 H 1 7.094 0.003 . 2 . . . A 55 GLN HE21 . 18047 1 614 . 1 1 55 55 GLN HE22 H 1 6.687 0.003 . 2 . . . A 55 GLN HE22 . 18047 1 615 . 1 1 55 55 GLN CA C 13 53.329 0.160 . 1 . . . A 55 GLN CA . 18047 1 616 . 1 1 55 55 GLN CB C 13 31.772 0.160 . 1 . . . A 55 GLN CB . 18047 1 617 . 1 1 55 55 GLN CG C 13 31.346 0.160 . 1 . . . A 55 GLN CG . 18047 1 618 . 1 1 55 55 GLN N N 15 120.501 0.130 . 1 . . . A 55 GLN N . 18047 1 619 . 1 1 55 55 GLN NE2 N 15 108.330 0.130 . 1 . . . A 55 GLN NE2 . 18047 1 620 . 1 1 56 56 ASN H H 1 8.867 0.003 . 1 . . . A 56 ASN H . 18047 1 621 . 1 1 56 56 ASN HA H 1 4.758 0.003 . 1 . . . A 56 ASN HA . 18047 1 622 . 1 1 56 56 ASN HB2 H 1 2.905 0.003 . 2 . . . A 56 ASN HB2 . 18047 1 623 . 1 1 56 56 ASN HB3 H 1 2.386 0.003 . 2 . . . A 56 ASN HB3 . 18047 1 624 . 1 1 56 56 ASN HD21 H 1 6.688 0.003 . 2 . . . A 56 ASN HD21 . 18047 1 625 . 1 1 56 56 ASN HD22 H 1 7.482 0.003 . 2 . . . A 56 ASN HD22 . 18047 1 626 . 1 1 56 56 ASN CA C 13 54.054 0.160 . 1 . . . A 56 ASN CA . 18047 1 627 . 1 1 56 56 ASN CB C 13 40.984 0.160 . 1 . . . A 56 ASN CB . 18047 1 628 . 1 1 56 56 ASN N N 15 119.770 0.130 . 1 . . . A 56 ASN N . 18047 1 629 . 1 1 56 56 ASN ND2 N 15 111.313 0.130 . 1 . . . A 56 ASN ND2 . 18047 1 630 . 1 1 57 57 ILE H H 1 8.527 0.003 . 1 . . . A 57 ILE H . 18047 1 631 . 1 1 57 57 ILE HA H 1 3.194 0.003 . 1 . . . A 57 ILE HA . 18047 1 632 . 1 1 57 57 ILE HB H 1 2.086 0.003 . 1 . . . A 57 ILE HB . 18047 1 633 . 1 1 57 57 ILE HG12 H 1 1.531 0.003 . 2 . . . A 57 ILE HG12 . 18047 1 634 . 1 1 57 57 ILE HG13 H 1 0.579 0.003 . 2 . . . A 57 ILE HG13 . 18047 1 635 . 1 1 57 57 ILE HG21 H 1 0.818 0.003 . 1 . . . A 57 ILE QG2 . 18047 1 636 . 1 1 57 57 ILE HG22 H 1 0.818 0.003 . 1 . . . A 57 ILE QG2 . 18047 1 637 . 1 1 57 57 ILE HG23 H 1 0.818 0.003 . 1 . . . A 57 ILE QG2 . 18047 1 638 . 1 1 57 57 ILE HD11 H 1 0.884 0.003 . 1 . . . A 57 ILE QD1 . 18047 1 639 . 1 1 57 57 ILE HD12 H 1 0.884 0.003 . 1 . . . A 57 ILE QD1 . 18047 1 640 . 1 1 57 57 ILE HD13 H 1 0.884 0.003 . 1 . . . A 57 ILE QD1 . 18047 1 641 . 1 1 57 57 ILE CA C 13 67.562 0.160 . 1 . . . A 57 ILE CA . 18047 1 642 . 1 1 57 57 ILE CB C 13 37.098 0.160 . 1 . . . A 57 ILE CB . 18047 1 643 . 1 1 57 57 ILE CG1 C 13 33.233 0.160 . 1 . . . A 57 ILE CG1 . 18047 1 644 . 1 1 57 57 ILE CG2 C 13 17.413 0.160 . 1 . . . A 57 ILE CG2 . 18047 1 645 . 1 1 57 57 ILE CD1 C 13 14.673 0.160 . 1 . . . A 57 ILE CD1 . 18047 1 646 . 1 1 57 57 ILE N N 15 126.827 0.130 . 1 . . . A 57 ILE N . 18047 1 647 . 1 1 58 58 GLN H H 1 7.916 0.003 . 1 . . . A 58 GLN H . 18047 1 648 . 1 1 58 58 GLN HA H 1 3.723 0.003 . 1 . . . A 58 GLN HA . 18047 1 649 . 1 1 58 58 GLN HB2 H 1 2.122 0.003 . 2 . . . A 58 GLN HB2 . 18047 1 650 . 1 1 58 58 GLN HB3 H 1 2.343 0.003 . 2 . . . A 58 GLN HB3 . 18047 1 651 . 1 1 58 58 GLN HG2 H 1 2.278 0.003 . 2 . . . A 58 GLN HG2 . 18047 1 652 . 1 1 58 58 GLN HG3 H 1 2.209 0.003 . 2 . . . A 58 GLN HG3 . 18047 1 653 . 1 1 58 58 GLN HE21 H 1 7.002 0.003 . 2 . . . A 58 GLN HE21 . 18047 1 654 . 1 1 58 58 GLN HE22 H 1 6.348 0.003 . 2 . . . A 58 GLN HE22 . 18047 1 655 . 1 1 58 58 GLN CA C 13 60.514 0.160 . 1 . . . A 58 GLN CA . 18047 1 656 . 1 1 58 58 GLN CB C 13 27.790 0.160 . 1 . . . A 58 GLN CB . 18047 1 657 . 1 1 58 58 GLN CG C 13 34.182 0.160 . 1 . . . A 58 GLN CG . 18047 1 658 . 1 1 58 58 GLN N N 15 118.287 0.130 . 1 . . . A 58 GLN N . 18047 1 659 . 1 1 58 58 GLN NE2 N 15 107.421 0.130 . 1 . . . A 58 GLN NE2 . 18047 1 660 . 1 1 59 59 LEU H H 1 8.114 0.003 . 1 . . . A 59 LEU H . 18047 1 661 . 1 1 59 59 LEU HA H 1 3.948 0.003 . 1 . . . A 59 LEU HA . 18047 1 662 . 1 1 59 59 LEU HB2 H 1 1.694 0.003 . 2 . . . A 59 LEU HB2 . 18047 1 663 . 1 1 59 59 LEU HB3 H 1 1.550 0.003 . 2 . . . A 59 LEU HB3 . 18047 1 664 . 1 1 59 59 LEU HG H 1 1.577 0.003 . 1 . . . A 59 LEU HG . 18047 1 665 . 1 1 59 59 LEU HD11 H 1 0.733 0.003 . 1 . . . A 59 LEU QD1 . 18047 1 666 . 1 1 59 59 LEU HD12 H 1 0.733 0.003 . 1 . . . A 59 LEU QD1 . 18047 1 667 . 1 1 59 59 LEU HD13 H 1 0.733 0.003 . 1 . . . A 59 LEU QD1 . 18047 1 668 . 1 1 59 59 LEU HD21 H 1 0.799 0.003 . 1 . . . A 59 LEU QD2 . 18047 1 669 . 1 1 59 59 LEU HD22 H 1 0.799 0.003 . 1 . . . A 59 LEU QD2 . 18047 1 670 . 1 1 59 59 LEU HD23 H 1 0.799 0.003 . 1 . . . A 59 LEU QD2 . 18047 1 671 . 1 1 59 59 LEU CA C 13 57.705 0.160 . 1 . . . A 59 LEU CA . 18047 1 672 . 1 1 59 59 LEU CB C 13 41.181 0.160 . 1 . . . A 59 LEU CB . 18047 1 673 . 1 1 59 59 LEU CG C 13 27.032 0.160 . 1 . . . A 59 LEU CG . 18047 1 674 . 1 1 59 59 LEU CD1 C 13 23.387 0.160 . 2 . . . A 59 LEU CD1 . 18047 1 675 . 1 1 59 59 LEU CD2 C 13 25.049 0.160 . 2 . . . A 59 LEU CD2 . 18047 1 676 . 1 1 59 59 LEU N N 15 115.970 0.130 . 1 . . . A 59 LEU N . 18047 1 677 . 1 1 60 60 MET H H 1 7.990 0.003 . 1 . . . A 60 MET H . 18047 1 678 . 1 1 60 60 MET HA H 1 3.433 0.003 . 1 . . . A 60 MET HA . 18047 1 679 . 1 1 60 60 MET HB2 H 1 1.982 0.003 . 2 . . . A 60 MET HB2 . 18047 1 680 . 1 1 60 60 MET HB3 H 1 1.540 0.003 . 2 . . . A 60 MET HB3 . 18047 1 681 . 1 1 60 60 MET HG2 H 1 1.863 0.003 . 2 . . . A 60 MET HG2 . 18047 1 682 . 1 1 60 60 MET HG3 H 1 2.349 0.003 . 2 . . . A 60 MET HG3 . 18047 1 683 . 1 1 60 60 MET HE1 H 1 2.064 0.003 . 1 . . . A 60 MET QE . 18047 1 684 . 1 1 60 60 MET HE2 H 1 2.064 0.003 . 1 . . . A 60 MET QE . 18047 1 685 . 1 1 60 60 MET HE3 H 1 2.064 0.003 . 1 . . . A 60 MET QE . 18047 1 686 . 1 1 60 60 MET CA C 13 60.831 0.160 . 1 . . . A 60 MET CA . 18047 1 687 . 1 1 60 60 MET CB C 13 33.127 0.160 . 1 . . . A 60 MET CB . 18047 1 688 . 1 1 60 60 MET CG C 13 33.985 0.160 . 1 . . . A 60 MET CG . 18047 1 689 . 1 1 60 60 MET CE C 13 18.916 0.160 . 1 . . . A 60 MET CE . 18047 1 690 . 1 1 60 60 MET N N 15 118.876 0.130 . 1 . . . A 60 MET N . 18047 1 691 . 1 1 61 61 ILE H H 1 7.914 0.003 . 1 . . . A 61 ILE H . 18047 1 692 . 1 1 61 61 ILE HA H 1 3.458 0.003 . 1 . . . A 61 ILE HA . 18047 1 693 . 1 1 61 61 ILE HB H 1 1.792 0.003 . 1 . . . A 61 ILE HB . 18047 1 694 . 1 1 61 61 ILE HG12 H 1 0.839 0.003 . 2 . . . A 61 ILE HG12 . 18047 1 695 . 1 1 61 61 ILE HG13 H 1 1.298 0.003 . 2 . . . A 61 ILE HG13 . 18047 1 696 . 1 1 61 61 ILE HG21 H 1 0.517 0.003 . 1 . . . A 61 ILE QG2 . 18047 1 697 . 1 1 61 61 ILE HG22 H 1 0.517 0.003 . 1 . . . A 61 ILE QG2 . 18047 1 698 . 1 1 61 61 ILE HG23 H 1 0.517 0.003 . 1 . . . A 61 ILE QG2 . 18047 1 699 . 1 1 61 61 ILE HD11 H 1 -0.176 0.003 . 1 . . . A 61 ILE QD1 . 18047 1 700 . 1 1 61 61 ILE HD12 H 1 -0.176 0.003 . 1 . . . A 61 ILE QD1 . 18047 1 701 . 1 1 61 61 ILE HD13 H 1 -0.176 0.003 . 1 . . . A 61 ILE QD1 . 18047 1 702 . 1 1 61 61 ILE CA C 13 63.751 0.160 . 1 . . . A 61 ILE CA . 18047 1 703 . 1 1 61 61 ILE CB C 13 35.812 0.160 . 1 . . . A 61 ILE CB . 18047 1 704 . 1 1 61 61 ILE CG1 C 13 27.456 0.160 . 1 . . . A 61 ILE CG1 . 18047 1 705 . 1 1 61 61 ILE CG2 C 13 17.674 0.160 . 1 . . . A 61 ILE CG2 . 18047 1 706 . 1 1 61 61 ILE CD1 C 13 11.314 0.160 . 1 . . . A 61 ILE CD1 . 18047 1 707 . 1 1 61 61 ILE N N 15 115.402 0.130 . 1 . . . A 61 ILE N . 18047 1 708 . 1 1 62 62 GLN H H 1 7.890 0.003 . 1 . . . A 62 GLN H . 18047 1 709 . 1 1 62 62 GLN HA H 1 4.068 0.003 . 1 . . . A 62 GLN HA . 18047 1 710 . 1 1 62 62 GLN HB2 H 1 1.976 0.003 . 2 . . . A 62 GLN QB . 18047 1 711 . 1 1 62 62 GLN HB3 H 1 1.976 0.003 . 2 . . . A 62 GLN QB . 18047 1 712 . 1 1 62 62 GLN HG2 H 1 2.588 0.003 . 2 . . . A 62 GLN HG2 . 18047 1 713 . 1 1 62 62 GLN HG3 H 1 2.374 0.003 . 2 . . . A 62 GLN HG3 . 18047 1 714 . 1 1 62 62 GLN HE21 H 1 6.920 0.003 . 2 . . . A 62 GLN HE21 . 18047 1 715 . 1 1 62 62 GLN HE22 H 1 7.221 0.003 . 2 . . . A 62 GLN HE22 . 18047 1 716 . 1 1 62 62 GLN CA C 13 57.900 0.160 . 1 . . . A 62 GLN CA . 18047 1 717 . 1 1 62 62 GLN CB C 13 28.576 0.160 . 1 . . . A 62 GLN CB . 18047 1 718 . 1 1 62 62 GLN CG C 13 35.255 0.160 . 1 . . . A 62 GLN CG . 18047 1 719 . 1 1 62 62 GLN N N 15 114.407 0.130 . 1 . . . A 62 GLN N . 18047 1 720 . 1 1 62 62 GLN NE2 N 15 109.801 0.130 . 1 . . . A 62 GLN NE2 . 18047 1 721 . 1 1 63 63 SER H H 1 7.570 0.003 . 1 . . . A 63 SER H . 18047 1 722 . 1 1 63 63 SER HA H 1 4.107 0.003 . 1 . . . A 63 SER HA . 18047 1 723 . 1 1 63 63 SER HB2 H 1 3.759 0.003 . 2 . . . A 63 SER HB2 . 18047 1 724 . 1 1 63 63 SER HB3 H 1 3.644 0.003 . 2 . . . A 63 SER HB3 . 18047 1 725 . 1 1 63 63 SER CA C 13 61.235 0.160 . 1 . . . A 63 SER CA . 18047 1 726 . 1 1 63 63 SER CB C 13 63.320 0.160 . 1 . . . A 63 SER CB . 18047 1 727 . 1 1 63 63 SER N N 15 112.761 0.130 . 1 . . . A 63 SER N . 18047 1 728 . 1 1 64 64 PHE H H 1 7.456 0.003 . 1 . . . A 64 PHE H . 18047 1 729 . 1 1 64 64 PHE HA H 1 3.456 0.003 . 1 . . . A 64 PHE HA . 18047 1 730 . 1 1 64 64 PHE HB2 H 1 2.905 0.003 . 2 . . . A 64 PHE HB2 . 18047 1 731 . 1 1 64 64 PHE HB3 H 1 3.157 0.003 . 2 . . . A 64 PHE HB3 . 18047 1 732 . 1 1 64 64 PHE HD1 H 1 6.848 0.003 . 3 . . . A 64 PHE QD . 18047 1 733 . 1 1 64 64 PHE HD2 H 1 6.848 0.003 . 3 . . . A 64 PHE QD . 18047 1 734 . 1 1 64 64 PHE HE1 H 1 6.435 0.003 . 3 . . . A 64 PHE QE . 18047 1 735 . 1 1 64 64 PHE HE2 H 1 6.435 0.003 . 3 . . . A 64 PHE QE . 18047 1 736 . 1 1 64 64 PHE CA C 13 63.826 0.160 . 1 . . . A 64 PHE CA . 18047 1 737 . 1 1 64 64 PHE CB C 13 40.647 0.160 . 1 . . . A 64 PHE CB . 18047 1 738 . 1 1 64 64 PHE CD1 C 13 128.900 0.160 . 3 . . . A 64 PHE CD1 . 18047 1 739 . 1 1 64 64 PHE CD2 C 13 128.901 0.160 . 3 . . . A 64 PHE CD2 . 18047 1 740 . 1 1 64 64 PHE CE1 C 13 127.007 0.160 . 3 . . . A 64 PHE CE1 . 18047 1 741 . 1 1 64 64 PHE CE2 C 13 127.007 0.160 . 3 . . . A 64 PHE CE2 . 18047 1 742 . 1 1 64 64 PHE N N 15 117.901 0.130 . 1 . . . A 64 PHE N . 18047 1 743 . 1 1 65 65 MET H H 1 8.172 0.003 . 1 . . . A 65 MET H . 18047 1 744 . 1 1 65 65 MET HA H 1 4.975 0.003 . 1 . . . A 65 MET HA . 18047 1 745 . 1 1 65 65 MET HB2 H 1 1.368 0.003 . 2 . . . A 65 MET HB2 . 18047 1 746 . 1 1 65 65 MET HB3 H 1 1.986 0.003 . 2 . . . A 65 MET HB3 . 18047 1 747 . 1 1 65 65 MET HE1 H 1 1.856 0.003 . 1 . . . A 65 MET QE . 18047 1 748 . 1 1 65 65 MET HE2 H 1 1.856 0.003 . 1 . . . A 65 MET QE . 18047 1 749 . 1 1 65 65 MET HE3 H 1 1.856 0.003 . 1 . . . A 65 MET QE . 18047 1 750 . 1 1 65 65 MET CA C 13 54.753 0.160 . 1 . . . A 65 MET CA . 18047 1 751 . 1 1 65 65 MET CB C 13 37.189 0.160 . 1 . . . A 65 MET CB . 18047 1 752 . 1 1 65 65 MET CE C 13 16.097 0.160 . 1 . . . A 65 MET CE . 18047 1 753 . 1 1 65 65 MET N N 15 117.747 0.130 . 1 . . . A 65 MET N . 18047 1 754 . 1 1 66 66 GLU H H 1 8.564 0.003 . 1 . . . A 66 GLU H . 18047 1 755 . 1 1 66 66 GLU HA H 1 4.351 0.003 . 1 . . . A 66 GLU HA . 18047 1 756 . 1 1 66 66 GLU HB2 H 1 1.648 0.003 . 2 . . . A 66 GLU HB2 . 18047 1 757 . 1 1 66 66 GLU HB3 H 1 1.551 0.003 . 2 . . . A 66 GLU HB3 . 18047 1 758 . 1 1 66 66 GLU HG2 H 1 1.963 0.003 . 2 . . . A 66 GLU HG2 . 18047 1 759 . 1 1 66 66 GLU HG3 H 1 1.764 0.003 . 2 . . . A 66 GLU HG3 . 18047 1 760 . 1 1 66 66 GLU CA C 13 54.433 0.160 . 1 . . . A 66 GLU CA . 18047 1 761 . 1 1 66 66 GLU CB C 13 33.294 0.160 . 1 . . . A 66 GLU CB . 18047 1 762 . 1 1 66 66 GLU CG C 13 36.779 0.160 . 1 . . . A 66 GLU CG . 18047 1 763 . 1 1 66 66 GLU N N 15 124.224 0.130 . 1 . . . A 66 GLU N . 18047 1 764 . 1 1 67 67 VAL H H 1 7.974 0.003 . 1 . . . A 67 VAL H . 18047 1 765 . 1 1 67 67 VAL HA H 1 4.434 0.003 . 1 . . . A 67 VAL HA . 18047 1 766 . 1 1 67 67 VAL HB H 1 0.912 0.003 . 1 . . . A 67 VAL HB . 18047 1 767 . 1 1 67 67 VAL HG11 H 1 -0.422 0.003 . 1 . . . A 67 VAL QG1 . 18047 1 768 . 1 1 67 67 VAL HG12 H 1 -0.422 0.003 . 1 . . . A 67 VAL QG1 . 18047 1 769 . 1 1 67 67 VAL HG13 H 1 -0.422 0.003 . 1 . . . A 67 VAL QG1 . 18047 1 770 . 1 1 67 67 VAL HG21 H 1 -0.034 0.003 . 1 . . . A 67 VAL QG2 . 18047 1 771 . 1 1 67 67 VAL HG22 H 1 -0.034 0.003 . 1 . . . A 67 VAL QG2 . 18047 1 772 . 1 1 67 67 VAL HG23 H 1 -0.034 0.003 . 1 . . . A 67 VAL QG2 . 18047 1 773 . 1 1 67 67 VAL CA C 13 60.792 0.160 . 1 . . . A 67 VAL CA . 18047 1 774 . 1 1 67 67 VAL CB C 13 33.862 0.160 . 1 . . . A 67 VAL CB . 18047 1 775 . 1 1 67 67 VAL CG1 C 13 21.642 0.160 . 2 . . . A 67 VAL CG1 . 18047 1 776 . 1 1 67 67 VAL CG2 C 13 21.662 0.160 . 2 . . . A 67 VAL CG2 . 18047 1 777 . 1 1 67 67 VAL N N 15 126.029 0.130 . 1 . . . A 67 VAL N . 18047 1 778 . 1 1 68 68 SER H H 1 8.899 0.003 . 1 . . . A 68 SER H . 18047 1 779 . 1 1 68 68 SER HA H 1 5.135 0.003 . 1 . . . A 68 SER HA . 18047 1 780 . 1 1 68 68 SER HB2 H 1 3.381 0.003 . 2 . . . A 68 SER HB2 . 18047 1 781 . 1 1 68 68 SER HB3 H 1 3.629 0.003 . 2 . . . A 68 SER HB3 . 18047 1 782 . 1 1 68 68 SER CA C 13 57.455 0.160 . 1 . . . A 68 SER CA . 18047 1 783 . 1 1 68 68 SER CB C 13 67.691 0.160 . 1 . . . A 68 SER CB . 18047 1 784 . 1 1 68 68 SER N N 15 118.914 0.130 . 1 . . . A 68 SER N . 18047 1 785 . 1 1 69 69 GLN H H 1 8.287 0.003 . 1 . . . A 69 GLN H . 18047 1 786 . 1 1 69 69 GLN HA H 1 4.610 0.003 . 1 . . . A 69 GLN HA . 18047 1 787 . 1 1 69 69 GLN HB2 H 1 1.845 0.003 . 2 . . . A 69 GLN HB2 . 18047 1 788 . 1 1 69 69 GLN HB3 H 1 1.993 0.003 . 2 . . . A 69 GLN HB3 . 18047 1 789 . 1 1 69 69 GLN HG2 H 1 2.351 0.003 . 2 . . . A 69 GLN HG2 . 18047 1 790 . 1 1 69 69 GLN HG3 H 1 2.853 0.003 . 2 . . . A 69 GLN HG3 . 18047 1 791 . 1 1 69 69 GLN HE21 H 1 7.677 0.003 . 2 . . . A 69 GLN HE21 . 18047 1 792 . 1 1 69 69 GLN HE22 H 1 6.773 0.003 . 2 . . . A 69 GLN HE22 . 18047 1 793 . 1 1 69 69 GLN CA C 13 56.376 0.160 . 1 . . . A 69 GLN CA . 18047 1 794 . 1 1 69 69 GLN CB C 13 35.685 0.160 . 1 . . . A 69 GLN CB . 18047 1 795 . 1 1 69 69 GLN CG C 13 38.133 0.160 . 1 . . . A 69 GLN CG . 18047 1 796 . 1 1 69 69 GLN N N 15 113.036 0.130 . 1 . . . A 69 GLN N . 18047 1 797 . 1 1 69 69 GLN NE2 N 15 116.549 0.130 . 1 . . . A 69 GLN NE2 . 18047 1 798 . 1 1 70 70 THR H H 1 8.393 0.003 . 1 . . . A 70 THR H . 18047 1 799 . 1 1 70 70 THR HA H 1 4.510 0.003 . 1 . . . A 70 THR HA . 18047 1 800 . 1 1 70 70 THR HB H 1 3.709 0.003 . 1 . . . A 70 THR HB . 18047 1 801 . 1 1 70 70 THR HG21 H 1 0.803 0.003 . 1 . . . A 70 THR QG2 . 18047 1 802 . 1 1 70 70 THR HG22 H 1 0.803 0.003 . 1 . . . A 70 THR QG2 . 18047 1 803 . 1 1 70 70 THR HG23 H 1 0.803 0.003 . 1 . . . A 70 THR QG2 . 18047 1 804 . 1 1 70 70 THR CA C 13 62.228 0.160 . 1 . . . A 70 THR CA . 18047 1 805 . 1 1 70 70 THR CB C 13 69.190 0.160 . 1 . . . A 70 THR CB . 18047 1 806 . 1 1 70 70 THR CG2 C 13 21.739 0.160 . 1 . . . A 70 THR CG2 . 18047 1 807 . 1 1 70 70 THR N N 15 115.321 0.130 . 1 . . . A 70 THR N . 18047 1 808 . 1 1 71 71 VAL H H 1 8.716 0.003 . 1 . . . A 71 VAL H . 18047 1 809 . 1 1 71 71 VAL HA H 1 3.983 0.003 . 1 . . . A 71 VAL HA . 18047 1 810 . 1 1 71 71 VAL HB H 1 1.746 0.003 . 1 . . . A 71 VAL HB . 18047 1 811 . 1 1 71 71 VAL HG11 H 1 0.677 0.003 . 1 . . . A 71 VAL QG1 . 18047 1 812 . 1 1 71 71 VAL HG12 H 1 0.677 0.003 . 1 . . . A 71 VAL QG1 . 18047 1 813 . 1 1 71 71 VAL HG13 H 1 0.677 0.003 . 1 . . . A 71 VAL QG1 . 18047 1 814 . 1 1 71 71 VAL HG21 H 1 0.612 0.003 . 1 . . . A 71 VAL QG2 . 18047 1 815 . 1 1 71 71 VAL HG22 H 1 0.612 0.003 . 1 . . . A 71 VAL QG2 . 18047 1 816 . 1 1 71 71 VAL HG23 H 1 0.612 0.003 . 1 . . . A 71 VAL QG2 . 18047 1 817 . 1 1 71 71 VAL CA C 13 61.379 0.160 . 1 . . . A 71 VAL CA . 18047 1 818 . 1 1 71 71 VAL CB C 13 34.505 0.160 . 1 . . . A 71 VAL CB . 18047 1 819 . 1 1 71 71 VAL CG1 C 13 21.080 0.160 . 2 . . . A 71 VAL CG1 . 18047 1 820 . 1 1 71 71 VAL CG2 C 13 20.704 0.160 . 2 . . . A 71 VAL CG2 . 18047 1 821 . 1 1 71 71 VAL N N 15 124.536 0.130 . 1 . . . A 71 VAL N . 18047 1 822 . 1 1 72 72 HIS HA H 1 4.253 0.003 . 1 . . . A 72 HIS HA . 18047 1 823 . 1 1 72 72 HIS HB2 H 1 3.262 0.003 . 2 . . . A 72 HIS HB2 . 18047 1 824 . 1 1 72 72 HIS HB3 H 1 3.152 0.003 . 2 . . . A 72 HIS HB3 . 18047 1 825 . 1 1 72 72 HIS HD2 H 1 7.084 0.003 . 1 . . . A 72 HIS HD2 . 18047 1 826 . 1 1 72 72 HIS HE1 H 1 7.969 0.003 . 1 . . . A 72 HIS HE1 . 18047 1 827 . 1 1 72 72 HIS CA C 13 55.959 0.160 . 1 . . . A 72 HIS CA . 18047 1 828 . 1 1 72 72 HIS CB C 13 27.537 0.160 . 1 . . . A 72 HIS CB . 18047 1 829 . 1 1 72 72 HIS CD2 C 13 118.938 0.160 . 1 . . . A 72 HIS CD2 . 18047 1 830 . 1 1 72 72 HIS CE1 C 13 136.188 0.160 . 1 . . . A 72 HIS CE1 . 18047 1 831 . 1 1 73 73 GLY H H 1 8.407 0.003 . 1 . . . A 73 GLY H . 18047 1 832 . 1 1 73 73 GLY HA2 H 1 3.397 0.003 . 2 . . . A 73 GLY HA2 . 18047 1 833 . 1 1 73 73 GLY HA3 H 1 4.008 0.003 . 2 . . . A 73 GLY HA3 . 18047 1 834 . 1 1 73 73 GLY CA C 13 45.529 0.160 . 1 . . . A 73 GLY CA . 18047 1 835 . 1 1 73 73 GLY N N 15 101.723 0.130 . 1 . . . A 73 GLY N . 18047 1 836 . 1 1 74 74 LYS H H 1 7.594 0.003 . 1 . . . A 74 LYS H . 18047 1 837 . 1 1 74 74 LYS HA H 1 4.506 0.003 . 1 . . . A 74 LYS HA . 18047 1 838 . 1 1 74 74 LYS HB2 H 1 1.624 0.003 . 2 . . . A 74 LYS HB2 . 18047 1 839 . 1 1 74 74 LYS HB3 H 1 1.708 0.003 . 2 . . . A 74 LYS HB3 . 18047 1 840 . 1 1 74 74 LYS HG2 H 1 1.298 0.003 . 2 . . . A 74 LYS HG2 . 18047 1 841 . 1 1 74 74 LYS HG3 H 1 1.249 0.003 . 2 . . . A 74 LYS HG3 . 18047 1 842 . 1 1 74 74 LYS HD2 H 1 1.567 0.003 . 2 . . . A 74 LYS QD . 18047 1 843 . 1 1 74 74 LYS HD3 H 1 1.567 0.003 . 2 . . . A 74 LYS QD . 18047 1 844 . 1 1 74 74 LYS CA C 13 54.335 0.160 . 1 . . . A 74 LYS CA . 18047 1 845 . 1 1 74 74 LYS CB C 13 35.167 0.160 . 1 . . . A 74 LYS CB . 18047 1 846 . 1 1 74 74 LYS CG C 13 24.460 0.160 . 1 . . . A 74 LYS CG . 18047 1 847 . 1 1 74 74 LYS CD C 13 29.128 0.160 . 1 . . . A 74 LYS CD . 18047 1 848 . 1 1 74 74 LYS N N 15 119.652 0.130 . 1 . . . A 74 LYS N . 18047 1 849 . 1 1 75 75 ALA H H 1 8.461 0.003 . 1 . . . A 75 ALA H . 18047 1 850 . 1 1 75 75 ALA HA H 1 4.163 0.003 . 1 . . . A 75 ALA HA . 18047 1 851 . 1 1 75 75 ALA HB1 H 1 1.023 0.003 . 1 . . . A 75 ALA QB . 18047 1 852 . 1 1 75 75 ALA HB2 H 1 1.023 0.003 . 1 . . . A 75 ALA QB . 18047 1 853 . 1 1 75 75 ALA HB3 H 1 1.023 0.003 . 1 . . . A 75 ALA QB . 18047 1 854 . 1 1 75 75 ALA CA C 13 52.616 0.160 . 1 . . . A 75 ALA CA . 18047 1 855 . 1 1 75 75 ALA CB C 13 19.103 0.160 . 1 . . . A 75 ALA CB . 18047 1 856 . 1 1 75 75 ALA N N 15 126.103 0.130 . 1 . . . A 75 ALA N . 18047 1 857 . 1 1 76 76 GLN H H 1 8.755 0.003 . 1 . . . A 76 GLN H . 18047 1 858 . 1 1 76 76 GLN HA H 1 4.424 0.003 . 1 . . . A 76 GLN HA . 18047 1 859 . 1 1 76 76 GLN HB2 H 1 1.765 0.003 . 2 . . . A 76 GLN HB2 . 18047 1 860 . 1 1 76 76 GLN HB3 H 1 1.884 0.003 . 2 . . . A 76 GLN HB3 . 18047 1 861 . 1 1 76 76 GLN HG2 H 1 2.181 0.003 . 2 . . . A 76 GLN QG . 18047 1 862 . 1 1 76 76 GLN HG3 H 1 2.181 0.003 . 2 . . . A 76 GLN QG . 18047 1 863 . 1 1 76 76 GLN HE21 H 1 7.426 0.003 . 2 . . . A 76 GLN HE21 . 18047 1 864 . 1 1 76 76 GLN HE22 H 1 6.751 0.003 . 2 . . . A 76 GLN HE22 . 18047 1 865 . 1 1 76 76 GLN CA C 13 54.344 0.160 . 1 . . . A 76 GLN CA . 18047 1 866 . 1 1 76 76 GLN CB C 13 31.224 0.160 . 1 . . . A 76 GLN CB . 18047 1 867 . 1 1 76 76 GLN CG C 13 33.827 0.160 . 1 . . . A 76 GLN CG . 18047 1 868 . 1 1 76 76 GLN N N 15 122.907 0.130 . 1 . . . A 76 GLN N . 18047 1 869 . 1 1 76 76 GLN NE2 N 15 110.645 0.130 . 1 . . . A 76 GLN NE2 . 18047 1 870 . 1 1 77 77 ASN H H 1 8.604 0.003 . 1 . . . A 77 ASN H . 18047 1 871 . 1 1 77 77 ASN HA H 1 4.631 0.003 . 1 . . . A 77 ASN HA . 18047 1 872 . 1 1 77 77 ASN HB2 H 1 2.519 0.003 . 2 . . . A 77 ASN HB2 . 18047 1 873 . 1 1 77 77 ASN HB3 H 1 2.723 0.003 . 2 . . . A 77 ASN HB3 . 18047 1 874 . 1 1 77 77 ASN HD21 H 1 6.670 0.003 . 2 . . . A 77 ASN HD21 . 18047 1 875 . 1 1 77 77 ASN HD22 H 1 7.196 0.003 . 2 . . . A 77 ASN HD22 . 18047 1 876 . 1 1 77 77 ASN CA C 13 53.665 0.160 . 1 . . . A 77 ASN CA . 18047 1 877 . 1 1 77 77 ASN CB C 13 37.800 0.160 . 1 . . . A 77 ASN CB . 18047 1 878 . 1 1 77 77 ASN N N 15 123.222 0.130 . 1 . . . A 77 ASN N . 18047 1 879 . 1 1 77 77 ASN ND2 N 15 108.297 0.130 . 1 . . . A 77 ASN ND2 . 18047 1 880 . 1 1 78 78 LEU H H 1 8.385 0.003 . 1 . . . A 78 LEU H . 18047 1 881 . 1 1 78 78 LEU HA H 1 4.462 0.003 . 1 . . . A 78 LEU HA . 18047 1 882 . 1 1 78 78 LEU HB2 H 1 1.427 0.003 . 2 . . . A 78 LEU QB . 18047 1 883 . 1 1 78 78 LEU HB3 H 1 1.427 0.003 . 2 . . . A 78 LEU QB . 18047 1 884 . 1 1 78 78 LEU HG H 1 1.319 0.003 . 1 . . . A 78 LEU HG . 18047 1 885 . 1 1 78 78 LEU HD11 H 1 0.683 0.003 . 1 . . . A 78 LEU QD1 . 18047 1 886 . 1 1 78 78 LEU HD12 H 1 0.683 0.003 . 1 . . . A 78 LEU QD1 . 18047 1 887 . 1 1 78 78 LEU HD13 H 1 0.683 0.003 . 1 . . . A 78 LEU QD1 . 18047 1 888 . 1 1 78 78 LEU HD21 H 1 1.038 0.003 . 1 . . . A 78 LEU QD2 . 18047 1 889 . 1 1 78 78 LEU HD22 H 1 1.038 0.003 . 1 . . . A 78 LEU QD2 . 18047 1 890 . 1 1 78 78 LEU HD23 H 1 1.038 0.003 . 1 . . . A 78 LEU QD2 . 18047 1 891 . 1 1 78 78 LEU CA C 13 54.399 0.160 . 1 . . . A 78 LEU CA . 18047 1 892 . 1 1 78 78 LEU CB C 13 40.109 0.160 . 1 . . . A 78 LEU CB . 18047 1 893 . 1 1 78 78 LEU CG C 13 27.150 0.160 . 1 . . . A 78 LEU CG . 18047 1 894 . 1 1 78 78 LEU CD1 C 13 26.266 0.160 . 2 . . . A 78 LEU CD1 . 18047 1 895 . 1 1 78 78 LEU CD2 C 13 21.540 0.160 . 2 . . . A 78 LEU CD2 . 18047 1 896 . 1 1 78 78 LEU N N 15 120.379 0.130 . 1 . . . A 78 LEU N . 18047 1 897 . 1 1 79 79 GLN H H 1 9.012 0.003 . 1 . . . A 79 GLN H . 18047 1 898 . 1 1 79 79 GLN HA H 1 4.351 0.003 . 1 . . . A 79 GLN HA . 18047 1 899 . 1 1 79 79 GLN HB2 H 1 2.108 0.003 . 2 . . . A 79 GLN HB2 . 18047 1 900 . 1 1 79 79 GLN HB3 H 1 1.825 0.003 . 2 . . . A 79 GLN HB3 . 18047 1 901 . 1 1 79 79 GLN HG2 H 1 2.358 0.003 . 2 . . . A 79 GLN HG2 . 18047 1 902 . 1 1 79 79 GLN HG3 H 1 2.383 0.003 . 2 . . . A 79 GLN HG3 . 18047 1 903 . 1 1 79 79 GLN HE21 H 1 7.388 0.003 . 2 . . . A 79 GLN HE21 . 18047 1 904 . 1 1 79 79 GLN HE22 H 1 6.807 0.003 . 2 . . . A 79 GLN HE22 . 18047 1 905 . 1 1 79 79 GLN CA C 13 54.189 0.160 . 1 . . . A 79 GLN CA . 18047 1 906 . 1 1 79 79 GLN CB C 13 30.978 0.160 . 1 . . . A 79 GLN CB . 18047 1 907 . 1 1 79 79 GLN CG C 13 34.069 0.160 . 1 . . . A 79 GLN CG . 18047 1 908 . 1 1 79 79 GLN N N 15 119.736 0.130 . 1 . . . A 79 GLN N . 18047 1 909 . 1 1 79 79 GLN NE2 N 15 112.059 0.130 . 1 . . . A 79 GLN NE2 . 18047 1 910 . 1 1 80 80 TYR H H 1 8.108 0.003 . 1 . . . A 80 TYR H . 18047 1 911 . 1 1 80 80 TYR HA H 1 4.407 0.003 . 1 . . . A 80 TYR HA . 18047 1 912 . 1 1 80 80 TYR HB2 H 1 2.837 0.003 . 2 . . . A 80 TYR HB2 . 18047 1 913 . 1 1 80 80 TYR HB3 H 1 2.738 0.003 . 2 . . . A 80 TYR HB3 . 18047 1 914 . 1 1 80 80 TYR HD1 H 1 6.571 0.003 . 3 . . . A 80 TYR QD . 18047 1 915 . 1 1 80 80 TYR HD2 H 1 6.571 0.003 . 3 . . . A 80 TYR QD . 18047 1 916 . 1 1 80 80 TYR HE1 H 1 6.252 0.003 . 3 . . . A 80 TYR QE . 18047 1 917 . 1 1 80 80 TYR HE2 H 1 6.252 0.003 . 3 . . . A 80 TYR QE . 18047 1 918 . 1 1 80 80 TYR CA C 13 57.706 0.160 . 1 . . . A 80 TYR CA . 18047 1 919 . 1 1 80 80 TYR CB C 13 39.071 0.160 . 1 . . . A 80 TYR CB . 18047 1 920 . 1 1 80 80 TYR CD1 C 13 132.496 0.160 . 3 . . . A 80 TYR CD1 . 18047 1 921 . 1 1 80 80 TYR CD2 C 13 132.496 0.160 . 3 . . . A 80 TYR CD2 . 18047 1 922 . 1 1 80 80 TYR CE1 C 13 117.217 0.160 . 3 . . . A 80 TYR CE1 . 18047 1 923 . 1 1 80 80 TYR CE2 C 13 117.217 0.160 . 3 . . . A 80 TYR CE2 . 18047 1 924 . 1 1 80 80 TYR N N 15 121.366 0.130 . 1 . . . A 80 TYR N . 18047 1 925 . 1 1 81 81 ALA H H 1 7.087 0.003 . 1 . . . A 81 ALA H . 18047 1 926 . 1 1 81 81 ALA HA H 1 4.293 0.003 . 1 . . . A 81 ALA HA . 18047 1 927 . 1 1 81 81 ALA HB1 H 1 0.669 0.003 . 1 . . . A 81 ALA QB . 18047 1 928 . 1 1 81 81 ALA HB2 H 1 0.669 0.003 . 1 . . . A 81 ALA QB . 18047 1 929 . 1 1 81 81 ALA HB3 H 1 0.669 0.003 . 1 . . . A 81 ALA QB . 18047 1 930 . 1 1 81 81 ALA CA C 13 50.563 0.160 . 1 . . . A 81 ALA CA . 18047 1 931 . 1 1 81 81 ALA CB C 13 20.178 0.160 . 1 . . . A 81 ALA CB . 18047 1 932 . 1 1 81 81 ALA N N 15 130.881 0.130 . 1 . . . A 81 ALA N . 18047 1 933 . 1 1 82 82 VAL H H 1 8.741 0.003 . 1 . . . A 82 VAL H . 18047 1 934 . 1 1 82 82 VAL HA H 1 3.621 0.003 . 1 . . . A 82 VAL HA . 18047 1 935 . 1 1 82 82 VAL HB H 1 1.834 0.003 . 1 . . . A 82 VAL HB . 18047 1 936 . 1 1 82 82 VAL HG11 H 1 0.247 0.003 . 1 . . . A 82 VAL QG1 . 18047 1 937 . 1 1 82 82 VAL HG12 H 1 0.247 0.003 . 1 . . . A 82 VAL QG1 . 18047 1 938 . 1 1 82 82 VAL HG13 H 1 0.247 0.003 . 1 . . . A 82 VAL QG1 . 18047 1 939 . 1 1 82 82 VAL HG21 H 1 0.824 0.003 . 1 . . . A 82 VAL QG2 . 18047 1 940 . 1 1 82 82 VAL HG22 H 1 0.824 0.003 . 1 . . . A 82 VAL QG2 . 18047 1 941 . 1 1 82 82 VAL HG23 H 1 0.824 0.003 . 1 . . . A 82 VAL QG2 . 18047 1 942 . 1 1 82 82 VAL CA C 13 63.290 0.160 . 1 . . . A 82 VAL CA . 18047 1 943 . 1 1 82 82 VAL CB C 13 31.566 0.160 . 1 . . . A 82 VAL CB . 18047 1 944 . 1 1 82 82 VAL CG1 C 13 21.005 0.160 . 2 . . . A 82 VAL CG1 . 18047 1 945 . 1 1 82 82 VAL CG2 C 13 21.417 0.160 . 2 . . . A 82 VAL CG2 . 18047 1 946 . 1 1 82 82 VAL N N 15 121.155 0.130 . 1 . . . A 82 VAL N . 18047 1 947 . 1 1 83 83 LEU H H 1 8.186 0.003 . 1 . . . A 83 LEU H . 18047 1 948 . 1 1 83 83 LEU HA H 1 4.675 0.003 . 1 . . . A 83 LEU HA . 18047 1 949 . 1 1 83 83 LEU HB2 H 1 1.601 0.003 . 2 . . . A 83 LEU HB2 . 18047 1 950 . 1 1 83 83 LEU HB3 H 1 1.360 0.003 . 2 . . . A 83 LEU HB3 . 18047 1 951 . 1 1 83 83 LEU HG H 1 1.483 0.003 . 1 . . . A 83 LEU HG . 18047 1 952 . 1 1 83 83 LEU HD11 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 953 . 1 1 83 83 LEU HD12 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 954 . 1 1 83 83 LEU HD13 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 955 . 1 1 83 83 LEU HD21 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 956 . 1 1 83 83 LEU HD22 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 957 . 1 1 83 83 LEU HD23 H 1 0.780 0.003 . 1 . . . A 83 LEU QQD . 18047 1 958 . 1 1 83 83 LEU CA C 13 53.754 0.160 . 1 . . . A 83 LEU CA . 18047 1 959 . 1 1 83 83 LEU CB C 13 45.358 0.160 . 1 . . . A 83 LEU CB . 18047 1 960 . 1 1 83 83 LEU CG C 13 26.994 0.160 . 1 . . . A 83 LEU CG . 18047 1 961 . 1 1 83 83 LEU CD1 C 13 26.212 0.160 . 2 . . . A 83 LEU CD1 . 18047 1 962 . 1 1 83 83 LEU CD2 C 13 26.250 0.160 . 2 . . . A 83 LEU CD2 . 18047 1 963 . 1 1 83 83 LEU N N 15 126.312 0.130 . 1 . . . A 83 LEU N . 18047 1 964 . 1 1 84 84 THR H H 1 8.562 0.003 . 1 . . . A 84 THR H . 18047 1 965 . 1 1 84 84 THR HA H 1 4.271 0.003 . 1 . . . A 84 THR HA . 18047 1 966 . 1 1 84 84 THR HB H 1 4.063 0.003 . 1 . . . A 84 THR HB . 18047 1 967 . 1 1 84 84 THR HG21 H 1 1.031 0.003 . 1 . . . A 84 THR QG2 . 18047 1 968 . 1 1 84 84 THR HG22 H 1 1.031 0.003 . 1 . . . A 84 THR QG2 . 18047 1 969 . 1 1 84 84 THR HG23 H 1 1.031 0.003 . 1 . . . A 84 THR QG2 . 18047 1 970 . 1 1 84 84 THR CA C 13 61.429 0.160 . 1 . . . A 84 THR CA . 18047 1 971 . 1 1 84 84 THR CB C 13 69.548 0.160 . 1 . . . A 84 THR CB . 18047 1 972 . 1 1 84 84 THR CG2 C 13 22.271 0.160 . 1 . . . A 84 THR CG2 . 18047 1 973 . 1 1 84 84 THR N N 15 111.971 0.130 . 1 . . . A 84 THR N . 18047 1 974 . 1 1 85 85 ASP H H 1 8.230 0.003 . 1 . . . A 85 ASP H . 18047 1 975 . 1 1 85 85 ASP HA H 1 4.423 0.003 . 1 . . . A 85 ASP HA . 18047 1 976 . 1 1 85 85 ASP HB2 H 1 2.459 0.003 . 2 . . . A 85 ASP HB2 . 18047 1 977 . 1 1 85 85 ASP HB3 H 1 2.565 0.003 . 2 . . . A 85 ASP HB3 . 18047 1 978 . 1 1 85 85 ASP CA C 13 53.912 0.160 . 1 . . . A 85 ASP CA . 18047 1 979 . 1 1 85 85 ASP CB C 13 41.526 0.160 . 1 . . . A 85 ASP CB . 18047 1 980 . 1 1 85 85 ASP N N 15 120.660 0.130 . 1 . . . A 85 ASP N . 18047 1 981 . 1 1 86 86 SER H H 1 8.491 0.003 . 1 . . . A 86 SER H . 18047 1 982 . 1 1 86 86 SER HA H 1 4.760 0.003 . 1 . . . A 86 SER HA . 18047 1 983 . 1 1 86 86 SER HB2 H 1 3.305 0.003 . 2 . . . A 86 SER HB2 . 18047 1 984 . 1 1 86 86 SER HB3 H 1 3.854 0.003 . 2 . . . A 86 SER HB3 . 18047 1 985 . 1 1 86 86 SER CA C 13 55.841 0.160 . 1 . . . A 86 SER CA . 18047 1 986 . 1 1 86 86 SER CB C 13 65.439 0.160 . 1 . . . A 86 SER CB . 18047 1 987 . 1 1 86 86 SER N N 15 111.879 0.130 . 1 . . . A 86 SER N . 18047 1 988 . 1 1 87 87 PRO HA H 1 4.264 0.003 . 1 . . . A 87 PRO HA . 18047 1 989 . 1 1 87 87 PRO HB2 H 1 1.849 0.003 . 2 . . . A 87 PRO HB2 . 18047 1 990 . 1 1 87 87 PRO HB3 H 1 0.753 0.003 . 2 . . . A 87 PRO HB3 . 18047 1 991 . 1 1 87 87 PRO HG2 H 1 1.655 0.003 . 2 . . . A 87 PRO HG2 . 18047 1 992 . 1 1 87 87 PRO HG3 H 1 1.143 0.003 . 2 . . . A 87 PRO HG3 . 18047 1 993 . 1 1 87 87 PRO HD2 H 1 3.452 0.003 . 2 . . . A 87 PRO HD2 . 18047 1 994 . 1 1 87 87 PRO HD3 H 1 3.763 0.003 . 2 . . . A 87 PRO HD3 . 18047 1 995 . 1 1 87 87 PRO CA C 13 63.136 0.160 . 1 . . . A 87 PRO CA . 18047 1 996 . 1 1 87 87 PRO CB C 13 31.420 0.160 . 1 . . . A 87 PRO CB . 18047 1 997 . 1 1 87 87 PRO CG C 13 26.561 0.160 . 1 . . . A 87 PRO CG . 18047 1 998 . 1 1 87 87 PRO CD C 13 51.212 0.160 . 1 . . . A 87 PRO CD . 18047 1 999 . 1 1 88 88 PHE H H 1 7.530 0.003 . 1 . . . A 88 PHE H . 18047 1 1000 . 1 1 88 88 PHE HA H 1 4.850 0.003 . 1 . . . A 88 PHE HA . 18047 1 1001 . 1 1 88 88 PHE HB2 H 1 2.938 0.003 . 2 . . . A 88 PHE HB2 . 18047 1 1002 . 1 1 88 88 PHE HB3 H 1 1.735 0.003 . 2 . . . A 88 PHE HB3 . 18047 1 1003 . 1 1 88 88 PHE HD1 H 1 5.914 0.003 . 3 . . . A 88 PHE QD . 18047 1 1004 . 1 1 88 88 PHE HD2 H 1 5.914 0.003 . 3 . . . A 88 PHE QD . 18047 1 1005 . 1 1 88 88 PHE HE1 H 1 6.662 0.003 . 3 . . . A 88 PHE QE . 18047 1 1006 . 1 1 88 88 PHE HE2 H 1 6.662 0.003 . 3 . . . A 88 PHE QE . 18047 1 1007 . 1 1 88 88 PHE HZ H 1 6.334 0.003 . 1 . . . A 88 PHE HZ . 18047 1 1008 . 1 1 88 88 PHE CA C 13 55.237 0.160 . 1 . . . A 88 PHE CA . 18047 1 1009 . 1 1 88 88 PHE CB C 13 38.836 0.160 . 1 . . . A 88 PHE CB . 18047 1 1010 . 1 1 88 88 PHE CD1 C 13 129.909 0.160 . 3 . . . A 88 PHE CD1 . 18047 1 1011 . 1 1 88 88 PHE CD2 C 13 129.909 0.160 . 3 . . . A 88 PHE CD2 . 18047 1 1012 . 1 1 88 88 PHE CE1 C 13 129.942 0.160 . 3 . . . A 88 PHE CE1 . 18047 1 1013 . 1 1 88 88 PHE CE2 C 13 129.941 0.160 . 3 . . . A 88 PHE CE2 . 18047 1 1014 . 1 1 88 88 PHE CZ C 13 128.334 0.160 . 1 . . . A 88 PHE CZ . 18047 1 1015 . 1 1 88 88 PHE N N 15 114.380 0.130 . 1 . . . A 88 PHE N . 18047 1 1016 . 1 1 89 89 GLN H H 1 7.159 0.003 . 1 . . . A 89 GLN H . 18047 1 1017 . 1 1 89 89 GLN HA H 1 3.508 0.003 . 1 . . . A 89 GLN HA . 18047 1 1018 . 1 1 89 89 GLN HB2 H 1 2.366 0.003 . 2 . . . A 89 GLN HB2 . 18047 1 1019 . 1 1 89 89 GLN HB3 H 1 1.894 0.003 . 2 . . . A 89 GLN HB3 . 18047 1 1020 . 1 1 89 89 GLN HG2 H 1 2.302 0.003 . 2 . . . A 89 GLN QG . 18047 1 1021 . 1 1 89 89 GLN HG3 H 1 2.302 0.003 . 2 . . . A 89 GLN QG . 18047 1 1022 . 1 1 89 89 GLN HE21 H 1 6.586 0.003 . 2 . . . A 89 GLN HE21 . 18047 1 1023 . 1 1 89 89 GLN HE22 H 1 7.948 0.003 . 2 . . . A 89 GLN HE22 . 18047 1 1024 . 1 1 89 89 GLN CA C 13 59.421 0.160 . 1 . . . A 89 GLN CA . 18047 1 1025 . 1 1 89 89 GLN CB C 13 29.214 0.160 . 1 . . . A 89 GLN CB . 18047 1 1026 . 1 1 89 89 GLN CG C 13 33.148 0.160 . 1 . . . A 89 GLN CG . 18047 1 1027 . 1 1 89 89 GLN N N 15 120.034 0.130 . 1 . . . A 89 GLN N . 18047 1 1028 . 1 1 89 89 GLN NE2 N 15 114.665 0.130 . 1 . . . A 89 GLN NE2 . 18047 1 1029 . 1 1 90 90 ASP H H 1 8.613 0.003 . 1 . . . A 90 ASP H . 18047 1 1030 . 1 1 90 90 ASP HA H 1 4.191 0.003 . 1 . . . A 90 ASP HA . 18047 1 1031 . 1 1 90 90 ASP HB2 H 1 2.616 0.003 . 2 . . . A 90 ASP HB2 . 18047 1 1032 . 1 1 90 90 ASP HB3 H 1 2.494 0.003 . 2 . . . A 90 ASP HB3 . 18047 1 1033 . 1 1 90 90 ASP CA C 13 56.751 0.160 . 1 . . . A 90 ASP CA . 18047 1 1034 . 1 1 90 90 ASP CB C 13 39.127 0.160 . 1 . . . A 90 ASP CB . 18047 1 1035 . 1 1 90 90 ASP N N 15 113.912 0.130 . 1 . . . A 90 ASP N . 18047 1 1036 . 1 1 91 91 LYS H H 1 7.255 0.003 . 1 . . . A 91 LYS H . 18047 1 1037 . 1 1 91 91 LYS HA H 1 4.037 0.003 . 1 . . . A 91 LYS HA . 18047 1 1038 . 1 1 91 91 LYS HB2 H 1 1.324 0.003 . 2 . . . A 91 LYS HB2 . 18047 1 1039 . 1 1 91 91 LYS HB3 H 1 1.614 0.003 . 2 . . . A 91 LYS HB3 . 18047 1 1040 . 1 1 91 91 LYS HG2 H 1 1.087 0.003 . 2 . . . A 91 LYS HG2 . 18047 1 1041 . 1 1 91 91 LYS HG3 H 1 1.403 0.003 . 2 . . . A 91 LYS HG3 . 18047 1 1042 . 1 1 91 91 LYS HD2 H 1 1.238 0.003 . 2 . . . A 91 LYS HD2 . 18047 1 1043 . 1 1 91 91 LYS HD3 H 1 1.193 0.003 . 2 . . . A 91 LYS HD3 . 18047 1 1044 . 1 1 91 91 LYS CA C 13 58.560 0.160 . 1 . . . A 91 LYS CA . 18047 1 1045 . 1 1 91 91 LYS CB C 13 34.402 0.160 . 1 . . . A 91 LYS CB . 18047 1 1046 . 1 1 91 91 LYS CG C 13 26.136 0.160 . 1 . . . A 91 LYS CG . 18047 1 1047 . 1 1 91 91 LYS CD C 13 29.712 0.160 . 1 . . . A 91 LYS CD . 18047 1 1048 . 1 1 91 91 LYS N N 15 117.511 0.130 . 1 . . . A 91 LYS N . 18047 1 1049 . 1 1 92 92 LEU H H 1 8.073 0.003 . 1 . . . A 92 LEU H . 18047 1 1050 . 1 1 92 92 LEU HA H 1 4.192 0.003 . 1 . . . A 92 LEU HA . 18047 1 1051 . 1 1 92 92 LEU HB2 H 1 1.422 0.003 . 2 . . . A 92 LEU HB2 . 18047 1 1052 . 1 1 92 92 LEU HB3 H 1 1.847 0.003 . 2 . . . A 92 LEU HB3 . 18047 1 1053 . 1 1 92 92 LEU HG H 1 1.517 0.003 . 1 . . . A 92 LEU HG . 18047 1 1054 . 1 1 92 92 LEU HD11 H 1 0.819 0.003 . 1 . . . A 92 LEU QD1 . 18047 1 1055 . 1 1 92 92 LEU HD12 H 1 0.819 0.003 . 1 . . . A 92 LEU QD1 . 18047 1 1056 . 1 1 92 92 LEU HD13 H 1 0.819 0.003 . 1 . . . A 92 LEU QD1 . 18047 1 1057 . 1 1 92 92 LEU HD21 H 1 0.663 0.003 . 1 . . . A 92 LEU QD2 . 18047 1 1058 . 1 1 92 92 LEU HD22 H 1 0.663 0.003 . 1 . . . A 92 LEU QD2 . 18047 1 1059 . 1 1 92 92 LEU HD23 H 1 0.663 0.003 . 1 . . . A 92 LEU QD2 . 18047 1 1060 . 1 1 92 92 LEU CA C 13 57.164 0.160 . 1 . . . A 92 LEU CA . 18047 1 1061 . 1 1 92 92 LEU CB C 13 42.008 0.160 . 1 . . . A 92 LEU CB . 18047 1 1062 . 1 1 92 92 LEU CG C 13 26.496 0.160 . 1 . . . A 92 LEU CG . 18047 1 1063 . 1 1 92 92 LEU CD1 C 13 26.480 0.160 . 2 . . . A 92 LEU CD1 . 18047 1 1064 . 1 1 92 92 LEU CD2 C 13 22.985 0.160 . 2 . . . A 92 LEU CD2 . 18047 1 1065 . 1 1 92 92 LEU N N 15 120.101 0.130 . 1 . . . A 92 LEU N . 18047 1 1066 . 1 1 93 93 ASP H H 1 8.623 0.003 . 1 . . . A 93 ASP H . 18047 1 1067 . 1 1 93 93 ASP HA H 1 4.303 0.003 . 1 . . . A 93 ASP HA . 18047 1 1068 . 1 1 93 93 ASP HB2 H 1 2.616 0.003 . 2 . . . A 93 ASP HB2 . 18047 1 1069 . 1 1 93 93 ASP HB3 H 1 2.676 0.003 . 2 . . . A 93 ASP HB3 . 18047 1 1070 . 1 1 93 93 ASP CA C 13 56.796 0.160 . 1 . . . A 93 ASP CA . 18047 1 1071 . 1 1 93 93 ASP CB C 13 40.124 0.160 . 1 . . . A 93 ASP CB . 18047 1 1072 . 1 1 93 93 ASP N N 15 119.083 0.130 . 1 . . . A 93 ASP N . 18047 1 1073 . 1 1 94 94 ARG H H 1 7.090 0.003 . 1 . . . A 94 ARG H . 18047 1 1074 . 1 1 94 94 ARG HA H 1 4.255 0.003 . 1 . . . A 94 ARG HA . 18047 1 1075 . 1 1 94 94 ARG HB2 H 1 1.933 0.003 . 2 . . . A 94 ARG QB . 18047 1 1076 . 1 1 94 94 ARG HB3 H 1 1.933 0.003 . 2 . . . A 94 ARG QB . 18047 1 1077 . 1 1 94 94 ARG HG2 H 1 1.854 0.003 . 2 . . . A 94 ARG HG2 . 18047 1 1078 . 1 1 94 94 ARG HG3 H 1 1.987 0.003 . 2 . . . A 94 ARG HG3 . 18047 1 1079 . 1 1 94 94 ARG HD2 H 1 3.208 0.003 . 2 . . . A 94 ARG HD2 . 18047 1 1080 . 1 1 94 94 ARG HD3 H 1 3.308 0.003 . 2 . . . A 94 ARG HD3 . 18047 1 1081 . 1 1 94 94 ARG HE H 1 7.518 0.003 . 1 . . . A 94 ARG HE . 18047 1 1082 . 1 1 94 94 ARG CA C 13 56.670 0.160 . 1 . . . A 94 ARG CA . 18047 1 1083 . 1 1 94 94 ARG CB C 13 29.763 0.160 . 1 . . . A 94 ARG CB . 18047 1 1084 . 1 1 94 94 ARG CG C 13 26.829 0.160 . 1 . . . A 94 ARG CG . 18047 1 1085 . 1 1 94 94 ARG CD C 13 43.290 0.160 . 1 . . . A 94 ARG CD . 18047 1 1086 . 1 1 94 94 ARG N N 15 114.229 0.130 . 1 . . . A 94 ARG N . 18047 1 1087 . 1 1 94 94 ARG NE N 15 83.412 0.130 . 1 . . . A 94 ARG NE . 18047 1 1088 . 1 1 95 95 LEU H H 1 7.586 0.003 . 1 . . . A 95 LEU H . 18047 1 1089 . 1 1 95 95 LEU HA H 1 3.867 0.003 . 1 . . . A 95 LEU HA . 18047 1 1090 . 1 1 95 95 LEU HB2 H 1 1.937 0.003 . 2 . . . A 95 LEU HB2 . 18047 1 1091 . 1 1 95 95 LEU HB3 H 1 1.584 0.003 . 2 . . . A 95 LEU HB3 . 18047 1 1092 . 1 1 95 95 LEU HG H 1 2.179 0.003 . 1 . . . A 95 LEU HG . 18047 1 1093 . 1 1 95 95 LEU HD11 H 1 1.089 0.003 . 1 . . . A 95 LEU QD1 . 18047 1 1094 . 1 1 95 95 LEU HD12 H 1 1.089 0.003 . 1 . . . A 95 LEU QD1 . 18047 1 1095 . 1 1 95 95 LEU HD13 H 1 1.089 0.003 . 1 . . . A 95 LEU QD1 . 18047 1 1096 . 1 1 95 95 LEU HD21 H 1 1.017 0.003 . 1 . . . A 95 LEU QD2 . 18047 1 1097 . 1 1 95 95 LEU HD22 H 1 1.017 0.003 . 1 . . . A 95 LEU QD2 . 18047 1 1098 . 1 1 95 95 LEU HD23 H 1 1.017 0.003 . 1 . . . A 95 LEU QD2 . 18047 1 1099 . 1 1 95 95 LEU CA C 13 57.695 0.160 . 1 . . . A 95 LEU CA . 18047 1 1100 . 1 1 95 95 LEU CB C 13 41.667 0.160 . 1 . . . A 95 LEU CB . 18047 1 1101 . 1 1 95 95 LEU CG C 13 27.607 0.160 . 1 . . . A 95 LEU CG . 18047 1 1102 . 1 1 95 95 LEU CD1 C 13 26.298 0.160 . 2 . . . A 95 LEU CD1 . 18047 1 1103 . 1 1 95 95 LEU CD2 C 13 23.350 0.160 . 2 . . . A 95 LEU CD2 . 18047 1 1104 . 1 1 95 95 LEU N N 15 114.999 0.130 . 1 . . . A 95 LEU N . 18047 1 1105 . 1 1 96 96 ALA H H 1 6.963 0.003 . 1 . . . A 96 ALA H . 18047 1 1106 . 1 1 96 96 ALA HA H 1 4.337 0.003 . 1 . . . A 96 ALA HA . 18047 1 1107 . 1 1 96 96 ALA HB1 H 1 1.370 0.003 . 1 . . . A 96 ALA QB . 18047 1 1108 . 1 1 96 96 ALA HB2 H 1 1.370 0.003 . 1 . . . A 96 ALA QB . 18047 1 1109 . 1 1 96 96 ALA HB3 H 1 1.370 0.003 . 1 . . . A 96 ALA QB . 18047 1 1110 . 1 1 96 96 ALA CA C 13 51.941 0.160 . 1 . . . A 96 ALA CA . 18047 1 1111 . 1 1 96 96 ALA CB C 13 19.587 0.160 . 1 . . . A 96 ALA CB . 18047 1 1112 . 1 1 96 96 ALA N N 15 114.369 0.130 . 1 . . . A 96 ALA N . 18047 1 1113 . 1 1 97 97 ASP H H 1 7.640 0.003 . 1 . . . A 97 ASP H . 18047 1 1114 . 1 1 97 97 ASP HA H 1 4.720 0.003 . 1 . . . A 97 ASP HA . 18047 1 1115 . 1 1 97 97 ASP HB2 H 1 2.975 0.003 . 2 . . . A 97 ASP HB2 . 18047 1 1116 . 1 1 97 97 ASP HB3 H 1 2.863 0.003 . 2 . . . A 97 ASP HB3 . 18047 1 1117 . 1 1 97 97 ASP CA C 13 53.723 0.160 . 1 . . . A 97 ASP CA . 18047 1 1118 . 1 1 97 97 ASP CB C 13 42.898 0.160 . 1 . . . A 97 ASP CB . 18047 1 1119 . 1 1 97 97 ASP N N 15 118.557 0.130 . 1 . . . A 97 ASP N . 18047 1 1120 . 1 1 98 98 GLU H H 1 8.202 0.003 . 1 . . . A 98 GLU H . 18047 1 1121 . 1 1 98 98 GLU HA H 1 4.932 0.003 . 1 . . . A 98 GLU HA . 18047 1 1122 . 1 1 98 98 GLU HB2 H 1 1.664 0.003 . 2 . . . A 98 GLU HB2 . 18047 1 1123 . 1 1 98 98 GLU HB3 H 1 1.733 0.003 . 2 . . . A 98 GLU HB3 . 18047 1 1124 . 1 1 98 98 GLU HG2 H 1 2.240 0.003 . 2 . . . A 98 GLU HG2 . 18047 1 1125 . 1 1 98 98 GLU HG3 H 1 2.004 0.003 . 2 . . . A 98 GLU HG3 . 18047 1 1126 . 1 1 98 98 GLU CA C 13 54.499 0.160 . 1 . . . A 98 GLU CA . 18047 1 1127 . 1 1 98 98 GLU CB C 13 31.990 0.160 . 1 . . . A 98 GLU CB . 18047 1 1128 . 1 1 98 98 GLU CG C 13 36.759 0.160 . 1 . . . A 98 GLU CG . 18047 1 1129 . 1 1 98 98 GLU N N 15 115.138 0.130 . 1 . . . A 98 GLU N . 18047 1 1130 . 1 1 99 99 ILE H H 1 9.169 0.003 . 1 . . . A 99 ILE H . 18047 1 1131 . 1 1 99 99 ILE HA H 1 4.581 0.003 . 1 . . . A 99 ILE HA . 18047 1 1132 . 1 1 99 99 ILE HB H 1 1.487 0.003 . 1 . . . A 99 ILE HB . 18047 1 1133 . 1 1 99 99 ILE HG12 H 1 1.286 0.003 . 1 . . . A 99 ILE QG1 . 18047 1 1134 . 1 1 99 99 ILE HG13 H 1 1.286 0.003 . 1 . . . A 99 ILE QG1 . 18047 1 1135 . 1 1 99 99 ILE HD11 H 1 0.867 0.003 . 1 . . . A 99 ILE QD1 . 18047 1 1136 . 1 1 99 99 ILE HD12 H 1 0.867 0.003 . 1 . . . A 99 ILE QD1 . 18047 1 1137 . 1 1 99 99 ILE HD13 H 1 0.867 0.003 . 1 . . . A 99 ILE QD1 . 18047 1 1138 . 1 1 99 99 ILE CA C 13 58.233 0.160 . 1 . . . A 99 ILE CA . 18047 1 1139 . 1 1 99 99 ILE CB C 13 41.741 0.160 . 1 . . . A 99 ILE CB . 18047 1 1140 . 1 1 99 99 ILE CG1 C 13 28.466 0.160 . 1 . . . A 99 ILE CG1 . 18047 1 1141 . 1 1 99 99 ILE CD1 C 13 15.193 0.160 . 1 . . . A 99 ILE CD1 . 18047 1 1142 . 1 1 99 99 ILE N N 15 117.154 0.130 . 1 . . . A 99 ILE N . 18047 1 1143 . 1 1 100 100 ASN H H 1 9.529 0.003 . 1 . . . A 100 ASN H . 18047 1 1144 . 1 1 100 100 ASN HA H 1 4.769 0.003 . 1 . . . A 100 ASN HA . 18047 1 1145 . 1 1 100 100 ASN HB2 H 1 2.494 0.003 . 2 . . . A 100 ASN HB2 . 18047 1 1146 . 1 1 100 100 ASN HB3 H 1 2.608 0.003 . 2 . . . A 100 ASN HB3 . 18047 1 1147 . 1 1 100 100 ASN HD21 H 1 7.711 0.003 . 2 . . . A 100 ASN HD21 . 18047 1 1148 . 1 1 100 100 ASN HD22 H 1 6.927 0.003 . 2 . . . A 100 ASN HD22 . 18047 1 1149 . 1 1 100 100 ASN CA C 13 52.778 0.160 . 1 . . . A 100 ASN CA . 18047 1 1150 . 1 1 100 100 ASN CB C 13 37.750 0.160 . 1 . . . A 100 ASN CB . 18047 1 1151 . 1 1 100 100 ASN N N 15 128.798 0.130 . 1 . . . A 100 ASN N . 18047 1 1152 . 1 1 100 100 ASN ND2 N 15 113.761 0.130 . 1 . . . A 100 ASN ND2 . 18047 1 1153 . 1 1 101 101 PRO HA H 1 3.880 0.003 . 1 . . . A 101 PRO HA . 18047 1 1154 . 1 1 101 101 PRO HB2 H 1 2.340 0.003 . 2 . . . A 101 PRO HB2 . 18047 1 1155 . 1 1 101 101 PRO HB3 H 1 1.666 0.003 . 2 . . . A 101 PRO HB3 . 18047 1 1156 . 1 1 101 101 PRO HG2 H 1 1.819 0.003 . 2 . . . A 101 PRO HG2 . 18047 1 1157 . 1 1 101 101 PRO HG3 H 1 1.352 0.003 . 2 . . . A 101 PRO HG3 . 18047 1 1158 . 1 1 101 101 PRO HD2 H 1 3.371 0.003 . 2 . . . A 101 PRO QD . 18047 1 1159 . 1 1 101 101 PRO HD3 H 1 3.371 0.003 . 2 . . . A 101 PRO QD . 18047 1 1160 . 1 1 101 101 PRO CA C 13 64.788 0.160 . 1 . . . A 101 PRO CA . 18047 1 1161 . 1 1 101 101 PRO CB C 13 31.572 0.160 . 1 . . . A 101 PRO CB . 18047 1 1162 . 1 1 101 101 PRO CG C 13 27.560 0.160 . 1 . . . A 101 PRO CG . 18047 1 1163 . 1 1 101 101 PRO CD C 13 50.434 0.160 . 1 . . . A 101 PRO CD . 18047 1 1164 . 1 1 102 102 GLY H H 1 9.296 0.003 . 1 . . . A 102 GLY H . 18047 1 1165 . 1 1 102 102 GLY HA2 H 1 3.521 0.003 . 2 . . . A 102 GLY HA2 . 18047 1 1166 . 1 1 102 102 GLY HA3 H 1 4.083 0.003 . 2 . . . A 102 GLY HA3 . 18047 1 1167 . 1 1 102 102 GLY CA C 13 45.541 0.160 . 1 . . . A 102 GLY CA . 18047 1 1168 . 1 1 102 102 GLY N N 15 113.286 0.130 . 1 . . . A 102 GLY N . 18047 1 1169 . 1 1 103 103 GLU H H 1 7.990 0.003 . 1 . . . A 103 GLU H . 18047 1 1170 . 1 1 103 103 GLU HA H 1 4.334 0.003 . 1 . . . A 103 GLU HA . 18047 1 1171 . 1 1 103 103 GLU HB2 H 1 2.259 0.003 . 2 . . . A 103 GLU HB2 . 18047 1 1172 . 1 1 103 103 GLU HB3 H 1 1.883 0.003 . 2 . . . A 103 GLU HB3 . 18047 1 1173 . 1 1 103 103 GLU HG2 H 1 2.257 0.003 . 2 . . . A 103 GLU HG2 . 18047 1 1174 . 1 1 103 103 GLU HG3 H 1 2.115 0.003 . 2 . . . A 103 GLU HG3 . 18047 1 1175 . 1 1 103 103 GLU CA C 13 56.048 0.160 . 1 . . . A 103 GLU CA . 18047 1 1176 . 1 1 103 103 GLU CB C 13 32.046 0.160 . 1 . . . A 103 GLU CB . 18047 1 1177 . 1 1 103 103 GLU CG C 13 37.028 0.160 . 1 . . . A 103 GLU CG . 18047 1 1178 . 1 1 103 103 GLU N N 15 121.918 0.130 . 1 . . . A 103 GLU N . 18047 1 1179 . 1 1 104 104 THR H H 1 8.274 0.003 . 1 . . . A 104 THR H . 18047 1 1180 . 1 1 104 104 THR HA H 1 5.633 0.003 . 1 . . . A 104 THR HA . 18047 1 1181 . 1 1 104 104 THR HB H 1 3.717 0.003 . 1 . . . A 104 THR HB . 18047 1 1182 . 1 1 104 104 THR HG21 H 1 0.924 0.003 . 1 . . . A 104 THR QG2 . 18047 1 1183 . 1 1 104 104 THR HG22 H 1 0.924 0.003 . 1 . . . A 104 THR QG2 . 18047 1 1184 . 1 1 104 104 THR HG23 H 1 0.924 0.003 . 1 . . . A 104 THR QG2 . 18047 1 1185 . 1 1 104 104 THR CA C 13 61.439 0.160 . 1 . . . A 104 THR CA . 18047 1 1186 . 1 1 104 104 THR CB C 13 70.799 0.160 . 1 . . . A 104 THR CB . 18047 1 1187 . 1 1 104 104 THR CG2 C 13 20.576 0.160 . 1 . . . A 104 THR CG2 . 18047 1 1188 . 1 1 104 104 THR N N 15 117.994 0.130 . 1 . . . A 104 THR N . 18047 1 1189 . 1 1 105 105 ILE H H 1 9.287 0.003 . 1 . . . A 105 ILE H . 18047 1 1190 . 1 1 105 105 ILE HA H 1 4.661 0.003 . 1 . . . A 105 ILE HA . 18047 1 1191 . 1 1 105 105 ILE HB H 1 1.764 0.003 . 1 . . . A 105 ILE HB . 18047 1 1192 . 1 1 105 105 ILE HG12 H 1 1.547 0.003 . 2 . . . A 105 ILE HG12 . 18047 1 1193 . 1 1 105 105 ILE HG13 H 1 1.136 0.003 . 2 . . . A 105 ILE HG13 . 18047 1 1194 . 1 1 105 105 ILE HG21 H 1 0.868 0.003 . 1 . . . A 105 ILE QG2 . 18047 1 1195 . 1 1 105 105 ILE HG22 H 1 0.868 0.003 . 1 . . . A 105 ILE QG2 . 18047 1 1196 . 1 1 105 105 ILE HG23 H 1 0.868 0.003 . 1 . . . A 105 ILE QG2 . 18047 1 1197 . 1 1 105 105 ILE HD11 H 1 0.803 0.003 . 1 . . . A 105 ILE QD1 . 18047 1 1198 . 1 1 105 105 ILE HD12 H 1 0.803 0.003 . 1 . . . A 105 ILE QD1 . 18047 1 1199 . 1 1 105 105 ILE HD13 H 1 0.803 0.003 . 1 . . . A 105 ILE QD1 . 18047 1 1200 . 1 1 105 105 ILE CA C 13 57.957 0.160 . 1 . . . A 105 ILE CA . 18047 1 1201 . 1 1 105 105 ILE CB C 13 43.159 0.160 . 1 . . . A 105 ILE CB . 18047 1 1202 . 1 1 105 105 ILE CG1 C 13 27.843 0.160 . 1 . . . A 105 ILE CG1 . 18047 1 1203 . 1 1 105 105 ILE CG2 C 13 20.455 0.160 . 1 . . . A 105 ILE CG2 . 18047 1 1204 . 1 1 105 105 ILE CD1 C 13 15.368 0.160 . 1 . . . A 105 ILE CD1 . 18047 1 1205 . 1 1 105 105 ILE N N 15 121.147 0.130 . 1 . . . A 105 ILE N . 18047 1 1206 . 1 1 106 106 GLN H H 1 8.187 0.003 . 1 . . . A 106 GLN H . 18047 1 1207 . 1 1 106 106 GLN HA H 1 5.051 0.003 . 1 . . . A 106 GLN HA . 18047 1 1208 . 1 1 106 106 GLN HB2 H 1 1.826 0.003 . 2 . . . A 106 GLN HB2 . 18047 1 1209 . 1 1 106 106 GLN HB3 H 1 1.909 0.003 . 2 . . . A 106 GLN HB3 . 18047 1 1210 . 1 1 106 106 GLN HG2 H 1 2.206 0.003 . 2 . . . A 106 GLN HG2 . 18047 1 1211 . 1 1 106 106 GLN HG3 H 1 2.293 0.003 . 2 . . . A 106 GLN HG3 . 18047 1 1212 . 1 1 106 106 GLN HE21 H 1 7.606 0.003 . 2 . . . A 106 GLN HE21 . 18047 1 1213 . 1 1 106 106 GLN HE22 H 1 6.813 0.003 . 2 . . . A 106 GLN HE22 . 18047 1 1214 . 1 1 106 106 GLN CA C 13 54.356 0.160 . 1 . . . A 106 GLN CA . 18047 1 1215 . 1 1 106 106 GLN CB C 13 29.428 0.160 . 1 . . . A 106 GLN CB . 18047 1 1216 . 1 1 106 106 GLN CG C 13 33.806 0.160 . 1 . . . A 106 GLN CG . 18047 1 1217 . 1 1 106 106 GLN N N 15 120.172 0.130 . 1 . . . A 106 GLN N . 18047 1 1218 . 1 1 106 106 GLN NE2 N 15 110.877 0.130 . 1 . . . A 106 GLN NE2 . 18047 1 1219 . 1 1 107 107 GLY H H 1 7.603 0.003 . 1 . . . A 107 GLY H . 18047 1 1220 . 1 1 107 107 GLY HA2 H 1 2.728 0.003 . 2 . . . A 107 GLY HA2 . 18047 1 1221 . 1 1 107 107 GLY HA3 H 1 4.327 0.003 . 2 . . . A 107 GLY HA3 . 18047 1 1222 . 1 1 107 107 GLY CA C 13 43.450 0.160 . 1 . . . A 107 GLY CA . 18047 1 1223 . 1 1 107 107 GLY N N 15 107.295 0.130 . 1 . . . A 107 GLY N . 18047 1 1224 . 1 1 108 108 ALA H H 1 7.070 0.003 . 1 . . . A 108 ALA H . 18047 1 1225 . 1 1 108 108 ALA HA H 1 5.381 0.003 . 1 . . . A 108 ALA HA . 18047 1 1226 . 1 1 108 108 ALA HB1 H 1 0.846 0.003 . 1 . . . A 108 ALA QB . 18047 1 1227 . 1 1 108 108 ALA HB2 H 1 0.846 0.003 . 1 . . . A 108 ALA QB . 18047 1 1228 . 1 1 108 108 ALA HB3 H 1 0.846 0.003 . 1 . . . A 108 ALA QB . 18047 1 1229 . 1 1 108 108 ALA CA C 13 50.255 0.160 . 1 . . . A 108 ALA CA . 18047 1 1230 . 1 1 108 108 ALA CB C 13 23.229 0.160 . 1 . . . A 108 ALA CB . 18047 1 1231 . 1 1 108 108 ALA N N 15 118.777 0.130 . 1 . . . A 108 ALA N . 18047 1 1232 . 1 1 109 109 TYR H H 1 8.826 0.003 . 1 . . . A 109 TYR H . 18047 1 1233 . 1 1 109 109 TYR HA H 1 4.974 0.003 . 1 . . . A 109 TYR HA . 18047 1 1234 . 1 1 109 109 TYR HB2 H 1 3.057 0.003 . 2 . . . A 109 TYR HB2 . 18047 1 1235 . 1 1 109 109 TYR HB3 H 1 2.561 0.003 . 2 . . . A 109 TYR HB3 . 18047 1 1236 . 1 1 109 109 TYR HD1 H 1 6.014 0.003 . 3 . . . A 109 TYR QD . 18047 1 1237 . 1 1 109 109 TYR HD2 H 1 6.014 0.003 . 3 . . . A 109 TYR QD . 18047 1 1238 . 1 1 109 109 TYR HE1 H 1 6.197 0.003 . 3 . . . A 109 TYR QE . 18047 1 1239 . 1 1 109 109 TYR HE2 H 1 6.197 0.003 . 3 . . . A 109 TYR QE . 18047 1 1240 . 1 1 109 109 TYR CA C 13 53.835 0.160 . 1 . . . A 109 TYR CA . 18047 1 1241 . 1 1 109 109 TYR CB C 13 43.864 0.160 . 1 . . . A 109 TYR CB . 18047 1 1242 . 1 1 109 109 TYR CD1 C 13 132.090 0.160 . 3 . . . A 109 TYR CD1 . 18047 1 1243 . 1 1 109 109 TYR CD2 C 13 132.090 0.160 . 3 . . . A 109 TYR CD2 . 18047 1 1244 . 1 1 109 109 TYR CE1 C 13 116.861 0.160 . 3 . . . A 109 TYR CE1 . 18047 1 1245 . 1 1 109 109 TYR CE2 C 13 116.861 0.160 . 3 . . . A 109 TYR CE2 . 18047 1 1246 . 1 1 109 109 TYR N N 15 119.503 0.130 . 1 . . . A 109 TYR N . 18047 1 1247 . 1 1 110 110 PRO HA H 1 4.698 0.003 . 1 . . . A 110 PRO HA . 18047 1 1248 . 1 1 110 110 PRO HB2 H 1 1.386 0.003 . 2 . . . A 110 PRO QB . 18047 1 1249 . 1 1 110 110 PRO HB3 H 1 1.386 0.003 . 2 . . . A 110 PRO QB . 18047 1 1250 . 1 1 110 110 PRO HG2 H 1 1.088 0.003 . 2 . . . A 110 PRO QG . 18047 1 1251 . 1 1 110 110 PRO HG3 H 1 1.088 0.003 . 2 . . . A 110 PRO QG . 18047 1 1252 . 1 1 110 110 PRO HD2 H 1 2.327 0.003 . 2 . . . A 110 PRO HD2 . 18047 1 1253 . 1 1 110 110 PRO HD3 H 1 3.024 0.003 . 2 . . . A 110 PRO HD3 . 18047 1 1254 . 1 1 110 110 PRO CA C 13 59.900 0.160 . 1 . . . A 110 PRO CA . 18047 1 1255 . 1 1 110 110 PRO CB C 13 32.590 0.160 . 1 . . . A 110 PRO CB . 18047 1 1256 . 1 1 110 110 PRO CG C 13 26.211 0.160 . 1 . . . A 110 PRO CG . 18047 1 1257 . 1 1 110 110 PRO CD C 13 49.392 0.160 . 1 . . . A 110 PRO CD . 18047 1 1258 . 1 1 111 111 TYR H H 1 8.549 0.003 . 1 . . . A 111 TYR H . 18047 1 1259 . 1 1 111 111 TYR HA H 1 4.635 0.003 . 1 . . . A 111 TYR HA . 18047 1 1260 . 1 1 111 111 TYR HB2 H 1 0.829 0.003 . 2 . . . A 111 TYR HB2 . 18047 1 1261 . 1 1 111 111 TYR HB3 H 1 1.922 0.003 . 2 . . . A 111 TYR HB3 . 18047 1 1262 . 1 1 111 111 TYR HD1 H 1 6.303 0.003 . 3 . . . A 111 TYR QD . 18047 1 1263 . 1 1 111 111 TYR HD2 H 1 6.303 0.003 . 3 . . . A 111 TYR QD . 18047 1 1264 . 1 1 111 111 TYR HE1 H 1 6.163 0.003 . 3 . . . A 111 TYR QE . 18047 1 1265 . 1 1 111 111 TYR HE2 H 1 6.163 0.003 . 3 . . . A 111 TYR QE . 18047 1 1266 . 1 1 111 111 TYR CA C 13 56.766 0.160 . 1 . . . A 111 TYR CA . 18047 1 1267 . 1 1 111 111 TYR CB C 13 41.651 0.160 . 1 . . . A 111 TYR CB . 18047 1 1268 . 1 1 111 111 TYR CD1 C 13 132.136 0.160 . 3 . . . A 111 TYR CD1 . 18047 1 1269 . 1 1 111 111 TYR CD2 C 13 132.136 0.160 . 3 . . . A 111 TYR CD2 . 18047 1 1270 . 1 1 111 111 TYR CE1 C 13 117.108 0.160 . 3 . . . A 111 TYR CE1 . 18047 1 1271 . 1 1 111 111 TYR CE2 C 13 117.108 0.160 . 3 . . . A 111 TYR CE2 . 18047 1 1272 . 1 1 111 111 TYR N N 15 121.125 0.130 . 1 . . . A 111 TYR N . 18047 1 1273 . 1 1 112 112 GLU H H 1 8.684 0.003 . 1 . . . A 112 GLU H . 18047 1 1274 . 1 1 112 112 GLU HA H 1 4.053 0.003 . 1 . . . A 112 GLU HA . 18047 1 1275 . 1 1 112 112 GLU HB2 H 1 1.935 0.003 . 2 . . . A 112 GLU HB2 . 18047 1 1276 . 1 1 112 112 GLU HB3 H 1 1.711 0.003 . 2 . . . A 112 GLU HB3 . 18047 1 1277 . 1 1 112 112 GLU HG2 H 1 2.211 0.003 . 2 . . . A 112 GLU QG . 18047 1 1278 . 1 1 112 112 GLU HG3 H 1 2.211 0.003 . 2 . . . A 112 GLU QG . 18047 1 1279 . 1 1 112 112 GLU CA C 13 55.527 0.160 . 1 . . . A 112 GLU CA . 18047 1 1280 . 1 1 112 112 GLU CB C 13 30.690 0.160 . 1 . . . A 112 GLU CB . 18047 1 1281 . 1 1 112 112 GLU CG C 13 34.110 0.160 . 1 . . . A 112 GLU CG . 18047 1 1282 . 1 1 112 112 GLU N N 15 120.209 0.130 . 1 . . . A 112 GLU N . 18047 1 1283 . 1 1 113 113 PHE H H 1 7.304 0.003 . 1 . . . A 113 PHE H . 18047 1 1284 . 1 1 113 113 PHE HA H 1 4.184 0.003 . 1 . . . A 113 PHE HA . 18047 1 1285 . 1 1 113 113 PHE HB2 H 1 2.681 0.003 . 2 . . . A 113 PHE HB2 . 18047 1 1286 . 1 1 113 113 PHE HB3 H 1 2.570 0.003 . 2 . . . A 113 PHE HB3 . 18047 1 1287 . 1 1 113 113 PHE HD1 H 1 6.953 0.003 . 3 . . . A 113 PHE QD . 18047 1 1288 . 1 1 113 113 PHE HD2 H 1 6.953 0.003 . 3 . . . A 113 PHE QD . 18047 1 1289 . 1 1 113 113 PHE HE1 H 1 7.212 0.003 . 3 . . . A 113 PHE QE . 18047 1 1290 . 1 1 113 113 PHE HE2 H 1 7.212 0.003 . 3 . . . A 113 PHE QE . 18047 1 1291 . 1 1 113 113 PHE CA C 13 61.112 0.160 . 1 . . . A 113 PHE CA . 18047 1 1292 . 1 1 113 113 PHE CB C 13 39.856 0.160 . 1 . . . A 113 PHE CB . 18047 1 1293 . 1 1 113 113 PHE CD1 C 13 130.317 0.160 . 3 . . . A 113 PHE CD1 . 18047 1 1294 . 1 1 113 113 PHE CD2 C 13 130.317 0.160 . 3 . . . A 113 PHE CD2 . 18047 1 1295 . 1 1 113 113 PHE CE1 C 13 131.635 0.160 . 3 . . . A 113 PHE CE1 . 18047 1 1296 . 1 1 113 113 PHE CE2 C 13 131.635 0.160 . 3 . . . A 113 PHE CE2 . 18047 1 1297 . 1 1 113 113 PHE N N 15 120.239 0.130 . 1 . . . A 113 PHE N . 18047 1 1298 . 1 1 114 114 ILE H H 1 8.087 0.003 . 1 . . . A 114 ILE H . 18047 1 1299 . 1 1 114 114 ILE HA H 1 4.056 0.003 . 1 . . . A 114 ILE HA . 18047 1 1300 . 1 1 114 114 ILE HB H 1 1.638 0.003 . 1 . . . A 114 ILE HB . 18047 1 1301 . 1 1 114 114 ILE HG12 H 1 0.995 0.003 . 2 . . . A 114 ILE HG12 . 18047 1 1302 . 1 1 114 114 ILE HG13 H 1 1.552 0.003 . 2 . . . A 114 ILE HG13 . 18047 1 1303 . 1 1 114 114 ILE HG21 H 1 0.710 0.003 . 1 . . . A 114 ILE QG2 . 18047 1 1304 . 1 1 114 114 ILE HG22 H 1 0.710 0.003 . 1 . . . A 114 ILE QG2 . 18047 1 1305 . 1 1 114 114 ILE HG23 H 1 0.710 0.003 . 1 . . . A 114 ILE QG2 . 18047 1 1306 . 1 1 114 114 ILE HD11 H 1 0.688 0.003 . 1 . . . A 114 ILE QD1 . 18047 1 1307 . 1 1 114 114 ILE HD12 H 1 0.688 0.003 . 1 . . . A 114 ILE QD1 . 18047 1 1308 . 1 1 114 114 ILE HD13 H 1 0.688 0.003 . 1 . . . A 114 ILE QD1 . 18047 1 1309 . 1 1 114 114 ILE CA C 13 64.556 0.160 . 1 . . . A 114 ILE CA . 18047 1 1310 . 1 1 114 114 ILE CB C 13 37.905 0.160 . 1 . . . A 114 ILE CB . 18047 1 1311 . 1 1 114 114 ILE CG1 C 13 28.499 0.160 . 1 . . . A 114 ILE CG1 . 18047 1 1312 . 1 1 114 114 ILE CG2 C 13 17.468 0.160 . 1 . . . A 114 ILE CG2 . 18047 1 1313 . 1 1 114 114 ILE CD1 C 13 14.061 0.160 . 1 . . . A 114 ILE CD1 . 18047 1 1314 . 1 1 114 114 ILE N N 15 118.751 0.130 . 1 . . . A 114 ILE N . 18047 1 1315 . 1 1 115 115 ASN H H 1 8.469 0.003 . 1 . . . A 115 ASN H . 18047 1 1316 . 1 1 115 115 ASN HA H 1 4.717 0.003 . 1 . . . A 115 ASN HA . 18047 1 1317 . 1 1 115 115 ASN HB2 H 1 2.496 0.003 . 2 . . . A 115 ASN QB . 18047 1 1318 . 1 1 115 115 ASN HB3 H 1 2.496 0.003 . 2 . . . A 115 ASN QB . 18047 1 1319 . 1 1 115 115 ASN HD21 H 1 7.070 0.003 . 2 . . . A 115 ASN HD21 . 18047 1 1320 . 1 1 115 115 ASN HD22 H 1 7.562 0.003 . 2 . . . A 115 ASN HD22 . 18047 1 1321 . 1 1 115 115 ASN CA C 13 52.000 0.160 . 1 . . . A 115 ASN CA . 18047 1 1322 . 1 1 115 115 ASN CB C 13 40.457 0.160 . 1 . . . A 115 ASN CB . 18047 1 1323 . 1 1 115 115 ASN N N 15 114.845 0.130 . 1 . . . A 115 ASN N . 18047 1 1324 . 1 1 115 115 ASN ND2 N 15 111.328 0.130 . 1 . . . A 115 ASN ND2 . 18047 1 1325 . 1 1 116 116 GLU H H 1 9.265 0.003 . 1 . . . A 116 GLU H . 18047 1 1326 . 1 1 116 116 GLU HA H 1 2.482 0.003 . 1 . . . A 116 GLU HA . 18047 1 1327 . 1 1 116 116 GLU HB2 H 1 1.238 0.003 . 2 . . . A 116 GLU HB2 . 18047 1 1328 . 1 1 116 116 GLU HB3 H 1 0.991 0.003 . 2 . . . A 116 GLU HB3 . 18047 1 1329 . 1 1 116 116 GLU HG2 H 1 1.847 0.003 . 2 . . . A 116 GLU HG2 . 18047 1 1330 . 1 1 116 116 GLU HG3 H 1 1.576 0.003 . 2 . . . A 116 GLU HG3 . 18047 1 1331 . 1 1 116 116 GLU CA C 13 57.294 0.160 . 1 . . . A 116 GLU CA . 18047 1 1332 . 1 1 116 116 GLU CB C 13 29.030 0.160 . 1 . . . A 116 GLU CB . 18047 1 1333 . 1 1 116 116 GLU CG C 13 34.200 0.160 . 1 . . . A 116 GLU CG . 18047 1 1334 . 1 1 116 116 GLU N N 15 125.239 0.130 . 1 . . . A 116 GLU N . 18047 1 1335 . 1 1 117 117 ASN H H 1 8.177 0.003 . 1 . . . A 117 ASN H . 18047 1 1336 . 1 1 117 117 ASN HA H 1 4.607 0.003 . 1 . . . A 117 ASN HA . 18047 1 1337 . 1 1 117 117 ASN HB2 H 1 2.779 0.003 . 2 . . . A 117 ASN HB2 . 18047 1 1338 . 1 1 117 117 ASN HB3 H 1 2.489 0.003 . 2 . . . A 117 ASN HB3 . 18047 1 1339 . 1 1 117 117 ASN HD21 H 1 6.958 0.003 . 2 . . . A 117 ASN HD21 . 18047 1 1340 . 1 1 117 117 ASN HD22 H 1 7.435 0.003 . 2 . . . A 117 ASN HD22 . 18047 1 1341 . 1 1 117 117 ASN CA C 13 53.084 0.160 . 1 . . . A 117 ASN CA . 18047 1 1342 . 1 1 117 117 ASN CB C 13 39.189 0.160 . 1 . . . A 117 ASN CB . 18047 1 1343 . 1 1 117 117 ASN N N 15 115.333 0.130 . 1 . . . A 117 ASN N . 18047 1 1344 . 1 1 117 117 ASN ND2 N 15 113.260 0.130 . 1 . . . A 117 ASN ND2 . 18047 1 1345 . 1 1 118 118 LYS H H 1 7.131 0.003 . 1 . . . A 118 LYS H . 18047 1 1346 . 1 1 118 118 LYS HA H 1 4.720 0.003 . 1 . . . A 118 LYS HA . 18047 1 1347 . 1 1 118 118 LYS HB2 H 1 1.851 0.003 . 2 . . . A 118 LYS HB2 . 18047 1 1348 . 1 1 118 118 LYS HB3 H 1 1.508 0.003 . 2 . . . A 118 LYS HB3 . 18047 1 1349 . 1 1 118 118 LYS HG2 H 1 1.337 0.003 . 2 . . . A 118 LYS HG2 . 18047 1 1350 . 1 1 118 118 LYS HG3 H 1 1.131 0.003 . 2 . . . A 118 LYS HG3 . 18047 1 1351 . 1 1 118 118 LYS HD2 H 1 1.676 0.003 . 2 . . . A 118 LYS HD2 . 18047 1 1352 . 1 1 118 118 LYS HD3 H 1 1.530 0.003 . 2 . . . A 118 LYS HD3 . 18047 1 1353 . 1 1 118 118 LYS HE2 H 1 2.856 0.003 . 2 . . . A 118 LYS QE . 18047 1 1354 . 1 1 118 118 LYS HE3 H 1 2.856 0.003 . 2 . . . A 118 LYS QE . 18047 1 1355 . 1 1 118 118 LYS CA C 13 52.858 0.160 . 1 . . . A 118 LYS CA . 18047 1 1356 . 1 1 118 118 LYS CB C 13 34.130 0.160 . 1 . . . A 118 LYS CB . 18047 1 1357 . 1 1 118 118 LYS CG C 13 25.132 0.160 . 1 . . . A 118 LYS CG . 18047 1 1358 . 1 1 118 118 LYS CD C 13 28.844 0.160 . 1 . . . A 118 LYS CD . 18047 1 1359 . 1 1 118 118 LYS CE C 13 42.103 0.160 . 1 . . . A 118 LYS CE . 18047 1 1360 . 1 1 118 118 LYS N N 15 118.115 0.130 . 1 . . . A 118 LYS N . 18047 1 1361 . 1 1 119 119 PRO HA H 1 4.374 0.003 . 1 . . . A 119 PRO HA . 18047 1 1362 . 1 1 119 119 PRO HB2 H 1 2.017 0.003 . 2 . . . A 119 PRO HB2 . 18047 1 1363 . 1 1 119 119 PRO HB3 H 1 1.474 0.003 . 2 . . . A 119 PRO HB3 . 18047 1 1364 . 1 1 119 119 PRO HG2 H 1 1.820 0.003 . 2 . . . A 119 PRO QG . 18047 1 1365 . 1 1 119 119 PRO HG3 H 1 1.820 0.003 . 2 . . . A 119 PRO QG . 18047 1 1366 . 1 1 119 119 PRO HD2 H 1 3.699 0.003 . 2 . . . A 119 PRO HD2 . 18047 1 1367 . 1 1 119 119 PRO HD3 H 1 3.433 0.003 . 2 . . . A 119 PRO HD3 . 18047 1 1368 . 1 1 119 119 PRO CA C 13 62.414 0.160 . 1 . . . A 119 PRO CA . 18047 1 1369 . 1 1 119 119 PRO CB C 13 33.189 0.160 . 1 . . . A 119 PRO CB . 18047 1 1370 . 1 1 119 119 PRO CG C 13 27.615 0.160 . 1 . . . A 119 PRO CG . 18047 1 1371 . 1 1 119 119 PRO CD C 13 50.413 0.160 . 1 . . . A 119 PRO CD . 18047 1 1372 . 1 1 120 120 VAL H H 1 8.969 0.003 . 1 . . . A 120 VAL H . 18047 1 1373 . 1 1 120 120 VAL HA H 1 4.128 0.003 . 1 . . . A 120 VAL HA . 18047 1 1374 . 1 1 120 120 VAL HB H 1 1.762 0.003 . 1 . . . A 120 VAL HB . 18047 1 1375 . 1 1 120 120 VAL HG11 H 1 0.322 0.003 . 1 . . . A 120 VAL QG1 . 18047 1 1376 . 1 1 120 120 VAL HG12 H 1 0.322 0.003 . 1 . . . A 120 VAL QG1 . 18047 1 1377 . 1 1 120 120 VAL HG13 H 1 0.322 0.003 . 1 . . . A 120 VAL QG1 . 18047 1 1378 . 1 1 120 120 VAL HG21 H 1 0.641 0.003 . 1 . . . A 120 VAL QG2 . 18047 1 1379 . 1 1 120 120 VAL HG22 H 1 0.641 0.003 . 1 . . . A 120 VAL QG2 . 18047 1 1380 . 1 1 120 120 VAL HG23 H 1 0.641 0.003 . 1 . . . A 120 VAL QG2 . 18047 1 1381 . 1 1 120 120 VAL CA C 13 61.730 0.160 . 1 . . . A 120 VAL CA . 18047 1 1382 . 1 1 120 120 VAL CB C 13 33.590 0.160 . 1 . . . A 120 VAL CB . 18047 1 1383 . 1 1 120 120 VAL CG1 C 13 24.167 0.160 . 2 . . . A 120 VAL CG1 . 18047 1 1384 . 1 1 120 120 VAL CG2 C 13 22.382 0.160 . 2 . . . A 120 VAL CG2 . 18047 1 1385 . 1 1 120 120 VAL N N 15 121.881 0.130 . 1 . . . A 120 VAL N . 18047 1 1386 . 1 1 121 121 HIS H H 1 8.936 0.003 . 1 . . . A 121 HIS H . 18047 1 1387 . 1 1 121 121 HIS HA H 1 4.813 0.003 . 1 . . . A 121 HIS HA . 18047 1 1388 . 1 1 121 121 HIS HB2 H 1 2.905 0.003 . 2 . . . A 121 HIS HB2 . 18047 1 1389 . 1 1 121 121 HIS HB3 H 1 2.968 0.003 . 2 . . . A 121 HIS HB3 . 18047 1 1390 . 1 1 121 121 HIS HD2 H 1 6.790 0.003 . 1 . . . A 121 HIS HD2 . 18047 1 1391 . 1 1 121 121 HIS HE1 H 1 8.234 0.003 . 1 . . . A 121 HIS HE1 . 18047 1 1392 . 1 1 121 121 HIS CA C 13 55.260 0.160 . 1 . . . A 121 HIS CA . 18047 1 1393 . 1 1 121 121 HIS CB C 13 30.080 0.160 . 1 . . . A 121 HIS CB . 18047 1 1394 . 1 1 121 121 HIS CD2 C 13 118.248 0.160 . 1 . . . A 121 HIS CD2 . 18047 1 1395 . 1 1 121 121 HIS CE1 C 13 135.988 0.160 . 1 . . . A 121 HIS CE1 . 18047 1 1396 . 1 1 121 121 HIS N N 15 124.718 0.130 . 1 . . . A 121 HIS N . 18047 1 1397 . 1 1 122 122 PHE H H 1 8.926 0.003 . 1 . . . A 122 PHE H . 18047 1 1398 . 1 1 122 122 PHE HA H 1 4.387 0.003 . 1 . . . A 122 PHE HA . 18047 1 1399 . 1 1 122 122 PHE HB2 H 1 2.078 0.003 . 2 . . . A 122 PHE HB2 . 18047 1 1400 . 1 1 122 122 PHE HB3 H 1 2.862 0.003 . 2 . . . A 122 PHE HB3 . 18047 1 1401 . 1 1 122 122 PHE HD1 H 1 7.016 0.003 . 3 . . . A 122 PHE QD . 18047 1 1402 . 1 1 122 122 PHE HD2 H 1 7.016 0.003 . 3 . . . A 122 PHE QD . 18047 1 1403 . 1 1 122 122 PHE HE1 H 1 6.851 0.003 . 3 . . . A 122 PHE QE . 18047 1 1404 . 1 1 122 122 PHE HE2 H 1 6.851 0.003 . 3 . . . A 122 PHE QE . 18047 1 1405 . 1 1 122 122 PHE CA C 13 56.676 0.160 . 1 . . . A 122 PHE CA . 18047 1 1406 . 1 1 122 122 PHE CB C 13 41.204 0.160 . 1 . . . A 122 PHE CB . 18047 1 1407 . 1 1 122 122 PHE CD1 C 13 131.330 0.160 . 3 . . . A 122 PHE CD1 . 18047 1 1408 . 1 1 122 122 PHE CD2 C 13 131.330 0.160 . 3 . . . A 122 PHE CD2 . 18047 1 1409 . 1 1 122 122 PHE CE1 C 13 129.927 0.160 . 3 . . . A 122 PHE CE1 . 18047 1 1410 . 1 1 122 122 PHE CE2 C 13 129.927 0.160 . 3 . . . A 122 PHE CE2 . 18047 1 1411 . 1 1 122 122 PHE N N 15 124.491 0.130 . 1 . . . A 122 PHE N . 18047 1 1412 . 1 1 123 123 LYS H H 1 8.355 0.003 . 1 . . . A 123 LYS H . 18047 1 1413 . 1 1 123 123 LYS HA H 1 4.491 0.003 . 1 . . . A 123 LYS HA . 18047 1 1414 . 1 1 123 123 LYS HB2 H 1 1.411 0.003 . 2 . . . A 123 LYS QB . 18047 1 1415 . 1 1 123 123 LYS HB3 H 1 1.411 0.003 . 2 . . . A 123 LYS QB . 18047 1 1416 . 1 1 123 123 LYS HG2 H 1 1.064 0.003 . 2 . . . A 123 LYS HG2 . 18047 1 1417 . 1 1 123 123 LYS HG3 H 1 1.109 0.003 . 2 . . . A 123 LYS HG3 . 18047 1 1418 . 1 1 123 123 LYS CA C 13 54.386 0.160 . 1 . . . A 123 LYS CA . 18047 1 1419 . 1 1 123 123 LYS CB C 13 35.798 0.160 . 1 . . . A 123 LYS CB . 18047 1 1420 . 1 1 123 123 LYS CG C 13 25.070 0.160 . 1 . . . A 123 LYS CG . 18047 1 1421 . 1 1 123 123 LYS N N 15 120.406 0.130 . 1 . . . A 123 LYS N . 18047 1 1422 . 1 1 124 124 PHE H H 1 8.202 0.003 . 1 . . . A 124 PHE H . 18047 1 1423 . 1 1 124 124 PHE HA H 1 5.526 0.003 . 1 . . . A 124 PHE HA . 18047 1 1424 . 1 1 124 124 PHE HB2 H 1 2.957 0.003 . 2 . . . A 124 PHE HB2 . 18047 1 1425 . 1 1 124 124 PHE HB3 H 1 2.087 0.003 . 2 . . . A 124 PHE HB3 . 18047 1 1426 . 1 1 124 124 PHE HD1 H 1 6.437 0.003 . 3 . . . A 124 PHE QD . 18047 1 1427 . 1 1 124 124 PHE HD2 H 1 6.437 0.003 . 3 . . . A 124 PHE QD . 18047 1 1428 . 1 1 124 124 PHE HE1 H 1 6.673 0.003 . 3 . . . A 124 PHE QE . 18047 1 1429 . 1 1 124 124 PHE HE2 H 1 6.673 0.003 . 3 . . . A 124 PHE QE . 18047 1 1430 . 1 1 124 124 PHE CA C 13 56.522 0.160 . 1 . . . A 124 PHE CA . 18047 1 1431 . 1 1 124 124 PHE CB C 13 41.736 0.160 . 1 . . . A 124 PHE CB . 18047 1 1432 . 1 1 124 124 PHE CD2 C 13 130.015 0.160 . 3 . . . A 124 PHE CD2 . 18047 1 1433 . 1 1 124 124 PHE CE2 C 13 130.015 0.160 . 3 . . . A 124 PHE CE2 . 18047 1 1434 . 1 1 124 124 PHE N N 15 120.066 0.130 . 1 . . . A 124 PHE N . 18047 1 1435 . 1 1 125 125 ARG H H 1 8.873 0.003 . 1 . . . A 125 ARG H . 18047 1 1436 . 1 1 125 125 ARG HA H 1 4.653 0.003 . 1 . . . A 125 ARG HA . 18047 1 1437 . 1 1 125 125 ARG HB2 H 1 1.755 0.003 . 2 . . . A 125 ARG HB2 . 18047 1 1438 . 1 1 125 125 ARG HB3 H 1 1.924 0.003 . 2 . . . A 125 ARG HB3 . 18047 1 1439 . 1 1 125 125 ARG HG2 H 1 1.309 0.003 . 2 . . . A 125 ARG HG2 . 18047 1 1440 . 1 1 125 125 ARG HG3 H 1 1.520 0.003 . 2 . . . A 125 ARG HG3 . 18047 1 1441 . 1 1 125 125 ARG HD2 H 1 2.924 0.003 . 2 . . . A 125 ARG QD . 18047 1 1442 . 1 1 125 125 ARG HD3 H 1 2.924 0.003 . 2 . . . A 125 ARG QD . 18047 1 1443 . 1 1 125 125 ARG CA C 13 55.400 0.160 . 1 . . . A 125 ARG CA . 18047 1 1444 . 1 1 125 125 ARG CB C 13 33.254 0.160 . 1 . . . A 125 ARG CB . 18047 1 1445 . 1 1 125 125 ARG CG C 13 28.120 0.160 . 1 . . . A 125 ARG CG . 18047 1 1446 . 1 1 125 125 ARG CD C 13 43.754 0.160 . 1 . . . A 125 ARG CD . 18047 1 1447 . 1 1 125 125 ARG N N 15 120.944 0.130 . 1 . . . A 125 ARG N . 18047 1 1448 . 1 1 127 127 ARG HA H 1 4.349 0.003 . 1 . . . A 127 ARG HA . 18047 1 1449 . 1 1 127 127 ARG HB2 H 1 1.840 0.003 . 2 . . . A 127 ARG HB2 . 18047 1 1450 . 1 1 127 127 ARG HB3 H 1 1.856 0.003 . 2 . . . A 127 ARG HB3 . 18047 1 1451 . 1 1 127 127 ARG HG2 H 1 1.434 0.003 . 2 . . . A 127 ARG HG2 . 18047 1 1452 . 1 1 127 127 ARG HG3 H 1 1.386 0.003 . 2 . . . A 127 ARG HG3 . 18047 1 1453 . 1 1 127 127 ARG HD2 H 1 3.038 0.003 . 2 . . . A 127 ARG QD . 18047 1 1454 . 1 1 127 127 ARG HD3 H 1 3.038 0.003 . 2 . . . A 127 ARG QD . 18047 1 1455 . 1 1 127 127 ARG HE H 1 7.459 0.003 . 1 . . . A 127 ARG HE . 18047 1 1456 . 1 1 127 127 ARG CA C 13 54.368 0.160 . 1 . . . A 127 ARG CA . 18047 1 1457 . 1 1 127 127 ARG CB C 13 31.812 0.160 . 1 . . . A 127 ARG CB . 18047 1 1458 . 1 1 127 127 ARG CG C 13 26.267 0.160 . 1 . . . A 127 ARG CG . 18047 1 1459 . 1 1 127 127 ARG CD C 13 43.666 0.160 . 1 . . . A 127 ARG CD . 18047 1 1460 . 1 1 127 127 ARG NE N 15 84.277 0.130 . 1 . . . A 127 ARG NE . 18047 1 1461 . 1 1 130 130 SER H H 1 7.687 0.003 . 1 . . . A 130 SER H . 18047 1 1462 . 1 1 130 130 SER HA H 1 4.112 0.003 . 1 . . . A 130 SER HA . 18047 1 1463 . 1 1 130 130 SER HB2 H 1 3.709 0.003 . 2 . . . A 130 SER HB2 . 18047 1 1464 . 1 1 130 130 SER HB3 H 1 3.872 0.003 . 2 . . . A 130 SER HB3 . 18047 1 1465 . 1 1 130 130 SER CA C 13 58.364 0.160 . 1 . . . A 130 SER CA . 18047 1 1466 . 1 1 130 130 SER CB C 13 63.493 0.160 . 1 . . . A 130 SER CB . 18047 1 1467 . 1 1 130 130 SER N N 15 111.054 0.130 . 1 . . . A 130 SER N . 18047 1 1468 . 1 1 131 131 LEU HA H 1 4.352 0.003 . 1 . . . A 131 LEU HA . 18047 1 1469 . 1 1 131 131 LEU HB2 H 1 1.556 0.003 . 2 . . . A 131 LEU QB . 18047 1 1470 . 1 1 131 131 LEU HB3 H 1 1.556 0.003 . 2 . . . A 131 LEU QB . 18047 1 1471 . 1 1 131 131 LEU HG H 1 1.516 0.003 . 1 . . . A 131 LEU HG . 18047 1 1472 . 1 1 131 131 LEU HD11 H 1 0.742 0.003 . 1 . . . A 131 LEU QD1 . 18047 1 1473 . 1 1 131 131 LEU HD12 H 1 0.742 0.003 . 1 . . . A 131 LEU QD1 . 18047 1 1474 . 1 1 131 131 LEU HD13 H 1 0.742 0.003 . 1 . . . A 131 LEU QD1 . 18047 1 1475 . 1 1 131 131 LEU HD21 H 1 0.801 0.003 . 1 . . . A 131 LEU QD2 . 18047 1 1476 . 1 1 131 131 LEU HD22 H 1 0.801 0.003 . 1 . . . A 131 LEU QD2 . 18047 1 1477 . 1 1 131 131 LEU HD23 H 1 0.801 0.003 . 1 . . . A 131 LEU QD2 . 18047 1 1478 . 1 1 131 131 LEU CA C 13 54.468 0.160 . 1 . . . A 131 LEU CA . 18047 1 1479 . 1 1 131 131 LEU CB C 13 41.982 0.160 . 1 . . . A 131 LEU CB . 18047 1 1480 . 1 1 131 131 LEU CG C 13 27.058 0.160 . 1 . . . A 131 LEU CG . 18047 1 1481 . 1 1 131 131 LEU CD1 C 13 23.397 0.160 . 2 . . . A 131 LEU CD1 . 18047 1 1482 . 1 1 131 131 LEU CD2 C 13 25.227 0.160 . 2 . . . A 131 LEU CD2 . 18047 1 1483 . 1 1 132 132 ASP H H 1 8.098 0.003 . 1 . . . A 132 ASP H . 18047 1 1484 . 1 1 132 132 ASP HA H 1 4.545 0.003 . 1 . . . A 132 ASP HA . 18047 1 1485 . 1 1 132 132 ASP HB2 H 1 2.686 0.003 . 2 . . . A 132 ASP HB2 . 18047 1 1486 . 1 1 132 132 ASP HB3 H 1 2.393 0.003 . 2 . . . A 132 ASP HB3 . 18047 1 1487 . 1 1 132 132 ASP CA C 13 54.078 0.160 . 1 . . . A 132 ASP CA . 18047 1 1488 . 1 1 132 132 ASP CB C 13 42.334 0.160 . 1 . . . A 132 ASP CB . 18047 1 1489 . 1 1 132 132 ASP N N 15 119.611 0.130 . 1 . . . A 132 ASP N . 18047 1 1490 . 1 1 133 133 GLU HA H 1 4.373 0.003 . 1 . . . A 133 GLU HA . 18047 1 1491 . 1 1 133 133 GLU HB2 H 1 1.900 0.003 . 2 . . . A 133 GLU HB2 . 18047 1 1492 . 1 1 133 133 GLU HB3 H 1 1.740 0.003 . 2 . . . A 133 GLU HB3 . 18047 1 1493 . 1 1 133 133 GLU HG2 H 1 2.201 0.003 . 2 . . . A 133 GLU QG . 18047 1 1494 . 1 1 133 133 GLU HG3 H 1 2.201 0.003 . 2 . . . A 133 GLU QG . 18047 1 1495 . 1 1 133 133 GLU CA C 13 54.400 0.160 . 1 . . . A 133 GLU CA . 18047 1 1496 . 1 1 133 133 GLU CB C 13 29.351 0.160 . 1 . . . A 133 GLU CB . 18047 1 1497 . 1 1 133 133 GLU CG C 13 35.740 0.160 . 1 . . . A 133 GLU CG . 18047 1 1498 . 1 1 134 134 PRO HA H 1 4.324 0.003 . 1 . . . A 134 PRO HA . 18047 1 1499 . 1 1 134 134 PRO HB2 H 1 1.764 0.003 . 2 . . . A 134 PRO HB2 . 18047 1 1500 . 1 1 134 134 PRO HB3 H 1 2.033 0.003 . 2 . . . A 134 PRO HB3 . 18047 1 1501 . 1 1 134 134 PRO HG2 H 1 1.650 0.003 . 2 . . . A 134 PRO HG2 . 18047 1 1502 . 1 1 134 134 PRO HG3 H 1 1.888 0.003 . 2 . . . A 134 PRO HG3 . 18047 1 1503 . 1 1 134 134 PRO HD2 H 1 3.541 0.003 . 2 . . . A 134 PRO HD2 . 18047 1 1504 . 1 1 134 134 PRO HD3 H 1 3.657 0.003 . 2 . . . A 134 PRO HD3 . 18047 1 1505 . 1 1 134 134 PRO CA C 13 63.209 0.160 . 1 . . . A 134 PRO CA . 18047 1 1506 . 1 1 134 134 PRO CB C 13 32.108 0.160 . 1 . . . A 134 PRO CB . 18047 1 1507 . 1 1 134 134 PRO CG C 13 27.689 0.160 . 1 . . . A 134 PRO CG . 18047 1 1508 . 1 1 134 134 PRO CD C 13 50.416 0.160 . 1 . . . A 134 PRO CD . 18047 1 1509 . 1 1 135 135 ILE H H 1 8.616 0.003 . 1 . . . A 135 ILE H . 18047 1 1510 . 1 1 135 135 ILE HA H 1 3.940 0.003 . 1 . . . A 135 ILE HA . 18047 1 1511 . 1 1 135 135 ILE HB H 1 1.528 0.003 . 1 . . . A 135 ILE HB . 18047 1 1512 . 1 1 135 135 ILE HG12 H 1 0.968 0.003 . 2 . . . A 135 ILE HG12 . 18047 1 1513 . 1 1 135 135 ILE HG13 H 1 1.265 0.003 . 2 . . . A 135 ILE HG13 . 18047 1 1514 . 1 1 135 135 ILE HG21 H 1 0.688 0.003 . 1 . . . A 135 ILE QG2 . 18047 1 1515 . 1 1 135 135 ILE HG22 H 1 0.688 0.003 . 1 . . . A 135 ILE QG2 . 18047 1 1516 . 1 1 135 135 ILE HG23 H 1 0.688 0.003 . 1 . . . A 135 ILE QG2 . 18047 1 1517 . 1 1 135 135 ILE HD11 H 1 0.565 0.003 . 1 . . . A 135 ILE QD1 . 18047 1 1518 . 1 1 135 135 ILE HD12 H 1 0.565 0.003 . 1 . . . A 135 ILE QD1 . 18047 1 1519 . 1 1 135 135 ILE HD13 H 1 0.565 0.003 . 1 . . . A 135 ILE QD1 . 18047 1 1520 . 1 1 135 135 ILE CA C 13 61.885 0.160 . 1 . . . A 135 ILE CA . 18047 1 1521 . 1 1 135 135 ILE CB C 13 39.231 0.160 . 1 . . . A 135 ILE CB . 18047 1 1522 . 1 1 135 135 ILE CG1 C 13 27.859 0.160 . 1 . . . A 135 ILE CG1 . 18047 1 1523 . 1 1 135 135 ILE CG2 C 13 17.831 0.160 . 1 . . . A 135 ILE CG2 . 18047 1 1524 . 1 1 135 135 ILE CD1 C 13 13.772 0.160 . 1 . . . A 135 ILE CD1 . 18047 1 1525 . 1 1 135 135 ILE N N 15 118.841 0.130 . 1 . . . A 135 ILE N . 18047 1 1526 . 1 1 136 136 ALA H H 1 7.498 0.003 . 1 . . . A 136 ALA H . 18047 1 1527 . 1 1 136 136 ALA HA H 1 4.489 0.003 . 1 . . . A 136 ALA HA . 18047 1 1528 . 1 1 136 136 ALA HB1 H 1 1.217 0.003 . 1 . . . A 136 ALA QB . 18047 1 1529 . 1 1 136 136 ALA HB2 H 1 1.217 0.003 . 1 . . . A 136 ALA QB . 18047 1 1530 . 1 1 136 136 ALA HB3 H 1 1.217 0.003 . 1 . . . A 136 ALA QB . 18047 1 1531 . 1 1 136 136 ALA CA C 13 51.399 0.160 . 1 . . . A 136 ALA CA . 18047 1 1532 . 1 1 136 136 ALA CB C 13 23.733 0.160 . 1 . . . A 136 ALA CB . 18047 1 1533 . 1 1 136 136 ALA N N 15 116.964 0.130 . 1 . . . A 136 ALA N . 18047 1 1534 . 1 1 137 137 SER H H 1 8.301 0.003 . 1 . . . A 137 SER H . 18047 1 1535 . 1 1 137 137 SER HA H 1 5.311 0.003 . 1 . . . A 137 SER HA . 18047 1 1536 . 1 1 137 137 SER HB2 H 1 3.594 0.003 . 2 . . . A 137 SER HB2 . 18047 1 1537 . 1 1 137 137 SER HB3 H 1 3.663 0.003 . 2 . . . A 137 SER HB3 . 18047 1 1538 . 1 1 137 137 SER CA C 13 57.052 0.160 . 1 . . . A 137 SER CA . 18047 1 1539 . 1 1 137 137 SER CB C 13 66.300 0.160 . 1 . . . A 137 SER CB . 18047 1 1540 . 1 1 137 137 SER N N 15 111.352 0.130 . 1 . . . A 137 SER N . 18047 1 1541 . 1 1 138 138 GLU H H 1 9.008 0.003 . 1 . . . A 138 GLU H . 18047 1 1542 . 1 1 138 138 GLU HA H 1 4.471 0.003 . 1 . . . A 138 GLU HA . 18047 1 1543 . 1 1 138 138 GLU HB2 H 1 2.053 0.003 . 2 . . . A 138 GLU HB2 . 18047 1 1544 . 1 1 138 138 GLU HB3 H 1 1.795 0.003 . 2 . . . A 138 GLU HB3 . 18047 1 1545 . 1 1 138 138 GLU HG2 H 1 2.083 0.003 . 2 . . . A 138 GLU HG2 . 18047 1 1546 . 1 1 138 138 GLU HG3 H 1 2.335 0.003 . 2 . . . A 138 GLU HG3 . 18047 1 1547 . 1 1 138 138 GLU CA C 13 56.529 0.160 . 1 . . . A 138 GLU CA . 18047 1 1548 . 1 1 138 138 GLU CB C 13 34.325 0.160 . 1 . . . A 138 GLU CB . 18047 1 1549 . 1 1 138 138 GLU CG C 13 36.284 0.160 . 1 . . . A 138 GLU CG . 18047 1 1550 . 1 1 138 138 GLU N N 15 120.270 0.130 . 1 . . . A 138 GLU N . 18047 1 1551 . 1 1 139 139 GLU H H 1 8.647 0.003 . 1 . . . A 139 GLU H . 18047 1 1552 . 1 1 139 139 GLU HA H 1 5.147 0.003 . 1 . . . A 139 GLU HA . 18047 1 1553 . 1 1 139 139 GLU HB2 H 1 1.782 0.003 . 2 . . . A 139 GLU QB . 18047 1 1554 . 1 1 139 139 GLU HB3 H 1 1.782 0.003 . 2 . . . A 139 GLU QB . 18047 1 1555 . 1 1 139 139 GLU HG2 H 1 1.910 0.003 . 2 . . . A 139 GLU HG2 . 18047 1 1556 . 1 1 139 139 GLU HG3 H 1 1.822 0.003 . 2 . . . A 139 GLU HG3 . 18047 1 1557 . 1 1 139 139 GLU CA C 13 54.777 0.160 . 1 . . . A 139 GLU CA . 18047 1 1558 . 1 1 139 139 GLU CB C 13 30.980 0.160 . 1 . . . A 139 GLU CB . 18047 1 1559 . 1 1 139 139 GLU CG C 13 36.676 0.160 . 1 . . . A 139 GLU CG . 18047 1 1560 . 1 1 139 139 GLU N N 15 124.822 0.130 . 1 . . . A 139 GLU N . 18047 1 1561 . 1 1 140 140 ILE H H 1 9.209 0.003 . 1 . . . A 140 ILE H . 18047 1 1562 . 1 1 140 140 ILE HA H 1 4.233 0.003 . 1 . . . A 140 ILE HA . 18047 1 1563 . 1 1 140 140 ILE HB H 1 1.486 0.003 . 1 . . . A 140 ILE HB . 18047 1 1564 . 1 1 140 140 ILE HG12 H 1 1.295 0.003 . 2 . . . A 140 ILE HG12 . 18047 1 1565 . 1 1 140 140 ILE HG13 H 1 0.693 0.003 . 2 . . . A 140 ILE HG13 . 18047 1 1566 . 1 1 140 140 ILE HG21 H 1 0.555 0.003 . 1 . . . A 140 ILE QG2 . 18047 1 1567 . 1 1 140 140 ILE HG22 H 1 0.555 0.003 . 1 . . . A 140 ILE QG2 . 18047 1 1568 . 1 1 140 140 ILE HG23 H 1 0.555 0.003 . 1 . . . A 140 ILE QG2 . 18047 1 1569 . 1 1 140 140 ILE HD11 H 1 0.012 0.003 . 1 . . . A 140 ILE QD1 . 18047 1 1570 . 1 1 140 140 ILE HD12 H 1 0.012 0.003 . 1 . . . A 140 ILE QD1 . 18047 1 1571 . 1 1 140 140 ILE HD13 H 1 0.012 0.003 . 1 . . . A 140 ILE QD1 . 18047 1 1572 . 1 1 140 140 ILE CA C 13 61.156 0.160 . 1 . . . A 140 ILE CA . 18047 1 1573 . 1 1 140 140 ILE CB C 13 41.994 0.160 . 1 . . . A 140 ILE CB . 18047 1 1574 . 1 1 140 140 ILE CG1 C 13 27.816 0.160 . 1 . . . A 140 ILE CG1 . 18047 1 1575 . 1 1 140 140 ILE CG2 C 13 17.096 0.160 . 1 . . . A 140 ILE CG2 . 18047 1 1576 . 1 1 140 140 ILE CD1 C 13 11.971 0.160 . 1 . . . A 140 ILE CD1 . 18047 1 1577 . 1 1 140 140 ILE N N 15 124.822 0.130 . 1 . . . A 140 ILE N . 18047 1 1578 . 1 1 141 141 THR H H 1 8.659 0.003 . 1 . . . A 141 THR H . 18047 1 1579 . 1 1 141 141 THR HA H 1 4.241 0.003 . 1 . . . A 141 THR HA . 18047 1 1580 . 1 1 141 141 THR HB H 1 3.890 0.003 . 1 . . . A 141 THR HB . 18047 1 1581 . 1 1 141 141 THR HG21 H 1 0.906 0.003 . 1 . . . A 141 THR QG2 . 18047 1 1582 . 1 1 141 141 THR HG22 H 1 0.906 0.003 . 1 . . . A 141 THR QG2 . 18047 1 1583 . 1 1 141 141 THR HG23 H 1 0.906 0.003 . 1 . . . A 141 THR QG2 . 18047 1 1584 . 1 1 141 141 THR CA C 13 62.843 0.160 . 1 . . . A 141 THR CA . 18047 1 1585 . 1 1 141 141 THR CB C 13 68.621 0.160 . 1 . . . A 141 THR CB . 18047 1 1586 . 1 1 141 141 THR CG2 C 13 21.176 0.160 . 1 . . . A 141 THR CG2 . 18047 1 1587 . 1 1 141 141 THR N N 15 124.142 0.130 . 1 . . . A 141 THR N . 18047 1 1588 . 1 1 142 142 ILE H H 1 8.761 0.003 . 1 . . . A 142 ILE H . 18047 1 1589 . 1 1 142 142 ILE HA H 1 3.894 0.003 . 1 . . . A 142 ILE HA . 18047 1 1590 . 1 1 142 142 ILE HB H 1 1.724 0.003 . 1 . . . A 142 ILE HB . 18047 1 1591 . 1 1 142 142 ILE HG12 H 1 0.971 0.003 . 2 . . . A 142 ILE HG12 . 18047 1 1592 . 1 1 142 142 ILE HG13 H 1 0.747 0.003 . 2 . . . A 142 ILE HG13 . 18047 1 1593 . 1 1 142 142 ILE HG21 H 1 0.714 0.003 . 1 . . . A 142 ILE QG2 . 18047 1 1594 . 1 1 142 142 ILE HG22 H 1 0.714 0.003 . 1 . . . A 142 ILE QG2 . 18047 1 1595 . 1 1 142 142 ILE HG23 H 1 0.714 0.003 . 1 . . . A 142 ILE QG2 . 18047 1 1596 . 1 1 142 142 ILE HD11 H 1 -0.072 0.003 . 1 . . . A 142 ILE QD1 . 18047 1 1597 . 1 1 142 142 ILE HD12 H 1 -0.072 0.003 . 1 . . . A 142 ILE QD1 . 18047 1 1598 . 1 1 142 142 ILE HD13 H 1 -0.072 0.003 . 1 . . . A 142 ILE QD1 . 18047 1 1599 . 1 1 142 142 ILE CA C 13 61.555 0.160 . 1 . . . A 142 ILE CA . 18047 1 1600 . 1 1 142 142 ILE CB C 13 37.917 0.160 . 1 . . . A 142 ILE CB . 18047 1 1601 . 1 1 142 142 ILE CG1 C 13 27.846 0.160 . 1 . . . A 142 ILE CG1 . 18047 1 1602 . 1 1 142 142 ILE CG2 C 13 17.783 0.160 . 1 . . . A 142 ILE CG2 . 18047 1 1603 . 1 1 142 142 ILE CD1 C 13 13.092 0.160 . 1 . . . A 142 ILE CD1 . 18047 1 1604 . 1 1 142 142 ILE N N 15 129.932 0.130 . 1 . . . A 142 ILE N . 18047 1 1605 . 1 1 143 143 THR H H 1 7.635 0.003 . 1 . . . A 143 THR H . 18047 1 1606 . 1 1 143 143 THR HA H 1 4.102 0.003 . 1 . . . A 143 THR HA . 18047 1 1607 . 1 1 143 143 THR HB H 1 4.192 0.003 . 1 . . . A 143 THR HB . 18047 1 1608 . 1 1 143 143 THR HG21 H 1 1.001 0.003 . 1 . . . A 143 THR QG2 . 18047 1 1609 . 1 1 143 143 THR HG22 H 1 1.001 0.003 . 1 . . . A 143 THR QG2 . 18047 1 1610 . 1 1 143 143 THR HG23 H 1 1.001 0.003 . 1 . . . A 143 THR QG2 . 18047 1 1611 . 1 1 143 143 THR CA C 13 62.585 0.160 . 1 . . . A 143 THR CA . 18047 1 1612 . 1 1 143 143 THR CB C 13 70.832 0.160 . 1 . . . A 143 THR CB . 18047 1 1613 . 1 1 143 143 THR CG2 C 13 22.152 0.160 . 1 . . . A 143 THR CG2 . 18047 1 1614 . 1 1 143 143 THR N N 15 123.540 0.130 . 1 . . . A 143 THR N . 18047 1 stop_ save_