data_6278 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6278 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for yeast Sed5p ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-07-28 _Entry.Accession_date 2004-07-28 _Entry.Last_release_date 2004-09-28 _Entry.Original_release_date 2004-09-28 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 Xiaocheng Chen . . . 6278 2 Josep Rizo . . . 6278 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6278 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 341 6278 '15N chemical shifts' 113 6278 '1H chemical shifts' 113 6278 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 . . 2004-09-28 2004-07-28 original author . 6278 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6278 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11879635 _Citation.Full_citation . _Citation.Title 'Sly1 Binds to Golgi and ER Syntaxins via a Conserved N-Terminal Peptide Motif' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Dev. Cell' _Citation.Journal_name_full . _Citation.Journal_volume 2 _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 295 _Citation.Page_last 305 _Citation.Year 2002 _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 Tomohiro Yamaguchi . . . 6278 1 2 Irina Dulubova . . . 6278 1 3 Sang-Won Min . . . 6278 1 4 Xiaocheng Chen . . . 6278 1 5 Josep Rizo . . . 6278 1 6 Thomas Sudhof . C. . 6278 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_Sed5p _Assembly.Sf_category assembly _Assembly.Sf_framecode system_Sed5p _Assembly.Entry_ID 6278 _Assembly.ID 1 _Assembly.Name 'yeast Sed5p' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 6278 1 stop_ 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 'Yeast Sed5p' 1 $Sed5p . . . native . . . . . 6278 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID Sed5p abbreviation 6278 1 'yeast Sed5p' system 6278 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Sed5p _Entity.Sf_category entity _Entity.Sf_framecode Sed5p _Entity.Entry_ID 6278 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Sed5p _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; KSVSEFQKKASGIAHEISST AQLLSKLAVLAKRKPMFNDN PVEIAELSFLIKRKIYAIEQ SLVQLSQLKKTDVNGNTSNQ SSKQPSAVQHSKNVVNLLNT QMKNISGSFKDVLEERQRLE MANKDRW ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 127 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 DBJ GAA24913 . "K7_Sed5p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 100.00 340 99.21 100.00 8.73e-81 . . . . 6278 1 2 no EMBL CAA47390 . "39kDa integral membrane protein required for secretion [Saccharomyces cerevisiae]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 3 no EMBL CAA97549 . "SED5 [Saccharomyces cerevisiae]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 4 no EMBL CAY81264 . "Sed5p [Saccharomyces cerevisiae EC1118]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 5 no GB AHY78432 . "Sed5p [Saccharomyces cerevisiae YJM993]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 6 no GB EDN59573 . "suppressor of erd2 deletion [Saccharomyces cerevisiae YJM789]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 7 no GB EDV09334 . "syntaxin family [Saccharomyces cerevisiae RM11-1a]" . . . . . 100.00 340 99.21 100.00 2.48e-81 . . . . 6278 1 8 no GB EDZ70730 . "YLR026Cp-like protein [Saccharomyces cerevisiae AWRI1631]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 9 no GB EEU04509 . "Sed5p [Saccharomyces cerevisiae JAY291]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 10 no REF NP_013126 . "Sed5p [Saccharomyces cerevisiae S288c]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 11 no SP Q01590 . "RecName: Full=Integral membrane protein SED5 [Saccharomyces cerevisiae S288c]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 12 no TPG DAA09344 . "TPA: Sed5p [Saccharomyces cerevisiae S288c]" . . . . . 100.00 340 100.00 100.00 1.26e-81 . . . . 6278 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Sed5p abbreviation 6278 1 Sed5p common 6278 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 49 LYS . 6278 1 2 50 SER . 6278 1 3 51 VAL . 6278 1 4 52 SER . 6278 1 5 53 GLU . 6278 1 6 54 PHE . 6278 1 7 55 GLN . 6278 1 8 56 LYS . 6278 1 9 57 LYS . 6278 1 10 58 ALA . 6278 1 11 59 SER . 6278 1 12 60 GLY . 6278 1 13 61 ILE . 6278 1 14 62 ALA . 6278 1 15 63 HIS . 6278 1 16 64 GLU . 6278 1 17 65 ILE . 6278 1 18 66 SER . 6278 1 19 67 SER . 6278 1 20 68 THR . 6278 1 21 69 ALA . 6278 1 22 70 GLN . 6278 1 23 71 LEU . 6278 1 24 72 LEU . 6278 1 25 73 SER . 6278 1 26 74 LYS . 6278 1 27 75 LEU . 6278 1 28 76 ALA . 6278 1 29 77 VAL . 6278 1 30 78 LEU . 6278 1 31 79 ALA . 6278 1 32 80 LYS . 6278 1 33 81 ARG . 6278 1 34 82 LYS . 6278 1 35 83 PRO . 6278 1 36 84 MET . 6278 1 37 85 PHE . 6278 1 38 86 ASN . 6278 1 39 87 ASP . 6278 1 40 88 ASN . 6278 1 41 89 PRO . 6278 1 42 90 VAL . 6278 1 43 91 GLU . 6278 1 44 92 ILE . 6278 1 45 93 ALA . 6278 1 46 94 GLU . 6278 1 47 95 LEU . 6278 1 48 96 SER . 6278 1 49 97 PHE . 6278 1 50 98 LEU . 6278 1 51 99 ILE . 6278 1 52 100 LYS . 6278 1 53 101 ARG . 6278 1 54 102 LYS . 6278 1 55 103 ILE . 6278 1 56 104 TYR . 6278 1 57 105 ALA . 6278 1 58 106 ILE . 6278 1 59 107 GLU . 6278 1 60 108 GLN . 6278 1 61 109 SER . 6278 1 62 110 LEU . 6278 1 63 111 VAL . 6278 1 64 112 GLN . 6278 1 65 113 LEU . 6278 1 66 114 SER . 6278 1 67 115 GLN . 6278 1 68 116 LEU . 6278 1 69 117 LYS . 6278 1 70 118 LYS . 6278 1 71 119 THR . 6278 1 72 120 ASP . 6278 1 73 121 VAL . 6278 1 74 122 ASN . 6278 1 75 123 GLY . 6278 1 76 124 ASN . 6278 1 77 125 THR . 6278 1 78 126 SER . 6278 1 79 127 ASN . 6278 1 80 128 GLN . 6278 1 81 129 SER . 6278 1 82 130 SER . 6278 1 83 131 LYS . 6278 1 84 132 GLN . 6278 1 85 133 PRO . 6278 1 86 134 SER . 6278 1 87 135 ALA . 6278 1 88 136 VAL . 6278 1 89 137 GLN . 6278 1 90 138 HIS . 6278 1 91 139 SER . 6278 1 92 140 LYS . 6278 1 93 141 ASN . 6278 1 94 142 VAL . 6278 1 95 143 VAL . 6278 1 96 144 ASN . 6278 1 97 145 LEU . 6278 1 98 146 LEU . 6278 1 99 147 ASN . 6278 1 100 148 THR . 6278 1 101 149 GLN . 6278 1 102 150 MET . 6278 1 103 151 LYS . 6278 1 104 152 ASN . 6278 1 105 153 ILE . 6278 1 106 154 SER . 6278 1 107 155 GLY . 6278 1 108 156 SER . 6278 1 109 157 PHE . 6278 1 110 158 LYS . 6278 1 111 159 ASP . 6278 1 112 160 VAL . 6278 1 113 161 LEU . 6278 1 114 162 GLU . 6278 1 115 163 GLU . 6278 1 116 164 ARG . 6278 1 117 165 GLN . 6278 1 118 166 ARG . 6278 1 119 167 LEU . 6278 1 120 168 GLU . 6278 1 121 169 MET . 6278 1 122 170 ALA . 6278 1 123 171 ASN . 6278 1 124 172 LYS . 6278 1 125 173 ASP . 6278 1 126 174 ARG . 6278 1 127 175 TRP . 6278 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 . LYS 1 1 6278 1 . SER 2 2 6278 1 . VAL 3 3 6278 1 . SER 4 4 6278 1 . GLU 5 5 6278 1 . PHE 6 6 6278 1 . GLN 7 7 6278 1 . LYS 8 8 6278 1 . LYS 9 9 6278 1 . ALA 10 10 6278 1 . SER 11 11 6278 1 . GLY 12 12 6278 1 . ILE 13 13 6278 1 . ALA 14 14 6278 1 . HIS 15 15 6278 1 . GLU 16 16 6278 1 . ILE 17 17 6278 1 . SER 18 18 6278 1 . SER 19 19 6278 1 . THR 20 20 6278 1 . ALA 21 21 6278 1 . GLN 22 22 6278 1 . LEU 23 23 6278 1 . LEU 24 24 6278 1 . SER 25 25 6278 1 . LYS 26 26 6278 1 . LEU 27 27 6278 1 . ALA 28 28 6278 1 . VAL 29 29 6278 1 . LEU 30 30 6278 1 . ALA 31 31 6278 1 . LYS 32 32 6278 1 . ARG 33 33 6278 1 . LYS 34 34 6278 1 . PRO 35 35 6278 1 . MET 36 36 6278 1 . PHE 37 37 6278 1 . ASN 38 38 6278 1 . ASP 39 39 6278 1 . ASN 40 40 6278 1 . PRO 41 41 6278 1 . VAL 42 42 6278 1 . GLU 43 43 6278 1 . ILE 44 44 6278 1 . ALA 45 45 6278 1 . GLU 46 46 6278 1 . LEU 47 47 6278 1 . SER 48 48 6278 1 . PHE 49 49 6278 1 . LEU 50 50 6278 1 . ILE 51 51 6278 1 . LYS 52 52 6278 1 . ARG 53 53 6278 1 . LYS 54 54 6278 1 . ILE 55 55 6278 1 . TYR 56 56 6278 1 . ALA 57 57 6278 1 . ILE 58 58 6278 1 . GLU 59 59 6278 1 . GLN 60 60 6278 1 . SER 61 61 6278 1 . LEU 62 62 6278 1 . VAL 63 63 6278 1 . GLN 64 64 6278 1 . LEU 65 65 6278 1 . SER 66 66 6278 1 . GLN 67 67 6278 1 . LEU 68 68 6278 1 . LYS 69 69 6278 1 . LYS 70 70 6278 1 . THR 71 71 6278 1 . ASP 72 72 6278 1 . VAL 73 73 6278 1 . ASN 74 74 6278 1 . GLY 75 75 6278 1 . ASN 76 76 6278 1 . THR 77 77 6278 1 . SER 78 78 6278 1 . ASN 79 79 6278 1 . GLN 80 80 6278 1 . SER 81 81 6278 1 . SER 82 82 6278 1 . LYS 83 83 6278 1 . GLN 84 84 6278 1 . PRO 85 85 6278 1 . SER 86 86 6278 1 . ALA 87 87 6278 1 . VAL 88 88 6278 1 . GLN 89 89 6278 1 . HIS 90 90 6278 1 . SER 91 91 6278 1 . LYS 92 92 6278 1 . ASN 93 93 6278 1 . VAL 94 94 6278 1 . VAL 95 95 6278 1 . ASN 96 96 6278 1 . LEU 97 97 6278 1 . LEU 98 98 6278 1 . ASN 99 99 6278 1 . THR 100 100 6278 1 . GLN 101 101 6278 1 . MET 102 102 6278 1 . LYS 103 103 6278 1 . ASN 104 104 6278 1 . ILE 105 105 6278 1 . SER 106 106 6278 1 . GLY 107 107 6278 1 . SER 108 108 6278 1 . PHE 109 109 6278 1 . LYS 110 110 6278 1 . ASP 111 111 6278 1 . VAL 112 112 6278 1 . LEU 113 113 6278 1 . GLU 114 114 6278 1 . GLU 115 115 6278 1 . ARG 116 116 6278 1 . GLN 117 117 6278 1 . ARG 118 118 6278 1 . LEU 119 119 6278 1 . GLU 120 120 6278 1 . MET 121 121 6278 1 . ALA 122 122 6278 1 . ASN 123 123 6278 1 . LYS 124 124 6278 1 . ASP 125 125 6278 1 . ARG 126 126 6278 1 . TRP 127 127 6278 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 6278 _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 $Sed5p . 4932 . . 'Saccharomyces cerevisiae' 'Baker's yeast' . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 6278 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 6278 _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 $Sed5p . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6278 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6278 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 Sed5p '[U-13C; U-15N]' . . 1 $Sed5p . . 0.5 . . mM . . . . 6278 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 6278 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 0.2 n/a 6278 1 temperature 302 1 K 6278 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 6278 _Software.ID 1 _Software.Name NMRView _Software.Version 4.12 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'analyze NMR data' 6278 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 6278 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6278 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Varian INOVA . 600 . . . 6278 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 6278 _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 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6278 1 2 '1H-15N NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6278 1 3 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6278 1 4 CBCACONH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6278 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 6278 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 6278 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H-15N NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 6278 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 6278 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name CBCACONH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 6278 _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 0.0 . indirect 0.251449530 . . . . . . . . . 6278 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6278 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 6278 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 6278 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 6278 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LYS N N 15 120.990 0.15 . 1 . . . . 49 . . . 6278 1 2 . 1 1 1 1 LYS H H 1 8.260 0.03 . 1 . . . . 49 . . . 6278 1 3 . 1 1 1 1 LYS CA C 13 56.660 0.12 . 1 . . . . 49 . . . 6278 1 4 . 1 1 1 1 LYS CB C 13 33.590 0.12 . 1 . . . . 49 . . . 6278 1 5 . 1 1 1 1 LYS C C 13 174.463 0.12 . 1 . . . . 49 . . . 6278 1 6 . 1 1 2 2 SER N N 15 117.250 0.15 . 1 . . . . 50 . . . 6278 1 7 . 1 1 2 2 SER H H 1 8.380 0.03 . 1 . . . . 50 . . . 6278 1 8 . 1 1 2 2 SER CA C 13 58.830 0.12 . 1 . . . . 50 . . . 6278 1 9 . 1 1 2 2 SER CB C 13 64.080 0.12 . 1 . . . . 50 . . . 6278 1 10 . 1 1 2 2 SER C C 13 177.112 0.12 . 1 . . . . 50 . . . 6278 1 11 . 1 1 3 3 VAL N N 15 121.790 0.15 . 1 . . . . 51 . . . 6278 1 12 . 1 1 3 3 VAL H H 1 8.180 0.03 . 1 . . . . 51 . . . 6278 1 13 . 1 1 3 3 VAL CA C 13 62.620 0.12 . 1 . . . . 51 . . . 6278 1 14 . 1 1 3 3 VAL CB C 13 33.500 0.12 . 1 . . . . 51 . . . 6278 1 15 . 1 1 3 3 VAL C C 13 174.864 0.12 . 1 . . . . 51 . . . 6278 1 16 . 1 1 4 4 SER N N 15 120.060 0.15 . 1 . . . . 52 . . . 6278 1 17 . 1 1 4 4 SER H H 1 8.510 0.03 . 1 . . . . 52 . . . 6278 1 18 . 1 1 4 4 SER CA C 13 58.450 0.12 . 1 . . . . 52 . . . 6278 1 19 . 1 1 4 4 SER CB C 13 64.980 0.12 . 1 . . . . 52 . . . 6278 1 20 . 1 1 4 4 SER C C 13 176.488 0.12 . 1 . . . . 52 . . . 6278 1 21 . 1 1 5 5 GLU N N 15 122.990 0.15 . 1 . . . . 53 . . . 6278 1 22 . 1 1 5 5 GLU H H 1 8.900 0.03 . 1 . . . . 53 . . . 6278 1 23 . 1 1 5 5 GLU CA C 13 59.940 0.12 . 1 . . . . 53 . . . 6278 1 24 . 1 1 5 5 GLU CB C 13 29.970 0.12 . 1 . . . . 53 . . . 6278 1 25 . 1 1 5 5 GLU C C 13 175.407 0.12 . 1 . . . . 53 . . . 6278 1 26 . 1 1 6 6 PHE N N 15 119.520 0.15 . 1 . . . . 54 . . . 6278 1 27 . 1 1 6 6 PHE H H 1 8.610 0.03 . 1 . . . . 54 . . . 6278 1 28 . 1 1 6 6 PHE CA C 13 62.530 0.12 . 1 . . . . 54 . . . 6278 1 29 . 1 1 6 6 PHE CB C 13 40.150 0.12 . 1 . . . . 54 . . . 6278 1 30 . 1 1 6 6 PHE C C 13 178.988 0.12 . 1 . . . . 54 . . . 6278 1 31 . 1 1 7 7 GLN N N 15 118.450 0.15 . 1 . . . . 55 . . . 6278 1 32 . 1 1 7 7 GLN H H 1 8.200 0.03 . 1 . . . . 55 . . . 6278 1 33 . 1 1 7 7 GLN CA C 13 59.240 0.12 . 1 . . . . 55 . . . 6278 1 34 . 1 1 7 7 GLN CB C 13 29.050 0.12 . 1 . . . . 55 . . . 6278 1 35 . 1 1 7 7 GLN C C 13 176.497 0.12 . 1 . . . . 55 . . . 6278 1 36 . 1 1 8 8 LYS N N 15 120.860 0.15 . 1 . . . . 56 . . . 6278 1 37 . 1 1 8 8 LYS H H 1 8.370 0.03 . 1 . . . . 56 . . . 6278 1 38 . 1 1 8 8 LYS CA C 13 59.950 0.12 . 1 . . . . 56 . . . 6278 1 39 . 1 1 8 8 LYS CB C 13 33.020 0.12 . 1 . . . . 56 . . . 6278 1 40 . 1 1 8 8 LYS C C 13 179.422 0.12 . 1 . . . . 56 . . . 6278 1 41 . 1 1 9 9 LYS N N 15 120.860 0.15 . 1 . . . . 57 . . . 6278 1 42 . 1 1 9 9 LYS H H 1 8.210 0.03 . 1 . . . . 57 . . . 6278 1 43 . 1 1 9 9 LYS CA C 13 59.000 0.12 . 1 . . . . 57 . . . 6278 1 44 . 1 1 9 9 LYS CB C 13 32.550 0.12 . 1 . . . . 57 . . . 6278 1 45 . 1 1 9 9 LYS C C 13 180.238 0.12 . 1 . . . . 57 . . . 6278 1 46 . 1 1 10 10 ALA N N 15 122.460 0.15 . 1 . . . . 58 . . . 6278 1 47 . 1 1 10 10 ALA H H 1 8.730 0.03 . 1 . . . . 58 . . . 6278 1 48 . 1 1 10 10 ALA CA C 13 55.910 0.12 . 1 . . . . 58 . . . 6278 1 49 . 1 1 10 10 ALA CB C 13 18.300 0.12 . 1 . . . . 58 . . . 6278 1 50 . 1 1 10 10 ALA C C 13 179.723 0.12 . 1 . . . . 58 . . . 6278 1 51 . 1 1 11 11 SER N N 15 113.780 0.15 . 1 . . . . 59 . . . 6278 1 52 . 1 1 11 11 SER H H 1 8.340 0.03 . 1 . . . . 59 . . . 6278 1 53 . 1 1 11 11 SER CA C 13 61.990 0.12 . 1 . . . . 59 . . . 6278 1 54 . 1 1 11 11 SER CB C 13 63.050 0.12 . 1 . . . . 59 . . . 6278 1 55 . 1 1 11 11 SER C C 13 179.929 0.12 . 1 . . . . 59 . . . 6278 1 56 . 1 1 12 12 GLY N N 15 110.300 0.15 . 1 . . . . 60 . . . 6278 1 57 . 1 1 12 12 GLY H H 1 7.900 0.03 . 1 . . . . 60 . . . 6278 1 58 . 1 1 12 12 GLY CA C 13 47.660 0.12 . 1 . . . . 60 . . . 6278 1 59 . 1 1 12 12 GLY C C 13 177.781 0.12 . 1 . . . . 60 . . . 6278 1 60 . 1 1 13 13 ILE N N 15 123.530 0.15 . 1 . . . . 61 . . . 6278 1 61 . 1 1 13 13 ILE H H 1 8.060 0.03 . 1 . . . . 61 . . . 6278 1 62 . 1 1 13 13 ILE CA C 13 65.940 0.12 . 1 . . . . 61 . . . 6278 1 63 . 1 1 13 13 ILE CB C 13 38.580 0.12 . 1 . . . . 61 . . . 6278 1 64 . 1 1 13 13 ILE C C 13 177.028 0.12 . 1 . . . . 61 . . . 6278 1 65 . 1 1 14 14 ALA N N 15 122.190 0.15 . 1 . . . . 62 . . . 6278 1 66 . 1 1 14 14 ALA H H 1 8.400 0.03 . 1 . . . . 62 . . . 6278 1 67 . 1 1 14 14 ALA CA C 13 56.180 0.12 . 1 . . . . 62 . . . 6278 1 68 . 1 1 14 14 ALA CB C 13 18.350 0.12 . 1 . . . . 62 . . . 6278 1 69 . 1 1 14 14 ALA C C 13 178.169 0.12 . 1 . . . . 62 . . . 6278 1 70 . 1 1 15 15 HIS N N 15 117.520 0.15 . 1 . . . . 63 . . . 6278 1 71 . 1 1 15 15 HIS H H 1 8.050 0.03 . 1 . . . . 63 . . . 6278 1 72 . 1 1 15 15 HIS CA C 13 59.870 0.12 . 1 . . . . 63 . . . 6278 1 73 . 1 1 15 15 HIS CB C 13 29.940 0.12 . 1 . . . . 63 . . . 6278 1 74 . 1 1 15 15 HIS C C 13 181.059 0.12 . 1 . . . . 63 . . . 6278 1 75 . 1 1 16 16 GLU N N 15 121.660 0.15 . 1 . . . . 64 . . . 6278 1 76 . 1 1 16 16 GLU H H 1 8.130 0.03 . 1 . . . . 64 . . . 6278 1 77 . 1 1 16 16 GLU CA C 13 59.100 0.12 . 1 . . . . 64 . . . 6278 1 78 . 1 1 16 16 GLU CB C 13 29.900 0.12 . 1 . . . . 64 . . . 6278 1 79 . 1 1 16 16 GLU C C 13 178.344 0.12 . 1 . . . . 64 . . . 6278 1 80 . 1 1 17 17 ILE N N 15 124.860 0.15 . 1 . . . . 65 . . . 6278 1 81 . 1 1 17 17 ILE H H 1 9.090 0.03 . 1 . . . . 65 . . . 6278 1 82 . 1 1 17 17 ILE CA C 13 67.340 0.12 . 1 . . . . 65 . . . 6278 1 83 . 1 1 17 17 ILE CB C 13 38.250 0.12 . 1 . . . . 65 . . . 6278 1 84 . 1 1 17 17 ILE C C 13 181.188 0.12 . 1 . . . . 65 . . . 6278 1 85 . 1 1 18 18 SER N N 15 115.500 0.15 . 1 . . . . 66 . . . 6278 1 86 . 1 1 18 18 SER H H 1 8.050 0.03 . 1 . . . . 66 . . . 6278 1 87 . 1 1 18 18 SER CA C 13 56.61 0.12 . 1 . . . . 66 . . . 6278 1 88 . 1 1 18 18 SER CB C 13 62.97 0.12 . 1 . . . . 66 . . . 6278 1 89 . 1 1 18 18 SER C C 13 177.700 0.12 . 1 . . . . 66 . . . 6278 1 90 . 1 1 19 19 SER N N 15 116.980 0.15 . 1 . . . . 67 . . . 6278 1 91 . 1 1 19 19 SER H H 1 8.360 0.03 . 1 . . . . 67 . . . 6278 1 92 . 1 1 19 19 SER CA C 13 61.850 0.12 . 1 . . . . 67 . . . 6278 1 93 . 1 1 19 19 SER CB C 13 63.000 0.12 . 1 . . . . 67 . . . 6278 1 94 . 1 1 19 19 SER C C 13 178.235 0.12 . 1 . . . . 67 . . . 6278 1 95 . 1 1 20 20 THR N N 15 120.860 0.15 . 1 . . . . 68 . . . 6278 1 96 . 1 1 20 20 THR H H 1 8.280 0.03 . 1 . . . . 68 . . . 6278 1 97 . 1 1 20 20 THR CA C 13 68.700 0.12 . 1 . . . . 68 . . . 6278 1 98 . 1 1 20 20 THR CB C 13 67.600 0.12 . 1 . . . . 68 . . . 6278 1 99 . 1 1 20 20 THR C C 13 177.620 0.12 . 1 . . . . 68 . . . 6278 1 100 . 1 1 21 21 ALA N N 15 125.000 0.15 . 1 . . . . 69 . . . 6278 1 101 . 1 1 21 21 ALA H H 1 8.770 0.03 . 1 . . . . 69 . . . 6278 1 102 . 1 1 21 21 ALA CA C 13 55.900 0.12 . 1 . . . . 69 . . . 6278 1 103 . 1 1 21 21 ALA CB C 13 18.060 0.12 . 1 . . . . 69 . . . 6278 1 104 . 1 1 21 21 ALA C C 13 176.253 0.12 . 1 . . . . 69 . . . 6278 1 105 . 1 1 22 22 GLN N N 15 118.180 0.15 . 1 . . . . 70 . . . 6278 1 106 . 1 1 22 22 GLN H H 1 7.770 0.03 . 1 . . . . 70 . . . 6278 1 107 . 1 1 22 22 GLN CA C 13 59.490 0.12 . 1 . . . . 70 . . . 6278 1 108 . 1 1 22 22 GLN CB C 13 28.680 0.12 . 1 . . . . 70 . . . 6278 1 109 . 1 1 22 22 GLN C C 13 180.913 0.12 . 1 . . . . 70 . . . 6278 1 110 . 1 1 23 23 LEU N N 15 121.390 0.15 . 1 . . . . 71 . . . 6278 1 111 . 1 1 23 23 LEU H H 1 7.720 0.03 . 1 . . . . 71 . . . 6278 1 112 . 1 1 23 23 LEU CA C 13 58.370 0.12 . 1 . . . . 71 . . . 6278 1 113 . 1 1 23 23 LEU CB C 13 42.480 0.12 . 1 . . . . 71 . . . 6278 1 114 . 1 1 23 23 LEU C C 13 179.878 0.12 . 1 . . . . 71 . . . 6278 1 115 . 1 1 24 24 LEU N N 15 120.720 0.15 . 1 . . . . 72 . . . 6278 1 116 . 1 1 24 24 LEU H H 1 8.530 0.03 . 1 . . . . 72 . . . 6278 1 117 . 1 1 24 24 LEU CA C 13 58.300 0.12 . 1 . . . . 72 . . . 6278 1 118 . 1 1 24 24 LEU CB C 13 41.990 0.12 . 1 . . . . 72 . . . 6278 1 119 . 1 1 24 24 LEU C C 13 179.250 0.12 . 1 . . . . 72 . . . 6278 1 120 . 1 1 25 25 SER N N 15 115.110 0.15 . 1 . . . . 73 . . . 6278 1 121 . 1 1 25 25 SER H H 1 8.090 0.03 . 1 . . . . 73 . . . 6278 1 122 . 1 1 25 25 SER CA C 13 62.050 0.12 . 1 . . . . 73 . . . 6278 1 123 . 1 1 25 25 SER CB C 13 63.000 0.12 . 1 . . . . 73 . . . 6278 1 124 . 1 1 25 25 SER C C 13 178.427 0.12 . 1 . . . . 73 . . . 6278 1 125 . 1 1 26 26 LYS N N 15 121.520 0.15 . 1 . . . . 74 . . . 6278 1 126 . 1 1 26 26 LYS H H 1 7.430 0.03 . 1 . . . . 74 . . . 6278 1 127 . 1 1 26 26 LYS CA C 13 59.690 0.12 . 1 . . . . 74 . . . 6278 1 128 . 1 1 26 26 LYS CB C 13 32.660 0.12 . 1 . . . . 74 . . . 6278 1 129 . 1 1 26 26 LYS C C 13 177.116 0.12 . 1 . . . . 74 . . . 6278 1 130 . 1 1 27 27 LEU N N 15 121.120 0.15 . 1 . . . . 75 . . . 6278 1 131 . 1 1 27 27 LEU H H 1 8.450 0.03 . 1 . . . . 75 . . . 6278 1 132 . 1 1 27 27 LEU CA C 13 58.400 0.12 . 1 . . . . 75 . . . 6278 1 133 . 1 1 27 27 LEU CB C 13 41.740 0.12 . 1 . . . . 75 . . . 6278 1 134 . 1 1 27 27 LEU C C 13 179.129 0.12 . 1 . . . . 75 . . . 6278 1 135 . 1 1 28 28 ALA N N 15 119.650 0.15 . 1 . . . . 76 . . . 6278 1 136 . 1 1 28 28 ALA H H 1 8.820 0.03 . 1 . . . . 76 . . . 6278 1 137 . 1 1 28 28 ALA CA C 13 55.700 0.12 . 1 . . . . 76 . . . 6278 1 138 . 1 1 28 28 ALA CB C 13 18.270 0.12 . 1 . . . . 76 . . . 6278 1 139 . 1 1 28 28 ALA C C 13 177.682 0.12 . 1 . . . . 76 . . . 6278 1 140 . 1 1 29 29 VAL N N 15 116.200 0.15 . 1 . . . . 77 . . . 6278 1 141 . 1 1 29 29 VAL H H 1 7.300 0.03 . 1 . . . . 77 . . . 6278 1 142 . 1 1 29 29 VAL CA C 13 66.300 0.12 . 1 . . . . 77 . . . 6278 1 143 . 1 1 29 29 VAL CB C 13 32.700 0.12 . 1 . . . . 77 . . . 6278 1 144 . 1 1 30 30 LEU N N 15 120.190 0.15 . 1 . . . . 78 . . . 6278 1 145 . 1 1 30 30 LEU H H 1 7.830 0.03 . 1 . . . . 78 . . . 6278 1 146 . 1 1 30 30 LEU CA C 13 58.090 0.12 . 1 . . . . 78 . . . 6278 1 147 . 1 1 30 30 LEU CB C 13 42.970 0.12 . 1 . . . . 78 . . . 6278 1 148 . 1 1 30 30 LEU C C 13 179.485 0.12 . 1 . . . . 78 . . . 6278 1 149 . 1 1 31 31 ALA N N 15 117.920 0.15 . 1 . . . . 79 . . . 6278 1 150 . 1 1 31 31 ALA H H 1 9.000 0.03 . 1 . . . . 79 . . . 6278 1 151 . 1 1 31 31 ALA CA C 13 54.140 0.12 . 1 . . . . 79 . . . 6278 1 152 . 1 1 31 31 ALA CB C 13 19.020 0.12 . 1 . . . . 79 . . . 6278 1 153 . 1 1 31 31 ALA C C 13 180.051 0.12 . 1 . . . . 79 . . . 6278 1 154 . 1 1 32 32 LYS N N 15 116.180 0.15 . 1 . . . . 80 . . . 6278 1 155 . 1 1 32 32 LYS H H 1 7.280 0.03 . 1 . . . . 80 . . . 6278 1 156 . 1 1 32 32 LYS CA C 13 56.880 0.12 . 1 . . . . 80 . . . 6278 1 157 . 1 1 32 32 LYS CB C 13 33.520 0.12 . 1 . . . . 80 . . . 6278 1 158 . 1 1 32 32 LYS C C 13 178.907 0.12 . 1 . . . . 80 . . . 6278 1 159 . 1 1 33 33 ARG N N 15 119.920 0.15 . 1 . . . . 81 . . . 6278 1 160 . 1 1 33 33 ARG H H 1 7.330 0.03 . 1 . . . . 81 . . . 6278 1 161 . 1 1 33 33 ARG CA C 13 56.770 0.12 . 1 . . . . 81 . . . 6278 1 162 . 1 1 33 33 ARG CB C 13 31.270 0.12 . 1 . . . . 81 . . . 6278 1 163 . 1 1 33 33 ARG C C 13 176.820 0.12 . 1 . . . . 81 . . . 6278 1 164 . 1 1 34 34 LYS N N 15 125.000 0.15 . 1 . . . . 82 . . . 6278 1 165 . 1 1 34 34 LYS H H 1 8.450 0.03 . 1 . . . . 82 . . . 6278 1 166 . 1 1 34 34 LYS CA C 13 55.430 0.12 . 1 . . . . 82 . . . 6278 1 167 . 1 1 34 34 LYS CB C 13 32.690 0.12 . 1 . . . . 82 . . . 6278 1 168 . 1 1 34 34 LYS C C 13 176.108 0.12 . 1 . . . . 82 . . . 6278 1 169 . 1 1 35 35 PRO CA C 13 63.960 0.12 . 1 . . . . 83 . . . 6278 1 170 . 1 1 35 35 PRO CB C 13 32.420 0.12 . 1 . . . . 83 . . . 6278 1 171 . 1 1 36 36 MET N N 15 119.650 0.15 . 1 . . . . 84 . . . 6278 1 172 . 1 1 36 36 MET H H 1 8.480 0.03 . 1 . . . . 84 . . . 6278 1 173 . 1 1 36 36 MET CA C 13 55.640 0.12 . 1 . . . . 84 . . . 6278 1 174 . 1 1 36 36 MET CB C 13 33.970 0.12 . 1 . . . . 84 . . . 6278 1 175 . 1 1 36 36 MET C C 13 176.883 0.12 . 1 . . . . 84 . . . 6278 1 176 . 1 1 37 37 PHE N N 15 120.000 0.15 . 1 . . . . 85 . . . 6278 1 177 . 1 1 37 37 PHE H H 1 8.270 0.03 . 1 . . . . 85 . . . 6278 1 178 . 1 1 37 37 PHE CA C 13 59.100 0.12 . 1 . . . . 85 . . . 6278 1 179 . 1 1 37 37 PHE CB C 13 39.400 0.12 . 1 . . . . 85 . . . 6278 1 180 . 1 1 38 38 ASN N N 15 117.520 0.15 . 1 . . . . 86 . . . 6278 1 181 . 1 1 38 38 ASN H H 1 8.130 0.03 . 1 . . . . 86 . . . 6278 1 182 . 1 1 38 38 ASN CA C 13 53.310 0.12 . 1 . . . . 86 . . . 6278 1 183 . 1 1 38 38 ASN CB C 13 38.250 0.12 . 1 . . . . 86 . . . 6278 1 184 . 1 1 38 38 ASN C C 13 175.820 0.12 . 1 . . . . 86 . . . 6278 1 185 . 1 1 39 39 ASP N N 15 119.520 0.15 . 1 . . . . 87 . . . 6278 1 186 . 1 1 39 39 ASP H H 1 7.880 0.03 . 1 . . . . 87 . . . 6278 1 187 . 1 1 39 39 ASP CA C 13 54.810 0.12 . 1 . . . . 87 . . . 6278 1 188 . 1 1 39 39 ASP CB C 13 42.050 0.12 . 1 . . . . 87 . . . 6278 1 189 . 1 1 39 39 ASP C C 13 174.951 0.12 . 1 . . . . 87 . . . 6278 1 190 . 1 1 40 40 ASN N N 15 119.250 0.15 . 1 . . . . 88 . . . 6278 1 191 . 1 1 40 40 ASN H H 1 8.540 0.03 . 1 . . . . 88 . . . 6278 1 192 . 1 1 40 40 ASN CA C 13 51.250 0.12 . 1 . . . . 88 . . . 6278 1 193 . 1 1 40 40 ASN CB C 13 39.360 0.12 . 1 . . . . 88 . . . 6278 1 194 . 1 1 40 40 ASN C C 13 175.963 0.12 . 1 . . . . 88 . . . 6278 1 195 . 1 1 41 41 PRO CA C 13 64.740 0.12 . 1 . . . . 89 . . . 6278 1 196 . 1 1 41 41 PRO CB C 13 32.360 0.12 . 1 . . . . 89 . . . 6278 1 197 . 1 1 42 42 VAL N N 15 119.390 0.15 . 1 . . . . 90 . . . 6278 1 198 . 1 1 42 42 VAL H H 1 7.950 0.03 . 1 . . . . 90 . . . 6278 1 199 . 1 1 42 42 VAL CA C 13 64.900 0.12 . 1 . . . . 90 . . . 6278 1 200 . 1 1 42 42 VAL CB C 13 32.500 0.12 . 1 . . . . 90 . . . 6278 1 201 . 1 1 42 42 VAL C C 13 178.610 0.12 . 1 . . . . 90 . . . 6278 1 202 . 1 1 43 43 GLU N N 15 120.990 0.15 . 1 . . . . 91 . . . 6278 1 203 . 1 1 43 43 GLU H H 1 7.890 0.03 . 1 . . . . 91 . . . 6278 1 204 . 1 1 43 43 GLU CA C 13 60.000 0.12 . 1 . . . . 91 . . . 6278 1 205 . 1 1 43 43 GLU CB C 13 30.140 0.12 . 1 . . . . 91 . . . 6278 1 206 . 1 1 43 43 GLU C C 13 177.332 0.12 . 1 . . . . 91 . . . 6278 1 207 . 1 1 44 44 ILE N N 15 117.920 0.15 . 1 . . . . 92 . . . 6278 1 208 . 1 1 44 44 ILE H H 1 7.810 0.03 . 1 . . . . 92 . . . 6278 1 209 . 1 1 44 44 ILE CA C 13 65.630 0.12 . 1 . . . . 92 . . . 6278 1 210 . 1 1 44 44 ILE CB C 13 38.210 0.12 . 1 . . . . 92 . . . 6278 1 211 . 1 1 44 44 ILE C C 13 179.517 0.12 . 1 . . . . 92 . . . 6278 1 212 . 1 1 45 45 ALA N N 15 125.000 0.15 . 1 . . . . 93 . . . 6278 1 213 . 1 1 45 45 ALA H H 1 7.930 0.03 . 1 . . . . 93 . . . 6278 1 214 . 1 1 45 45 ALA CA C 13 55.950 0.12 . 1 . . . . 93 . . . 6278 1 215 . 1 1 45 45 ALA CB C 13 18.670 0.12 . 1 . . . . 93 . . . 6278 1 216 . 1 1 45 45 ALA C C 13 178.410 0.12 . 1 . . . . 93 . . . 6278 1 217 . 1 1 46 46 GLU N N 15 118.590 0.15 . 1 . . . . 94 . . . 6278 1 218 . 1 1 46 46 GLU H H 1 8.630 0.03 . 1 . . . . 94 . . . 6278 1 219 . 1 1 46 46 GLU CA C 13 60.080 0.12 . 1 . . . . 94 . . . 6278 1 220 . 1 1 46 46 GLU CB C 13 30.090 0.12 . 1 . . . . 94 . . . 6278 1 221 . 1 1 46 46 GLU C C 13 180.800 0.12 . 1 . . . . 94 . . . 6278 1 222 . 1 1 47 47 LEU N N 15 120.720 0.15 . 1 . . . . 95 . . . 6278 1 223 . 1 1 47 47 LEU H H 1 8.180 0.03 . 1 . . . . 95 . . . 6278 1 224 . 1 1 47 47 LEU CA C 13 58.33 0.12 . 1 . . . . 95 . . . 6278 1 225 . 1 1 47 47 LEU CB C 13 42.96 0.12 . 1 . . . . 95 . . . 6278 1 226 . 1 1 47 47 LEU C C 13 175.812 0.12 . 1 . . . . 95 . . . 6278 1 227 . 1 1 48 48 SER N N 15 114.180 0.15 . 1 . . . . 96 . . . 6278 1 228 . 1 1 48 48 SER H H 1 8.510 0.03 . 1 . . . . 96 . . . 6278 1 229 . 1 1 48 48 SER CA C 13 63.340 0.12 . 1 . . . . 96 . . . 6278 1 230 . 1 1 48 48 SER C C 13 179.032 0.12 . 1 . . . . 96 . . . 6278 1 231 . 1 1 49 49 PHE N N 15 121.390 0.15 . 1 . . . . 97 . . . 6278 1 232 . 1 1 49 49 PHE H H 1 8.160 0.03 . 1 . . . . 97 . . . 6278 1 233 . 1 1 49 49 PHE CA C 13 61.290 0.12 . 1 . . . . 97 . . . 6278 1 234 . 1 1 49 49 PHE CB C 13 39.280 0.12 . 1 . . . . 97 . . . 6278 1 235 . 1 1 49 49 PHE C C 13 176.066 0.12 . 1 . . . . 97 . . . 6278 1 236 . 1 1 50 50 LEU N N 15 120.460 0.15 . 1 . . . . 98 . . . 6278 1 237 . 1 1 50 50 LEU H H 1 8.070 0.03 . 1 . . . . 98 . . . 6278 1 238 . 1 1 50 50 LEU CA C 13 58.610 0.12 . 1 . . . . 98 . . . 6278 1 239 . 1 1 50 50 LEU CB C 13 42.550 0.12 . 1 . . . . 98 . . . 6278 1 240 . 1 1 50 50 LEU C C 13 177.887 0.12 . 1 . . . . 98 . . . 6278 1 241 . 1 1 51 51 ILE N N 15 119.120 0.15 . 1 . . . . 99 . . . 6278 1 242 . 1 1 51 51 ILE H H 1 8.450 0.03 . 1 . . . . 99 . . . 6278 1 243 . 1 1 51 51 ILE CA C 13 66.740 0.12 . 1 . . . . 99 . . . 6278 1 244 . 1 1 51 51 ILE CB C 13 38.180 0.12 . 1 . . . . 99 . . . 6278 1 245 . 1 1 51 51 ILE C C 13 179.411 0.12 . 1 . . . . 99 . . . 6278 1 246 . 1 1 52 52 LYS N N 15 119.250 0.15 . 1 . . . . 100 . . . 6278 1 247 . 1 1 52 52 LYS H H 1 8.120 0.03 . 1 . . . . 100 . . . 6278 1 248 . 1 1 52 52 LYS CA C 13 60.910 0.12 . 1 . . . . 100 . . . 6278 1 249 . 1 1 52 52 LYS CB C 13 33.100 0.12 . 1 . . . . 100 . . . 6278 1 250 . 1 1 52 52 LYS C C 13 177.266 0.12 . 1 . . . . 100 . . . 6278 1 251 . 1 1 53 53 ARG N N 15 118.180 0.15 . 1 . . . . 101 . . . 6278 1 252 . 1 1 53 53 ARG H H 1 7.880 0.03 . 1 . . . . 101 . . . 6278 1 253 . 1 1 53 53 ARG CA C 13 59.510 0.12 . 1 . . . . 101 . . . 6278 1 254 . 1 1 53 53 ARG CB C 13 30.290 0.12 . 1 . . . . 101 . . . 6278 1 255 . 1 1 53 53 ARG C C 13 179.736 0.12 . 1 . . . . 101 . . . 6278 1 256 . 1 1 54 54 LYS N N 15 122.460 0.15 . 1 . . . . 102 . . . 6278 1 257 . 1 1 54 54 LYS H H 1 8.410 0.03 . 1 . . . . 102 . . . 6278 1 258 . 1 1 54 54 LYS CA C 13 59.970 0.12 . 1 . . . . 102 . . . 6278 1 259 . 1 1 54 54 LYS CB C 13 32.950 0.12 . 1 . . . . 102 . . . 6278 1 260 . 1 1 54 54 LYS C C 13 179.970 0.12 . 1 . . . . 102 . . . 6278 1 261 . 1 1 55 55 ILE N N 15 119.390 0.15 . 1 . . . . 103 . . . 6278 1 262 . 1 1 55 55 ILE H H 1 8.750 0.03 . 1 . . . . 103 . . . 6278 1 263 . 1 1 55 55 ILE CA C 13 66.700 0.12 . 1 . . . . 103 . . . 6278 1 264 . 1 1 55 55 ILE CB C 13 38.350 0.12 . 1 . . . . 103 . . . 6278 1 265 . 1 1 55 55 ILE C C 13 179.622 0.12 . 1 . . . . 103 . . . 6278 1 266 . 1 1 56 56 TYR N N 15 119.120 0.15 . 1 . . . . 104 . . . 6278 1 267 . 1 1 56 56 TYR H H 1 7.780 0.03 . 1 . . . . 104 . . . 6278 1 268 . 1 1 56 56 TYR CA C 13 61.450 0.12 . 1 . . . . 104 . . . 6278 1 269 . 1 1 56 56 TYR CB C 13 38.380 0.12 . 1 . . . . 104 . . . 6278 1 270 . 1 1 56 56 TYR C C 13 177.675 0.12 . 1 . . . . 104 . . . 6278 1 271 . 1 1 57 57 ALA N N 15 120.860 0.15 . 1 . . . . 105 . . . 6278 1 272 . 1 1 57 57 ALA H H 1 7.940 0.03 . 1 . . . . 105 . . . 6278 1 273 . 1 1 57 57 ALA CA C 13 55.490 0.12 . 1 . . . . 105 . . . 6278 1 274 . 1 1 57 57 ALA CB C 13 18.710 0.12 . 1 . . . . 105 . . . 6278 1 275 . 1 1 57 57 ALA C C 13 178.156 0.12 . 1 . . . . 105 . . . 6278 1 276 . 1 1 58 58 ILE N N 15 121.790 0.15 . 1 . . . . 106 . . . 6278 1 277 . 1 1 58 58 ILE H H 1 8.680 0.03 . 1 . . . . 106 . . . 6278 1 278 . 1 1 58 58 ILE CA C 13 66.250 0.12 . 1 . . . . 106 . . . 6278 1 279 . 1 1 58 58 ILE CB C 13 38.520 0.12 . 1 . . . . 106 . . . 6278 1 280 . 1 1 58 58 ILE C C 13 181.795 0.12 . 1 . . . . 106 . . . 6278 1 281 . 1 1 59 59 GLU N N 15 120.860 0.15 . 1 . . . . 107 . . . 6278 1 282 . 1 1 59 59 GLU H H 1 8.780 0.03 . 1 . . . . 107 . . . 6278 1 283 . 1 1 59 59 GLU CA C 13 60.920 0.12 . 1 . . . . 107 . . . 6278 1 284 . 1 1 59 59 GLU CB C 13 29.750 0.12 . 1 . . . . 107 . . . 6278 1 285 . 1 1 59 59 GLU C C 13 178.822 0.12 . 1 . . . . 107 . . . 6278 1 286 . 1 1 60 60 GLN N N 15 116.850 0.15 . 1 . . . . 108 . . . 6278 1 287 . 1 1 60 60 GLN H H 1 7.970 0.03 . 1 . . . . 108 . . . 6278 1 288 . 1 1 60 60 GLN CA C 13 58.790 0.12 . 1 . . . . 108 . . . 6278 1 289 . 1 1 60 60 GLN CB C 13 28.700 0.12 . 1 . . . . 108 . . . 6278 1 290 . 1 1 60 60 GLN C C 13 180.465 0.12 . 1 . . . . 108 . . . 6278 1 291 . 1 1 61 61 SER N N 15 118.180 0.15 . 1 . . . . 109 . . . 6278 1 292 . 1 1 61 61 SER H H 1 8.340 0.03 . 1 . . . . 109 . . . 6278 1 293 . 1 1 61 61 SER CA C 13 59.000 0.12 . 1 . . . . 109 . . . 6278 1 294 . 1 1 61 61 SER C C 13 179.625 0.12 . 1 . . . . 109 . . . 6278 1 295 . 1 1 62 62 LEU N N 15 124.860 0.15 . 1 . . . . 110 . . . 6278 1 296 . 1 1 62 62 LEU H H 1 8.680 0.03 . 1 . . . . 110 . . . 6278 1 297 . 1 1 62 62 LEU CA C 13 58.460 0.12 . 1 . . . . 110 . . . 6278 1 298 . 1 1 62 62 LEU CB C 13 42.160 0.12 . 1 . . . . 110 . . . 6278 1 299 . 1 1 62 62 LEU C C 13 177.185 0.12 . 1 . . . . 110 . . . 6278 1 300 . 1 1 63 63 VAL N N 15 122.460 0.15 . 1 . . . . 111 . . . 6278 1 301 . 1 1 63 63 VAL H H 1 7.820 0.03 . 1 . . . . 111 . . . 6278 1 302 . 1 1 63 63 VAL CA C 13 67.030 0.12 . 1 . . . . 111 . . . 6278 1 303 . 1 1 63 63 VAL CB C 13 31.860 0.12 . 1 . . . . 111 . . . 6278 1 304 . 1 1 63 63 VAL C C 13 180.265 0.12 . 1 . . . . 111 . . . 6278 1 305 . 1 1 64 64 GLN N N 15 118.300 0.15 . 1 . . . . 112 . . . 6278 1 306 . 1 1 64 64 GLN H H 1 7.530 0.03 . 1 . . . . 112 . . . 6278 1 307 . 1 1 64 64 GLN CA C 13 59.100 0.12 . 1 . . . . 112 . . . 6278 1 308 . 1 1 64 64 GLN CB C 13 28.460 0.12 . 1 . . . . 112 . . . 6278 1 309 . 1 1 64 64 GLN C C 13 179.923 0.12 . 1 . . . . 112 . . . 6278 1 310 . 1 1 65 65 LEU CA C 13 58.150 0.12 . 1 . . . . 113 . . . 6278 1 311 . 1 1 65 65 LEU CB C 13 42.580 0.12 . 1 . . . . 113 . . . 6278 1 312 . 1 1 66 66 SER N N 15 112.170 0.15 . 1 . . . . 114 . . . 6278 1 313 . 1 1 66 66 SER H H 1 7.920 0.03 . 1 . . . . 114 . . . 6278 1 314 . 1 1 66 66 SER CA C 13 61.440 0.12 . 1 . . . . 114 . . . 6278 1 315 . 1 1 66 66 SER CB C 13 63.670 0.12 . 1 . . . . 114 . . . 6278 1 316 . 1 1 66 66 SER C C 13 178.789 0.12 . 1 . . . . 114 . . . 6278 1 317 . 1 1 67 67 GLN N N 15 119.250 0.15 . 1 . . . . 115 . . . 6278 1 318 . 1 1 67 67 GLN H H 1 7.580 0.03 . 1 . . . . 115 . . . 6278 1 319 . 1 1 67 67 GLN CA C 13 56.770 0.12 . 1 . . . . 115 . . . 6278 1 320 . 1 1 67 67 GLN CB C 13 29.230 0.12 . 1 . . . . 115 . . . 6278 1 321 . 1 1 67 67 GLN C C 13 175.589 0.12 . 1 . . . . 115 . . . 6278 1 322 . 1 1 68 68 LEU N N 15 121.120 0.15 . 1 . . . . 116 . . . 6278 1 323 . 1 1 68 68 LEU H H 1 7.660 0.03 . 1 . . . . 116 . . . 6278 1 324 . 1 1 68 68 LEU CA C 13 56.340 0.12 . 1 . . . . 116 . . . 6278 1 325 . 1 1 68 68 LEU CB C 13 43.020 0.12 . 1 . . . . 116 . . . 6278 1 326 . 1 1 68 68 LEU C C 13 177.015 0.12 . 1 . . . . 116 . . . 6278 1 327 . 1 1 69 69 LYS N N 15 121.260 0.15 . 1 . . . . 117 . . . 6278 1 328 . 1 1 69 69 LYS H H 1 8.220 0.03 . 1 . . . . 117 . . . 6278 1 329 . 1 1 69 69 LYS CA C 13 56.800 0.12 . 1 . . . . 117 . . . 6278 1 330 . 1 1 69 69 LYS CB C 13 33.300 0.12 . 1 . . . . 117 . . . 6278 1 331 . 1 1 69 69 LYS C C 13 177.798 0.12 . 1 . . . . 117 . . . 6278 1 332 . 1 1 70 70 LYS N N 15 121.790 0.15 . 1 . . . . 118 . . . 6278 1 333 . 1 1 70 70 LYS H H 1 8.210 0.03 . 1 . . . . 118 . . . 6278 1 334 . 1 1 70 70 LYS CA C 13 57.000 0.12 . 1 . . . . 118 . . . 6278 1 335 . 1 1 70 70 LYS CB C 13 33.400 0.12 . 1 . . . . 118 . . . 6278 1 336 . 1 1 70 70 LYS C C 13 176.854 0.12 . 1 . . . . 118 . . . 6278 1 337 . 1 1 71 71 THR N N 15 113.600 0.15 . 1 . . . . 119 . . . 6278 1 338 . 1 1 71 71 THR H H 1 8.030 0.03 . 1 . . . . 119 . . . 6278 1 339 . 1 1 71 71 THR CA C 13 62.300 0.12 . 1 . . . . 119 . . . 6278 1 340 . 1 1 71 71 THR CB C 13 70.000 0.12 . 1 . . . . 119 . . . 6278 1 341 . 1 1 72 72 ASP N N 15 122.860 0.15 . 1 . . . . 120 . . . 6278 1 342 . 1 1 72 72 ASP H H 1 8.280 0.03 . 1 . . . . 120 . . . 6278 1 343 . 1 1 72 72 ASP CA C 13 54.660 0.12 . 1 . . . . 120 . . . 6278 1 344 . 1 1 72 72 ASP CB C 13 41.910 0.12 . 1 . . . . 120 . . . 6278 1 345 . 1 1 72 72 ASP C C 13 174.575 0.12 . 1 . . . . 120 . . . 6278 1 346 . 1 1 73 73 VAL N N 15 119.390 0.15 . 1 . . . . 121 . . . 6278 1 347 . 1 1 73 73 VAL H H 1 8.090 0.03 . 1 . . . . 121 . . . 6278 1 348 . 1 1 73 73 VAL CA C 13 63.010 0.12 . 1 . . . . 121 . . . 6278 1 349 . 1 1 73 73 VAL CB C 13 32.990 0.12 . 1 . . . . 121 . . . 6278 1 350 . 1 1 73 73 VAL C C 13 176.787 0.12 . 1 . . . . 121 . . . 6278 1 351 . 1 1 74 74 ASN N N 15 120.860 0.15 . 1 . . . . 122 . . . 6278 1 352 . 1 1 74 74 ASN H H 1 8.450 0.03 . 1 . . . . 122 . . . 6278 1 353 . 1 1 74 74 ASN CA C 13 53.880 0.12 . 1 . . . . 122 . . . 6278 1 354 . 1 1 74 74 ASN CB C 13 39.550 0.12 . 1 . . . . 122 . . . 6278 1 355 . 1 1 74 74 ASN C C 13 176.425 0.12 . 1 . . . . 122 . . . 6278 1 356 . 1 1 75 75 GLY N N 15 108.97 0.15 . 1 . . . . 123 . . . 6278 1 357 . 1 1 75 75 GLY H H 1 8.310 0.03 . 1 . . . . 123 . . . 6278 1 358 . 1 1 75 75 GLY CA C 13 45.990 0.12 . 1 . . . . 123 . . . 6278 1 359 . 1 1 75 75 GLY C C 13 176.022 0.12 . 1 . . . . 123 . . . 6278 1 360 . 1 1 76 76 ASN N N 15 118.990 0.15 . 1 . . . . 124 . . . 6278 1 361 . 1 1 76 76 ASN H H 1 8.380 0.03 . 1 . . . . 124 . . . 6278 1 362 . 1 1 76 76 ASN CA C 13 53.710 0.12 . 1 . . . . 124 . . . 6278 1 363 . 1 1 76 76 ASN CB C 13 39.360 0.12 . 1 . . . . 124 . . . 6278 1 364 . 1 1 76 76 ASN C C 13 174.339 0.12 . 1 . . . . 124 . . . 6278 1 365 . 1 1 77 77 THR N N 15 113.640 0.15 . 1 . . . . 125 . . . 6278 1 366 . 1 1 77 77 THR H H 1 8.030 0.03 . 1 . . . . 125 . . . 6278 1 367 . 1 1 77 77 THR CA C 13 62.400 0.12 . 1 . . . . 125 . . . 6278 1 368 . 1 1 77 77 THR CB C 13 70.000 0.12 . 1 . . . . 125 . . . 6278 1 369 . 1 1 77 77 THR C C 13 176.171 0.12 . 1 . . . . 125 . . . 6278 1 370 . 1 1 78 78 SER N N 15 117.650 0.15 . 1 . . . . 126 . . . 6278 1 371 . 1 1 78 78 SER H H 1 8.350 0.03 . 1 . . . . 126 . . . 6278 1 372 . 1 1 78 78 SER CA C 13 59.000 0.12 . 1 . . . . 126 . . . 6278 1 373 . 1 1 78 78 SER CB C 13 64.160 0.12 . 1 . . . . 126 . . . 6278 1 374 . 1 1 78 78 SER C C 13 175.223 0.12 . 1 . . . . 126 . . . 6278 1 375 . 1 1 79 79 ASN N N 15 120.460 0.15 . 1 . . . . 127 . . . 6278 1 376 . 1 1 79 79 ASN H H 1 8.440 0.03 . 1 . . . . 127 . . . 6278 1 377 . 1 1 79 79 ASN CA C 13 53.860 0.12 . 1 . . . . 127 . . . 6278 1 378 . 1 1 79 79 ASN CB C 13 39.230 0.12 . 1 . . . . 127 . . . 6278 1 379 . 1 1 79 79 ASN C C 13 174.803 0.12 . 1 . . . . 127 . . . 6278 1 380 . 1 1 85 85 PRO CA C 13 64.300 0.12 . 1 . . . . 133 . . . 6278 1 381 . 1 1 85 85 PRO CB C 13 32.500 0.12 . 1 . . . . 133 . . . 6278 1 382 . 1 1 86 86 SER N N 15 115.780 0.15 . 1 . . . . 134 . . . 6278 1 383 . 1 1 86 86 SER H H 1 8.370 0.03 . 1 . . . . 134 . . . 6278 1 384 . 1 1 86 86 SER CA C 13 58.810 0.12 . 1 . . . . 134 . . . 6278 1 385 . 1 1 86 86 SER CB C 13 63.700 0.12 . 1 . . . . 134 . . . 6278 1 386 . 1 1 86 86 SER C C 13 177.288 0.12 . 1 . . . . 134 . . . 6278 1 387 . 1 1 87 87 ALA N N 15 125.930 0.15 . 1 . . . . 135 . . . 6278 1 388 . 1 1 87 87 ALA H H 1 8.340 0.03 . 1 . . . . 135 . . . 6278 1 389 . 1 1 87 87 ALA CA C 13 53.010 0.12 . 1 . . . . 135 . . . 6278 1 390 . 1 1 87 87 ALA CB C 13 19.750 0.12 . 1 . . . . 135 . . . 6278 1 391 . 1 1 87 87 ALA C C 13 174.752 0.12 . 1 . . . . 135 . . . 6278 1 392 . 1 1 88 88 VAL N N 15 118.850 0.15 . 1 . . . . 136 . . . 6278 1 393 . 1 1 88 88 VAL H H 1 8.010 0.03 . 1 . . . . 136 . . . 6278 1 394 . 1 1 88 88 VAL CA C 13 62.820 0.12 . 1 . . . . 136 . . . 6278 1 395 . 1 1 88 88 VAL CB C 13 32.990 0.12 . 1 . . . . 136 . . . 6278 1 396 . 1 1 88 88 VAL C C 13 178.089 0.12 . 1 . . . . 136 . . . 6278 1 397 . 1 1 89 89 GLN N N 15 123.800 0.15 . 1 . . . . 137 . . . 6278 1 398 . 1 1 89 89 GLN H H 1 8.340 0.03 . 1 . . . . 137 . . . 6278 1 399 . 1 1 89 89 GLN CA C 13 56.100 0.12 . 1 . . . . 137 . . . 6278 1 400 . 1 1 89 89 GLN CB C 13 29.950 0.12 . 1 . . . . 137 . . . 6278 1 401 . 1 1 89 89 GLN C C 13 176.474 0.12 . 1 . . . . 137 . . . 6278 1 402 . 1 1 90 90 HIS CA C 13 56.600 0.12 . 1 . . . . 138 . . . 6278 1 403 . 1 1 90 90 HIS CB C 13 29.700 0.12 . 1 . . . . 138 . . . 6278 1 404 . 1 1 91 91 SER N N 15 116.600 0.15 . 1 . . . . 139 . . . 6278 1 405 . 1 1 91 91 SER H H 1 8.350 0.03 . 1 . . . . 139 . . . 6278 1 406 . 1 1 91 91 SER CA C 13 59.100 0.12 . 1 . . . . 139 . . . 6278 1 407 . 1 1 91 91 SER CB C 13 64.100 0.12 . 1 . . . . 139 . . . 6278 1 408 . 1 1 92 92 LYS N N 15 122.730 0.15 . 1 . . . . 140 . . . 6278 1 409 . 1 1 92 92 LYS H H 1 8.420 0.03 . 1 . . . . 140 . . . 6278 1 410 . 1 1 92 92 LYS CA C 13 57.030 0.12 . 1 . . . . 140 . . . 6278 1 411 . 1 1 92 92 LYS CB C 13 33.240 0.12 . 1 . . . . 140 . . . 6278 1 412 . 1 1 92 92 LYS C C 13 174.903 0.12 . 1 . . . . 140 . . . 6278 1 413 . 1 1 93 93 ASN N N 15 119.390 0.15 . 1 . . . . 141 . . . 6278 1 414 . 1 1 93 93 ASN H H 1 8.380 0.03 . 1 . . . . 141 . . . 6278 1 415 . 1 1 93 93 ASN CA C 13 53.780 0.12 . 1 . . . . 141 . . . 6278 1 416 . 1 1 93 93 ASN CB C 13 39.230 0.12 . 1 . . . . 141 . . . 6278 1 417 . 1 1 93 93 ASN C C 13 176.566 0.12 . 1 . . . . 141 . . . 6278 1 418 . 1 1 94 94 VAL N N 15 120.460 0.15 . 1 . . . . 142 . . . 6278 1 419 . 1 1 94 94 VAL H H 1 8.050 0.03 . 1 . . . . 142 . . . 6278 1 420 . 1 1 94 94 VAL CA C 13 62.930 0.12 . 1 . . . . 142 . . . 6278 1 421 . 1 1 94 94 VAL CB C 13 33.100 0.12 . 1 . . . . 142 . . . 6278 1 422 . 1 1 94 94 VAL C C 13 175.434 0.12 . 1 . . . . 142 . . . 6278 1 423 . 1 1 95 95 VAL N N 15 123.260 0.15 . 1 . . . . 143 . . . 6278 1 424 . 1 1 95 95 VAL H H 1 8.140 0.03 . 1 . . . . 143 . . . 6278 1 425 . 1 1 95 95 VAL CA C 13 62.900 0.12 . 1 . . . . 143 . . . 6278 1 426 . 1 1 95 95 VAL CB C 13 33.200 0.12 . 1 . . . . 143 . . . 6278 1 427 . 1 1 95 95 VAL C C 13 176.429 0.12 . 1 . . . . 143 . . . 6278 1 428 . 1 1 96 96 ASN N N 15 117.780 0.15 . 1 . . . . 144 . . . 6278 1 429 . 1 1 96 96 ASN H H 1 8.110 0.03 . 1 . . . . 144 . . . 6278 1 430 . 1 1 96 96 ASN CA C 13 56.820 0.12 . 1 . . . . 144 . . . 6278 1 431 . 1 1 96 96 ASN CB C 13 38.400 0.12 . 1 . . . . 144 . . . 6278 1 432 . 1 1 96 96 ASN C C 13 178.263 0.12 . 1 . . . . 144 . . . 6278 1 433 . 1 1 97 97 LEU N N 15 122.990 0.15 . 1 . . . . 145 . . . 6278 1 434 . 1 1 97 97 LEU H H 1 8.240 0.03 . 1 . . . . 145 . . . 6278 1 435 . 1 1 97 97 LEU CA C 13 58.650 0.12 . 1 . . . . 145 . . . 6278 1 436 . 1 1 97 97 LEU CB C 13 33.000 0.12 . 1 . . . . 145 . . . 6278 1 437 . 1 1 97 97 LEU C C 13 178.525 0.12 . 1 . . . . 145 . . . 6278 1 438 . 1 1 98 98 LEU N N 15 119.520 0.15 . 1 . . . . 146 . . . 6278 1 439 . 1 1 98 98 LEU H H 1 8.240 0.03 . 1 . . . . 146 . . . 6278 1 440 . 1 1 98 98 LEU CA C 13 58.800 0.12 . 1 . . . . 146 . . . 6278 1 441 . 1 1 98 98 LEU CB C 13 42.400 0.12 . 1 . . . . 146 . . . 6278 1 442 . 1 1 98 98 LEU C C 13 179.935 0.12 . 1 . . . . 146 . . . 6278 1 443 . 1 1 99 99 ASN N N 15 117.520 0.15 . 1 . . . . 147 . . . 6278 1 444 . 1 1 99 99 ASN H H 1 8.600 0.03 . 1 . . . . 147 . . . 6278 1 445 . 1 1 99 99 ASN CA C 13 57.350 0.12 . 1 . . . . 147 . . . 6278 1 446 . 1 1 99 99 ASN CB C 13 39.450 0.12 . 1 . . . . 147 . . . 6278 1 447 . 1 1 99 99 ASN C C 13 179.388 0.12 . 1 . . . . 147 . . . 6278 1 448 . 1 1 100 100 THR N N 15 118.050 0.15 . 1 . . . . 148 . . . 6278 1 449 . 1 1 100 100 THR H H 1 8.420 0.03 . 1 . . . . 148 . . . 6278 1 450 . 1 1 100 100 THR CA C 13 67.640 0.12 . 1 . . . . 148 . . . 6278 1 451 . 1 1 100 100 THR CB C 13 68.850 0.12 . 1 . . . . 148 . . . 6278 1 452 . 1 1 100 100 THR C C 13 178.801 0.12 . 1 . . . . 148 . . . 6278 1 453 . 1 1 102 102 MET CA C 13 58.200 0.12 . 1 . . . . 150 . . . 6278 1 454 . 1 1 102 102 MET CB C 13 32.160 0.12 . 1 . . . . 150 . . . 6278 1 455 . 1 1 103 103 LYS N N 15 122.190 0.15 . 1 . . . . 151 . . . 6278 1 456 . 1 1 103 103 LYS H H 1 8.440 0.03 . 1 . . . . 151 . . . 6278 1 457 . 1 1 103 103 LYS CA C 13 59.910 0.12 . 1 . . . . 151 . . . 6278 1 458 . 1 1 103 103 LYS CB C 13 32.200 0.12 . 1 . . . . 151 . . . 6278 1 459 . 1 1 103 103 LYS C C 13 178.804 0.12 . 1 . . . . 151 . . . 6278 1 460 . 1 1 104 104 ASN N N 15 119.250 0.15 . 1 . . . . 152 . . . 6278 1 461 . 1 1 104 104 ASN H H 1 8.070 0.03 . 1 . . . . 152 . . . 6278 1 462 . 1 1 104 104 ASN CA C 13 57.900 0.12 . 1 . . . . 152 . . . 6278 1 463 . 1 1 104 104 ASN CB C 13 38.310 0.12 . 1 . . . . 152 . . . 6278 1 464 . 1 1 104 104 ASN C C 13 180.335 0.12 . 1 . . . . 152 . . . 6278 1 465 . 1 1 105 105 ILE N N 15 121.660 0.15 . 1 . . . . 153 . . . 6278 1 466 . 1 1 105 105 ILE H H 1 8.170 0.03 . 1 . . . . 153 . . . 6278 1 467 . 1 1 105 105 ILE CA C 13 65.300 0.12 . 1 . . . . 153 . . . 6278 1 468 . 1 1 105 105 ILE C C 13 178.727 0.12 . 1 . . . . 153 . . . 6278 1 469 . 1 1 106 106 SER N N 15 116.450 0.15 . 1 . . . . 154 . . . 6278 1 470 . 1 1 106 106 SER H H 1 8.830 0.03 . 1 . . . . 154 . . . 6278 1 471 . 1 1 106 106 SER CA C 13 63.13 0.12 . 1 . . . . 154 . . . 6278 1 472 . 1 1 106 106 SER CB C 13 62.16 0.12 . 1 . . . . 154 . . . 6278 1 473 . 1 1 106 106 SER C C 13 177.778 0.12 . 1 . . . . 154 . . . 6278 1 474 . 1 1 107 107 GLY N N 15 109.770 0.15 . 1 . . . . 155 . . . 6278 1 475 . 1 1 107 107 GLY H H 1 8.420 0.03 . 1 . . . . 155 . . . 6278 1 476 . 1 1 107 107 GLY CA C 13 47.760 0.12 . 1 . . . . 155 . . . 6278 1 477 . 1 1 107 107 GLY C C 13 178.147 0.12 . 1 . . . . 155 . . . 6278 1 478 . 1 1 108 108 SER N N 15 118.320 0.15 . 1 . . . . 156 . . . 6278 1 479 . 1 1 108 108 SER H H 1 8.110 0.03 . 1 . . . . 156 . . . 6278 1 480 . 1 1 108 108 SER CA C 13 62.240 0.12 . 1 . . . . 156 . . . 6278 1 481 . 1 1 108 108 SER CB C 13 63.360 0.12 . 1 . . . . 156 . . . 6278 1 482 . 1 1 108 108 SER C C 13 176.146 0.12 . 1 . . . . 156 . . . 6278 1 483 . 1 1 109 109 PHE N N 15 121.260 0.15 . 1 . . . . 157 . . . 6278 1 484 . 1 1 109 109 PHE H H 1 8.660 0.03 . 1 . . . . 157 . . . 6278 1 485 . 1 1 109 109 PHE CA C 13 59.390 0.12 . 1 . . . . 157 . . . 6278 1 486 . 1 1 109 109 PHE C C 13 176.548 0.12 . 1 . . . . 157 . . . 6278 1 487 . 1 1 110 110 LYS N N 15 118.450 0.15 . 1 . . . . 158 . . . 6278 1 488 . 1 1 110 110 LYS H H 1 7.780 0.03 . 1 . . . . 158 . . . 6278 1 489 . 1 1 110 110 LYS CA C 13 59.800 0.12 . 1 . . . . 158 . . . 6278 1 490 . 1 1 110 110 LYS CB C 13 32.200 0.12 . 1 . . . . 158 . . . 6278 1 491 . 1 1 110 110 LYS C C 13 176.353 0.12 . 1 . . . . 158 . . . 6278 1 492 . 1 1 111 111 ASP N N 15 119.120 0.15 . 1 . . . . 159 . . . 6278 1 493 . 1 1 111 111 ASP H H 1 7.980 0.03 . 1 . . . . 159 . . . 6278 1 494 . 1 1 111 111 ASP CA C 13 58.140 0.12 . 1 . . . . 159 . . . 6278 1 495 . 1 1 111 111 ASP CB C 13 40.810 0.12 . 1 . . . . 159 . . . 6278 1 496 . 1 1 111 111 ASP C C 13 179.031 0.12 . 1 . . . . 159 . . . 6278 1 497 . 1 1 112 112 VAL N N 15 121.390 0.15 . 1 . . . . 160 . . . 6278 1 498 . 1 1 112 112 VAL H H 1 8.380 0.03 . 1 . . . . 160 . . . 6278 1 499 . 1 1 112 112 VAL CA C 13 66.500 0.12 . 1 . . . . 160 . . . 6278 1 500 . 1 1 112 112 VAL CB C 13 32.000 0.12 . 1 . . . . 160 . . . 6278 1 501 . 1 1 113 113 LEU N N 15 123.660 0.15 . 1 . . . . 161 . . . 6278 1 502 . 1 1 113 113 LEU H H 1 8.150 0.03 . 1 . . . . 161 . . . 6278 1 503 . 1 1 113 113 LEU CA C 13 56.850 0.12 . 1 . . . . 161 . . . 6278 1 504 . 1 1 113 113 LEU CB C 13 42.300 0.12 . 1 . . . . 161 . . . 6278 1 505 . 1 1 113 113 LEU C C 13 177.243 0.12 . 1 . . . . 161 . . . 6278 1 506 . 1 1 114 114 GLU N N 15 120.720 0.15 . 1 . . . . 162 . . . 6278 1 507 . 1 1 114 114 GLU H H 1 8.290 0.03 . 1 . . . . 162 . . . 6278 1 508 . 1 1 114 114 GLU CA C 13 58.330 0.12 . 1 . . . . 162 . . . 6278 1 509 . 1 1 114 114 GLU CB C 13 30.360 0.12 . 1 . . . . 162 . . . 6278 1 510 . 1 1 114 114 GLU C C 13 178.650 0.12 . 1 . . . . 162 . . . 6278 1 511 . 1 1 116 116 ARG CA C 13 58.150 0.12 . 1 . . . . 164 . . . 6278 1 512 . 1 1 116 116 ARG CB C 13 29.670 0.12 . 1 . . . . 164 . . . 6278 1 513 . 1 1 117 117 GLN N N 15 119.100 0.15 . 1 . . . . 165 . . . 6278 1 514 . 1 1 117 117 GLN H H 1 8.040 0.03 . 1 . . . . 165 . . . 6278 1 515 . 1 1 117 117 GLN CA C 13 58.980 0.12 . 1 . . . . 165 . . . 6278 1 516 . 1 1 117 117 GLN CB C 13 28.920 0.12 . 1 . . . . 165 . . . 6278 1 517 . 1 1 117 117 GLN C C 13 178.238 0.12 . 1 . . . . 165 . . . 6278 1 518 . 1 1 118 118 ARG N N 15 119.120 0.15 . 1 . . . . 166 . . . 6278 1 519 . 1 1 118 118 ARG H H 1 7.910 0.03 . 1 . . . . 166 . . . 6278 1 520 . 1 1 118 118 ARG CA C 13 59.720 0.12 . 1 . . . . 166 . . . 6278 1 521 . 1 1 118 118 ARG CB C 13 30.620 0.12 . 1 . . . . 166 . . . 6278 1 522 . 1 1 118 118 ARG C C 13 178.694 0.12 . 1 . . . . 166 . . . 6278 1 523 . 1 1 119 119 LEU N N 15 121.520 0.15 . 1 . . . . 167 . . . 6278 1 524 . 1 1 119 119 LEU H H 1 8.090 0.03 . 1 . . . . 167 . . . 6278 1 525 . 1 1 119 119 LEU CA C 13 58.190 0.12 . 1 . . . . 167 . . . 6278 1 526 . 1 1 119 119 LEU CB C 13 42.510 0.12 . 1 . . . . 167 . . . 6278 1 527 . 1 1 119 119 LEU C C 13 179.476 0.12 . 1 . . . . 167 . . . 6278 1 528 . 1 1 120 120 GLU N N 15 119.100 0.15 . 1 . . . . 168 . . . 6278 1 529 . 1 1 120 120 GLU H H 1 8.390 0.03 . 1 . . . . 168 . . . 6278 1 530 . 1 1 120 120 GLU CA C 13 58.200 0.12 . 1 . . . . 168 . . . 6278 1 531 . 1 1 120 120 GLU CB C 13 30.230 0.12 . 1 . . . . 168 . . . 6278 1 532 . 1 1 120 120 GLU C C 13 179.817 0.12 . 1 . . . . 168 . . . 6278 1 533 . 1 1 121 121 MET N N 15 117.780 0.15 . 1 . . . . 169 . . . 6278 1 534 . 1 1 121 121 MET H H 1 8.060 0.03 . 1 . . . . 169 . . . 6278 1 535 . 1 1 121 121 MET CA C 13 57.410 0.12 . 1 . . . . 169 . . . 6278 1 536 . 1 1 121 121 MET CB C 13 32.870 0.12 . 1 . . . . 169 . . . 6278 1 537 . 1 1 121 121 MET C C 13 179.271 0.12 . 1 . . . . 169 . . . 6278 1 538 . 1 1 122 122 ALA N N 15 121.660 0.15 . 1 . . . . 170 . . . 6278 1 539 . 1 1 122 122 ALA H H 1 7.830 0.03 . 1 . . . . 170 . . . 6278 1 540 . 1 1 122 122 ALA CA C 13 53.820 0.12 . 1 . . . . 170 . . . 6278 1 541 . 1 1 122 122 ALA CB C 13 19.280 0.12 . 1 . . . . 170 . . . 6278 1 542 . 1 1 122 122 ALA C C 13 177.740 0.12 . 1 . . . . 170 . . . 6278 1 543 . 1 1 123 123 ASN N N 15 116.310 0.15 . 1 . . . . 171 . . . 6278 1 544 . 1 1 123 123 ASN H H 1 7.860 0.03 . 1 . . . . 171 . . . 6278 1 545 . 1 1 123 123 ASN CA C 13 53.910 0.12 . 1 . . . . 171 . . . 6278 1 546 . 1 1 123 123 ASN CB C 13 39.820 0.12 . 1 . . . . 171 . . . 6278 1 547 . 1 1 123 123 ASN C C 13 178.343 0.12 . 1 . . . . 171 . . . 6278 1 548 . 1 1 124 124 LYS N N 15 120.860 0.15 . 1 . . . . 172 . . . 6278 1 549 . 1 1 124 124 LYS H H 1 7.860 0.03 . 1 . . . . 172 . . . 6278 1 550 . 1 1 124 124 LYS CA C 13 57.440 0.12 . 1 . . . . 172 . . . 6278 1 551 . 1 1 124 124 LYS CB C 13 33.250 0.12 . 1 . . . . 172 . . . 6278 1 552 . 1 1 124 124 LYS C C 13 175.390 0.12 . 1 . . . . 172 . . . 6278 1 553 . 1 1 125 125 ASP N N 15 119.920 0.15 . 1 . . . . 173 . . . 6278 1 554 . 1 1 125 125 ASP H H 1 8.250 0.03 . 1 . . . . 173 . . . 6278 1 555 . 1 1 125 125 ASP CA C 13 55.150 0.12 . 1 . . . . 173 . . . 6278 1 556 . 1 1 125 125 ASP CB C 13 41.330 0.12 . 1 . . . . 173 . . . 6278 1 557 . 1 1 125 125 ASP C C 13 176.685 0.12 . 1 . . . . 173 . . . 6278 1 558 . 1 1 126 126 ARG N N 15 119.520 0.15 . 1 . . . . 174 . . . 6278 1 559 . 1 1 126 126 ARG H H 1 7.810 0.03 . 1 . . . . 174 . . . 6278 1 560 . 1 1 126 126 ARG CA C 13 56.270 0.12 . 1 . . . . 174 . . . 6278 1 561 . 1 1 126 126 ARG CB C 13 31.410 0.12 . 1 . . . . 174 . . . 6278 1 562 . 1 1 126 126 ARG C C 13 176.093 0.12 . 1 . . . . 174 . . . 6278 1 563 . 1 1 127 127 TRP N N 15 109.500 0.15 . 1 . . . . 175 . . . 6278 1 564 . 1 1 127 127 TRP H H 1 7.650 0.03 . 1 . . . . 175 . . . 6278 1 565 . 1 1 127 127 TRP CA C 13 58.800 0.12 . 1 . . . . 175 . . . 6278 1 566 . 1 1 127 127 TRP CB C 13 30.680 0.12 . 1 . . . . 175 . . . 6278 1 567 . 1 1 127 127 TRP C C 13 175.189 0.12 . 1 . . . . 175 . . . 6278 1 stop_ save_