data_25108 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25108 _Entry.Title ; Backbone Chemical Shift Assignment for the pfPP1 phosphatase regulator pfI2 of Plasmodium falciparum ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-07-24 _Entry.Accession_date 2014-07-24 _Entry.Last_release_date 2014-08-26 _Entry.Original_release_date 2014-08-26 _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 _Entry.Details 'Backbone Chemical Shift Assignment for the pfPP1 phosphatase regulator pfI2 of Plasmodium falciparum' _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 Isabelle Landrieu . . . 25108 2 Francois-Xavier Cantrelle . . . 25108 3 Aline Freville . . . 25108 4 Jamal Khalife . . . 25108 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'National French Research Center' . 25108 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25108 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 95 25108 '13C chemical shifts' 300 25108 '15N chemical shifts' 93 25108 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 . . 2014-08-26 2014-07-24 original author . 25108 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25108 _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 'Identification of a Plasmodium falciparum inhibitor-2 motif involved in binding and regulation activity of the Protein Phosphatase type 1' _Citation.Status 'in press' _Citation.Type journal _Citation.Journal_abbrev 'FEBS J.' _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 Aline Freville . . . 25108 1 2 Geraldine Tellier . . . 25108 1 3 Audrey Vandomme . . . 25108 1 4 Christine Pierrot . . . 25108 1 5 Jerome Vicogne . . . 25108 1 6 'Fran ois-Xavier' Cantrelle . . . 25108 1 7 Alain Martoriati . . . 25108 1 8 Katia Cailliau-Maggio . . . 25108 1 9 Jamal Khalife . . . 25108 1 10 Isabelle Landrieu . . . 25108 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Plasmodium falciparum' 25108 1 'protein phosphatase type 1' 25108 1 'PP1 Inhibitor 2' 25108 1 'NMR spectroscopy' 25108 1 'protein-protein interaction' 25108 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25108 _Assembly.ID 1 _Assembly.Name PfI2 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 16701 _Assembly.Enzyme_commission_number . _Assembly.Details Monomer _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 PfI2 1 $PfI2 A . yes native no no . . . 25108 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PfI2 _Entity.Sf_category entity _Entity.Sf_framecode PfI2 _Entity.Entry_ID 25108 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PfI2 _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 ; RGSHHHHHHGSMKKKVDKSV TKKTISWDEVTINEQDKERG SRMKILEPNTPFNFILMDSA SEDEASKYGDVKGSDEGQNN IADDLINKLNQLVEKQENKG VSNIDFKEKRKKHYNEYKML QKLRKSGTLDDIDEEYKPDN KDSNCDNSNMNESEE ; _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 155 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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 2015-11-25 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 yes plasmodb PF3D7_0320000 . . . . . . . . . . . . . . . . 25108 1 2 no EMBL CAX64439 . "conserved Plasmodium protein, unknown function [Plasmodium falciparum 3D7]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 3 no EMBL CDO62624 . "protein phosphatase inhibitor 2, putative [Plasmodium reichenowi]" . . . . . 92.90 144 98.61 100.00 3.75e-96 . . . . 25108 1 4 no GB ETW20523 . "hypothetical protein PFFVO_00575 [Plasmodium falciparum Vietnam Oak-Knoll (FVO)]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 5 no GB ETW38648 . "hypothetical protein PFTANZ_00648 [Plasmodium falciparum Tanzania (2000708)]" . . . . . 86.45 142 100.00 100.00 5.47e-90 . . . . 25108 1 6 no GB ETW45017 . "hypothetical protein PFNF135_00618 [Plasmodium falciparum NF135/5.C10]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 7 no GB ETW51416 . "hypothetical protein PFMALIP_00574 [Plasmodium falciparum MaliPS096_E11]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 8 no GB ETW52113 . "hypothetical protein PFUGPA_05729 [Plasmodium falciparum Palo Alto/Uganda]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 9 no REF XP_002808630 . "conserved Plasmodium protein, unknown function [Plasmodium falciparum 3D7]" . . . . . 92.90 144 100.00 100.00 3.01e-97 . . . . 25108 1 10 no REF XP_012761271 . "protein phosphatase inhibitor 2, putative [Plasmodium reichenowi]" . . . . . 92.90 144 98.61 100.00 3.75e-96 . . . . 25108 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'The regulation of PfPP1 phosphatase activity in Plasmodium falciparum' 25108 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 -10 ARG . 25108 1 2 -9 GLY . 25108 1 3 -8 SER . 25108 1 4 -7 HIS . 25108 1 5 -6 HIS . 25108 1 6 -5 HIS . 25108 1 7 -4 HIS . 25108 1 8 -3 HIS . 25108 1 9 -2 HIS . 25108 1 10 -1 GLY . 25108 1 11 0 SER . 25108 1 12 1 MET . 25108 1 13 2 LYS . 25108 1 14 3 LYS . 25108 1 15 4 LYS . 25108 1 16 5 VAL . 25108 1 17 6 ASP . 25108 1 18 7 LYS . 25108 1 19 8 SER . 25108 1 20 9 VAL . 25108 1 21 10 THR . 25108 1 22 11 LYS . 25108 1 23 12 LYS . 25108 1 24 13 THR . 25108 1 25 14 ILE . 25108 1 26 15 SER . 25108 1 27 16 TRP . 25108 1 28 17 ASP . 25108 1 29 18 GLU . 25108 1 30 19 VAL . 25108 1 31 20 THR . 25108 1 32 21 ILE . 25108 1 33 22 ASN . 25108 1 34 23 GLU . 25108 1 35 24 GLN . 25108 1 36 25 ASP . 25108 1 37 26 LYS . 25108 1 38 27 GLU . 25108 1 39 28 ARG . 25108 1 40 29 GLY . 25108 1 41 30 SER . 25108 1 42 31 ARG . 25108 1 43 32 MET . 25108 1 44 33 LYS . 25108 1 45 34 ILE . 25108 1 46 35 LEU . 25108 1 47 36 GLU . 25108 1 48 37 PRO . 25108 1 49 38 ASN . 25108 1 50 39 THR . 25108 1 51 40 PRO . 25108 1 52 41 PHE . 25108 1 53 42 ASN . 25108 1 54 43 PHE . 25108 1 55 44 ILE . 25108 1 56 45 LEU . 25108 1 57 46 MET . 25108 1 58 47 ASP . 25108 1 59 48 SER . 25108 1 60 49 ALA . 25108 1 61 50 SER . 25108 1 62 51 GLU . 25108 1 63 52 ASP . 25108 1 64 53 GLU . 25108 1 65 54 ALA . 25108 1 66 55 SER . 25108 1 67 56 LYS . 25108 1 68 57 TYR . 25108 1 69 58 GLY . 25108 1 70 59 ASP . 25108 1 71 60 VAL . 25108 1 72 61 LYS . 25108 1 73 62 GLY . 25108 1 74 63 SER . 25108 1 75 64 ASP . 25108 1 76 65 GLU . 25108 1 77 66 GLY . 25108 1 78 67 GLN . 25108 1 79 68 ASN . 25108 1 80 69 ASN . 25108 1 81 70 ILE . 25108 1 82 71 ALA . 25108 1 83 72 ASP . 25108 1 84 73 ASP . 25108 1 85 74 LEU . 25108 1 86 75 ILE . 25108 1 87 76 ASN . 25108 1 88 77 LYS . 25108 1 89 78 LEU . 25108 1 90 79 ASN . 25108 1 91 80 GLN . 25108 1 92 81 LEU . 25108 1 93 82 VAL . 25108 1 94 83 GLU . 25108 1 95 84 LYS . 25108 1 96 85 GLN . 25108 1 97 86 GLU . 25108 1 98 87 ASN . 25108 1 99 88 LYS . 25108 1 100 89 GLY . 25108 1 101 90 VAL . 25108 1 102 91 SER . 25108 1 103 92 ASN . 25108 1 104 93 ILE . 25108 1 105 94 ASP . 25108 1 106 95 PHE . 25108 1 107 96 LYS . 25108 1 108 97 GLU . 25108 1 109 98 LYS . 25108 1 110 99 ARG . 25108 1 111 100 LYS . 25108 1 112 101 LYS . 25108 1 113 102 HIS . 25108 1 114 103 TYR . 25108 1 115 104 ASN . 25108 1 116 105 GLU . 25108 1 117 106 TYR . 25108 1 118 107 LYS . 25108 1 119 108 MET . 25108 1 120 109 LEU . 25108 1 121 110 GLN . 25108 1 122 111 LYS . 25108 1 123 112 LEU . 25108 1 124 113 ARG . 25108 1 125 114 LYS . 25108 1 126 115 SER . 25108 1 127 116 GLY . 25108 1 128 117 THR . 25108 1 129 118 LEU . 25108 1 130 119 ASP . 25108 1 131 120 ASP . 25108 1 132 121 ILE . 25108 1 133 122 ASP . 25108 1 134 123 GLU . 25108 1 135 124 GLU . 25108 1 136 125 TYR . 25108 1 137 126 LYS . 25108 1 138 127 PRO . 25108 1 139 128 ASP . 25108 1 140 129 ASN . 25108 1 141 130 LYS . 25108 1 142 131 ASP . 25108 1 143 132 SER . 25108 1 144 133 ASN . 25108 1 145 134 CYS . 25108 1 146 135 ASP . 25108 1 147 136 ASN . 25108 1 148 137 SER . 25108 1 149 138 ASN . 25108 1 150 139 MET . 25108 1 151 140 ASN . 25108 1 152 141 GLU . 25108 1 153 142 SER . 25108 1 154 143 GLU . 25108 1 155 144 GLU . 25108 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 . ARG 1 1 25108 1 . GLY 2 2 25108 1 . SER 3 3 25108 1 . HIS 4 4 25108 1 . HIS 5 5 25108 1 . HIS 6 6 25108 1 . HIS 7 7 25108 1 . HIS 8 8 25108 1 . HIS 9 9 25108 1 . GLY 10 10 25108 1 . SER 11 11 25108 1 . MET 12 12 25108 1 . LYS 13 13 25108 1 . LYS 14 14 25108 1 . LYS 15 15 25108 1 . VAL 16 16 25108 1 . ASP 17 17 25108 1 . LYS 18 18 25108 1 . SER 19 19 25108 1 . VAL 20 20 25108 1 . THR 21 21 25108 1 . LYS 22 22 25108 1 . LYS 23 23 25108 1 . THR 24 24 25108 1 . ILE 25 25 25108 1 . SER 26 26 25108 1 . TRP 27 27 25108 1 . ASP 28 28 25108 1 . GLU 29 29 25108 1 . VAL 30 30 25108 1 . THR 31 31 25108 1 . ILE 32 32 25108 1 . ASN 33 33 25108 1 . GLU 34 34 25108 1 . GLN 35 35 25108 1 . ASP 36 36 25108 1 . LYS 37 37 25108 1 . GLU 38 38 25108 1 . ARG 39 39 25108 1 . GLY 40 40 25108 1 . SER 41 41 25108 1 . ARG 42 42 25108 1 . MET 43 43 25108 1 . LYS 44 44 25108 1 . ILE 45 45 25108 1 . LEU 46 46 25108 1 . GLU 47 47 25108 1 . PRO 48 48 25108 1 . ASN 49 49 25108 1 . THR 50 50 25108 1 . PRO 51 51 25108 1 . PHE 52 52 25108 1 . ASN 53 53 25108 1 . PHE 54 54 25108 1 . ILE 55 55 25108 1 . LEU 56 56 25108 1 . MET 57 57 25108 1 . ASP 58 58 25108 1 . SER 59 59 25108 1 . ALA 60 60 25108 1 . SER 61 61 25108 1 . GLU 62 62 25108 1 . ASP 63 63 25108 1 . GLU 64 64 25108 1 . ALA 65 65 25108 1 . SER 66 66 25108 1 . LYS 67 67 25108 1 . TYR 68 68 25108 1 . GLY 69 69 25108 1 . ASP 70 70 25108 1 . VAL 71 71 25108 1 . LYS 72 72 25108 1 . GLY 73 73 25108 1 . SER 74 74 25108 1 . ASP 75 75 25108 1 . GLU 76 76 25108 1 . GLY 77 77 25108 1 . GLN 78 78 25108 1 . ASN 79 79 25108 1 . ASN 80 80 25108 1 . ILE 81 81 25108 1 . ALA 82 82 25108 1 . ASP 83 83 25108 1 . ASP 84 84 25108 1 . LEU 85 85 25108 1 . ILE 86 86 25108 1 . ASN 87 87 25108 1 . LYS 88 88 25108 1 . LEU 89 89 25108 1 . ASN 90 90 25108 1 . GLN 91 91 25108 1 . LEU 92 92 25108 1 . VAL 93 93 25108 1 . GLU 94 94 25108 1 . LYS 95 95 25108 1 . GLN 96 96 25108 1 . GLU 97 97 25108 1 . ASN 98 98 25108 1 . LYS 99 99 25108 1 . GLY 100 100 25108 1 . VAL 101 101 25108 1 . SER 102 102 25108 1 . ASN 103 103 25108 1 . ILE 104 104 25108 1 . ASP 105 105 25108 1 . PHE 106 106 25108 1 . LYS 107 107 25108 1 . GLU 108 108 25108 1 . LYS 109 109 25108 1 . ARG 110 110 25108 1 . LYS 111 111 25108 1 . LYS 112 112 25108 1 . HIS 113 113 25108 1 . TYR 114 114 25108 1 . ASN 115 115 25108 1 . GLU 116 116 25108 1 . TYR 117 117 25108 1 . LYS 118 118 25108 1 . MET 119 119 25108 1 . LEU 120 120 25108 1 . GLN 121 121 25108 1 . LYS 122 122 25108 1 . LEU 123 123 25108 1 . ARG 124 124 25108 1 . LYS 125 125 25108 1 . SER 126 126 25108 1 . GLY 127 127 25108 1 . THR 128 128 25108 1 . LEU 129 129 25108 1 . ASP 130 130 25108 1 . ASP 131 131 25108 1 . ILE 132 132 25108 1 . ASP 133 133 25108 1 . GLU 134 134 25108 1 . GLU 135 135 25108 1 . TYR 136 136 25108 1 . LYS 137 137 25108 1 . PRO 138 138 25108 1 . ASP 139 139 25108 1 . ASN 140 140 25108 1 . LYS 141 141 25108 1 . ASP 142 142 25108 1 . SER 143 143 25108 1 . ASN 144 144 25108 1 . CYS 145 145 25108 1 . ASP 146 146 25108 1 . ASN 147 147 25108 1 . SER 148 148 25108 1 . ASN 149 149 25108 1 . MET 150 150 25108 1 . ASN 151 151 25108 1 . GLU 152 152 25108 1 . SER 153 153 25108 1 . GLU 154 154 25108 1 . GLU 155 155 25108 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 25108 _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 $PfI2 . 5833 organism . 'Plasmodium falciparum' 'malaria parasite P. falciparum' . . Eukaryota . Plasmodium falciparum . . . . . . . . . . . . . . . . Pf3D7 . 'Protein phosphatase inhibitor 2' . . 25108 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 25108 _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 $PfI2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli M15 . . . . . . . . . . . . . . . pQE30 . . . . . . 25108 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25108 _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 PfI2 '[U-98% 15N]' . . 1 $PfI2 . . . 0.05 0.1 mM . . . . 25108 1 2 'sodium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 25108 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25108 1 4 EDTA 'natural abundance' . . . . . . 2.5 . . mM . . . . 25108 1 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 25108 1 6 TSP 'natural abundance' . . . . . . 0.1 . . mM . . . . 25108 1 7 D2O 'natural abundance' . . . . . . 5 . . % . . . . 25108 1 8 H2O 'natural abundance' . . . . . . 95 . . % . . . . 25108 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25108 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PfI2 '[U-98% 13C; U-98% 15N]' . . 1 $PfI2 . . . 0.05 0.2 mM . . . . 25108 2 2 'sodium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 25108 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25108 2 4 EDTA 'natural abundance' . . . . . . 2.5 . . mM . . . . 25108 2 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 25108 2 6 TSP 'natural abundance' . . . . . . 0.1 . . mM . . . . 25108 2 7 D2O 'natural abundance' . . . . . . 5 . . % . . . . 25108 2 8 H2O 'natural abundance' . . . . . . 95 . . % . . . . 25108 2 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 25108 _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 temperature 298 . K 25108 1 pH 6.7 . pH 25108 1 pressure 1 . atm 25108 1 'ionic strength' 100 . mM 25108 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25108 _Software.ID 1 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25108 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 25108 1 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25108 _Software.ID 2 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25108 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25108 2 stop_ save_ save_Mars _Software.Sf_category software _Software.Sf_framecode Mars _Software.Entry_ID 25108 _Software.ID 3 _Software.Name Mars _Software.Version . _Software.Details 'Jung YS & Zweckstetter M (2004) Mars -- robust automatic backbone assignment of proteins, J Biomol NMR. 30, 11-23.' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Jung YS & Zweckstetter M' . http://www3.mpibpc.mpg.de/groups/zweckstetter/_links/software_mars.htm 25108 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25108 3 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 25108 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details Cryoprobe _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 25108 _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 DMX . 600 Cryoprobe . . 25108 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 25108 _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 . . . . . . . . . . . . . . . . 25108 1 2 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25108 1 3 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25108 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25108 1 5 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25108 1 6 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25108 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 25108 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TSP 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . 25108 1 C 13 TSP 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . 25108 1 N 15 TSP 'methyl protons' . . . . ppm 0 internal indirect 0.251449530 . . . . . . . . . 25108 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 25108 _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' . . . 25108 1 2 '3D HNCACB' . . . 25108 1 3 '3D HNCA' . . . 25108 1 5 '3D HNCO' . . . 25108 1 4 '3D CBCA(CO)NH' . . . 25108 1 6 '3D HN(CA)CO' . . . 25108 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 14 14 LYS H H 1 8.37 . . 1 . . . . 3 LYS H . 25108 1 2 . 1 1 14 14 LYS C C 13 176.4 . . 1 . . . . 3 LYS C . 25108 1 3 . 1 1 14 14 LYS CA C 13 56.44 . . 1 . . . . 3 LYS CA . 25108 1 4 . 1 1 14 14 LYS CB C 13 33.06 . . 1 . . . . 3 LYS CB . 25108 1 5 . 1 1 14 14 LYS N N 15 123.8 . . 1 . . . . 3 LYS N . 25108 1 6 . 1 1 15 15 LYS H H 1 8.28 . . 1 . . . . 4 LYS H . 25108 1 7 . 1 1 15 15 LYS C C 13 176.3 . . 1 . . . . 4 LYS C . 25108 1 8 . 1 1 15 15 LYS CA C 13 56.44 . . 1 . . . . 4 LYS CA . 25108 1 9 . 1 1 15 15 LYS CB C 13 33.19 . . 1 . . . . 4 LYS CB . 25108 1 10 . 1 1 15 15 LYS N N 15 123 . . 1 . . . . 4 LYS N . 25108 1 11 . 1 1 16 16 VAL H H 1 8.23 . . 1 . . . . 5 VAL H . 25108 1 12 . 1 1 16 16 VAL C C 13 175.6 . . 1 . . . . 5 VAL C . 25108 1 13 . 1 1 16 16 VAL CA C 13 62.13 . . 1 . . . . 5 VAL CA . 25108 1 14 . 1 1 16 16 VAL CB C 13 33.02 . . 1 . . . . 5 VAL CB . 25108 1 15 . 1 1 16 16 VAL N N 15 122.3 . . 1 . . . . 5 VAL N . 25108 1 16 . 1 1 17 17 ASP H H 1 8.43 . . 1 . . . . 6 ASP H . 25108 1 17 . 1 1 17 17 ASP C C 13 176.3 . . 1 . . . . 6 ASP C . 25108 1 18 . 1 1 17 17 ASP CA C 13 54.18 . . 1 . . . . 6 ASP CA . 25108 1 19 . 1 1 17 17 ASP CB C 13 41.62 . . 1 . . . . 6 ASP CB . 25108 1 20 . 1 1 17 17 ASP N N 15 125.2 . . 1 . . . . 6 ASP N . 25108 1 21 . 1 1 18 18 LYS H H 1 8.42 . . 1 . . . . 7 LYS H . 25108 1 22 . 1 1 18 18 LYS C C 13 176.7 . . 1 . . . . 7 LYS C . 25108 1 23 . 1 1 18 18 LYS CA C 13 56.53 . . 1 . . . . 7 LYS CA . 25108 1 24 . 1 1 18 18 LYS CB C 13 32.68 . . 1 . . . . 7 LYS CB . 25108 1 25 . 1 1 18 18 LYS N N 15 122.9 . . 1 . . . . 7 LYS N . 25108 1 26 . 1 1 19 19 SER H H 1 8.45 . . 1 . . . . 8 SER H . 25108 1 27 . 1 1 19 19 SER C C 13 174.7 . . 1 . . . . 8 SER C . 25108 1 28 . 1 1 19 19 SER CA C 13 59.02 . . 1 . . . . 8 SER CA . 25108 1 29 . 1 1 19 19 SER CB C 13 63.87 . . 1 . . . . 8 SER CB . 25108 1 30 . 1 1 19 19 SER N N 15 117.1 . . 1 . . . . 8 SER N . 25108 1 31 . 1 1 20 20 VAL H H 1 8.05 . . 1 . . . . 9 VAL H . 25108 1 32 . 1 1 20 20 VAL C C 13 176.4 . . 1 . . . . 9 VAL C . 25108 1 33 . 1 1 20 20 VAL CA C 13 62.49 . . 1 . . . . 9 VAL CA . 25108 1 34 . 1 1 20 20 VAL CB C 13 32.53 . . 1 . . . . 9 VAL CB . 25108 1 35 . 1 1 20 20 VAL N N 15 121.4 . . 1 . . . . 9 VAL N . 25108 1 36 . 1 1 21 21 THR H H 1 8.17 . . 1 . . . . 10 THR H . 25108 1 37 . 1 1 21 21 THR C C 13 174.4 . . 1 . . . . 10 THR C . 25108 1 38 . 1 1 21 21 THR CA C 13 62.15 . . 1 . . . . 10 THR CA . 25108 1 39 . 1 1 21 21 THR CB C 13 69.71 . . 1 . . . . 10 THR CB . 25108 1 40 . 1 1 21 21 THR N N 15 118.2 . . 1 . . . . 10 THR N . 25108 1 41 . 1 1 22 22 LYS H H 1 8.30 . . 1 . . . . 11 LYS H . 25108 1 42 . 1 1 22 22 LYS C C 13 176.3 . . 1 . . . . 11 LYS C . 25108 1 43 . 1 1 22 22 LYS CA C 13 56.42 . . 1 . . . . 11 LYS CA . 25108 1 44 . 1 1 22 22 LYS CB C 13 33.29 . . 1 . . . . 11 LYS CB . 25108 1 45 . 1 1 22 22 LYS N N 15 124.4 . . 1 . . . . 11 LYS N . 25108 1 46 . 1 1 23 23 LYS H H 1 8.36 . . 1 . . . . 12 LYS H . 25108 1 47 . 1 1 23 23 LYS C C 13 176.5 . . 1 . . . . 12 LYS C . 25108 1 48 . 1 1 23 23 LYS CA C 13 56.45 . . 1 . . . . 12 LYS CA . 25108 1 49 . 1 1 23 23 LYS CB C 13 33.19 . . 1 . . . . 12 LYS CB . 25108 1 50 . 1 1 23 23 LYS N N 15 123.2 . . 1 . . . . 12 LYS N . 25108 1 51 . 1 1 24 24 THR H H 1 8.20 . . 1 . . . . 13 THR H . 25108 1 52 . 1 1 24 24 THR C C 13 174.2 . . 1 . . . . 13 THR C . 25108 1 53 . 1 1 24 24 THR CA C 13 62.15 . . 1 . . . . 13 THR CA . 25108 1 54 . 1 1 24 24 THR CB C 13 69.64 . . 1 . . . . 13 THR CB . 25108 1 55 . 1 1 24 24 THR N N 15 116.8 . . 1 . . . . 13 THR N . 25108 1 56 . 1 1 25 25 ILE H H 1 8.18 . . 1 . . . . 14 ILE H . 25108 1 57 . 1 1 25 25 ILE C C 13 175.7 . . 1 . . . . 14 ILE C . 25108 1 58 . 1 1 25 25 ILE CA C 13 61.05 . . 1 . . . . 14 ILE CA . 25108 1 59 . 1 1 25 25 ILE CB C 13 69.64 . . 1 . . . . 14 ILE CB . 25108 1 60 . 1 1 25 25 ILE N N 15 123.5 . . 1 . . . . 14 ILE N . 25108 1 61 . 1 1 26 26 SER H H 1 8.24 . . 1 . . . . 15 SER H . 25108 1 62 . 1 1 26 26 SER C C 13 174.4 . . 1 . . . . 15 SER C . 25108 1 63 . 1 1 26 26 SER CA C 13 57.85 . . 1 . . . . 15 SER CA . 25108 1 64 . 1 1 26 26 SER CB C 13 63.93 . . 1 . . . . 15 SER CB . 25108 1 65 . 1 1 26 26 SER N N 15 120.0 . . 1 . . . . 15 SER N . 25108 1 66 . 1 1 27 27 TRP H H 1 8.22 . . 1 . . . . 16 TRP H . 25108 1 67 . 1 1 27 27 TRP C C 13 175.9 . . 1 . . . . 16 TRP C . 25108 1 68 . 1 1 27 27 TRP CA C 13 57.75 . . 1 . . . . 16 TRP CA . 25108 1 69 . 1 1 27 27 TRP CB C 13 29.60 . . 1 . . . . 16 TRP CB . 25108 1 70 . 1 1 27 27 TRP N N 15 123.8 . . 1 . . . . 16 TRP N . 25108 1 71 . 1 1 28 28 ASP H H 1 8.15 . . 1 . . . . 17 ASP H . 25108 1 72 . 1 1 28 28 ASP C C 13 176 . . 1 . . . . 17 ASP C . 25108 1 73 . 1 1 28 28 ASP CA C 13 54.44 . . 1 . . . . 17 ASP CA . 25108 1 74 . 1 1 28 28 ASP CB C 13 40.92 . . 1 . . . . 17 ASP CB . 25108 1 75 . 1 1 28 28 ASP N N 15 120.7 . . 1 . . . . 17 ASP N . 25108 1 76 . 1 1 29 29 GLU H H 1 8.04 . . 1 . . . . 18 GLU H . 25108 1 77 . 1 1 29 29 GLU C C 13 176.6 . . 1 . . . . 18 GLU C . 25108 1 78 . 1 1 29 29 GLU CA C 13 56.96 . . 1 . . . . 18 GLU CA . 25108 1 79 . 1 1 29 29 GLU CB C 13 30.3 . . 1 . . . . 18 GLU CB . 25108 1 80 . 1 1 29 29 GLU N N 15 120.5 . . 1 . . . . 18 GLU N . 25108 1 81 . 1 1 30 30 VAL H H 1 8.05 . . 1 . . . . 19 VAL H . 25108 1 82 . 1 1 30 30 VAL C C 13 176.6 . . 1 . . . . 19 VAL C . 25108 1 83 . 1 1 30 30 VAL CA C 13 62.97 . . 1 . . . . 19 VAL CA . 25108 1 84 . 1 1 30 30 VAL CB C 13 32.58 . . 1 . . . . 19 VAL CB . 25108 1 85 . 1 1 30 30 VAL N N 15 120.8 . . 1 . . . . 19 VAL N . 25108 1 86 . 1 1 31 31 THR H H 1 8.21 . . 1 . . . . 20 THR H . 25108 1 87 . 1 1 31 31 THR C C 13 174.7 . . 1 . . . . 20 THR C . 25108 1 88 . 1 1 31 31 THR CA C 13 62.41 . . 1 . . . . 20 THR CA . 25108 1 89 . 1 1 31 31 THR CB C 13 69.58 . . 1 . . . . 20 THR CB . 25108 1 90 . 1 1 31 31 THR N N 15 118.4 . . 1 . . . . 20 THR N . 25108 1 91 . 1 1 32 32 ILE H H 1 8.12 . . 1 . . . . 21 ILE H . 25108 1 92 . 1 1 32 32 ILE C C 13 176 . . 1 . . . . 21 ILE C . 25108 1 93 . 1 1 32 32 ILE CA C 13 61.48 . . 1 . . . . 21 ILE CA . 25108 1 94 . 1 1 32 32 ILE CB C 13 38.72 . . 1 . . . . 21 ILE CB . 25108 1 95 . 1 1 32 32 ILE N N 15 123.4 . . 1 . . . . 21 ILE N . 25108 1 96 . 1 1 33 33 ASN H H 1 8.49 . . 1 . . . . 22 ASN H . 25108 1 97 . 1 1 33 33 ASN C C 13 175.7 . . 1 . . . . 22 ASN C . 25108 1 98 . 1 1 33 33 ASN CA C 13 53.53 . . 1 . . . . 22 ASN CA . 25108 1 99 . 1 1 33 33 ASN CB C 13 38.92 . . 1 . . . . 22 ASN CB . 25108 1 100 . 1 1 33 33 ASN N N 15 123.4 . . 1 . . . . 22 ASN N . 25108 1 101 . 1 1 34 34 GLU H H 1 8.48 . . 1 . . . . 23 GLU H . 25108 1 102 . 1 1 34 34 GLU C C 13 177.2 . . 1 . . . . 23 GLU C . 25108 1 103 . 1 1 34 34 GLU CA C 13 57.68 . . 1 . . . . 23 GLU CA . 25108 1 104 . 1 1 34 34 GLU CB C 13 30.03 . . 1 . . . . 23 GLU CB . 25108 1 105 . 1 1 34 34 GLU N N 15 121.9 . . 1 . . . . 23 GLU N . 25108 1 106 . 1 1 35 35 GLN H H 1 8.34 . . 1 . . . . 24 GLN H . 25108 1 107 . 1 1 35 35 GLN C C 13 176.5 . . 1 . . . . 24 GLN C . 25108 1 108 . 1 1 35 35 GLN CA C 13 56.94 . . 1 . . . . 24 GLN CA . 25108 1 109 . 1 1 35 35 GLN CB C 13 29.08 . . 1 . . . . 24 GLN CB . 25108 1 110 . 1 1 35 35 GLN N N 15 119.7 . . 1 . . . . 24 GLN N . 25108 1 111 . 1 1 36 36 ASP H H 1 8.23 . . 1 . . . . 25 ASP H . 25108 1 112 . 1 1 36 36 ASP C C 13 177 . . 1 . . . . 25 ASP C . 25108 1 113 . 1 1 36 36 ASP CA C 13 55.02 . . 1 . . . . 25 ASP CA . 25108 1 114 . 1 1 36 36 ASP CB C 13 40.95 . . 1 . . . . 25 ASP CB . 25108 1 115 . 1 1 36 36 ASP N N 15 120.6 . . 1 . . . . 25 ASP N . 25108 1 116 . 1 1 37 37 LYS H H 1 8.11 . . 1 . . . . 26 LYS H . 25108 1 117 . 1 1 37 37 LYS C C 13 177.4 . . 1 . . . . 26 LYS C . 25108 1 118 . 1 1 37 37 LYS CA C 13 57.46 . . 1 . . . . 26 LYS CA . 25108 1 119 . 1 1 37 37 LYS CB C 13 32.81 . . 1 . . . . 26 LYS CB . 25108 1 120 . 1 1 37 37 LYS N N 15 121.5 . . 1 . . . . 26 LYS N . 25108 1 121 . 1 1 38 38 GLU H H 1 8.29 . . 1 . . . . 27 GLU H . 25108 1 122 . 1 1 38 38 GLU C C 13 177.2 . . 1 . . . . 27 GLU C . 25108 1 123 . 1 1 38 38 GLU CA C 13 57.21 . . 1 . . . . 27 GLU CA . 25108 1 124 . 1 1 38 38 GLU CB C 13 29.72 . . 1 . . . . 27 GLU CB . 25108 1 125 . 1 1 38 38 GLU N N 15 120.3 . . 1 . . . . 27 GLU N . 25108 1 126 . 1 1 39 39 ARG H H 1 8.287 . . 1 . . . . 28 ARG H . 25108 1 127 . 1 1 39 39 ARG C C 13 177.3 . . 1 . . . . 28 ARG C . 25108 1 128 . 1 1 39 39 ARG CA C 13 56.53 . . 1 . . . . 28 ARG CA . 25108 1 129 . 1 1 39 39 ARG CB C 13 30.52 . . 1 . . . . 28 ARG CB . 25108 1 130 . 1 1 39 39 ARG N N 15 121.1 . . 1 . . . . 28 ARG N . 25108 1 131 . 1 1 40 40 GLY H H 1 8.38 . . 1 . . . . 29 GLY H . 25108 1 132 . 1 1 40 40 GLY C C 13 174.7 . . 1 . . . . 29 GLY C . 25108 1 133 . 1 1 40 40 GLY CA C 13 45.7 . . 1 . . . . 29 GLY CA . 25108 1 134 . 1 1 40 40 GLY N N 15 109 . . 1 . . . . 29 GLY N . 25108 1 135 . 1 1 41 41 SER H H 1 8.17 . . 1 . . . . 30 SER H . 25108 1 136 . 1 1 41 41 SER C C 13 175.1 . . 1 . . . . 30 SER C . 25108 1 137 . 1 1 41 41 SER CA C 13 58.83 . . 1 . . . . 30 SER CA . 25108 1 138 . 1 1 41 41 SER CB C 13 63.79 . . 1 . . . . 30 SER CB . 25108 1 139 . 1 1 41 41 SER N N 15 115.6 . . 1 . . . . 30 SER N . 25108 1 140 . 1 1 42 42 ARG H H 1 8.29 . . 1 . . . . 31 ARG H . 25108 1 141 . 1 1 42 42 ARG C C 13 176.4 . . 1 . . . . 31 ARG C . 25108 1 142 . 1 1 42 42 ARG CA C 13 56.53 . . 1 . . . . 31 ARG CA . 25108 1 143 . 1 1 42 42 ARG CB C 13 30.52 . . 1 . . . . 31 ARG CB . 25108 1 144 . 1 1 42 42 ARG N N 15 122.4 . . 1 . . . . 31 ARG N . 25108 1 145 . 1 1 43 43 MET CA C 13 55.7 . . 1 . . . . 32 MET CA . 25108 1 146 . 1 1 43 43 MET CB C 13 32.81 . . 1 . . . . 32 MET CB . 25108 1 147 . 1 1 44 44 LYS H H 1 8.24 . . 1 . . . . 33 LYS H . 25108 1 148 . 1 1 44 44 LYS C C 13 176.1 . . 1 . . . . 33 LYS C . 25108 1 149 . 1 1 44 44 LYS CA C 13 56.44 . . 1 . . . . 33 LYS CA . 25108 1 150 . 1 1 44 44 LYS CB C 13 32.95 . . 1 . . . . 33 LYS CB . 25108 1 151 . 1 1 44 44 LYS N N 15 122.7 . . 1 . . . . 33 LYS N . 25108 1 152 . 1 1 45 45 ILE H H 1 8.12 . . 1 . . . . 34 ILE H . 25108 1 153 . 1 1 45 45 ILE CA C 13 61.17 . . 1 . . . . 34 ILE CA . 25108 1 154 . 1 1 45 45 ILE CB C 13 38.7 . . 1 . . . . 34 ILE CB . 25108 1 155 . 1 1 45 45 ILE N N 15 122.6 . . 1 . . . . 34 ILE N . 25108 1 156 . 1 1 46 46 LEU H H 1 8.24 . . 1 . . . . 35 LEU H . 25108 1 157 . 1 1 46 46 LEU CA C 13 55.1 . . 1 . . . . 35 LEU CA . 25108 1 158 . 1 1 46 46 LEU CB C 13 42.44 . . 1 . . . . 35 LEU CB . 25108 1 159 . 1 1 46 46 LEU N N 15 126.5 . . 1 . . . . 35 LEU N . 25108 1 160 . 1 1 48 48 PRO CA C 13 63.49 . . 1 . . . . 37 PRO CA . 25108 1 161 . 1 1 48 48 PRO CB C 13 32.17 . . 1 . . . . 37 PRO CB . 25108 1 162 . 1 1 49 49 ASN H H 1 8.56 . . 1 . . . . 38 ASN H . 25108 1 163 . 1 1 49 49 ASN CA C 13 53.48 . . 1 . . . . 38 ASN CA . 25108 1 164 . 1 1 49 49 ASN CB C 13 38.54 . . 1 . . . . 38 ASN CB . 25108 1 165 . 1 1 49 49 ASN N N 15 118.1 . . 1 . . . . 38 ASN N . 25108 1 166 . 1 1 50 50 THR H H 1 7.97 . . 1 . . . . 39 THR H . 25108 1 167 . 1 1 50 50 THR C C 13 174.4 . . 1 . . . . 39 THR C . 25108 1 168 . 1 1 50 50 THR CA C 13 59.91 . . 1 . . . . 39 THR CA . 25108 1 169 . 1 1 50 50 THR CB C 13 69.82 . . 1 . . . . 39 THR CB . 25108 1 170 . 1 1 50 50 THR N N 15 116.3 . . 1 . . . . 39 THR N . 25108 1 171 . 1 1 51 51 PRO C C 13 176.6 . . 1 . . . . 40 PRO C . 25108 1 172 . 1 1 51 51 PRO CA C 13 63.38 . . 1 . . . . 40 PRO CA . 25108 1 173 . 1 1 51 51 PRO CB C 13 31.97 . . 1 . . . . 40 PRO CB . 25108 1 174 . 1 1 52 52 PHE H H 1 8.15 . . 1 . . . . 41 PHE H . 25108 1 175 . 1 1 52 52 PHE C C 13 174.7 . . 1 . . . . 41 PHE C . 25108 1 176 . 1 1 52 52 PHE CA C 13 57.96 . . 1 . . . . 41 PHE CA . 25108 1 177 . 1 1 52 52 PHE CB C 13 39.49 . . 1 . . . . 41 PHE CB . 25108 1 178 . 1 1 52 52 PHE N N 15 120 . . 1 . . . . 41 PHE N . 25108 1 179 . 1 1 53 53 ASN CA C 13 52.99 . . 1 . . . . 42 ASN CA . 25108 1 180 . 1 1 53 53 ASN CB C 13 38.75 . . 1 . . . . 42 ASN CB . 25108 1 181 . 1 1 54 54 PHE H H 1 7.95 . . 1 . . . . 43 PHE H . 25108 1 182 . 1 1 54 54 PHE C C 13 175.1 . . 1 . . . . 43 PHE C . 25108 1 183 . 1 1 54 54 PHE CA C 13 58.15 . . 1 . . . . 43 PHE CA . 25108 1 184 . 1 1 54 54 PHE CB C 13 39.73 . . 1 . . . . 43 PHE CB . 25108 1 185 . 1 1 54 54 PHE N N 15 120.6 . . 1 . . . . 43 PHE N . 25108 1 186 . 1 1 55 55 ILE H H 1 8.06 . . 1 . . . . 44 ILE H . 25108 1 187 . 1 1 55 55 ILE CA C 13 60.91 . . 1 . . . . 44 ILE CA . 25108 1 188 . 1 1 56 56 LEU CA C 13 55.49 . . 1 . . . . 45 LEU CA . 25108 1 189 . 1 1 56 56 LEU CB C 13 41.25 . . 1 . . . . 45 LEU CB . 25108 1 190 . 1 1 57 57 MET H H 1 8.33 . . 1 . . . . 46 MET H . 25108 1 191 . 1 1 57 57 MET C C 13 176.4 . . 1 . . . . 46 MET C . 25108 1 192 . 1 1 57 57 MET CA C 13 56.77 . . 1 . . . . 46 MET CA . 25108 1 193 . 1 1 57 57 MET CB C 13 32.69 . . 1 . . . . 46 MET CB . 25108 1 194 . 1 1 57 57 MET N N 15 121.7 . . 1 . . . . 46 MET N . 25108 1 195 . 1 1 58 58 ASP H H 1 8.33 . . 1 . . . . 47 ASP H . 25108 1 196 . 1 1 58 58 ASP C C 13 176.4 . . 1 . . . . 47 ASP C . 25108 1 197 . 1 1 58 58 ASP CA C 13 54.72 . . 1 . . . . 47 ASP CA . 25108 1 198 . 1 1 58 58 ASP CB C 13 41.4 . . 1 . . . . 47 ASP CB . 25108 1 199 . 1 1 58 58 ASP N N 15 121.7 . . 1 . . . . 47 ASP N . 25108 1 200 . 1 1 59 59 SER H H 1 8.25 . . 1 . . . . 48 SER H . 25108 1 201 . 1 1 59 59 SER C C 13 174.5 . . 1 . . . . 48 SER C . 25108 1 202 . 1 1 59 59 SER CA C 13 58.7 . . 1 . . . . 48 SER CA . 25108 1 203 . 1 1 59 59 SER CB C 13 64 . . 1 . . . . 48 SER CB . 25108 1 204 . 1 1 59 59 SER N N 15 116.3 . . 1 . . . . 48 SER N . 25108 1 205 . 1 1 60 60 ALA H H 1 8.32 . . 1 . . . . 49 ALA H . 25108 1 206 . 1 1 60 60 ALA C C 13 178 . . 1 . . . . 49 ALA C . 25108 1 207 . 1 1 60 60 ALA CA C 13 52.84 . . 1 . . . . 49 ALA CA . 25108 1 208 . 1 1 60 60 ALA CB C 13 19.22 . . 1 . . . . 49 ALA CB . 25108 1 209 . 1 1 60 60 ALA N N 15 125.8 . . 1 . . . . 49 ALA N . 25108 1 210 . 1 1 61 61 SER H H 1 8.23 . . 1 . . . . 50 SER H . 25108 1 211 . 1 1 61 61 SER CA C 13 58.72 . . 1 . . . . 50 SER CA . 25108 1 212 . 1 1 61 61 SER CB C 13 63.92 . . 1 . . . . 50 SER CB . 25108 1 213 . 1 1 61 61 SER N N 15 115.1 . . 1 . . . . 50 SER N . 25108 1 214 . 1 1 62 62 GLU H H 1 8.46 . . 1 . . . . 51 GLU H . 25108 1 215 . 1 1 62 62 GLU CA C 13 57.08 . . 1 . . . . 51 GLU CA . 25108 1 216 . 1 1 62 62 GLU CB C 13 30.17 . . 1 . . . . 51 GLU CB . 25108 1 217 . 1 1 62 62 GLU N N 15 122.8 . . 1 . . . . 51 GLU N . 25108 1 218 . 1 1 63 63 ASP H H 1 8.30 . . 1 . . . . 52 ASP H . 25108 1 219 . 1 1 63 63 ASP CA C 13 54.74 . . 1 . . . . 52 ASP CA . 25108 1 220 . 1 1 63 63 ASP CB C 13 41.29 . . 1 . . . . 52 ASP CB . 25108 1 221 . 1 1 63 63 ASP N N 15 121 . . 1 . . . . 52 ASP N . 25108 1 222 . 1 1 64 64 GLU H H 1 8.33 . . 1 . . . . 53 GLU H . 25108 1 223 . 1 1 64 64 GLU C C 13 177.1 . . 1 . . . . 53 GLU C . 25108 1 224 . 1 1 64 64 GLU CA C 13 57.73 . . 1 . . . . 53 GLU CA . 25108 1 225 . 1 1 64 64 GLU CB C 13 30.07 . . 1 . . . . 53 GLU CB . 25108 1 226 . 1 1 64 64 GLU N N 15 121.9 . . 1 . . . . 53 GLU N . 25108 1 227 . 1 1 65 65 ALA H H 1 8.25 . . 1 . . . . 54 ALA H . 25108 1 228 . 1 1 65 65 ALA C C 13 178.8 . . 1 . . . . 54 ALA C . 25108 1 229 . 1 1 65 65 ALA CA C 13 53.59 . . 1 . . . . 54 ALA CA . 25108 1 230 . 1 1 65 65 ALA CB C 13 18.86 . . 1 . . . . 54 ALA CB . 25108 1 231 . 1 1 65 65 ALA N N 15 123.1 . . 1 . . . . 54 ALA N . 25108 1 232 . 1 1 66 66 SER H H 1 8.08 . . 1 . . . . 55 SER H . 25108 1 233 . 1 1 66 66 SER C C 13 175.1 . . 1 . . . . 55 SER C . 25108 1 234 . 1 1 66 66 SER CA C 13 59.12 . . 1 . . . . 55 SER CA . 25108 1 235 . 1 1 66 66 SER CB C 13 63.54 . . 1 . . . . 55 SER CB . 25108 1 236 . 1 1 66 66 SER N N 15 113.9 . . 1 . . . . 55 SER N . 25108 1 237 . 1 1 67 67 LYS H H 1 7.96 . . 1 . . . . 56 LYS H . 25108 1 238 . 1 1 67 67 LYS C C 13 176.6 . . 1 . . . . 56 LYS C . 25108 1 239 . 1 1 67 67 LYS CA C 13 57.03 . . 1 . . . . 56 LYS CA . 25108 1 240 . 1 1 67 67 LYS CB C 13 32.84 . . 1 . . . . 56 LYS CB . 25108 1 241 . 1 1 67 67 LYS N N 15 122.4 . . 1 . . . . 56 LYS N . 25108 1 242 . 1 1 68 68 TYR H H 1 7.99 . . 1 . . . . 57 TYR H . 25108 1 243 . 1 1 68 68 TYR C C 13 176.4 . . 1 . . . . 57 TYR C . 25108 1 244 . 1 1 68 68 TYR CA C 13 57.94 . . 1 . . . . 57 TYR CA . 25108 1 245 . 1 1 68 68 TYR CB C 13 38.62 . . 1 . . . . 57 TYR CB . 25108 1 246 . 1 1 68 68 TYR N N 15 119.4 . . 1 . . . . 57 TYR N . 25108 1 247 . 1 1 69 69 GLY H H 1 8.12 . . 1 . . . . 58 GLY H . 25108 1 248 . 1 1 69 69 GLY C C 13 173.6 . . 1 . . . . 58 GLY C . 25108 1 249 . 1 1 69 69 GLY CA C 13 45.39 . . 1 . . . . 58 GLY CA . 25108 1 250 . 1 1 69 69 GLY N N 15 109.7 . . 1 . . . . 58 GLY N . 25108 1 251 . 1 1 70 70 ASP H H 1 8.2 . . 1 . . . . 59 ASP H . 25108 1 252 . 1 1 70 70 ASP C C 13 176.4 . . 1 . . . . 59 ASP C . 25108 1 253 . 1 1 70 70 ASP CA C 13 54.33 . . 1 . . . . 59 ASP CA . 25108 1 254 . 1 1 70 70 ASP CB C 13 41.31 . . 1 . . . . 59 ASP CB . 25108 1 255 . 1 1 70 70 ASP N N 15 120.7 . . 1 . . . . 59 ASP N . 25108 1 256 . 1 1 71 71 VAL H H 1 8.1 . . 1 . . . . 60 VAL H . 25108 1 257 . 1 1 71 71 VAL C C 13 176.3 . . 1 . . . . 60 VAL C . 25108 1 258 . 1 1 71 71 VAL CA C 13 62.45 . . 1 . . . . 60 VAL CA . 25108 1 259 . 1 1 71 71 VAL CB C 13 32.67 . . 1 . . . . 60 VAL CB . 25108 1 260 . 1 1 71 71 VAL N N 15 120.5 . . 1 . . . . 60 VAL N . 25108 1 261 . 1 1 72 72 LYS H H 1 8.43 . . 1 . . . . 61 LYS H . 25108 1 262 . 1 1 72 72 LYS C C 13 177.1 . . 1 . . . . 61 LYS C . 25108 1 263 . 1 1 72 72 LYS CA C 13 56.47 . . 1 . . . . 61 LYS CA . 25108 1 264 . 1 1 72 72 LYS CB C 13 32.87 . . 1 . . . . 61 LYS CB . 25108 1 265 . 1 1 72 72 LYS N N 15 125.4 . . 1 . . . . 61 LYS N . 25108 1 266 . 1 1 73 73 GLY H H 1 8.45 . . 1 . . . . 62 GLY H . 25108 1 267 . 1 1 73 73 GLY C C 13 174.3 . . 1 . . . . 62 GLY C . 25108 1 268 . 1 1 73 73 GLY CA C 13 45.31 . . 1 . . . . 62 GLY CA . 25108 1 269 . 1 1 73 73 GLY N N 15 110.5 . . 1 . . . . 62 GLY N . 25108 1 270 . 1 1 74 74 SER H H 1 8.27 . . 1 . . . . 63 SER H . 25108 1 271 . 1 1 74 74 SER C C 13 174.5 . . 1 . . . . 63 SER C . 25108 1 272 . 1 1 74 74 SER CA C 13 58.51 . . 1 . . . . 63 SER CA . 25108 1 273 . 1 1 74 74 SER CB C 13 64.07 . . 1 . . . . 63 SER CB . 25108 1 274 . 1 1 74 74 SER N N 15 115.6 . . 1 . . . . 63 SER N . 25108 1 275 . 1 1 75 75 ASP H H 1 8.47 . . 1 . . . . 64 ASP H . 25108 1 276 . 1 1 75 75 ASP C C 13 176.5 . . 1 . . . . 64 ASP C . 25108 1 277 . 1 1 75 75 ASP CA C 13 54.54 . . 1 . . . . 64 ASP CA . 25108 1 278 . 1 1 75 75 ASP CB C 13 41.21 . . 1 . . . . 64 ASP CB . 25108 1 279 . 1 1 75 75 ASP N N 15 122.4 . . 1 . . . . 64 ASP N . 25108 1 280 . 1 1 76 76 GLU H H 1 8.37 . . 1 . . . . 65 GLU H . 25108 1 281 . 1 1 76 76 GLU C C 13 177.3 . . 1 . . . . 65 GLU C . 25108 1 282 . 1 1 76 76 GLU CA C 13 57.17 . . 1 . . . . 65 GLU CA . 25108 1 283 . 1 1 76 76 GLU CB C 13 30.03 . . 1 . . . . 65 GLU CB . 25108 1 284 . 1 1 76 76 GLU N N 15 121.3 . . 1 . . . . 65 GLU N . 25108 1 285 . 1 1 77 77 GLY H H 1 8.47 . . 1 . . . . 66 GLY H . 25108 1 286 . 1 1 77 77 GLY C C 13 174.5 . . 1 . . . . 66 GLY C . 25108 1 287 . 1 1 77 77 GLY CA C 13 45.64 . . 1 . . . . 66 GLY CA . 25108 1 288 . 1 1 77 77 GLY N N 15 109.6 . . 1 . . . . 66 GLY N . 25108 1 289 . 1 1 78 78 GLN H H 1 8.18 . . 1 . . . . 67 GLN H . 25108 1 290 . 1 1 78 78 GLN C C 13 175.9 . . 1 . . . . 67 GLN C . 25108 1 291 . 1 1 78 78 GLN CA C 13 55.98 . . 1 . . . . 67 GLN CA . 25108 1 292 . 1 1 78 78 GLN CB C 13 29.29 . . 1 . . . . 67 GLN CB . 25108 1 293 . 1 1 78 78 GLN N N 15 119.4 . . 1 . . . . 67 GLN N . 25108 1 294 . 1 1 79 79 ASN H H 1 8.46 . . 1 . . . . 68 ASN H . 25108 1 295 . 1 1 79 79 ASN C C 13 174.9 . . 1 . . . . 68 ASN C . 25108 1 296 . 1 1 79 79 ASN CA C 13 53.4 . . 1 . . . . 68 ASN CA . 25108 1 297 . 1 1 79 79 ASN CB C 13 38.9 . . 1 . . . . 68 ASN CB . 25108 1 298 . 1 1 79 79 ASN N N 15 119.4 . . 1 . . . . 68 ASN N . 25108 1 299 . 1 1 80 80 ASN H H 1 8.40 . . 1 . . . . 69 ASN H . 25108 1 300 . 1 1 80 80 ASN C C 13 175.2 . . 1 . . . . 69 ASN C . 25108 1 301 . 1 1 80 80 ASN CA C 13 53.44 . . 1 . . . . 69 ASN CA . 25108 1 302 . 1 1 80 80 ASN CB C 13 38.84 . . 1 . . . . 69 ASN CB . 25108 1 303 . 1 1 80 80 ASN N N 15 119.4 . . 1 . . . . 69 ASN N . 25108 1 304 . 1 1 81 81 ILE H H 1 8.08 . . 1 . . . . 70 ILE H . 25108 1 305 . 1 1 81 81 ILE C C 13 176.2 . . 1 . . . . 70 ILE C . 25108 1 306 . 1 1 81 81 ILE CA C 13 61.5 . . 1 . . . . 70 ILE CA . 25108 1 307 . 1 1 81 81 ILE CB C 13 38.8 . . 1 . . . . 70 ILE CB . 25108 1 308 . 1 1 81 81 ILE N N 15 121.3 . . 1 . . . . 70 ILE N . 25108 1 309 . 1 1 82 82 ALA H H 1 8.31 . . 1 . . . . 71 ALA H . 25108 1 310 . 1 1 82 82 ALA C C 13 177.9 . . 1 . . . . 71 ALA C . 25108 1 311 . 1 1 82 82 ALA CA C 13 52.96 . . 1 . . . . 71 ALA CA . 25108 1 312 . 1 1 82 82 ALA CB C 13 19.26 . . 1 . . . . 71 ALA CB . 25108 1 313 . 1 1 82 82 ALA N N 15 127.4 . . 1 . . . . 71 ALA N . 25108 1 314 . 1 1 83 83 ASP H H 1 8.18 . . 1 . . . . 72 ASP H . 25108 1 315 . 1 1 83 83 ASP C C 13 176.6 . . 1 . . . . 72 ASP C . 25108 1 316 . 1 1 83 83 ASP CA C 13 55.22 . . 1 . . . . 72 ASP CA . 25108 1 317 . 1 1 83 83 ASP CB C 13 41.14 . . 1 . . . . 72 ASP CB . 25108 1 318 . 1 1 83 83 ASP N N 15 119.7 . . 1 . . . . 72 ASP N . 25108 1 319 . 1 1 84 84 ASP H H 1 8.24 . . 1 . . . . 73 ASP H . 25108 1 320 . 1 1 84 84 ASP C C 13 177.1 . . 1 . . . . 73 ASP C . 25108 1 321 . 1 1 84 84 ASP CA C 13 55.31 . . 1 . . . . 73 ASP CA . 25108 1 322 . 1 1 84 84 ASP CB C 13 40.92 . . 1 . . . . 73 ASP CB . 25108 1 323 . 1 1 84 84 ASP N N 15 120 . . 1 . . . . 73 ASP N . 25108 1 324 . 1 1 85 85 LEU H H 1 8.03 . . 1 . . . . 74 LEU H . 25108 1 325 . 1 1 85 85 LEU CA C 13 56.55 . . 1 . . . . 74 LEU CA . 25108 1 326 . 1 1 85 85 LEU CB C 13 41.94 . . 1 . . . . 74 LEU CB . 25108 1 327 . 1 1 86 86 ILE H H 1 7.85 . . 1 . . . . 75 ILE H . 25108 1 328 . 1 1 86 86 ILE CA C 13 62.56 . . 1 . . . . 75 ILE CA . 25108 1 329 . 1 1 86 86 ILE CB C 13 38.09 . . 1 . . . . 75 ILE CB . 25108 1 330 . 1 1 86 86 ILE N N 15 119.5 . . 1 . . . . 75 ILE N . 25108 1 331 . 1 1 90 90 ASN C C 13 175.7 . . 1 . . . . 79 ASN C . 25108 1 332 . 1 1 90 90 ASN CA C 13 53.81 . . 1 . . . . 79 ASN CA . 25108 1 333 . 1 1 90 90 ASN CB C 13 38.54 . . 1 . . . . 79 ASN CB . 25108 1 334 . 1 1 91 91 GLN H H 1 8.09 . . 1 . . . . 80 GLN H . 25108 1 335 . 1 1 91 91 GLN C C 13 176.2 . . 1 . . . . 80 GLN C . 25108 1 336 . 1 1 91 91 GLN CA C 13 56.55 . . 1 . . . . 80 GLN CA . 25108 1 337 . 1 1 91 91 GLN CB C 13 29.1 . . 1 . . . . 80 GLN CB . 25108 1 338 . 1 1 91 91 GLN N N 15 119.5 . . 1 . . . . 80 GLN N . 25108 1 339 . 1 1 96 96 GLN C C 13 176.2 . . 1 . . . . 85 GLN C . 25108 1 340 . 1 1 96 96 GLN CA C 13 56.04 . . 1 . . . . 85 GLN CA . 25108 1 341 . 1 1 96 96 GLN CB C 13 29.29 . . 1 . . . . 85 GLN CB . 25108 1 342 . 1 1 97 97 GLU H H 1 8.54 . . 1 . . . . 86 GLU H . 25108 1 343 . 1 1 97 97 GLU C C 13 176.2 . . 1 . . . . 86 GLU C . 25108 1 344 . 1 1 97 97 GLU CA C 13 56.85 . . 1 . . . . 86 GLU CA . 25108 1 345 . 1 1 97 97 GLU CB C 13 30.29 . . 1 . . . . 86 GLU CB . 25108 1 346 . 1 1 97 97 GLU N N 15 122.1 . . 1 . . . . 86 GLU N . 25108 1 347 . 1 1 100 100 GLY C C 13 174.2 . . 1 . . . . 89 GLY C . 25108 1 348 . 1 1 100 100 GLY CA C 13 45.44 . . 1 . . . . 89 GLY CA . 25108 1 349 . 1 1 101 101 VAL H H 1 7.96 . . 1 . . . . 90 VAL H . 25108 1 350 . 1 1 101 101 VAL C C 13 176.3 . . 1 . . . . 90 VAL C . 25108 1 351 . 1 1 101 101 VAL CA C 13 62.31 . . 1 . . . . 90 VAL CA . 25108 1 352 . 1 1 101 101 VAL CB C 13 32.88 . . 1 . . . . 90 VAL CB . 25108 1 353 . 1 1 101 101 VAL N N 15 118.9 . . 1 . . . . 90 VAL N . 25108 1 354 . 1 1 102 102 SER H H 1 8.43 . . 1 . . . . 91 SER H . 25108 1 355 . 1 1 102 102 SER CA C 13 58.34 . . 1 . . . . 91 SER CA . 25108 1 356 . 1 1 102 102 SER CB C 13 63.96 . . 1 . . . . 91 SER CB . 25108 1 357 . 1 1 102 102 SER N N 15 119.2 . . 1 . . . . 91 SER N . 25108 1 358 . 1 1 103 103 ASN C C 13 175.3 . . 1 . . . . 92 ASN C . 25108 1 359 . 1 1 103 103 ASN CA C 13 53.61 . . 1 . . . . 92 ASN CA . 25108 1 360 . 1 1 103 103 ASN CB C 13 38.89 . . 1 . . . . 92 ASN CB . 25108 1 361 . 1 1 104 104 ILE H H 1 8.01 . . 1 . . . . 93 ILE H . 25108 1 362 . 1 1 104 104 ILE C C 13 175.7 . . 1 . . . . 93 ILE C . 25108 1 363 . 1 1 104 104 ILE CA C 13 61.62 . . 1 . . . . 93 ILE CA . 25108 1 364 . 1 1 104 104 ILE CB C 13 38.8 . . 1 . . . . 93 ILE CB . 25108 1 365 . 1 1 104 104 ILE N N 15 120.5 . . 1 . . . . 93 ILE N . 25108 1 366 . 1 1 105 105 ASP H H 1 8.25 . . 1 . . . . 94 ASP H . 25108 1 367 . 1 1 105 105 ASP C C 13 176.5 . . 1 . . . . 94 ASP C . 25108 1 368 . 1 1 105 105 ASP CA C 13 54.42 . . 1 . . . . 94 ASP CA . 25108 1 369 . 1 1 105 105 ASP CB C 13 41.25 . . 1 . . . . 94 ASP CB . 25108 1 370 . 1 1 105 105 ASP N N 15 123.7 . . 1 . . . . 94 ASP N . 25108 1 371 . 1 1 127 127 GLY C C 13 174.3 . . 1 . . . . 116 GLY C . 25108 1 372 . 1 1 127 127 GLY CA C 13 45.52 . . 1 . . . . 116 GLY CA . 25108 1 373 . 1 1 128 128 THR H H 1 8.05 . . 1 . . . . 117 THR H . 25108 1 374 . 1 1 128 128 THR C C 13 174.4 . . 1 . . . . 117 THR C . 25108 1 375 . 1 1 128 128 THR CA C 13 61.82 . . 1 . . . . 117 THR CA . 25108 1 376 . 1 1 128 128 THR CB C 13 69.96 . . 1 . . . . 117 THR CB . 25108 1 377 . 1 1 128 128 THR N N 15 113.4 . . 1 . . . . 117 THR N . 25108 1 378 . 1 1 129 129 LEU H H 1 8.33 . . 1 . . . . 118 LEU H . 25108 1 379 . 1 1 129 129 LEU CA C 13 55.35 . . 1 . . . . 118 LEU CA . 25108 1 380 . 1 1 129 129 LEU CB C 13 42.23 . . 1 . . . . 118 LEU CB . 25108 1 381 . 1 1 129 129 LEU N N 15 123.5 . . 1 . . . . 118 LEU N . 25108 1 382 . 1 1 130 130 ASP CA C 13 54.6 . . 1 . . . . 119 ASP CA . 25108 1 383 . 1 1 130 130 ASP CB C 13 41.4 . . 1 . . . . 119 ASP CB . 25108 1 384 . 1 1 131 131 ASP H H 1 8.18 . . 1 . . . . 120 ASP H . 25108 1 385 . 1 1 131 131 ASP C C 13 176.1 . . 1 . . . . 120 ASP C . 25108 1 386 . 1 1 131 131 ASP CA C 13 54.5 . . 1 . . . . 120 ASP CA . 25108 1 387 . 1 1 131 131 ASP CB C 13 41.2 . . 1 . . . . 120 ASP CB . 25108 1 388 . 1 1 131 131 ASP N N 15 120.1 . . 1 . . . . 120 ASP N . 25108 1 389 . 1 1 132 132 ILE H H 1 7.97 . . 1 . . . . 121 ILE H . 25108 1 390 . 1 1 132 132 ILE C C 13 175.9 . . 1 . . . . 121 ILE C . 25108 1 391 . 1 1 132 132 ILE CA C 13 61.27 . . 1 . . . . 121 ILE CA . 25108 1 392 . 1 1 132 132 ILE CB C 13 39.01 . . 1 . . . . 121 ILE CB . 25108 1 393 . 1 1 132 132 ILE N N 15 120.1 . . 1 . . . . 121 ILE N . 25108 1 394 . 1 1 133 133 ASP H H 1 8.35 . . 1 . . . . 122 ASP H . 25108 1 395 . 1 1 133 133 ASP C C 13 176.5 . . 1 . . . . 122 ASP C . 25108 1 396 . 1 1 133 133 ASP CA C 13 54.49 . . 1 . . . . 122 ASP CA . 25108 1 397 . 1 1 133 133 ASP CB C 13 41.42 . . 1 . . . . 122 ASP CB . 25108 1 398 . 1 1 133 133 ASP N N 15 124.2 . . 1 . . . . 122 ASP N . 25108 1 399 . 1 1 134 134 GLU H H 1 8.31 . . 1 . . . . 123 GLU H . 25108 1 400 . 1 1 134 134 GLU CA C 13 56.87 . . 1 . . . . 123 GLU CA . 25108 1 401 . 1 1 134 134 GLU CB C 13 30.51 . . 1 . . . . 123 GLU CB . 25108 1 402 . 1 1 135 135 GLU N N 15 121.7 . . 1 . . . . 124 GLU N . 25108 1 403 . 1 1 136 136 TYR H H 1 8.20 . . 1 . . . . 125 TYR H . 25108 1 404 . 1 1 136 136 TYR C C 13 175.1 . . 1 . . . . 125 TYR C . 25108 1 405 . 1 1 136 136 TYR CA C 13 58.06 . . 1 . . . . 125 TYR CA . 25108 1 406 . 1 1 136 136 TYR CB C 13 38.58 . . 1 . . . . 125 TYR CB . 25108 1 407 . 1 1 136 136 TYR N N 15 122.2 . . 1 . . . . 125 TYR N . 25108 1 408 . 1 1 137 137 LYS H H 1 8.00 . . 1 . . . . 126 LYS H . 25108 1 409 . 1 1 137 137 LYS C C 13 173.7 . . 1 . . . . 126 LYS C . 25108 1 410 . 1 1 137 137 LYS CA C 13 53.59 . . 1 . . . . 126 LYS CA . 25108 1 411 . 1 1 137 137 LYS CB C 13 32.94 . . 1 . . . . 126 LYS CB . 25108 1 412 . 1 1 137 137 LYS N N 15 126.4 . . 1 . . . . 126 LYS N . 25108 1 413 . 1 1 138 138 PRO C C 13 176.6 . . 1 . . . . 127 PRO C . 25108 1 414 . 1 1 138 138 PRO CA C 13 63.14 . . 1 . . . . 127 PRO CA . 25108 1 415 . 1 1 138 138 PRO CB C 13 32.05 . . 1 . . . . 127 PRO CB . 25108 1 416 . 1 1 139 139 ASP H H 1 8.36 . . 1 . . . . 128 ASP H . 25108 1 417 . 1 1 139 139 ASP C C 13 176.1 . . 1 . . . . 128 ASP C . 25108 1 418 . 1 1 139 139 ASP CA C 13 54.28 . . 1 . . . . 128 ASP CA . 25108 1 419 . 1 1 139 139 ASP CB C 13 41.18 . . 1 . . . . 128 ASP CB . 25108 1 420 . 1 1 139 139 ASP N N 15 120.1 . . 1 . . . . 128 ASP N . 25108 1 421 . 1 1 140 140 ASN H H 1 8.29 . . 1 . . . . 129 ASN H . 25108 1 422 . 1 1 140 140 ASN C C 13 175.4 . . 1 . . . . 129 ASN C . 25108 1 423 . 1 1 140 140 ASN CA C 13 53.36 . . 1 . . . . 129 ASN CA . 25108 1 424 . 1 1 140 140 ASN CB C 13 38.86 . . 1 . . . . 129 ASN CB . 25108 1 425 . 1 1 140 140 ASN N N 15 119.4 . . 1 . . . . 129 ASN N . 25108 1 426 . 1 1 143 143 SER H H 1 8.21 . . 1 . . . . 132 SER H . 25108 1 427 . 1 1 143 143 SER C C 13 174.5 . . 1 . . . . 132 SER C . 25108 1 428 . 1 1 143 143 SER CA C 13 58.84 . . 1 . . . . 132 SER CA . 25108 1 429 . 1 1 143 143 SER CB C 13 63.8 . . 1 . . . . 132 SER CB . 25108 1 430 . 1 1 143 143 SER N N 15 116.2 . . 1 . . . . 132 SER N . 25108 1 431 . 1 1 144 144 ASN H H 1 8.49 . . 1 . . . . 133 ASN H . 25108 1 432 . 1 1 144 144 ASN C C 13 175.3 . . 1 . . . . 133 ASN C . 25108 1 433 . 1 1 144 144 ASN CA C 13 53.56 . . 1 . . . . 133 ASN CA . 25108 1 434 . 1 1 144 144 ASN CB C 13 38.85 . . 1 . . . . 133 ASN CB . 25108 1 435 . 1 1 144 144 ASN N N 15 120.7 . . 1 . . . . 133 ASN N . 25108 1 436 . 1 1 145 145 CYS H H 1 8.23 . . 1 . . . . 134 CYS H . 25108 1 437 . 1 1 145 145 CYS C C 13 174.2 . . 1 . . . . 134 CYS C . 25108 1 438 . 1 1 145 145 CYS CA C 13 58.68 . . 1 . . . . 134 CYS CA . 25108 1 439 . 1 1 145 145 CYS CB C 13 28.13 . . 1 . . . . 134 CYS CB . 25108 1 440 . 1 1 145 145 CYS N N 15 119.1 . . 1 . . . . 134 CYS N . 25108 1 441 . 1 1 146 146 ASP H H 1 8.41 . . 1 . . . . 135 ASP H . 25108 1 442 . 1 1 146 146 ASP C C 13 176.1 . . 1 . . . . 135 ASP C . 25108 1 443 . 1 1 146 146 ASP CA C 13 54.46 . . 1 . . . . 135 ASP CA . 25108 1 444 . 1 1 146 146 ASP CB C 13 41.17 . . 1 . . . . 135 ASP CB . 25108 1 445 . 1 1 146 146 ASP N N 15 122.7 . . 1 . . . . 135 ASP N . 25108 1 446 . 1 1 147 147 ASN H H 1 8.37 . . 1 . . . . 136 ASN H . 25108 1 447 . 1 1 147 147 ASN C C 13 175.6 . . 1 . . . . 136 ASN C . 25108 1 448 . 1 1 147 147 ASN CA C 13 53.41 . . 1 . . . . 136 ASN CA . 25108 1 449 . 1 1 147 147 ASN CB C 13 38.94 . . 1 . . . . 136 ASN CB . 25108 1 450 . 1 1 147 147 ASN N N 15 119.9 . . 1 . . . . 136 ASN N . 25108 1 451 . 1 1 148 148 SER H H 1 8.35 . . 1 . . . . 137 SER H . 25108 1 452 . 1 1 148 148 SER C C 13 174.5 . . 1 . . . . 137 SER C . 25108 1 453 . 1 1 148 148 SER CA C 13 59.29 . . 1 . . . . 137 SER CA . 25108 1 454 . 1 1 148 148 SER CB C 13 63.73 . . 1 . . . . 137 SER CB . 25108 1 455 . 1 1 148 148 SER N N 15 116.3 . . 1 . . . . 137 SER N . 25108 1 456 . 1 1 149 149 ASN H H 1 8.43 . . 1 . . . . 138 ASN H . 25108 1 457 . 1 1 149 149 ASN C C 13 175.3 . . 1 . . . . 138 ASN C . 25108 1 458 . 1 1 149 149 ASN CA C 13 53.47 . . 1 . . . . 138 ASN CA . 25108 1 459 . 1 1 149 149 ASN CB C 13 38.67 . . 1 . . . . 138 ASN CB . 25108 1 460 . 1 1 149 149 ASN N N 15 120.2 . . 1 . . . . 138 ASN N . 25108 1 461 . 1 1 150 150 MET C C 13 176 . . 1 . . . . 139 MET C . 25108 1 462 . 1 1 150 150 MET CA C 13 57.02 . . 1 . . . . 139 MET CA . 25108 1 463 . 1 1 150 150 MET CB C 13 32.72 . . 1 . . . . 139 MET CB . 25108 1 464 . 1 1 151 151 ASN H H 1 8.43 . . 1 . . . . 140 ASN H . 25108 1 465 . 1 1 151 151 ASN C C 13 175.2 . . 1 . . . . 140 ASN C . 25108 1 466 . 1 1 151 151 ASN CA C 13 53.58 . . 1 . . . . 140 ASN CA . 25108 1 467 . 1 1 151 151 ASN CB C 13 38.99 . . 1 . . . . 140 ASN CB . 25108 1 468 . 1 1 151 151 ASN N N 15 119.6 . . 1 . . . . 140 ASN N . 25108 1 469 . 1 1 152 152 GLU H H 1 8.41 . . 1 . . . . 141 GLU H . 25108 1 470 . 1 1 152 152 GLU C C 13 176.5 . . 1 . . . . 141 GLU C . 25108 1 471 . 1 1 152 152 GLU CA C 13 56.73 . . 1 . . . . 141 GLU CA . 25108 1 472 . 1 1 152 152 GLU CB C 13 30.36 . . 1 . . . . 141 GLU CB . 25108 1 473 . 1 1 152 152 GLU N N 15 121.5 . . 1 . . . . 141 GLU N . 25108 1 474 . 1 1 153 153 SER H H 1 8.31 . . 1 . . . . 142 SER H . 25108 1 475 . 1 1 153 153 SER C C 13 174.4 . . 1 . . . . 142 SER C . 25108 1 476 . 1 1 153 153 SER CA C 13 58.46 . . 1 . . . . 142 SER CA . 25108 1 477 . 1 1 153 153 SER CB C 13 64.09 . . 1 . . . . 142 SER CB . 25108 1 478 . 1 1 153 153 SER N N 15 116.4 . . 1 . . . . 142 SER N . 25108 1 479 . 1 1 154 154 GLU H H 1 8.43 . . 1 . . . . 143 GLU H . 25108 1 480 . 1 1 154 154 GLU C C 13 175.6 . . 1 . . . . 143 GLU C . 25108 1 481 . 1 1 154 154 GLU CA C 13 56.62 . . 1 . . . . 143 GLU CA . 25108 1 482 . 1 1 154 154 GLU CB C 13 30.54 . . 1 . . . . 143 GLU CB . 25108 1 483 . 1 1 154 154 GLU N N 15 123.4 . . 1 . . . . 143 GLU N . 25108 1 484 . 1 1 155 155 GLU H H 1 7.99 . . 1 . . . . 144 GLU H . 25108 1 485 . 1 1 155 155 GLU CA C 13 58.21 . . 1 . . . . 144 GLU CA . 25108 1 486 . 1 1 155 155 GLU CB C 13 31.09 . . 1 . . . . 144 GLU CB . 25108 1 487 . 1 1 155 155 GLU CG C 13 181.2 . . 1 . . . . 144 GLU CG . 25108 1 488 . 1 1 155 155 GLU N N 15 126.7 . . 1 . . . . 144 GLU N . 25108 1 stop_ save_