data_15901 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15901 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for D+PHS, a hyperstable variant of SNase, at pH 4.66 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-08-01 _Entry.Accession_date 2008-08-01 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.116 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'D+PHS; Backbone HN, N, Ca, Cb Assignments; pH 4.66, 100 mM KCl, 25 mM KAc, 298 K' _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 Carlos Castaneda . A. . 15901 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15901 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 276 15901 '15N chemical shifts' 138 15901 '1H chemical shifts' 138 15901 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-11-11 2008-08-01 update BMRB 'complete entry citation' 15901 1 . . 2009-06-24 2008-08-01 original author 'original release' 15901 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15901 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19533744 _Citation.Full_citation . _Citation.Title 'Molecular determinants of the pKa values of Asp and Glu residues in staphylococcal nuclease.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full Proteins _Citation.Journal_volume 77 _Citation.Journal_issue 3 _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 570 _Citation.Page_last 588 _Citation.Year 2009 _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 Carlos Castaneda . A. . 15901 1 2 Carolyn Fitch . A. . 15901 1 3 Ananya Majumdar . . . 15901 1 4 Victor Khangulov . . . 15901 1 5 Jamie Schlessman . L. . 15901 1 6 Bertrand Garcia-Moreno . E. . 15901 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID dynamics 15901 1 electrostatics 15901 1 NMR 15901 1 'pKa values' 15901 1 'staphylococcal nuclease' 15901 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15901 _Assembly.ID 1 _Assembly.Name D+PHS _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 D+PHS 1 $D+PHS A . yes native no no . . . 15901 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_D+PHS _Entity.Sf_category entity _Entity.Sf_framecode D+PHS _Entity.Entry_ID 15901 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name D+PHS _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 ; ATSTKKLHKEPATLIKAIDG DTVKLMYKGQPMTFRLLLVD TPEFNEKYGPEASAFTKKMV ENAKKIEVEFDKGQRTDKYG RGLAYIYADGKMVNEALVRQ GLAKVAYVYKGNNTHEQLLR KAEAQAKKEKLNIWSEDNAD SGQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; The residue numbering scheme we use for D+PHS is based on the WT-SNase numbering scheme. In D+PHS, we have deleted 6 residues (44-49 in WT) and thus, this is why the residue numbering goes from 1-43 and 44-149. 1,A 2,T 3,S ... 41,T 42,P 43,E 50,F 51,N 52,E ... 147,S 148,G 149,Q ; _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 143 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 3.1.31.1 _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 2015-11-26 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 BMRB 16123 . D+PHS-V66K_Nuclease . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 2 no PDB 1TQO . "Cryogenic Crystal Structure Of Staphylococcal Nuclease Variant Truncated Delta+phs I92e" . . . . . 96.50 138 99.28 99.28 1.26e-93 . . . . 15901 1 3 no PDB 1TR5 . "Room Temperature Structure Of Staphylococcal Nuclease Variant Truncated Delta+phs I92e" . . . . . 96.50 138 99.28 99.28 1.26e-93 . . . . 15901 1 4 no PDB 1TT2 . "Cryogenic Crystal Structure Of Staphylococcal Nuclease Variant Truncated Delta+phs I92k" . . . . . 96.50 138 99.28 99.28 9.80e-94 . . . . 15901 1 5 no PDB 2RBM . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 8.73e-98 . . . . 15901 1 6 no PDB 3BDC . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs At Cryogenic Temperature" . . . . . 100.00 143 100.00 100.00 5.32e-99 . . . . 15901 1 7 no PDB 3C1E . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L125k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 6.94e-98 . . . . 15901 1 8 no PDB 3C1F . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V104k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 9 no PDB 3D4D . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs Y91e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.20e-97 . . . . 15901 1 10 no PDB 3D4W . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs A109r At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.15e-98 . . . . 15901 1 11 no PDB 3D8G . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72r At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.91e-98 . . . . 15901 1 12 no PDB 3DHQ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs A90r At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.15e-98 . . . . 15901 1 13 no PDB 3E5S . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L103k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 6.94e-98 . . . . 15901 1 14 no PDB 3EJI . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 6.94e-98 . . . . 15901 1 15 no PDB 3ERO . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.05e-97 . . . . 15901 1 16 no PDB 3ERQ . "Crystal Structure Of Staphylococcal Nuclease Variant L25k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 6.94e-98 . . . . 15901 1 17 no PDB 3EVQ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.49e-98 . . . . 15901 1 18 no PDB 3H6M . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V104e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.01e-98 . . . . 15901 1 19 no PDB 3HEJ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+p Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.58e-98 . . . . 15901 1 20 no PDB 3HZX . "Crystal Structure Of Staphylococcal Nuclease Variant D+phsV 9 Determined At 100 K" . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 21 no PDB 3ITP . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs F34k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.54e-97 . . . . 15901 1 22 no PDB 3LX0 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs D21n At Cryogenic Temperature" . . . . . 100.00 143 99.30 100.00 2.89e-98 . . . . 15901 1 23 no PDB 3MEH . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.76e-98 . . . . 15901 1 24 no PDB 3MHB . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L38a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.72e-98 . . . . 15901 1 25 no PDB 3MVV . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs F34a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.05e-97 . . . . 15901 1 26 no PDB 3MXP . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs T62a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 2.77e-98 . . . . 15901 1 27 no PDB 3MZ5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L103a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.72e-98 . . . . 15901 1 28 no PDB 3NHH . "Crystal Structure Of Staphylococcal Nuclease Variant V23e-l36k At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 9.65e-97 . . . . 15901 1 29 no PDB 3NK9 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V74a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 2.28e-98 . . . . 15901 1 30 no PDB 3NP8 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.72e-98 . . . . 15901 1 31 no PDB 3NQT . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 2.28e-98 . . . . 15901 1 32 no PDB 3NXW . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L125a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.72e-98 . . . . 15901 1 33 no PDB 3OSO . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.72e-98 . . . . 15901 1 34 no PDB 3OWF . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66r At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 6.57e-98 . . . . 15901 1 35 no PDB 3P1H . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23kI92A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 5.24e-97 . . . . 15901 1 36 no PDB 3P75 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V104d At Cryogenic Temperature" . . . . . 90.21 129 99.22 99.22 4.97e-87 . . . . 15901 1 37 no PDB 3PMF . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23a At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 2.28e-98 . . . . 15901 1 38 no PDB 3QB3 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92kl25a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 6.30e-97 . . . . 15901 1 39 no PDB 3QOJ . "Cryogenic Structure Of Staphylococcal Nuclease Variant D+phsV23K" . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 40 no PDB 3QOL . "Crystal Structure Of Staphylococcal Nuclease Variant D+phs/v23e At Ph 6 Determined At 100 K" . . . . . 100.00 143 99.30 99.30 7.01e-98 . . . . 15901 1 41 no PDB 3QON . "Crystal Structure Of Staphylococcal Nuclease Variant D+phsV23KL36E At Ph 7 Determined At 100 K" . . . . . 100.00 143 98.60 98.60 1.05e-96 . . . . 15901 1 42 no PDB 3R3O . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs T62a At Cryogenic Temperature And With High Redundancy" . . . . . 100.00 143 99.30 99.30 2.77e-98 . . . . 15901 1 43 no PDB 3RUZ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V74k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 44 no PDB 3S9W . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs M98g Bound To Ca2+ And Thymidine-5',3'-Diphosphate At Cryogenic " . . . . . 100.00 143 99.30 99.30 1.66e-97 . . . . 15901 1 45 no PDB 3SHL . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V74kl25a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 5.24e-97 . . . . 15901 1 46 no PDB 3SK4 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs D21nV23E AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 99.30 3.57e-97 . . . . 15901 1 47 no PDB 3SK5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V39d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 48 no PDB 3SK8 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs M98g Apo Protein At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.66e-97 . . . . 15901 1 49 no PDB 3SR1 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs A69g Bound To Ca2+ And Thymidine-5',3'-Diphosphate At Cryogenic " . . . . . 100.00 143 99.30 99.30 3.12e-98 . . . . 15901 1 50 no PDB 3SXH . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92al103a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 2.69e-97 . . . . 15901 1 51 no PDB 3T13 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs A69g At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.12e-98 . . . . 15901 1 52 no PDB 3TP6 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36e/l103k At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 9.65e-97 . . . . 15901 1 53 no PDB 3TP7 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V99e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.01e-98 . . . . 15901 1 54 no PDB 3TP8 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.49e-98 . . . . 15901 1 55 no PDB 3V2T . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92aV66A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 1.70e-97 . . . . 15901 1 56 no PDB 3VA5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92aV23A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 1.70e-97 . . . . 15901 1 57 no PDB 4DF7 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23lV99I AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 100.00 2.74e-98 . . . . 15901 1 58 no PDB 4DFA . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92aL36A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 2.69e-97 . . . . 15901 1 59 no PDB 4DGZ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92aL125A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 2.69e-97 . . . . 15901 1 60 no PDB 4DU9 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92a/v74a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.70e-97 . . . . 15901 1 61 no PDB 4EQN . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23e/i72k At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.11e-96 . . . . 15901 1 62 no PDB 4EQO . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V99d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 63 no PDB 4EQP . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.03e-97 . . . . 15901 1 64 no PDB 4F7X . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92aL25A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 98.60 2.69e-97 . . . . 15901 1 65 no PDB 4F8M . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23iI92V AT CRYOGENIC TEMPERATURE" . . . . . 100.00 143 98.60 100.00 1.49e-98 . . . . 15901 1 66 no PDB 4HMI . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V99k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.25e-98 . . . . 15901 1 67 no PDB 4HMJ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.11e-97 . . . . 15901 1 68 no PDB 4HTH . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+viagla At Cryogenic Temperature" . . . . . 100.00 143 97.90 98.60 6.95e-97 . . . . 15901 1 69 no PDB 4IAL . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs H121e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 70 no PDB 4IUN . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs R126e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.89e-98 . . . . 15901 1 71 no PDB 4IZ8 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs H8e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 72 no PDB 4J1M . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs R105e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.89e-98 . . . . 15901 1 73 no PDB 4J6H . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs H121q At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.57e-98 . . . . 15901 1 74 no PDB 4K2K . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25a/l36a/i92a At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 2.14e-96 . . . . 15901 1 75 no PDB 4K2L . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92q At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.74e-98 . . . . 15901 1 76 no PDB 4K5V . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23t/l36a/v99t At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 6.73e-97 . . . . 15901 1 77 no PDB 4KD3 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25a/v66a/i92a At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 1.41e-96 . . . . 15901 1 78 no PDB 4KHV . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23s At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.30e-98 . . . . 15901 1 79 no PDB 4KJN . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23t/v66a/v99t At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 4.69e-97 . . . . 15901 1 80 no PDB 4KJO . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36a/v66t/v99t At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 6.73e-97 . . . . 15901 1 81 no PDB 4KTA . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs R105q At Cryogenic Temperatures" . . . . . 100.00 143 99.30 100.00 2.68e-98 . . . . 15901 1 82 no PDB 4KV6 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs R126q At Cryogenic Temperature" . . . . . 100.00 143 99.30 100.00 2.68e-98 . . . . 15901 1 83 no PDB 4KY5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23d At Ph 7 And Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 84 no PDB 4KY6 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25d At Ph 6 And Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.11e-97 . . . . 15901 1 85 no PDB 4KY7 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V74d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.07e-97 . . . . 15901 1 86 no PDB 4LAA . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.65e-98 . . . . 15901 1 87 no PDB 4ME5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23s/v66a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.38e-97 . . . . 15901 1 88 no PDB 4MIU . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23t/v99t At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.12e-97 . . . . 15901 1 89 no PDB 4N9P . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23t/l25a/v99t At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 6.73e-97 . . . . 15901 1 90 no PDB 4N9T . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66a/i92s At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 2.11e-97 . . . . 15901 1 91 no PDB 4NDX . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92n At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.06e-97 . . . . 15901 1 92 no PDB 4NKL . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66a/i92q At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 3.35e-97 . . . . 15901 1 93 no PDB 4NMZ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23q/v66a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 2.41e-97 . . . . 15901 1 94 no PDB 4NP5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66a/i92n At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 4.85e-97 . . . . 15901 1 95 no PDB 4OL7 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66e A109e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 4.03e-97 . . . . 15901 1 96 no PDB 4PMB . "Crystal Structure Of Staphylcoccal Nuclease Variant Delta+phs I92s At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 4.89e-98 . . . . 15901 1 97 no PDB 4PMC . "Crystal Structure Of Staphylcoccal Nuclease Variant Delta+phs I72k V74k At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.17e-96 . . . . 15901 1 98 no PDB 4PNY . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 9.95e-98 . . . . 15901 1 99 no PDB 4RKB . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66t/v99t At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.12e-97 . . . . 15901 1 100 no PDB 4RKL . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23t/v66t At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.12e-97 . . . . 15901 1 101 no PDB 4S3S . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92k/v23a At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 3.94e-97 . . . . 15901 1 102 no PDB 4TRD . "Crystal Structure Of Staphylcoccal Nuclease Variant Delta+phs I72k/v74k At Ph 9.0 At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.17e-96 . . . . 15901 1 103 no PDB 4WRD . "Crystal Structure Of Staphylcoccal Nulease Variant Delta+phs V66e L125e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.08e-96 . . . . 15901 1 104 no PDB 4YIJ . "Crystal Structure Of Staphylcoccal Nuclease Variant Delta+phs A109e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.89e-98 . . . . 15901 1 105 no PDB 4ZQ3 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92t At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 3.12e-98 . . . . 15901 1 106 no PDB 4ZUI . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 9.73e-98 . . . . 15901 1 107 no PDB 4ZUJ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs Y91h At Cryogenic Temperature" . . . . . 100.00 143 99.30 100.00 2.68e-98 . . . . 15901 1 108 no PDB 5C3W . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 9.73e-98 . . . . 15901 1 109 no PDB 5C3X . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I72d/n100e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.12e-96 . . . . 15901 1 110 no PDB 5C4H . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 9.95e-98 . . . . 15901 1 111 no PDB 5C4Z . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25h At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.65e-98 . . . . 15901 1 112 no PDB 5C5L . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs T62e / L125e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 7.11e-97 . . . . 15901 1 113 no PDB 5C5M . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs T62d / V104e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 7.84e-97 . . . . 15901 1 114 no PDB 5C6A . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L25e / N100e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 7.03e-97 . . . . 15901 1 115 no PDB 5CC4 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs T62e/v66e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 6.17e-97 . . . . 15901 1 116 no PDB 5CGK . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66d/n100e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.05e-96 . . . . 15901 1 117 no PDB 5CR3 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V104e/l125e At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 6.46e-96 . . . . 15901 1 118 no PDB 5CV4 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23d/v66h At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.49e-96 . . . . 15901 1 119 no PDB 5CV5 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs K64g/v66k/e67g At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 1.00e-95 . . . . 15901 1 120 no PDB 5CV6 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66h/i92e At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.40e-96 . . . . 15901 1 121 no PDB 5CV7 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66h/i92d At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.58e-96 . . . . 15901 1 122 no PDB 5CV8 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V23d/t62h At Cryogenic Temperature" . . . . . 100.00 142 97.90 97.90 5.81e-94 . . . . 15901 1 123 no PDB 5CV9 . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs L36e/v66h At Cryogenic Temperature" . . . . . 100.00 143 98.60 98.60 1.16e-96 . . . . 15901 1 124 no PDB 5DAU . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V39e/v104e At Cryogenic Temperature" . . . . . 100.00 143 97.90 97.90 1.30e-95 . . . . 15901 1 125 no PDB 5DEH . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs N100d At Cryogenic Temperature" . . . . . 100.00 143 99.30 100.00 3.41e-98 . . . . 15901 1 126 no PDB 5E1F . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs G20e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 1.02e-97 . . . . 15901 1 127 no PDB 5E3F . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs I92k At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 8.73e-98 . . . . 15901 1 128 no PDB 5EGT . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs V66e At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 7.01e-98 . . . . 15901 1 129 no PDB 5EGZ . "Crystal Structure Of Staphylococcal Nuclease Variant Delta+phs Y91d At Cryogenic Temperature" . . . . . 100.00 143 99.30 99.30 2.11e-97 . . . . 15901 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 1 ALA . 15901 1 2 2 THR . 15901 1 3 3 SER . 15901 1 4 4 THR . 15901 1 5 5 LYS . 15901 1 6 6 LYS . 15901 1 7 7 LEU . 15901 1 8 8 HIS . 15901 1 9 9 LYS . 15901 1 10 10 GLU . 15901 1 11 11 PRO . 15901 1 12 12 ALA . 15901 1 13 13 THR . 15901 1 14 14 LEU . 15901 1 15 15 ILE . 15901 1 16 16 LYS . 15901 1 17 17 ALA . 15901 1 18 18 ILE . 15901 1 19 19 ASP . 15901 1 20 20 GLY . 15901 1 21 21 ASP . 15901 1 22 22 THR . 15901 1 23 23 VAL . 15901 1 24 24 LYS . 15901 1 25 25 LEU . 15901 1 26 26 MET . 15901 1 27 27 TYR . 15901 1 28 28 LYS . 15901 1 29 29 GLY . 15901 1 30 30 GLN . 15901 1 31 31 PRO . 15901 1 32 32 MET . 15901 1 33 33 THR . 15901 1 34 34 PHE . 15901 1 35 35 ARG . 15901 1 36 36 LEU . 15901 1 37 37 LEU . 15901 1 38 38 LEU . 15901 1 39 39 VAL . 15901 1 40 40 ASP . 15901 1 41 41 THR . 15901 1 42 42 PRO . 15901 1 43 43 GLU . 15901 1 44 50 PHE . 15901 1 45 51 ASN . 15901 1 46 52 GLU . 15901 1 47 53 LYS . 15901 1 48 54 TYR . 15901 1 49 55 GLY . 15901 1 50 56 PRO . 15901 1 51 57 GLU . 15901 1 52 58 ALA . 15901 1 53 59 SER . 15901 1 54 60 ALA . 15901 1 55 61 PHE . 15901 1 56 62 THR . 15901 1 57 63 LYS . 15901 1 58 64 LYS . 15901 1 59 65 MET . 15901 1 60 66 VAL . 15901 1 61 67 GLU . 15901 1 62 68 ASN . 15901 1 63 69 ALA . 15901 1 64 70 LYS . 15901 1 65 71 LYS . 15901 1 66 72 ILE . 15901 1 67 73 GLU . 15901 1 68 74 VAL . 15901 1 69 75 GLU . 15901 1 70 76 PHE . 15901 1 71 77 ASP . 15901 1 72 78 LYS . 15901 1 73 79 GLY . 15901 1 74 80 GLN . 15901 1 75 81 ARG . 15901 1 76 82 THR . 15901 1 77 83 ASP . 15901 1 78 84 LYS . 15901 1 79 85 TYR . 15901 1 80 86 GLY . 15901 1 81 87 ARG . 15901 1 82 88 GLY . 15901 1 83 89 LEU . 15901 1 84 90 ALA . 15901 1 85 91 TYR . 15901 1 86 92 ILE . 15901 1 87 93 TYR . 15901 1 88 94 ALA . 15901 1 89 95 ASP . 15901 1 90 96 GLY . 15901 1 91 97 LYS . 15901 1 92 98 MET . 15901 1 93 99 VAL . 15901 1 94 100 ASN . 15901 1 95 101 GLU . 15901 1 96 102 ALA . 15901 1 97 103 LEU . 15901 1 98 104 VAL . 15901 1 99 105 ARG . 15901 1 100 106 GLN . 15901 1 101 107 GLY . 15901 1 102 108 LEU . 15901 1 103 109 ALA . 15901 1 104 110 LYS . 15901 1 105 111 VAL . 15901 1 106 112 ALA . 15901 1 107 113 TYR . 15901 1 108 114 VAL . 15901 1 109 115 TYR . 15901 1 110 116 LYS . 15901 1 111 117 GLY . 15901 1 112 118 ASN . 15901 1 113 119 ASN . 15901 1 114 120 THR . 15901 1 115 121 HIS . 15901 1 116 122 GLU . 15901 1 117 123 GLN . 15901 1 118 124 LEU . 15901 1 119 125 LEU . 15901 1 120 126 ARG . 15901 1 121 127 LYS . 15901 1 122 128 ALA . 15901 1 123 129 GLU . 15901 1 124 130 ALA . 15901 1 125 131 GLN . 15901 1 126 132 ALA . 15901 1 127 133 LYS . 15901 1 128 134 LYS . 15901 1 129 135 GLU . 15901 1 130 136 LYS . 15901 1 131 137 LEU . 15901 1 132 138 ASN . 15901 1 133 139 ILE . 15901 1 134 140 TRP . 15901 1 135 141 SER . 15901 1 136 142 GLU . 15901 1 137 143 ASP . 15901 1 138 144 ASN . 15901 1 139 145 ALA . 15901 1 140 146 ASP . 15901 1 141 147 SER . 15901 1 142 148 GLY . 15901 1 143 149 GLN . 15901 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 . ALA 1 1 15901 1 . THR 2 2 15901 1 . SER 3 3 15901 1 . THR 4 4 15901 1 . LYS 5 5 15901 1 . LYS 6 6 15901 1 . LEU 7 7 15901 1 . HIS 8 8 15901 1 . LYS 9 9 15901 1 . GLU 10 10 15901 1 . PRO 11 11 15901 1 . ALA 12 12 15901 1 . THR 13 13 15901 1 . LEU 14 14 15901 1 . ILE 15 15 15901 1 . LYS 16 16 15901 1 . ALA 17 17 15901 1 . ILE 18 18 15901 1 . ASP 19 19 15901 1 . GLY 20 20 15901 1 . ASP 21 21 15901 1 . THR 22 22 15901 1 . VAL 23 23 15901 1 . LYS 24 24 15901 1 . LEU 25 25 15901 1 . MET 26 26 15901 1 . TYR 27 27 15901 1 . LYS 28 28 15901 1 . GLY 29 29 15901 1 . GLN 30 30 15901 1 . PRO 31 31 15901 1 . MET 32 32 15901 1 . THR 33 33 15901 1 . PHE 34 34 15901 1 . ARG 35 35 15901 1 . LEU 36 36 15901 1 . LEU 37 37 15901 1 . LEU 38 38 15901 1 . VAL 39 39 15901 1 . ASP 40 40 15901 1 . THR 41 41 15901 1 . PRO 42 42 15901 1 . GLU 43 43 15901 1 . PHE 44 44 15901 1 . ASN 45 45 15901 1 . GLU 46 46 15901 1 . LYS 47 47 15901 1 . TYR 48 48 15901 1 . GLY 49 49 15901 1 . PRO 50 50 15901 1 . GLU 51 51 15901 1 . ALA 52 52 15901 1 . SER 53 53 15901 1 . ALA 54 54 15901 1 . PHE 55 55 15901 1 . THR 56 56 15901 1 . LYS 57 57 15901 1 . LYS 58 58 15901 1 . MET 59 59 15901 1 . VAL 60 60 15901 1 . GLU 61 61 15901 1 . ASN 62 62 15901 1 . ALA 63 63 15901 1 . LYS 64 64 15901 1 . LYS 65 65 15901 1 . ILE 66 66 15901 1 . GLU 67 67 15901 1 . VAL 68 68 15901 1 . GLU 69 69 15901 1 . PHE 70 70 15901 1 . ASP 71 71 15901 1 . LYS 72 72 15901 1 . GLY 73 73 15901 1 . GLN 74 74 15901 1 . ARG 75 75 15901 1 . THR 76 76 15901 1 . ASP 77 77 15901 1 . LYS 78 78 15901 1 . TYR 79 79 15901 1 . GLY 80 80 15901 1 . ARG 81 81 15901 1 . GLY 82 82 15901 1 . LEU 83 83 15901 1 . ALA 84 84 15901 1 . TYR 85 85 15901 1 . ILE 86 86 15901 1 . TYR 87 87 15901 1 . ALA 88 88 15901 1 . ASP 89 89 15901 1 . GLY 90 90 15901 1 . LYS 91 91 15901 1 . MET 92 92 15901 1 . VAL 93 93 15901 1 . ASN 94 94 15901 1 . GLU 95 95 15901 1 . ALA 96 96 15901 1 . LEU 97 97 15901 1 . VAL 98 98 15901 1 . ARG 99 99 15901 1 . GLN 100 100 15901 1 . GLY 101 101 15901 1 . LEU 102 102 15901 1 . ALA 103 103 15901 1 . LYS 104 104 15901 1 . VAL 105 105 15901 1 . ALA 106 106 15901 1 . TYR 107 107 15901 1 . VAL 108 108 15901 1 . TYR 109 109 15901 1 . LYS 110 110 15901 1 . GLY 111 111 15901 1 . ASN 112 112 15901 1 . ASN 113 113 15901 1 . THR 114 114 15901 1 . HIS 115 115 15901 1 . GLU 116 116 15901 1 . GLN 117 117 15901 1 . LEU 118 118 15901 1 . LEU 119 119 15901 1 . ARG 120 120 15901 1 . LYS 121 121 15901 1 . ALA 122 122 15901 1 . GLU 123 123 15901 1 . ALA 124 124 15901 1 . GLN 125 125 15901 1 . ALA 126 126 15901 1 . LYS 127 127 15901 1 . LYS 128 128 15901 1 . GLU 129 129 15901 1 . LYS 130 130 15901 1 . LEU 131 131 15901 1 . ASN 132 132 15901 1 . ILE 133 133 15901 1 . TRP 134 134 15901 1 . SER 135 135 15901 1 . GLU 136 136 15901 1 . ASP 137 137 15901 1 . ASN 138 138 15901 1 . ALA 139 139 15901 1 . ASP 140 140 15901 1 . SER 141 141 15901 1 . GLY 142 142 15901 1 . GLN 143 143 15901 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 15901 _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 $D+PHS . . 'not applicable' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15901 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 15901 _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 $D+PHS . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . PET24a+ . . . . . . 15901 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1_pH_4p66 _Sample.Sf_category sample _Sample.Sf_framecode sample_1_pH_4p66 _Sample.Entry_ID 15901 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '~1 mM D+PHS; pH 4.66' _Sample.Aggregate_sample_number 3 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D+PHS '[U-99% 13C; U-99% 15N]' . . 1 $D+PHS . . 0.8-1.1 . . mM . . . . 15901 1 2 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15901 1 3 'potassium acetate' 'natural abundance' . . . . . . 25 . . mM . . . . 15901 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 15901 1 5 'sodium azide' 'natural abundance' . . . . . . 0.5 . . mM . . . . 15901 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15901 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15901 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 15901 1 pH 4.66 . pH 15901 1 pressure 1 . atm 15901 1 temperature 298 0.5 K 15901 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15901 _Software.ID 1 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15901 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15901 1 'peak picking' 15901 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15901 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15901 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15901 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 15901 _Software.ID 3 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15901 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15901 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 15901 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'with cryoprobe' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 15901 _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 Varian INOVA . 600 'with cryoprobe' . . 15901 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 15901 _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_pH_4p66 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15901 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1_pH_4p66 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15901 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1_pH_4p66 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15901 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 15901 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details 'HDO peak was referenced to DSS peak (external referencing); 13C and 15N chemical shifts were indirectly referenced.' loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15901 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.000000000 . . . . . . . . . 15901 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15901 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 15901 _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' . . . 15901 1 1 '2D 1H-15N HSQC' . . . 15901 1 1 '2D 1H-15N HSQC' . . . 15901 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 15901 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 ALA CA C 13 51.882 . . 1 . . . . 1 A CA . 15901 1 2 . 1 1 1 1 ALA CB C 13 19.498 . . 1 . . . . 1 A CB . 15901 1 3 . 1 1 2 2 THR H H 1 8.617 . . 1 . . . . 2 T H . 15901 1 4 . 1 1 2 2 THR CA C 13 62.016 . . 1 . . . . 2 T CA . 15901 1 5 . 1 1 2 2 THR CB C 13 69.937 . . 1 . . . . 2 T CB . 15901 1 6 . 1 1 2 2 THR N N 15 115.017 . . 1 . . . . 2 T N . 15901 1 7 . 1 1 3 3 SER H H 1 8.532 . . 1 . . . . 3 S H . 15901 1 8 . 1 1 3 3 SER CA C 13 58.133 . . 1 . . . . 3 S CA . 15901 1 9 . 1 1 3 3 SER CB C 13 63.955 . . 1 . . . . 3 S CB . 15901 1 10 . 1 1 3 3 SER N N 15 118.862 . . 1 . . . . 3 S N . 15901 1 11 . 1 1 4 4 THR H H 1 8.317 . . 1 . . . . 4 T H . 15901 1 12 . 1 1 4 4 THR CA C 13 61.923 . . 1 . . . . 4 T CA . 15901 1 13 . 1 1 4 4 THR CB C 13 69.753 . . 1 . . . . 4 T CB . 15901 1 14 . 1 1 4 4 THR N N 15 116.925 . . 1 . . . . 4 T N . 15901 1 15 . 1 1 5 5 LYS H H 1 8.343 . . 1 . . . . 5 K H . 15901 1 16 . 1 1 5 5 LYS CA C 13 56.349 . . 1 . . . . 5 K CA . 15901 1 17 . 1 1 5 5 LYS CB C 13 33.072 . . 1 . . . . 5 K CB . 15901 1 18 . 1 1 5 5 LYS N N 15 124.13 . . 1 . . . . 5 K N . 15901 1 19 . 1 1 6 6 LYS H H 1 8.256 . . 1 . . . . 6 K H . 15901 1 20 . 1 1 6 6 LYS CA C 13 55.957 . . 1 . . . . 6 K CA . 15901 1 21 . 1 1 6 6 LYS CB C 13 33.631 . . 1 . . . . 6 K CB . 15901 1 22 . 1 1 6 6 LYS N N 15 122.713 . . 1 . . . . 6 K N . 15901 1 23 . 1 1 7 7 LEU H H 1 8.413 . . 1 . . . . 7 L H . 15901 1 24 . 1 1 7 7 LEU CA C 13 54.666 . . 1 . . . . 7 L CA . 15901 1 25 . 1 1 7 7 LEU CB C 13 41.458 . . 1 . . . . 7 L CB . 15901 1 26 . 1 1 7 7 LEU N N 15 122.496 . . 1 . . . . 7 L N . 15901 1 27 . 1 1 8 8 HIS H H 1 8.914 . . 1 . . . . 8 H H . 15901 1 28 . 1 1 8 8 HIS CA C 13 54.729 . . 1 . . . . 8 H CA . 15901 1 29 . 1 1 8 8 HIS CB C 13 30.891 . . 1 . . . . 8 H CB . 15901 1 30 . 1 1 8 8 HIS N N 15 117.63 . . 1 . . . . 8 H N . 15901 1 31 . 1 1 9 9 LYS H H 1 8.627 . . 1 . . . . 9 K H . 15901 1 32 . 1 1 9 9 LYS CA C 13 56.134 . . 1 . . . . 9 K CA . 15901 1 33 . 1 1 9 9 LYS CB C 13 34.632 . . 1 . . . . 9 K CB . 15901 1 34 . 1 1 9 9 LYS N N 15 124.016 . . 1 . . . . 9 K N . 15901 1 35 . 1 1 10 10 GLU H H 1 9.439 . . 1 . . . . 10 E H . 15901 1 36 . 1 1 10 10 GLU CA C 13 53.424 . . 1 . . . . 10 E CA . 15901 1 37 . 1 1 10 10 GLU CB C 13 33.105 . . 1 . . . . 10 E CB . 15901 1 38 . 1 1 10 10 GLU N N 15 123.05 . . 1 . . . . 10 E N . 15901 1 39 . 1 1 11 11 PRO CA C 13 63.252 . . 1 . . . . 11 P CA . 15901 1 40 . 1 1 11 11 PRO CB C 13 33.215 . . 1 . . . . 11 P CB . 15901 1 41 . 1 1 12 12 ALA H H 1 8.063 . . 1 . . . . 12 A H . 15901 1 42 . 1 1 12 12 ALA CA C 13 51.668 . . 1 . . . . 12 A CA . 15901 1 43 . 1 1 12 12 ALA CB C 13 24.765 . . 1 . . . . 12 A CB . 15901 1 44 . 1 1 12 12 ALA N N 15 119.762 . . 1 . . . . 12 A N . 15901 1 45 . 1 1 13 13 THR H H 1 8.109 . . 1 . . . . 13 T H . 15901 1 46 . 1 1 13 13 THR CA C 13 60.503 . . 1 . . . . 13 T CA . 15901 1 47 . 1 1 13 13 THR CB C 13 71.561 . . 1 . . . . 13 T CB . 15901 1 48 . 1 1 13 13 THR N N 15 108.771 . . 1 . . . . 13 T N . 15901 1 49 . 1 1 14 14 LEU H H 1 9.194 . . 1 . . . . 14 L H . 15901 1 50 . 1 1 14 14 LEU CA C 13 56.782 . . 1 . . . . 14 L CA . 15901 1 51 . 1 1 14 14 LEU CB C 13 42.956 . . 1 . . . . 14 L CB . 15901 1 52 . 1 1 14 14 LEU N N 15 125.081 . . 1 . . . . 14 L N . 15901 1 53 . 1 1 15 15 ILE H H 1 8.439 . . 1 . . . . 15 I H . 15901 1 54 . 1 1 15 15 ILE CA C 13 64.172 . . 1 . . . . 15 I CA . 15901 1 55 . 1 1 15 15 ILE CB C 13 38.946 . . 1 . . . . 15 I CB . 15901 1 56 . 1 1 15 15 ILE N N 15 125.13 . . 1 . . . . 15 I N . 15901 1 57 . 1 1 16 16 LYS H H 1 8.099 . . 1 . . . . 16 K H . 15901 1 58 . 1 1 16 16 LYS CA C 13 56.486 . . 1 . . . . 16 K CA . 15901 1 59 . 1 1 16 16 LYS CB C 13 35.716 . . 1 . . . . 16 K CB . 15901 1 60 . 1 1 16 16 LYS N N 15 114.577 . . 1 . . . . 16 K N . 15901 1 61 . 1 1 17 17 ALA H H 1 9.489 . . 1 . . . . 17 A H . 15901 1 62 . 1 1 17 17 ALA CA C 13 52.396 . . 1 . . . . 17 A CA . 15901 1 63 . 1 1 17 17 ALA CB C 13 18.421 . . 1 . . . . 17 A CB . 15901 1 64 . 1 1 17 17 ALA N N 15 129.699 . . 1 . . . . 17 A N . 15901 1 65 . 1 1 18 18 ILE H H 1 8.067 . . 1 . . . . 18 I H . 15901 1 66 . 1 1 18 18 ILE CA C 13 63.331 . . 1 . . . . 18 I CA . 15901 1 67 . 1 1 18 18 ILE CB C 13 38.316 . . 1 . . . . 18 I CB . 15901 1 68 . 1 1 18 18 ILE N N 15 123.578 . . 1 . . . . 18 I N . 15901 1 69 . 1 1 19 19 ASP H H 1 8.25 . . 1 . . . . 19 D H . 15901 1 70 . 1 1 19 19 ASP CA C 13 53.893 . . 1 . . . . 19 D CA . 15901 1 71 . 1 1 19 19 ASP CB C 13 39.546 . . 1 . . . . 19 D CB . 15901 1 72 . 1 1 19 19 ASP N N 15 119.309 . . 1 . . . . 19 D N . 15901 1 73 . 1 1 20 20 GLY H H 1 8.426 . . 1 . . . . 20 G H . 15901 1 74 . 1 1 20 20 GLY CA C 13 47.781 . . 1 . . . . 20 G CA . 15901 1 75 . 1 1 20 20 GLY N N 15 103.205 . . 1 . . . . 20 G N . 15901 1 76 . 1 1 21 21 ASP H H 1 7.718 . . 1 . . . . 21 D H . 15901 1 77 . 1 1 21 21 ASP CA C 13 51.144 . . 1 . . . . 21 D CA . 15901 1 78 . 1 1 21 21 ASP CB C 13 38.526 . . 1 . . . . 21 D CB . 15901 1 79 . 1 1 21 21 ASP N N 15 110.574 . . 1 . . . . 21 D N . 15901 1 80 . 1 1 22 22 THR H H 1 7.594 . . 1 . . . . 22 T H . 15901 1 81 . 1 1 22 22 THR CA C 13 61.633 . . 1 . . . . 22 T CA . 15901 1 82 . 1 1 22 22 THR CB C 13 70.291 . . 1 . . . . 22 T CB . 15901 1 83 . 1 1 22 22 THR N N 15 115.289 . . 1 . . . . 22 T N . 15901 1 84 . 1 1 23 23 VAL H H 1 9.029 . . 1 . . . . 23 V H . 15901 1 85 . 1 1 23 23 VAL CA C 13 60.084 . . 1 . . . . 23 V CA . 15901 1 86 . 1 1 23 23 VAL CB C 13 36.379 . . 1 . . . . 23 V CB . 15901 1 87 . 1 1 23 23 VAL N N 15 119.319 . . 1 . . . . 23 V N . 15901 1 88 . 1 1 24 24 LYS H H 1 9.496 . . 1 . . . . 24 K H . 15901 1 89 . 1 1 24 24 LYS CA C 13 55.949 . . 1 . . . . 24 K CA . 15901 1 90 . 1 1 24 24 LYS CB C 13 34.662 . . 1 . . . . 24 K CB . 15901 1 91 . 1 1 24 24 LYS N N 15 127.279 . . 1 . . . . 24 K N . 15901 1 92 . 1 1 25 25 LEU H H 1 9.422 . . 1 . . . . 25 L H . 15901 1 93 . 1 1 25 25 LEU CA C 13 53.113 . . 1 . . . . 25 L CA . 15901 1 94 . 1 1 25 25 LEU CB C 13 45.528 . . 1 . . . . 25 L CB . 15901 1 95 . 1 1 25 25 LEU N N 15 127.235 . . 1 . . . . 25 L N . 15901 1 96 . 1 1 26 26 MET H H 1 9.572 . . 1 . . . . 26 M H . 15901 1 97 . 1 1 26 26 MET CA C 13 54.652 . . 1 . . . . 26 M CA . 15901 1 98 . 1 1 26 26 MET CB C 13 31.449 . . 1 . . . . 26 M CB . 15901 1 99 . 1 1 26 26 MET N N 15 122.18 . . 1 . . . . 26 M N . 15901 1 100 . 1 1 27 27 TYR H H 1 9.085 . . 1 . . . . 27 Y H . 15901 1 101 . 1 1 27 27 TYR CA C 13 56.83 . . 1 . . . . 27 Y CA . 15901 1 102 . 1 1 27 27 TYR CB C 13 41.973 . . 1 . . . . 27 Y CB . 15901 1 103 . 1 1 27 27 TYR N N 15 129.755 . . 1 . . . . 27 Y N . 15901 1 104 . 1 1 28 28 LYS H H 1 9.337 . . 1 . . . . 28 K H . 15901 1 105 . 1 1 28 28 LYS CA C 13 57.461 . . 1 . . . . 28 K CA . 15901 1 106 . 1 1 28 28 LYS CB C 13 29.772 . . 1 . . . . 28 K CB . 15901 1 107 . 1 1 28 28 LYS N N 15 127.514 . . 1 . . . . 28 K N . 15901 1 108 . 1 1 29 29 GLY H H 1 8.479 . . 1 . . . . 29 G H . 15901 1 109 . 1 1 29 29 GLY CA C 13 45.59 . . 1 . . . . 29 G CA . 15901 1 110 . 1 1 29 29 GLY N N 15 102.43 . . 1 . . . . 29 G N . 15901 1 111 . 1 1 30 30 GLN H H 1 7.802 . . 1 . . . . 30 Q H . 15901 1 112 . 1 1 30 30 GLN CA C 13 52.49 . . 1 . . . . 30 Q CA . 15901 1 113 . 1 1 30 30 GLN CB C 13 31.603 . . 1 . . . . 30 Q CB . 15901 1 114 . 1 1 30 30 GLN N N 15 119.107 . . 1 . . . . 30 Q N . 15901 1 115 . 1 1 31 31 PRO CA C 13 62.727 . . 1 . . . . 31 P CA . 15901 1 116 . 1 1 31 31 PRO CB C 13 32.155 . . 1 . . . . 31 P CB . 15901 1 117 . 1 1 32 32 MET H H 1 9.623 . . 1 . . . . 32 M H . 15901 1 118 . 1 1 32 32 MET CA C 13 56.023 . . 1 . . . . 32 M CA . 15901 1 119 . 1 1 32 32 MET CB C 13 37.035 . . 1 . . . . 32 M CB . 15901 1 120 . 1 1 32 32 MET N N 15 126.093 . . 1 . . . . 32 M N . 15901 1 121 . 1 1 33 33 THR H H 1 8.989 . . 1 . . . . 33 T H . 15901 1 122 . 1 1 33 33 THR CA C 13 63.884 . . 1 . . . . 33 T CA . 15901 1 123 . 1 1 33 33 THR CB C 13 68.488 . . 1 . . . . 33 T CB . 15901 1 124 . 1 1 33 33 THR N N 15 124.142 . . 1 . . . . 33 T N . 15901 1 125 . 1 1 34 34 PHE H H 1 9.593 . . 1 . . . . 34 F H . 15901 1 126 . 1 1 34 34 PHE CA C 13 57.314 . . 1 . . . . 34 F CA . 15901 1 127 . 1 1 34 34 PHE CB C 13 42.396 . . 1 . . . . 34 F CB . 15901 1 128 . 1 1 34 34 PHE N N 15 125.544 . . 1 . . . . 34 F N . 15901 1 129 . 1 1 35 35 ARG H H 1 9.537 . . 1 . . . . 35 R H . 15901 1 130 . 1 1 35 35 ARG CA C 13 52.311 . . 1 . . . . 35 R CA . 15901 1 131 . 1 1 35 35 ARG CB C 13 32.822 . . 1 . . . . 35 R CB . 15901 1 132 . 1 1 35 35 ARG N N 15 123.229 . . 1 . . . . 35 R N . 15901 1 133 . 1 1 36 36 LEU H H 1 8.368 . . 1 . . . . 36 L H . 15901 1 134 . 1 1 36 36 LEU CA C 13 55.684 . . 1 . . . . 36 L CA . 15901 1 135 . 1 1 36 36 LEU CB C 13 41.915 . . 1 . . . . 36 L CB . 15901 1 136 . 1 1 36 36 LEU N N 15 123.061 . . 1 . . . . 36 L N . 15901 1 137 . 1 1 37 37 LEU H H 1 7.751 . . 1 . . . . 37 L H . 15901 1 138 . 1 1 37 37 LEU CA C 13 55.753 . . 1 . . . . 37 L CA . 15901 1 139 . 1 1 37 37 LEU CB C 13 44.474 . . 1 . . . . 37 L CB . 15901 1 140 . 1 1 37 37 LEU N N 15 124.713 . . 1 . . . . 37 L N . 15901 1 141 . 1 1 38 38 LEU H H 1 8.489 . . 1 . . . . 38 L H . 15901 1 142 . 1 1 38 38 LEU CA C 13 57.037 . . 1 . . . . 38 L CA . 15901 1 143 . 1 1 38 38 LEU CB C 13 41.087 . . 1 . . . . 38 L CB . 15901 1 144 . 1 1 38 38 LEU N N 15 113.095 . . 1 . . . . 38 L N . 15901 1 145 . 1 1 39 39 VAL H H 1 7.026 . . 1 . . . . 39 V H . 15901 1 146 . 1 1 39 39 VAL CA C 13 58.57 . . 1 . . . . 39 V CA . 15901 1 147 . 1 1 39 39 VAL CB C 13 35.537 . . 1 . . . . 39 V CB . 15901 1 148 . 1 1 39 39 VAL N N 15 108.763 . . 1 . . . . 39 V N . 15901 1 149 . 1 1 40 40 ASP H H 1 8.869 . . 1 . . . . 40 D H . 15901 1 150 . 1 1 40 40 ASP CA C 13 53.064 . . 1 . . . . 40 D CA . 15901 1 151 . 1 1 40 40 ASP CB C 13 42.379 . . 1 . . . . 40 D CB . 15901 1 152 . 1 1 40 40 ASP N N 15 121.996 . . 1 . . . . 40 D N . 15901 1 153 . 1 1 41 41 THR H H 1 7.736 . . 1 . . . . 41 T H . 15901 1 154 . 1 1 41 41 THR CA C 13 58.351 . . 1 . . . . 41 T CA . 15901 1 155 . 1 1 41 41 THR CB C 13 67.799 . . 1 . . . . 41 T CB . 15901 1 156 . 1 1 41 41 THR N N 15 116.052 . . 1 . . . . 41 T N . 15901 1 157 . 1 1 42 42 PRO CA C 13 62.152 . . 1 . . . . 42 P CA . 15901 1 158 . 1 1 42 42 PRO CB C 13 31.815 . . 1 . . . . 42 P CB . 15901 1 159 . 1 1 43 43 GLU H H 1 8.619 . . 1 . . . . 43 E H . 15901 1 160 . 1 1 43 43 GLU CA C 13 55.847 . . 1 . . . . 43 E CA . 15901 1 161 . 1 1 43 43 GLU CB C 13 29.839 . . 1 . . . . 43 E CB . 15901 1 162 . 1 1 43 43 GLU N N 15 121.692 . . 1 . . . . 43 E N . 15901 1 163 . 1 1 44 44 PHE H H 1 8.887 . . 1 . . . . 50 F H . 15901 1 164 . 1 1 44 44 PHE CA C 13 62.767 . . 1 . . . . 50 F CA . 15901 1 165 . 1 1 44 44 PHE CB C 13 39.477 . . 1 . . . . 50 F CB . 15901 1 166 . 1 1 44 44 PHE N N 15 120.124 . . 1 . . . . 50 F N . 15901 1 167 . 1 1 45 45 ASN H H 1 7.857 . . 1 . . . . 51 N H . 15901 1 168 . 1 1 45 45 ASN CA C 13 52.793 . . 1 . . . . 51 N CA . 15901 1 169 . 1 1 45 45 ASN CB C 13 37.474 . . 1 . . . . 51 N CB . 15901 1 170 . 1 1 45 45 ASN N N 15 110.687 . . 1 . . . . 51 N N . 15901 1 171 . 1 1 46 46 GLU H H 1 7.98 . . 1 . . . . 52 E H . 15901 1 172 . 1 1 46 46 GLU CA C 13 54.389 . . 1 . . . . 52 E CA . 15901 1 173 . 1 1 46 46 GLU CB C 13 32.162 . . 1 . . . . 52 E CB . 15901 1 174 . 1 1 46 46 GLU N N 15 120.46 . . 1 . . . . 52 E N . 15901 1 175 . 1 1 47 47 LYS H H 1 8.552 . . 1 . . . . 53 K H . 15901 1 176 . 1 1 47 47 LYS CA C 13 59.093 . . 1 . . . . 53 K CA . 15901 1 177 . 1 1 47 47 LYS CB C 13 31.721 . . 1 . . . . 53 K CB . 15901 1 178 . 1 1 47 47 LYS N N 15 124.818 . . 1 . . . . 53 K N . 15901 1 179 . 1 1 48 48 TYR H H 1 8.658 . . 1 . . . . 54 Y H . 15901 1 180 . 1 1 48 48 TYR CA C 13 62.353 . . 1 . . . . 54 Y CA . 15901 1 181 . 1 1 48 48 TYR CB C 13 35.22 . . 1 . . . . 54 Y CB . 15901 1 182 . 1 1 48 48 TYR N N 15 116.09 . . 1 . . . . 54 Y N . 15901 1 183 . 1 1 49 49 GLY H H 1 8.725 . . 1 . . . . 55 G H . 15901 1 184 . 1 1 49 49 GLY CA C 13 48.929 . . 1 . . . . 55 G CA . 15901 1 185 . 1 1 49 49 GLY N N 15 109.636 . . 1 . . . . 55 G N . 15901 1 186 . 1 1 50 50 PRO CA C 13 65.153 . . 1 . . . . 56 P CA . 15901 1 187 . 1 1 50 50 PRO CB C 13 31.437 . . 1 . . . . 56 P CB . 15901 1 188 . 1 1 51 51 GLU H H 1 9.008 . . 1 . . . . 57 E H . 15901 1 189 . 1 1 51 51 GLU CA C 13 61.576 . . 1 . . . . 57 E CA . 15901 1 190 . 1 1 51 51 GLU CB C 13 28.387 . . 1 . . . . 57 E CB . 15901 1 191 . 1 1 51 51 GLU N N 15 120.649 . . 1 . . . . 57 E N . 15901 1 192 . 1 1 52 52 ALA H H 1 8.991 . . 1 . . . . 58 A H . 15901 1 193 . 1 1 52 52 ALA CA C 13 55.951 . . 1 . . . . 58 A CA . 15901 1 194 . 1 1 52 52 ALA CB C 13 18.251 . . 1 . . . . 58 A CB . 15901 1 195 . 1 1 52 52 ALA N N 15 124.842 . . 1 . . . . 58 A N . 15901 1 196 . 1 1 53 53 SER H H 1 8.209 . . 1 . . . . 59 S H . 15901 1 197 . 1 1 53 53 SER CA C 13 63.021 . . 1 . . . . 59 S CA . 15901 1 198 . 1 1 53 53 SER CB C 13 62.319 . . 1 . . . . 59 S CB . 15901 1 199 . 1 1 53 53 SER N N 15 111.747 . . 1 . . . . 59 S N . 15901 1 200 . 1 1 54 54 ALA H H 1 8.49 . . 1 . . . . 60 A H . 15901 1 201 . 1 1 54 54 ALA CA C 13 54.988 . . 1 . . . . 60 A CA . 15901 1 202 . 1 1 54 54 ALA CB C 13 18.408 . . 1 . . . . 60 A CB . 15901 1 203 . 1 1 54 54 ALA N N 15 122.7 . . 1 . . . . 60 A N . 15901 1 204 . 1 1 55 55 PHE H H 1 8.245 . . 1 . . . . 61 F H . 15901 1 205 . 1 1 55 55 PHE CA C 13 61.743 . . 1 . . . . 61 F CA . 15901 1 206 . 1 1 55 55 PHE CB C 13 39.928 . . 1 . . . . 61 F CB . 15901 1 207 . 1 1 55 55 PHE N N 15 121.613 . . 1 . . . . 61 F N . 15901 1 208 . 1 1 56 56 THR H H 1 8.537 . . 1 . . . . 62 T H . 15901 1 209 . 1 1 56 56 THR CA C 13 67.514 . . 1 . . . . 62 T CA . 15901 1 210 . 1 1 56 56 THR CB C 13 68.356 . . 1 . . . . 62 T CB . 15901 1 211 . 1 1 56 56 THR N N 15 120.317 . . 1 . . . . 62 T N . 15901 1 212 . 1 1 57 57 LYS H H 1 7.876 . . 1 . . . . 63 K H . 15901 1 213 . 1 1 57 57 LYS CA C 13 60.199 . . 1 . . . . 63 K CA . 15901 1 214 . 1 1 57 57 LYS CB C 13 33.249 . . 1 . . . . 63 K CB . 15901 1 215 . 1 1 57 57 LYS N N 15 119.915 . . 1 . . . . 63 K N . 15901 1 216 . 1 1 58 58 LYS H H 1 8.009 . . 1 . . . . 64 K H . 15901 1 217 . 1 1 58 58 LYS CA C 13 59.305 . . 1 . . . . 64 K CA . 15901 1 218 . 1 1 58 58 LYS CB C 13 32.071 . . 1 . . . . 64 K CB . 15901 1 219 . 1 1 58 58 LYS N N 15 117.326 . . 1 . . . . 64 K N . 15901 1 220 . 1 1 59 59 MET H H 1 7.68 . . 1 . . . . 65 M H . 15901 1 221 . 1 1 59 59 MET CA C 13 59.791 . . 1 . . . . 65 M CA . 15901 1 222 . 1 1 59 59 MET CB C 13 32.34 . . 1 . . . . 65 M CB . 15901 1 223 . 1 1 59 59 MET N N 15 116.012 . . 1 . . . . 65 M N . 15901 1 224 . 1 1 60 60 VAL H H 1 8.173 . . 1 . . . . 66 V H . 15901 1 225 . 1 1 60 60 VAL CA C 13 64.304 . . 1 . . . . 66 V CA . 15901 1 226 . 1 1 60 60 VAL CB C 13 31.423 . . 1 . . . . 66 V CB . 15901 1 227 . 1 1 60 60 VAL N N 15 107.639 . . 1 . . . . 66 V N . 15901 1 228 . 1 1 61 61 GLU H H 1 8.737 . . 1 . . . . 67 E H . 15901 1 229 . 1 1 61 61 GLU CA C 13 59.229 . . 1 . . . . 67 E CA . 15901 1 230 . 1 1 61 61 GLU CB C 13 29.094 . . 1 . . . . 67 E CB . 15901 1 231 . 1 1 61 61 GLU N N 15 121.151 . . 1 . . . . 67 E N . 15901 1 232 . 1 1 62 62 ASN H H 1 7.431 . . 1 . . . . 68 N H . 15901 1 233 . 1 1 62 62 ASN CA C 13 53.361 . . 1 . . . . 68 N CA . 15901 1 234 . 1 1 62 62 ASN CB C 13 38.966 . . 1 . . . . 68 N CB . 15901 1 235 . 1 1 62 62 ASN N N 15 113.516 . . 1 . . . . 68 N N . 15901 1 236 . 1 1 63 63 ALA H H 1 6.685 . . 1 . . . . 69 A H . 15901 1 237 . 1 1 63 63 ALA CA C 13 51.391 . . 1 . . . . 69 A CA . 15901 1 238 . 1 1 63 63 ALA CB C 13 19.405 . . 1 . . . . 69 A CB . 15901 1 239 . 1 1 63 63 ALA N N 15 121.128 . . 1 . . . . 69 A N . 15901 1 240 . 1 1 64 64 LYS H H 1 10.131 . . 1 . . . . 70 K H . 15901 1 241 . 1 1 64 64 LYS CA C 13 57.86 . . 1 . . . . 70 K CA . 15901 1 242 . 1 1 64 64 LYS CB C 13 32.219 . . 1 . . . . 70 K CB . 15901 1 243 . 1 1 64 64 LYS N N 15 125.835 . . 1 . . . . 70 K N . 15901 1 244 . 1 1 65 65 LYS H H 1 8.955 . . 1 . . . . 71 K H . 15901 1 245 . 1 1 65 65 LYS CA C 13 55.446 . . 1 . . . . 71 K CA . 15901 1 246 . 1 1 65 65 LYS CB C 13 35.451 . . 1 . . . . 71 K CB . 15901 1 247 . 1 1 65 65 LYS N N 15 121.391 . . 1 . . . . 71 K N . 15901 1 248 . 1 1 66 66 ILE H H 1 9.005 . . 1 . . . . 72 I H . 15901 1 249 . 1 1 66 66 ILE CA C 13 58.556 . . 1 . . . . 72 I CA . 15901 1 250 . 1 1 66 66 ILE CB C 13 38.247 . . 1 . . . . 72 I CB . 15901 1 251 . 1 1 66 66 ILE N N 15 129.009 . . 1 . . . . 72 I N . 15901 1 252 . 1 1 67 67 GLU H H 1 8.779 . . 1 . . . . 73 E H . 15901 1 253 . 1 1 67 67 GLU CA C 13 53.8 . . 1 . . . . 73 E CA . 15901 1 254 . 1 1 67 67 GLU CB C 13 36.325 . . 1 . . . . 73 E CB . 15901 1 255 . 1 1 67 67 GLU N N 15 123.081 . . 1 . . . . 73 E N . 15901 1 256 . 1 1 68 68 VAL H H 1 9.59 . . 1 . . . . 74 V H . 15901 1 257 . 1 1 68 68 VAL CA C 13 59.527 . . 1 . . . . 74 V CA . 15901 1 258 . 1 1 68 68 VAL CB C 13 34.753 . . 1 . . . . 74 V CB . 15901 1 259 . 1 1 68 68 VAL N N 15 117.006 . . 1 . . . . 74 V N . 15901 1 260 . 1 1 69 69 GLU H H 1 8.842 . . 1 . . . . 75 E H . 15901 1 261 . 1 1 69 69 GLU CA C 13 54.484 . . 1 . . . . 75 E CA . 15901 1 262 . 1 1 69 69 GLU CB C 13 35.784 . . 1 . . . . 75 E CB . 15901 1 263 . 1 1 69 69 GLU N N 15 126.257 . . 1 . . . . 75 E N . 15901 1 264 . 1 1 70 70 PHE H H 1 8.954 . . 1 . . . . 76 F H . 15901 1 265 . 1 1 70 70 PHE CA C 13 59.632 . . 1 . . . . 76 F CA . 15901 1 266 . 1 1 70 70 PHE CB C 13 39.966 . . 1 . . . . 76 F CB . 15901 1 267 . 1 1 70 70 PHE N N 15 127.109 . . 1 . . . . 76 F N . 15901 1 268 . 1 1 71 71 ASP H H 1 9.461 . . 1 . . . . 77 D H . 15901 1 269 . 1 1 71 71 ASP CA C 13 51.634 . . 1 . . . . 77 D CA . 15901 1 270 . 1 1 71 71 ASP CB C 13 43.589 . . 1 . . . . 77 D CB . 15901 1 271 . 1 1 71 71 ASP N N 15 123.534 . . 1 . . . . 77 D N . 15901 1 272 . 1 1 72 72 LYS H H 1 10.584 . . 1 . . . . 78 K H . 15901 1 273 . 1 1 72 72 LYS CA C 13 57.293 . . 1 . . . . 78 K CA . 15901 1 274 . 1 1 72 72 LYS CB C 13 33.522 . . 1 . . . . 78 K CB . 15901 1 275 . 1 1 72 72 LYS N N 15 119.066 . . 1 . . . . 78 K N . 15901 1 276 . 1 1 73 73 GLY H H 1 8.216 . . 1 . . . . 79 G H . 15901 1 277 . 1 1 73 73 GLY CA C 13 44.705 . . 1 . . . . 79 G CA . 15901 1 278 . 1 1 73 73 GLY N N 15 112.009 . . 1 . . . . 79 G N . 15901 1 279 . 1 1 74 74 GLN H H 1 8.381 . . 1 . . . . 80 Q H . 15901 1 280 . 1 1 74 74 GLN CA C 13 56.977 . . 1 . . . . 80 Q CA . 15901 1 281 . 1 1 74 74 GLN CB C 13 29.805 . . 1 . . . . 80 Q CB . 15901 1 282 . 1 1 74 74 GLN N N 15 123.414 . . 1 . . . . 80 Q N . 15901 1 283 . 1 1 75 75 ARG H H 1 8.711 . . 1 . . . . 81 R H . 15901 1 284 . 1 1 75 75 ARG CA C 13 58.411 . . 1 . . . . 81 R CA . 15901 1 285 . 1 1 75 75 ARG CB C 13 32.344 . . 1 . . . . 81 R CB . 15901 1 286 . 1 1 75 75 ARG N N 15 123.454 . . 1 . . . . 81 R N . 15901 1 287 . 1 1 76 76 THR H H 1 7.296 . . 1 . . . . 82 T H . 15901 1 288 . 1 1 76 76 THR CA C 13 58.086 . . 1 . . . . 82 T CA . 15901 1 289 . 1 1 76 76 THR CB C 13 72.553 . . 1 . . . . 82 T CB . 15901 1 290 . 1 1 76 76 THR N N 15 106.052 . . 1 . . . . 82 T N . 15901 1 291 . 1 1 77 77 ASP H H 1 8.638 . . 1 . . . . 83 D H . 15901 1 292 . 1 1 77 77 ASP CA C 13 51.957 . . 1 . . . . 83 D CA . 15901 1 293 . 1 1 77 77 ASP CB C 13 41.885 . . 1 . . . . 83 D CB . 15901 1 294 . 1 1 77 77 ASP N N 15 120.889 . . 1 . . . . 83 D N . 15901 1 295 . 1 1 78 78 LYS H H 1 8.279 . . 1 . . . . 84 K H . 15901 1 296 . 1 1 78 78 LYS CA C 13 58.147 . . 1 . . . . 84 K CA . 15901 1 297 . 1 1 78 78 LYS CB C 13 31.602 . . 1 . . . . 84 K CB . 15901 1 298 . 1 1 78 78 LYS N N 15 116.803 . . 1 . . . . 84 K N . 15901 1 299 . 1 1 79 79 TYR H H 1 7.959 . . 1 . . . . 85 Y H . 15901 1 300 . 1 1 79 79 TYR CA C 13 57.028 . . 1 . . . . 85 Y CA . 15901 1 301 . 1 1 79 79 TYR CB C 13 38.112 . . 1 . . . . 85 Y CB . 15901 1 302 . 1 1 79 79 TYR N N 15 119.031 . . 1 . . . . 85 Y N . 15901 1 303 . 1 1 80 80 GLY H H 1 8.132 . . 1 . . . . 86 G H . 15901 1 304 . 1 1 80 80 GLY CA C 13 45.471 . . 1 . . . . 86 G CA . 15901 1 305 . 1 1 80 80 GLY N N 15 108.408 . . 1 . . . . 86 G N . 15901 1 306 . 1 1 81 81 ARG H H 1 8.539 . . 1 . . . . 87 R H . 15901 1 307 . 1 1 81 81 ARG CA C 13 55.797 . . 1 . . . . 87 R CA . 15901 1 308 . 1 1 81 81 ARG CB C 13 29.954 . . 1 . . . . 87 R CB . 15901 1 309 . 1 1 81 81 ARG N N 15 121.439 . . 1 . . . . 87 R N . 15901 1 310 . 1 1 82 82 GLY H H 1 8.709 . . 1 . . . . 88 G H . 15901 1 311 . 1 1 82 82 GLY CA C 13 45.256 . . 1 . . . . 88 G CA . 15901 1 312 . 1 1 82 82 GLY N N 15 108.481 . . 1 . . . . 88 G N . 15901 1 313 . 1 1 83 83 LEU H H 1 8.376 . . 1 . . . . 89 L H . 15901 1 314 . 1 1 83 83 LEU CA C 13 52.8 . . 1 . . . . 89 L CA . 15901 1 315 . 1 1 83 83 LEU CB C 13 42.236 . . 1 . . . . 89 L CB . 15901 1 316 . 1 1 83 83 LEU N N 15 125.826 . . 1 . . . . 89 L N . 15901 1 317 . 1 1 84 84 ALA H H 1 7.506 . . 1 . . . . 90 A H . 15901 1 318 . 1 1 84 84 ALA CA C 13 50.585 . . 1 . . . . 90 A CA . 15901 1 319 . 1 1 84 84 ALA CB C 13 23.9 . . 1 . . . . 90 A CB . 15901 1 320 . 1 1 84 84 ALA N N 15 120.317 . . 1 . . . . 90 A N . 15901 1 321 . 1 1 85 85 TYR H H 1 9.03 . . 1 . . . . 91 Y H . 15901 1 322 . 1 1 85 85 TYR CA C 13 57.203 . . 1 . . . . 91 Y CA . 15901 1 323 . 1 1 85 85 TYR CB C 13 37.733 . . 1 . . . . 91 Y CB . 15901 1 324 . 1 1 85 85 TYR N N 15 122.639 . . 1 . . . . 91 Y N . 15901 1 325 . 1 1 86 86 ILE H H 1 7.952 . . 1 . . . . 92 I H . 15901 1 326 . 1 1 86 86 ILE CA C 13 58.682 . . 1 . . . . 92 I CA . 15901 1 327 . 1 1 86 86 ILE CB C 13 39 . . 1 . . . . 92 I CB . 15901 1 328 . 1 1 86 86 ILE N N 15 122.433 . . 1 . . . . 92 I N . 15901 1 329 . 1 1 87 87 TYR H H 1 9.555 . . 1 . . . . 93 Y H . 15901 1 330 . 1 1 87 87 TYR CA C 13 56.325 . . 1 . . . . 93 Y CA . 15901 1 331 . 1 1 87 87 TYR CB C 13 41.5 . . 1 . . . . 93 Y CB . 15901 1 332 . 1 1 87 87 TYR N N 15 126.293 . . 1 . . . . 93 Y N . 15901 1 333 . 1 1 88 88 ALA H H 1 9.312 . . 1 . . . . 94 A H . 15901 1 334 . 1 1 88 88 ALA CA C 13 49.8 . . 1 . . . . 94 A CA . 15901 1 335 . 1 1 88 88 ALA CB C 13 21.071 . . 1 . . . . 94 A CB . 15901 1 336 . 1 1 88 88 ALA N N 15 125.675 . . 1 . . . . 94 A N . 15901 1 337 . 1 1 89 89 ASP H H 1 9.726 . . 1 . . . . 95 D H . 15901 1 338 . 1 1 89 89 ASP CA C 13 56.44 . . 1 . . . . 95 D CA . 15901 1 339 . 1 1 89 89 ASP CB C 13 39.579 . . 1 . . . . 95 D CB . 15901 1 340 . 1 1 89 89 ASP N N 15 127.563 . . 1 . . . . 95 D N . 15901 1 341 . 1 1 90 90 GLY H H 1 9.346 . . 1 . . . . 96 G H . 15901 1 342 . 1 1 90 90 GLY CA C 13 45.352 . . 1 . . . . 96 G CA . 15901 1 343 . 1 1 90 90 GLY N N 15 103.075 . . 1 . . . . 96 G N . 15901 1 344 . 1 1 91 91 LYS H H 1 7.867 . . 1 . . . . 97 K H . 15901 1 345 . 1 1 91 91 LYS CA C 13 54.328 . . 1 . . . . 97 K CA . 15901 1 346 . 1 1 91 91 LYS CB C 13 33.144 . . 1 . . . . 97 K CB . 15901 1 347 . 1 1 91 91 LYS N N 15 121.422 . . 1 . . . . 97 K N . 15901 1 348 . 1 1 92 92 MET H H 1 9.391 . . 1 . . . . 98 M H . 15901 1 349 . 1 1 92 92 MET CA C 13 56.108 . . 1 . . . . 98 M CA . 15901 1 350 . 1 1 92 92 MET CB C 13 34.376 . . 1 . . . . 98 M CB . 15901 1 351 . 1 1 92 92 MET N N 15 126.826 . . 1 . . . . 98 M N . 15901 1 352 . 1 1 93 93 VAL H H 1 10.114 . . 1 . . . . 99 V H . 15901 1 353 . 1 1 93 93 VAL CA C 13 65.768 . . 1 . . . . 99 V CA . 15901 1 354 . 1 1 93 93 VAL CB C 13 32.546 . . 1 . . . . 99 V CB . 15901 1 355 . 1 1 93 93 VAL N N 15 135.935 . . 1 . . . . 99 V N . 15901 1 356 . 1 1 94 94 ASN H H 1 9.685 . . 1 . . . . 100 N H . 15901 1 357 . 1 1 94 94 ASN CA C 13 56.946 . . 1 . . . . 100 N CA . 15901 1 358 . 1 1 94 94 ASN CB C 13 34.969 . . 1 . . . . 100 N CB . 15901 1 359 . 1 1 94 94 ASN N N 15 108.38 . . 1 . . . . 100 N N . 15901 1 360 . 1 1 95 95 GLU H H 1 6.126 . . 1 . . . . 101 E H . 15901 1 361 . 1 1 95 95 GLU CA C 13 59.054 . . 1 . . . . 101 E CA . 15901 1 362 . 1 1 95 95 GLU CB C 13 31.039 . . 1 . . . . 101 E CB . 15901 1 363 . 1 1 95 95 GLU N N 15 113.144 . . 1 . . . . 101 E N . 15901 1 364 . 1 1 96 96 ALA H H 1 7.864 . . 1 . . . . 102 A H . 15901 1 365 . 1 1 96 96 ALA CA C 13 55.356 . . 1 . . . . 102 A CA . 15901 1 366 . 1 1 96 96 ALA CB C 13 18.291 . . 1 . . . . 102 A CB . 15901 1 367 . 1 1 96 96 ALA N N 15 122.608 . . 1 . . . . 102 A N . 15901 1 368 . 1 1 97 97 LEU H H 1 8.089 . . 1 . . . . 103 L H . 15901 1 369 . 1 1 97 97 LEU CA C 13 57.966 . . 1 . . . . 103 L CA . 15901 1 370 . 1 1 97 97 LEU CB C 13 45.357 . . 1 . . . . 103 L CB . 15901 1 371 . 1 1 97 97 LEU N N 15 116.409 . . 1 . . . . 103 L N . 15901 1 372 . 1 1 98 98 VAL H H 1 6.84 . . 1 . . . . 104 V H . 15901 1 373 . 1 1 98 98 VAL CA C 13 65.199 . . 1 . . . . 104 V CA . 15901 1 374 . 1 1 98 98 VAL CB C 13 31.965 . . 1 . . . . 104 V CB . 15901 1 375 . 1 1 98 98 VAL N N 15 116.414 . . 1 . . . . 104 V N . 15901 1 376 . 1 1 99 99 ARG H H 1 9.104 . . 1 . . . . 105 R H . 15901 1 377 . 1 1 99 99 ARG CA C 13 57.022 . . 1 . . . . 105 R CA . 15901 1 378 . 1 1 99 99 ARG CB C 13 28.799 . . 1 . . . . 105 R CB . 15901 1 379 . 1 1 99 99 ARG N N 15 122.604 . . 1 . . . . 105 R N . 15901 1 380 . 1 1 100 100 GLN H H 1 7.192 . . 1 . . . . 106 Q H . 15901 1 381 . 1 1 100 100 GLN CA C 13 53.826 . . 1 . . . . 106 Q CA . 15901 1 382 . 1 1 100 100 GLN CB C 13 28.468 . . 1 . . . . 106 Q CB . 15901 1 383 . 1 1 100 100 GLN N N 15 112.727 . . 1 . . . . 106 Q N . 15901 1 384 . 1 1 101 101 GLY H H 1 8.09 . . 1 . . . . 107 G H . 15901 1 385 . 1 1 101 101 GLY CA C 13 46.545 . . 1 . . . . 107 G CA . 15901 1 386 . 1 1 101 101 GLY N N 15 107.013 . . 1 . . . . 107 G N . 15901 1 387 . 1 1 102 102 LEU H H 1 7.739 . . 1 . . . . 108 L H . 15901 1 388 . 1 1 102 102 LEU CA C 13 53.209 . . 1 . . . . 108 L CA . 15901 1 389 . 1 1 102 102 LEU CB C 13 43.431 . . 1 . . . . 108 L CB . 15901 1 390 . 1 1 102 102 LEU N N 15 114.958 . . 1 . . . . 108 L N . 15901 1 391 . 1 1 103 103 ALA H H 1 6.944 . . 1 . . . . 109 A H . 15901 1 392 . 1 1 103 103 ALA CA C 13 50.314 . . 1 . . . . 109 A CA . 15901 1 393 . 1 1 103 103 ALA CB C 13 24.885 . . 1 . . . . 109 A CB . 15901 1 394 . 1 1 103 103 ALA N N 15 112.761 . . 1 . . . . 109 A N . 15901 1 395 . 1 1 104 104 LYS H H 1 7.854 . . 1 . . . . 110 K H . 15901 1 396 . 1 1 104 104 LYS CA C 13 54.266 . . 1 . . . . 110 K CA . 15901 1 397 . 1 1 104 104 LYS CB C 13 35.51 . . 1 . . . . 110 K CB . 15901 1 398 . 1 1 104 104 LYS N N 15 118.028 . . 1 . . . . 110 K N . 15901 1 399 . 1 1 105 105 VAL H H 1 8.921 . . 1 . . . . 111 V H . 15901 1 400 . 1 1 105 105 VAL CA C 13 63.138 . . 1 . . . . 111 V CA . 15901 1 401 . 1 1 105 105 VAL CB C 13 31.422 . . 1 . . . . 111 V CB . 15901 1 402 . 1 1 105 105 VAL N N 15 122.387 . . 1 . . . . 111 V N . 15901 1 403 . 1 1 106 106 ALA H H 1 7.814 . . 1 . . . . 112 A H . 15901 1 404 . 1 1 106 106 ALA CA C 13 51.263 . . 1 . . . . 112 A CA . 15901 1 405 . 1 1 106 106 ALA CB C 13 21.729 . . 1 . . . . 112 A CB . 15901 1 406 . 1 1 106 106 ALA N N 15 132.037 . . 1 . . . . 112 A N . 15901 1 407 . 1 1 107 107 TYR H H 1 8.529 . . 1 . . . . 113 Y H . 15901 1 408 . 1 1 107 107 TYR CA C 13 56.633 . . 1 . . . . 113 Y CA . 15901 1 409 . 1 1 107 107 TYR CB C 13 37.562 . . 1 . . . . 113 Y CB . 15901 1 410 . 1 1 107 107 TYR N N 15 122.317 . . 1 . . . . 113 Y N . 15901 1 411 . 1 1 108 108 VAL H H 1 7.829 . . 1 . . . . 114 V H . 15901 1 412 . 1 1 108 108 VAL CA C 13 62.833 . . 1 . . . . 114 V CA . 15901 1 413 . 1 1 108 108 VAL CB C 13 33.65 . . 1 . . . . 114 V CB . 15901 1 414 . 1 1 108 108 VAL N N 15 124.127 . . 1 . . . . 114 V N . 15901 1 415 . 1 1 109 109 TYR H H 1 8.382 . . 1 . . . . 115 Y H . 15901 1 416 . 1 1 109 109 TYR CA C 13 57.15 . . 1 . . . . 115 Y CA . 15901 1 417 . 1 1 109 109 TYR CB C 13 39.395 . . 1 . . . . 115 Y CB . 15901 1 418 . 1 1 109 109 TYR N N 15 123.189 . . 1 . . . . 115 Y N . 15901 1 419 . 1 1 110 110 LYS H H 1 8.613 . . 1 . . . . 116 K H . 15901 1 420 . 1 1 110 110 LYS CA C 13 57.847 . . 1 . . . . 116 K CA . 15901 1 421 . 1 1 110 110 LYS CB C 13 32.085 . . 1 . . . . 116 K CB . 15901 1 422 . 1 1 110 110 LYS N N 15 124.341 . . 1 . . . . 116 K N . 15901 1 423 . 1 1 111 111 GLY H H 1 8.639 . . 1 . . . . 117 G H . 15901 1 424 . 1 1 111 111 GLY CA C 13 45.419 . . 1 . . . . 117 G CA . 15901 1 425 . 1 1 111 111 GLY N N 15 110.823 . . 1 . . . . 117 G N . 15901 1 426 . 1 1 112 112 ASN H H 1 7.986 . . 1 . . . . 118 N H . 15901 1 427 . 1 1 112 112 ASN CA C 13 51.29 . . 1 . . . . 118 N CA . 15901 1 428 . 1 1 112 112 ASN CB C 13 38.241 . . 1 . . . . 118 N CB . 15901 1 429 . 1 1 112 112 ASN N N 15 120.99 . . 1 . . . . 118 N N . 15901 1 430 . 1 1 113 113 ASN H H 1 7.74 . . 1 . . . . 119 N H . 15901 1 431 . 1 1 113 113 ASN CA C 13 51.9 . . 1 . . . . 119 N CA . 15901 1 432 . 1 1 113 113 ASN CB C 13 39.244 . . 1 . . . . 119 N CB . 15901 1 433 . 1 1 113 113 ASN N N 15 116.365 . . 1 . . . . 119 N N . 15901 1 434 . 1 1 114 114 THR H H 1 10.445 . . 1 . . . . 120 T H . 15901 1 435 . 1 1 114 114 THR CA C 13 68.977 . . 1 . . . . 120 T CA . 15901 1 436 . 1 1 114 114 THR CB C 13 66.624 . . 1 . . . . 120 T CB . 15901 1 437 . 1 1 114 114 THR N N 15 123.509 . . 1 . . . . 120 T N . 15901 1 438 . 1 1 115 115 HIS H H 1 7.004 . . 1 . . . . 121 H H . 15901 1 439 . 1 1 115 115 HIS CA C 13 52.72 . . 1 . . . . 121 H CA . 15901 1 440 . 1 1 115 115 HIS CB C 13 28.028 . . 1 . . . . 121 H CB . 15901 1 441 . 1 1 115 115 HIS N N 15 111.231 . . 1 . . . . 121 H N . 15901 1 442 . 1 1 116 116 GLU H H 1 7.502 . . 1 . . . . 122 E H . 15901 1 443 . 1 1 116 116 GLU CA C 13 61.402 . . 1 . . . . 122 E CA . 15901 1 444 . 1 1 116 116 GLU CB C 13 29.888 . . 1 . . . . 122 E CB . 15901 1 445 . 1 1 116 116 GLU N N 15 120.368 . . 1 . . . . 122 E N . 15901 1 446 . 1 1 117 117 GLN H H 1 8.932 . . 1 . . . . 123 Q H . 15901 1 447 . 1 1 117 117 GLN CA C 13 59.702 . . 1 . . . . 123 Q CA . 15901 1 448 . 1 1 117 117 GLN CB C 13 27.442 . . 1 . . . . 123 Q CB . 15901 1 449 . 1 1 117 117 GLN N N 15 118.181 . . 1 . . . . 123 Q N . 15901 1 450 . 1 1 118 118 LEU H H 1 7.895 . . 1 . . . . 124 L H . 15901 1 451 . 1 1 118 118 LEU CA C 13 58.222 . . 1 . . . . 124 L CA . 15901 1 452 . 1 1 118 118 LEU CB C 13 42.38 . . 1 . . . . 124 L CB . 15901 1 453 . 1 1 118 118 LEU N N 15 121.547 . . 1 . . . . 124 L N . 15901 1 454 . 1 1 119 119 LEU H H 1 7.767 . . 1 . . . . 125 L H . 15901 1 455 . 1 1 119 119 LEU CA C 13 58.367 . . 1 . . . . 125 L CA . 15901 1 456 . 1 1 119 119 LEU CB C 13 41.044 . . 1 . . . . 125 L CB . 15901 1 457 . 1 1 119 119 LEU N N 15 120.358 . . 1 . . . . 125 L N . 15901 1 458 . 1 1 120 120 ARG H H 1 8.954 . . 1 . . . . 126 R H . 15901 1 459 . 1 1 120 120 ARG CA C 13 60.089 . . 1 . . . . 126 R CA . 15901 1 460 . 1 1 120 120 ARG CB C 13 29.102 . . 1 . . . . 126 R CB . 15901 1 461 . 1 1 120 120 ARG N N 15 119.963 . . 1 . . . . 126 R N . 15901 1 462 . 1 1 121 121 LYS H H 1 8.206 . . 1 . . . . 127 K H . 15901 1 463 . 1 1 121 121 LYS CA C 13 59.708 . . 1 . . . . 127 K CA . 15901 1 464 . 1 1 121 121 LYS CB C 13 32.112 . . 1 . . . . 127 K CB . 15901 1 465 . 1 1 121 121 LYS N N 15 122.197 . . 1 . . . . 127 K N . 15901 1 466 . 1 1 122 122 ALA H H 1 7.405 . . 1 . . . . 128 A H . 15901 1 467 . 1 1 122 122 ALA CA C 13 55.071 . . 1 . . . . 128 A CA . 15901 1 468 . 1 1 122 122 ALA CB C 13 17.827 . . 1 . . . . 128 A CB . 15901 1 469 . 1 1 122 122 ALA N N 15 122.913 . . 1 . . . . 128 A N . 15901 1 470 . 1 1 123 123 GLU H H 1 8.355 . . 1 . . . . 129 E H . 15901 1 471 . 1 1 123 123 GLU CA C 13 59.112 . . 1 . . . . 129 E CA . 15901 1 472 . 1 1 123 123 GLU CB C 13 30.983 . . 1 . . . . 129 E CB . 15901 1 473 . 1 1 123 123 GLU N N 15 120.946 . . 1 . . . . 129 E N . 15901 1 474 . 1 1 124 124 ALA H H 1 8.017 . . 1 . . . . 130 A H . 15901 1 475 . 1 1 124 124 ALA CA C 13 54.884 . . 1 . . . . 130 A CA . 15901 1 476 . 1 1 124 124 ALA CB C 13 17.763 . . 1 . . . . 130 A CB . 15901 1 477 . 1 1 124 124 ALA N N 15 119.733 . . 1 . . . . 130 A N . 15901 1 478 . 1 1 125 125 GLN H H 1 7.534 . . 1 . . . . 131 Q H . 15901 1 479 . 1 1 125 125 GLN CA C 13 58.688 . . 1 . . . . 131 Q CA . 15901 1 480 . 1 1 125 125 GLN CB C 13 28.179 . . 1 . . . . 131 Q CB . 15901 1 481 . 1 1 125 125 GLN N N 15 118.466 . . 1 . . . . 131 Q N . 15901 1 482 . 1 1 126 126 ALA H H 1 7.996 . . 1 . . . . 132 A H . 15901 1 483 . 1 1 126 126 ALA CA C 13 55.759 . . 1 . . . . 132 A CA . 15901 1 484 . 1 1 126 126 ALA CB C 13 18.674 . . 1 . . . . 132 A CB . 15901 1 485 . 1 1 126 126 ALA N N 15 123.161 . . 1 . . . . 132 A N . 15901 1 486 . 1 1 127 127 LYS H H 1 8.228 . . 1 . . . . 133 K H . 15901 1 487 . 1 1 127 127 LYS CA C 13 59.596 . . 1 . . . . 133 K CA . 15901 1 488 . 1 1 127 127 LYS CB C 13 32.511 . . 1 . . . . 133 K CB . 15901 1 489 . 1 1 127 127 LYS N N 15 117.249 . . 1 . . . . 133 K N . 15901 1 490 . 1 1 128 128 LYS H H 1 7.79 . . 1 . . . . 134 K H . 15901 1 491 . 1 1 128 128 LYS CA C 13 59.32 . . 1 . . . . 134 K CA . 15901 1 492 . 1 1 128 128 LYS CB C 13 32.282 . . 1 . . . . 134 K CB . 15901 1 493 . 1 1 128 128 LYS N N 15 122.406 . . 1 . . . . 134 K N . 15901 1 494 . 1 1 129 129 GLU H H 1 7.621 . . 1 . . . . 135 E H . 15901 1 495 . 1 1 129 129 GLU CA C 13 56.451 . . 1 . . . . 135 E CA . 15901 1 496 . 1 1 129 129 GLU CB C 13 29.904 . . 1 . . . . 135 E CB . 15901 1 497 . 1 1 129 129 GLU N N 15 116.201 . . 1 . . . . 135 E N . 15901 1 498 . 1 1 130 130 LYS H H 1 7.845 . . 1 . . . . 136 K H . 15901 1 499 . 1 1 130 130 LYS CA C 13 56.775 . . 1 . . . . 136 K CA . 15901 1 500 . 1 1 130 130 LYS CB C 13 29.299 . . 1 . . . . 136 K CB . 15901 1 501 . 1 1 130 130 LYS N N 15 116.977 . . 1 . . . . 136 K N . 15901 1 502 . 1 1 131 131 LEU H H 1 7.648 . . 1 . . . . 137 L H . 15901 1 503 . 1 1 131 131 LEU CA C 13 54.991 . . 1 . . . . 137 L CA . 15901 1 504 . 1 1 131 131 LEU CB C 13 44.178 . . 1 . . . . 137 L CB . 15901 1 505 . 1 1 131 131 LEU N N 15 117.224 . . 1 . . . . 137 L N . 15901 1 506 . 1 1 132 132 ASN H H 1 9.09 . . 1 . . . . 138 N H . 15901 1 507 . 1 1 132 132 ASN CA C 13 56.252 . . 1 . . . . 138 N CA . 15901 1 508 . 1 1 132 132 ASN CB C 13 38.637 . . 1 . . . . 138 N CB . 15901 1 509 . 1 1 132 132 ASN N N 15 119.021 . . 1 . . . . 138 N N . 15901 1 510 . 1 1 133 133 ILE H H 1 8.356 . . 1 . . . . 139 I H . 15901 1 511 . 1 1 133 133 ILE CA C 13 65.647 . . 1 . . . . 139 I CA . 15901 1 512 . 1 1 133 133 ILE CB C 13 37.428 . . 1 . . . . 139 I CB . 15901 1 513 . 1 1 133 133 ILE N N 15 124.645 . . 1 . . . . 139 I N . 15901 1 514 . 1 1 134 134 TRP H H 1 7.785 . . 1 . . . . 140 W H . 15901 1 515 . 1 1 134 134 TRP HE1 H 1 11.534 . . . . . . . 140 W HE1 . 15901 1 516 . 1 1 134 134 TRP CA C 13 55.046 . . 1 . . . . 140 W CA . 15901 1 517 . 1 1 134 134 TRP CB C 13 29.962 . . 1 . . . . 140 W CB . 15901 1 518 . 1 1 134 134 TRP N N 15 119.57 . . 1 . . . . 140 W N . 15901 1 519 . 1 1 134 134 TRP NE1 N 15 130.866 . . . . . . . 140 W NE1 . 15901 1 520 . 1 1 135 135 SER H H 1 8.149 . . 1 . . . . 141 S H . 15901 1 521 . 1 1 135 135 SER CA C 13 59.774 . . 1 . . . . 141 S CA . 15901 1 522 . 1 1 135 135 SER CB C 13 64.484 . . 1 . . . . 141 S CB . 15901 1 523 . 1 1 135 135 SER N N 15 116.232 . . 1 . . . . 141 S N . 15901 1 524 . 1 1 136 136 GLU H H 1 7.868 . . 1 . . . . 142 E H . 15901 1 525 . 1 1 136 136 GLU CA C 13 56.016 . . 1 . . . . 142 E CA . 15901 1 526 . 1 1 136 136 GLU CB C 13 29.886 . . 1 . . . . 142 E CB . 15901 1 527 . 1 1 136 136 GLU N N 15 121.131 . . 1 . . . . 142 E N . 15901 1 528 . 1 1 137 137 ASP H H 1 8.411 . . 1 . . . . 143 D H . 15901 1 529 . 1 1 137 137 ASP CA C 13 54.462 . . 1 . . . . 143 D CA . 15901 1 530 . 1 1 137 137 ASP CB C 13 40.567 . . 1 . . . . 143 D CB . 15901 1 531 . 1 1 137 137 ASP N N 15 121.095 . . 1 . . . . 143 D N . 15901 1 532 . 1 1 138 138 ASN H H 1 8.437 . . 1 . . . . 144 N H . 15901 1 533 . 1 1 138 138 ASN CA C 13 53.256 . . 1 . . . . 144 N CA . 15901 1 534 . 1 1 138 138 ASN CB C 13 39.044 . . 1 . . . . 144 N CB . 15901 1 535 . 1 1 138 138 ASN N N 15 119.424 . . 1 . . . . 144 N N . 15901 1 536 . 1 1 139 139 ALA H H 1 8.259 . . 1 . . . . 145 A H . 15901 1 537 . 1 1 139 139 ALA CA C 13 53.209 . . 1 . . . . 145 A CA . 15901 1 538 . 1 1 139 139 ALA CB C 13 19.248 . . 1 . . . . 145 A CB . 15901 1 539 . 1 1 139 139 ALA N N 15 123.924 . . 1 . . . . 145 A N . 15901 1 540 . 1 1 140 140 ASP H H 1 8.355 . . 1 . . . . 146 D H . 15901 1 541 . 1 1 140 140 ASP CA C 13 54.098 . . 1 . . . . 146 D CA . 15901 1 542 . 1 1 140 140 ASP CB C 13 40.575 . . 1 . . . . 146 D CB . 15901 1 543 . 1 1 140 140 ASP N N 15 118.603 . . 1 . . . . 146 D N . 15901 1 544 . 1 1 141 141 SER H H 1 8.225 . . 1 . . . . 147 S H . 15901 1 545 . 1 1 141 141 SER CA C 13 58.859 . . 1 . . . . 147 S CA . 15901 1 546 . 1 1 141 141 SER CB C 13 63.939 . . 1 . . . . 147 S CB . 15901 1 547 . 1 1 141 141 SER N N 15 116.152 . . 1 . . . . 147 S N . 15901 1 548 . 1 1 142 142 GLY H H 1 8.476 . . 1 . . . . 148 G H . 15901 1 549 . 1 1 142 142 GLY CA C 13 45.552 . . 1 . . . . 148 G CA . 15901 1 550 . 1 1 142 142 GLY N N 15 111.17 . . 1 . . . . 148 G N . 15901 1 551 . 1 1 143 143 GLN H H 1 7.876 . . 1 . . . . 149 Q H . 15901 1 552 . 1 1 143 143 GLN CA C 13 57.151 . . 1 . . . . 149 Q CA . 15901 1 553 . 1 1 143 143 GLN CB C 13 30.326 . . 1 . . . . 149 Q CB . 15901 1 554 . 1 1 143 143 GLN N N 15 124.375 . . 1 . . . . 149 Q N . 15901 1 stop_ save_