data_497 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 497 _Entry.Title ; Two-Dimensional NMR Studies of Staphylococcal Nuclease. 2. Sequence-Specific Assignments of Carbon-13 and Nitrogen-15 Signals from the Nuclease H124L-Thymidine 3',5'-Bisphosphate-Ca2+ Ternary Complex ; _Entry.Type macromolecule _Entry.Version_type update _Entry.Submission_date 1995-07-31 _Entry.Accession_date 1996-03-25 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Jinfeng Wang . . . 497 2 Andrew Hinck . P. . 497 3 Stewart Loh . N. . 497 4 John Markley . L. . 497 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 497 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 163 497 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 4 . . 2010-06-11 . revision BMRB 'Complete natural source information' 497 3 . . 1999-06-14 . revision BMRB 'Converted to BMRB NMR-STAR V 2.1 format' 497 2 . . 1996-03-25 . reformat BMRB 'Converted to the BMRB 1996-03-01 STAR flat-file format' 497 1 . . 1995-07-31 . original BMRB 'Last release in original BMRB flat-file format' 497 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 497 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Wang, Jinfeng, Hinck, Andrew P., Loh, Stewart N., Markley, John L., "Two-Dimensional NMR Studies of Staphylococcal Nuclease. 2. Sequence-Specific Assignments of Carbon-13 and Nitrogen-15 Signals from the Nuclease H124L-Thymidine 3',5'-Bisphosphate-Ca2+ Ternary Complex," Biochemistry 29, 102-113 (1990). ; _Citation.Title ; Two-Dimensional NMR Studies of Staphylococcal Nuclease. 2. Sequence-Specific Assignments of Carbon-13 and Nitrogen-15 Signals from the Nuclease H124L-Thymidine 3',5'-Bisphosphate-Ca2+ Ternary Complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 29 _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 102 _Citation.Page_last 113 _Citation.Year 1990 _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 Jinfeng Wang . . . 497 1 2 Andrew Hinck . P. . 497 1 3 Stewart Loh . N. . 497 1 4 John Markley . L. . 497 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_micrococcal_nuclease _Assembly.Sf_category assembly _Assembly.Sf_framecode system_micrococcal_nuclease _Assembly.Entry_ID 497 _Assembly.ID 1 _Assembly.Name 'micrococcal nuclease' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _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 'micrococcal nuclease' 1 $micrococcal_nuclease . . . . . . . . . 497 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'micrococcal nuclease' system 497 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_micrococcal_nuclease _Entity.Sf_category entity _Entity.Sf_framecode micrococcal_nuclease _Entity.Entry_ID 497 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'micrococcal nuclease' _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 ; ATSTKKLHKEPATLIKAIDG DTVKLMYKGQPMTFRLLLVD TPETKHPKKGVEKYGPEASA FTKKMVENAKKIEVEFDKGQ RTDKYGRGLAYIYADGKMVN EALVRQGLAKVAYVYKPNNT HEQLLRKSEAQAKKEKLNIW SED ; _Entity.Polymer_seq_one_letter_code ; ATSTKKLHKEPATLIKAIDG DTVKLMYKGQPMTFRLLLVD TPETKHPKKGVEKYGPEASA FTKKMVENAKKIEVEFDKGQ RTDKYGRGLAYIYADGKMVN EALVRQGLAKVAYVYKPNNT HEQLLRKSEAQAKKEKLNIW SED ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 143 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 136 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 2 no BMRB 1581 . "micrococcal nuclease" . . . . . 96.50 156 97.83 99.28 1.82e-92 . . . . 497 1 3 no BMRB 1582 . "micrococcal nuclease" . . . . . 96.50 156 97.10 99.28 7.45e-92 . . . . 497 1 4 no BMRB 16585 . SNase140 . . . . . 97.90 140 100.00 100.00 2.49e-96 . . . . 497 1 5 no BMRB 1704 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 6 no BMRB 17718 . Staphylococcal_nuclease . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 7 no BMRB 18013 . SNase_PHS . . . . . 100.00 149 98.60 99.30 9.05e-97 . . . . 497 1 8 no BMRB 1874 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 9 no BMRB 1875 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 10 no BMRB 1876 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 11 no BMRB 1877 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 12 no BMRB 1878 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 13 no BMRB 18788 . staph_nuc_E43S . . . . . 100.00 149 99.30 99.30 4.44e-98 . . . . 497 1 14 no BMRB 188 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 15 no BMRB 189 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 16 no BMRB 2784 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 17 no BMRB 2785 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 18 no BMRB 4010 . SNOB . . . . . 72.03 103 98.06 99.03 3.27e-65 . . . . 497 1 19 no BMRB 4052 . staph-nucl-H124L . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 20 no BMRB 4053 . staph-nucl-H124L . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 21 no BMRB 4905 . Snase . . . . . 76.92 110 99.09 99.09 7.14e-71 . . . . 497 1 22 no BMRB 494 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 23 no BMRB 495 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 24 no BMRB 496 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 25 no BMRB 530 . "micrococcal nuclease" . . . . . 100.00 143 100.00 100.00 1.10e-98 . . . . 497 1 26 no BMRB 5536 . G88W110_Snase . . . . . 76.92 110 99.09 99.09 7.14e-71 . . . . 497 1 27 no BMRB 6250 . G88W121 . . . . . 84.62 121 99.17 99.17 3.37e-80 . . . . 497 1 28 no BMRB 6251 . V66W121 . . . . . 84.62 121 99.17 99.17 2.45e-80 . . . . 497 1 29 no BMRB 644 . "micrococcal nuclease" . . . . . 100.00 156 97.90 99.30 5.17e-96 . . . . 497 1 30 no BMRB 6907 . V66W110_fragment_of_staphylococcal_nuclease . . . . . 76.92 110 99.09 99.09 5.15e-71 . . . . 497 1 31 no BMRB 6908 . SNase110_fragment_of_Staphylococcal_Nuclease . . . . . 76.92 110 100.00 100.00 2.62e-72 . . . . 497 1 32 no PDB 1A2T . "Staphylococcal Nuclease, B-Mercaptoethanol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 33 no PDB 1A2U . "Staphylococcal Nuclease, V23c Variant, Complex With 1-N- Butane Thiol And 3',5'-Thymidine Diphosphate" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 34 no PDB 1A3T . "Staphylococcal Nuclease, V23c Variant, Complex With 2- Fluoroethane Thiol And 3',5'-Thymidine Diphosphate" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 35 no PDB 1A3U . "Staphylococcal Nuclease, Cyclohexane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 36 no PDB 1A3V . "Staphylococcal Nuclease, Cyclopentane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 37 no PDB 1AEX . "Staphylococcal Nuclease, Methane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 38 no PDB 1ENA . "Crystal Structures Of The Binary Ca2+ And Pdtp Complexes And The Ternary Complex Of The Asp 21->glu Mutant Of Staphylococcal Nu" . . . . . 94.41 135 98.52 99.26 4.10e-91 . . . . 497 1 39 no PDB 1ENC . "Crystal Structures Of The Binary Ca2+ And Pdtp Complexes And The Ternary Complex Of The Asp 21->glu Mutant Of Staphylococcal Nu" . . . . . 100.00 149 98.60 99.30 6.89e-97 . . . . 497 1 40 no PDB 1EY0 . "Structure Of Wild-Type S. Nuclease At 1.6 A Resolution" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 41 no PDB 1EY4 . "Structure Of S. Nuclease Stabilizing Mutant S59a" . . . . . 100.00 149 98.60 99.30 4.86e-97 . . . . 497 1 42 no PDB 1EY5 . "Structure Of S. Nuclease Stabilizing Mutant T33v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 43 no PDB 1EY6 . "Structure Of S. Nuclease Stabilizing Mutant T41i" . . . . . 100.00 149 98.60 98.60 1.03e-96 . . . . 497 1 44 no PDB 1EY7 . "Structure Of S. Nuclease Stabilizing Mutant S128a" . . . . . 100.00 149 98.60 99.30 4.86e-97 . . . . 497 1 45 no PDB 1EY8 . "Structure Of S. Nuclease Stabilizing Triple Mutant P117gH124LS128A" . . . . . 100.00 149 98.60 99.30 9.05e-97 . . . . 497 1 46 no PDB 1EY9 . "Structure Of S. Nuclease Stabilizing Quadruple Mutant T41iP117GH124LS128A" . . . . . 100.00 149 97.90 98.60 6.47e-96 . . . . 497 1 47 no PDB 1EYA . "Structure Of S. Nuclease Stabilizing Quintuple Mutant T33vT41IP117GH124LS128A" . . . . . 100.00 149 97.20 97.90 2.98e-95 . . . . 497 1 48 no PDB 1EYC . "Structure Of S. Nuclease Stabilizing Quintuple Mutant T41iS59AP117GH124LS128A" . . . . . 100.00 149 97.20 98.60 1.42e-95 . . . . 497 1 49 no PDB 1EYD . "Structure Of Wild-Type S. Nuclease At 1.7 A Resolution" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 50 no PDB 1EZ8 . "Structure Of S. Nuclease Stabilizing Mutant T33v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 51 no PDB 1F2M . "Simplification Of A Protein Loop In Staphylococcal Nuclease" . . . . . 100.00 149 97.90 97.90 3.51e-96 . . . . 497 1 52 no PDB 1F2Y . "Simplification Of A Protein Loop In Staphylococcal Nuclease" . . . . . 100.00 149 97.90 97.90 1.23e-95 . . . . 497 1 53 no PDB 1F2Z . "Simplification Of A Protein Loop In Staphylococcal Nuclease" . . . . . 100.00 149 97.90 97.90 1.23e-95 . . . . 497 1 54 no PDB 1JOK . "Averaged Structure For Staphylococcal Nuclease-H124l In Ternary Complex With Ca2+ And Thymidine-3',5'-Bisphosphate" . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 55 no PDB 1JOO . "Averaged Structure For Unligated Staphylococcal Nuclease- H124l" . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 56 no PDB 1JOQ . "Ensemble Structures For Staphylococcal Nuclease-H124l In Ternary Complex With Ca2+ And Thymidine-3',5'-Bisphosphate" . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 57 no PDB 1JOR . "Ensemble Structures For Unligated Staphylococcal Nuclease- H124l" . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 58 no PDB 1KAA . "Stress And Strain In Staphylococcal Nuclease" . . . . . 95.10 136 98.53 98.53 1.21e-91 . . . . 497 1 59 no PDB 1KAB . "Stress And Strain In Staphylococcal Nuclease" . . . . . 95.10 136 98.53 98.53 2.54e-91 . . . . 497 1 60 no PDB 1KDA . "Stabilization Of A Strained Protein Loop Conformation Through Protein Engineering" . . . . . 100.00 149 97.90 98.60 4.36e-96 . . . . 497 1 61 no PDB 1KDB . "Stabilization Of A Strained Protein Loop Conformation Through Protein Engineering" . . . . . 100.00 149 97.90 99.30 2.95e-96 . . . . 497 1 62 no PDB 1KDC . "Stabilization Of A Strained Protein Loop Conformation Through Protein Engineering" . . . . . 100.00 149 97.90 98.60 3.29e-96 . . . . 497 1 63 no PDB 1NSN . "The Crystal Structure Of Antibody N10-Staphylococcal Nuclease Complex At 2.9 Angstroms Resolution" . . . . . 100.00 149 98.60 99.30 7.85e-97 . . . . 497 1 64 no PDB 1NUC . "Staphylococcal Nuclease, V23c Variant" . . . . . 100.00 149 98.60 98.60 4.45e-97 . . . . 497 1 65 no PDB 1RKN . "Solution Structure Of 1-110 Fragment Of Staphylococcal Nuclease With G88w Mutation" . . . . . 76.92 110 99.09 99.09 7.14e-71 . . . . 497 1 66 no PDB 1SNC . "The Crystal Structure Of The Ternary Complex Of Staphylococcal Nuclease, Ca2+, And The Inhibitor PdTp, Refined At 1.65 Angstrom" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 67 no PDB 1SNM . "Active Site Mutant Glu-43 (Right Arrow) Asp In Staphylococcal Nuclease Displays Nonlocal Structural Changes" . . . . . 100.00 149 98.60 99.30 5.42e-97 . . . . 497 1 68 no PDB 1SNO . "Protein Stability In Staphylococcal Nuclease" . . . . . 100.00 149 100.00 100.00 1.02e-98 . . . . 497 1 69 no PDB 1SNP . "Protein Stability In Staphylococcal Nuclease" . . . . . 100.00 149 99.30 99.30 2.88e-97 . . . . 497 1 70 no PDB 1SNQ . "Protein Stability In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 3.66e-96 . . . . 497 1 71 no PDB 1STA . "Accommodation Of Insertion Mutations On The Surface And In The Interior Of Staphylococcal Nuclease" . . . . . 101.40 151 97.93 97.93 2.30e-95 . . . . 497 1 72 no PDB 1STB . "Accommodation Of Insertion Mutations On The Surface And In The Interior Of Staphylococcal Nuclease" . . . . . 100.70 150 98.61 98.61 1.21e-95 . . . . 497 1 73 no PDB 1STG . "Two Distinctly Different Metal Binding Modes Are Seen In X- Ray Crystal Structures Of Staphylococcal Nuclease- Cobalt(Ii)-Nucle" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 74 no PDB 1STH . "Two Distinctly Different Metal Binding Modes Are Seen In X- Ray Crystal Structures Of Staphylococcal Nuclease- Cobalt(Ii)-Nucle" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 75 no PDB 1STN . "The Crystal Structure Of Staphylococcal Nuclease Refined At 1.7 Angstroms Resolution" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 76 no PDB 1STY . "The Alpha Aneurism: A Structural Motif Revealed In An Insertion Mutant Of Staphylococcal Nuclease" . . . . . 100.70 150 98.61 98.61 1.32e-95 . . . . 497 1 77 no PDB 1SYC . "Engineering Alternative Beta-Turn Types In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 3.75e-96 . . . . 497 1 78 no PDB 1SYD . "Engineering Alternative Beta-Turn Types In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 3.75e-96 . . . . 497 1 79 no PDB 1SYE . "Engineering Alternative Beta-Turn Types In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 2.05e-96 . . . . 497 1 80 no PDB 1SYF . "Engineering Alternative Beta-Turn Types In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 2.05e-96 . . . . 497 1 81 no PDB 1SYG . "Engineering Alternative Beta-Turn Types In Staphylococcal Nuclease" . . . . . 100.00 149 98.60 98.60 1.69e-96 . . . . 497 1 82 no PDB 1U9R . "Crystal Structure Of Staphylococcal Nuclease Mutant V66eP117GH124LS128A AT ROOM TEMPERATURE" . . . . . 100.00 149 97.90 98.60 9.48e-96 . . . . 497 1 83 no PDB 2ENB . "Crystal Structures Of The Binary Ca2+ And Pdtp Complexes And The Ternary Complex Of The Asp 21->glu Mutant Of Staphylococcal Nu" . . . . . 94.41 135 98.52 99.26 4.10e-91 . . . . 497 1 84 no PDB 2EXZ . "Crystal Structure Of Staphylococcal Nuclease Mutant T22c" . . . . . 100.00 149 98.60 98.60 5.07e-97 . . . . 497 1 85 no PDB 2EY1 . "Crystal Structure Of Staphylococcal Nuclease Mutant T22v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 86 no PDB 2EY2 . "Crystal Structure Of Staphylococcal Nuclease Mutant T41c" . . . . . 100.00 149 98.60 98.60 5.07e-97 . . . . 497 1 87 no PDB 2EY5 . "Crystal Structure Of Staphylococcal Nuclease Mutant T41s" . . . . . 100.00 149 98.60 99.30 3.70e-97 . . . . 497 1 88 no PDB 2EY6 . "Crystal Structure Of Staphylococcal Nuclease Mutant T41v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 89 no PDB 2EYF . "Crystal Structure Of Staphylococcal Nuclease Mutant T44v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 90 no PDB 2EYH . "Crystal Structure Of Staphylococcal Nuclease Mutant T62s" . . . . . 100.00 149 98.60 99.30 3.70e-97 . . . . 497 1 91 no PDB 2EYJ . "Crystal Structure Of Staphylococcal Nuclease Mutant T62v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 92 no PDB 2EYL . "Crystal Structure Of Staphylococcal Nuclease Mutant T82s" . . . . . 100.00 149 98.60 99.30 3.70e-97 . . . . 497 1 93 no PDB 2EYM . "Crystal Structure Of Staphylococcal Nuclease Mutant T120c" . . . . . 100.00 149 98.60 98.60 5.07e-97 . . . . 497 1 94 no PDB 2EYO . "Crystal Structure Of Staphylococcal Nuclease Mutant T120s" . . . . . 100.00 149 98.60 99.30 3.70e-97 . . . . 497 1 95 no PDB 2EYP . "Crystal Structure Of Staphylococcal Nuclease Mutant T120v" . . . . . 100.00 149 98.60 98.60 7.04e-97 . . . . 497 1 96 no PDB 2F0D . "Crystal Structure Of Staphylococcal Nuclease Mutant I92v" . . . . . 100.00 149 98.60 99.30 2.47e-97 . . . . 497 1 97 no PDB 2F0E . "Crystal Structure Of Staphylococcal Nuclease Mutant V23l" . . . . . 100.00 149 98.60 99.30 5.24e-97 . . . . 497 1 98 no PDB 2F0F . "Crystal Structure Of Staphylococcal Nuclease Mutant L25i" . . . . . 100.00 149 98.60 99.30 2.91e-97 . . . . 497 1 99 no PDB 2F0G . "Crystal Structure Of Staphylococcal Nuclease Mutant V66i" . . . . . 100.00 149 98.60 99.30 2.19e-97 . . . . 497 1 100 no PDB 2F0H . "Crystal Structure Of Staphylococcal Nuclease Mutant V66l" . . . . . 100.00 149 98.60 99.30 5.24e-97 . . . . 497 1 101 no PDB 2F0I . "Crystal Structure Of Staphylococcal Nuclease Mutant I72l" . . . . . 100.00 149 98.60 99.30 3.78e-97 . . . . 497 1 102 no PDB 2F0J . "Crystal Structure Of Staphylococcal Nuclease Mutant I72v" . . . . . 100.00 149 98.60 99.30 2.47e-97 . . . . 497 1 103 no PDB 2F0K . "Crystal Structure Of Staphylococcal Nuclease Mutant V23iL25I" . . . . . 100.00 149 97.90 99.30 5.13e-97 . . . . 497 1 104 no PDB 2F0L . "Crystal Structure Of Staphylococcal Nuclease Mutant V23lI72L" . . . . . 100.00 149 97.90 99.30 1.42e-96 . . . . 497 1 105 no PDB 2F0M . "Crystal Structure Of Staphylococcal Nuclease Mutant V23lI72V" . . . . . 100.00 149 97.90 99.30 8.03e-97 . . . . 497 1 106 no PDB 2F0N . "Crystal Structure Of Staphylococcal Nuclease Mutant L25iI72L" . . . . . 100.00 149 97.90 99.30 9.05e-97 . . . . 497 1 107 no PDB 2F0O . "Crystal Structure Of Staphylococcal Nuclease Mutant V66iI72V" . . . . . 100.00 149 97.90 99.30 4.03e-97 . . . . 497 1 108 no PDB 2F0P . "Crystal Structure Of Staphylococcal Nuclease Mutant V66iV99I" . . . . . 100.00 149 97.90 99.30 3.62e-97 . . . . 497 1 109 no PDB 2F0Q . "Crystal Structure Of Staphylococcal Nuclease Mutant V66lI92L" . . . . . 100.00 149 97.90 99.30 1.42e-96 . . . . 497 1 110 no PDB 2F0S . "Crystal Structure Of Staphylococcal Nuclease Mutant V66lI92V" . . . . . 100.00 149 97.90 99.30 8.03e-97 . . . . 497 1 111 no PDB 2F0T . "Crystal Structure Of Staphylococcal Nuclease Mutant V66lV99I" . . . . . 100.00 149 97.90 99.30 7.94e-97 . . . . 497 1 112 no PDB 2F0U . "Crystal Structure Of Staphylococcal Nuclease Mutant V23iL25II72V" . . . . . 100.00 149 97.20 99.30 8.12e-97 . . . . 497 1 113 no PDB 2F0V . "Crystal Structure Of Staphylococcal Nuclease Mutant V23lV66LI72L" . . . . . 100.00 149 97.20 99.30 4.22e-96 . . . . 497 1 114 no PDB 2F3V . "Solution Structure Of 1-110 Fragment Of Staphylococcal Nuclease With V66w Mutation" . . . . . 76.92 110 99.09 99.09 5.15e-71 . . . . 497 1 115 no PDB 2F3W . "Solution Structure Of 1-110 Fragment Of Staphylococcal Nuclease In 2m Tmao" . . . . . 76.92 110 100.00 100.00 2.62e-72 . . . . 497 1 116 no PDB 2KHS . "Solution Structure Of Snase121:snase(111-143) Complex" . . . . . 84.62 121 100.00 100.00 1.02e-81 . . . . 497 1 117 no PDB 2KQ3 . "Solution Structure Of Snase140" . . . . . 97.90 140 100.00 100.00 2.49e-96 . . . . 497 1 118 no PDB 2LKV . "Staphylococcal Nuclease Phs Variant" . . . . . 100.00 149 98.60 99.30 9.05e-97 . . . . 497 1 119 no PDB 2M00 . "Solution Structure Of Staphylococcal Nuclease E43s Mutant In The Presence Of Ssdna And Cd2+" . . . . . 100.00 149 99.30 99.30 4.44e-98 . . . . 497 1 120 no PDB 2NUC . "Staphlococcal Nuclease, Ethane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 121 no PDB 2OXP . "Crystal Structure Of Staphylococcal Nuclease Mutant V66dP117GH124LS128A" . . . . . 100.00 149 97.90 98.60 1.10e-95 . . . . 497 1 122 no PDB 2PW5 . "Crystal Structure Of Staphylococcal Nuclease Variant V66yP117GH124LS128A AT ROOM TEMPERATURE" . . . . . 100.00 149 97.90 98.60 8.05e-96 . . . . 497 1 123 no PDB 2PW7 . "Crystal Structure Of Staphylococcal Nuclease Variant V66yP117GH124LS128A AT 100K" . . . . . 100.00 149 97.90 98.60 8.05e-96 . . . . 497 1 124 no PDB 2PYK . "Crystal Structure Of Staphylococcal Nuclease Variant V66qP117GH124LS128A AT ROOM TEMPERATURE" . . . . . 100.00 149 97.90 98.60 7.96e-96 . . . . 497 1 125 no PDB 2PZT . "Crystal Structure Of Staphylococcal Nuclease Variant V66qP117GH124LS128A AT 100 K" . . . . . 100.00 149 97.90 98.60 7.96e-96 . . . . 497 1 126 no PDB 2PZU . "Crystal Structure Of Staphylococcal Nuclease Variant V66nP117GH124LS128A AT CRYOGENIC TEMPERATURE" . . . . . 100.00 149 97.90 98.60 9.17e-96 . . . . 497 1 127 no PDB 2PZW . "Crystal Structure Of Staphylococcal Nuclease Variant V66nP117GH124LS128A AT ROOM TEMPERATURE" . . . . . 100.00 149 97.90 98.60 9.17e-96 . . . . 497 1 128 no PDB 2RKS . "Crystal Structure Of Staphylococcal Nuclease Variant Phs L38k At Cryogenic Temperature" . . . . . 100.00 149 97.90 98.60 1.19e-95 . . . . 497 1 129 no PDB 2SNM . "In A Staphylococcal Nuclease Mutant The Side-chain Of A Lysine Replacing Valine 66 Is Fully Buried In The Hydrophobic Core" . . . . . 100.00 149 98.60 98.60 1.88e-96 . . . . 497 1 130 no PDB 2SNS . "Staphylococcal Nuclease. Proposed Mechanism Of Action Based On Structure Of Enzyme-Thymidine 3(Prime),5(Prime)-Biphosphate-Calc" . . . . . 100.00 149 97.90 99.30 3.66e-96 . . . . 497 1 131 no PDB 2SOB . "Sn-Ob, Ob-Fold Sub-Domain Of Staphylococcal Nuclease, Nmr, 10 Structures" . . . . . 72.03 103 98.06 99.03 3.27e-65 . . . . 497 1 132 no PDB 3D6C . "Crystal Structure Of Staphylococcal Nuclease Variant Phs L38e At Cryogenic Temperature" . . . . . 100.00 149 97.90 98.60 1.21e-95 . . . . 497 1 133 no PDB 3DMU . "Crystal Structure Of Staphylococcal Nuclease Variant Phs T62k At Cryogenic Temperature" . . . . . 100.00 149 97.90 98.60 8.50e-96 . . . . 497 1 134 no PDB 3NUC . "Staphlococcal Nuclease, 1-N-Propane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 135 no PDB 4G57 . "Staphylococcal Nuclease Double Mutant I72l, I92l" . . . . . 94.41 135 97.78 99.26 6.56e-91 . . . . 497 1 136 no PDB 4H7B . "Crystal Structure Of Staphylococcal Nuclease Mutant I72vV99L" . . . . . 100.00 149 97.90 99.30 8.03e-97 . . . . 497 1 137 no PDB 4ID6 . "Crystal Structure Of Staphylococcal Nuclease Mutant V23i/i72l" . . . . . 100.00 149 97.90 99.30 6.89e-97 . . . . 497 1 138 no PDB 4K14 . "Crystal Structure Of Staphylococcal Nuclease Mutant V66i/v99l" . . . . . 95.10 136 97.79 99.26 1.30e-91 . . . . 497 1 139 no PDB 4K5W . "Crystal Structure Of Staphylococcal Nuclease Variant V23m/l25f/t62f At Cryogenic Temperature" . . . . . 100.00 149 97.20 97.90 1.83e-95 . . . . 497 1 140 no PDB 4K5X . "Crystal Structure Of Staphylococcal Nuclease Variant V23m/l36f At Cryogenic Temperature" . . . . . 100.00 149 97.90 98.60 1.65e-96 . . . . 497 1 141 no PDB 4K6D . "Crystal Structure Of Staphylococcal Nuclease Variant V23m/t62f At Cryogenic Temperature" . . . . . 100.00 149 97.90 98.60 6.06e-96 . . . . 497 1 142 no PDB 4K8I . "Crystal Structure Of Staphylococcal Nuclease Mutant I92v/v99l" . . . . . 94.41 135 97.78 99.26 5.10e-91 . . . . 497 1 143 no PDB 4K8J . "Crystal Structure Of Staphylococcal Nuclease Mutant V23l/v66i" . . . . . 94.41 135 97.78 99.26 4.67e-91 . . . . 497 1 144 no PDB 4QB4 . "Crystal Structure Of Staphylococcal Nuclease Mutant V23l/l25v/v66l" . . . . . 95.10 136 97.06 99.26 8.16e-91 . . . . 497 1 145 no PDB 4QF4 . "Crystal Structure Of Staphylococcal Nuclease Variant V23m At Cryogenic Temperature" . . . . . 100.00 149 97.20 97.90 6.84e-95 . . . . 497 1 146 no PDB 4WOR . "Staphylococcal Nuclease In Complex With Ca2+ And Thymidine-3'-5'- Diphosphate (pdtp) At Room Temperature" . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 147 no PDB 5NUC . "Staphylococcal Nuclease, 1-N-Pentane Thiol Disulfide To V23c Variant" . . . . . 100.00 149 98.60 98.60 8.57e-97 . . . . 497 1 148 no DBJ BAB41979 . "staphylococcal nuclease [Staphylococcus aureus subsp. aureus N315]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 149 no DBJ BAB56977 . "staphylococcal nuclease [Staphylococcus aureus subsp. aureus Mu50]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 150 no DBJ BAB94634 . "staphylococcal nuclease [Staphylococcus aureus subsp. aureus MW2]" . . . . . 100.00 228 100.00 100.00 3.21e-99 . . . . 497 1 151 no DBJ BAF67032 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus str. Newman]" . . . . . 100.00 228 100.00 100.00 3.04e-99 . . . . 497 1 152 no DBJ BAF77694 . "staphylococcal nuclease [Staphylococcus aureus subsp. aureus Mu3]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 153 no EMBL CAA24594 . "nuclease [Staphylococcus aureus]" . . . . . 100.00 231 99.30 99.30 5.97e-98 . . . . 497 1 154 no EMBL CAG39855 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus MRSA252]" . . . . . 100.00 228 100.00 100.00 2.36e-99 . . . . 497 1 155 no EMBL CAG42530 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus MSSA476]" . . . . . 100.00 228 100.00 100.00 3.21e-99 . . . . 497 1 156 no EMBL CAI80436 . "staphylococcal thermonuclease precursor [Staphylococcus aureus RF122]" . . . . . 100.00 228 99.30 100.00 1.61e-98 . . . . 497 1 157 no EMBL CAQ49298 . "thermonuclease (TNase) (Micrococcal nuclease)(Staphylococcal nuclease) [Staphylococcus aureus subsp. aureus ST398]" . . . . . 100.00 228 100.00 100.00 2.34e-99 . . . . 497 1 158 no GB AAC14660 . "deltaSP-Nuc [Cloning vector pFUN]" . . . . . 100.00 155 99.30 99.30 1.97e-97 . . . . 497 1 159 no GB AAW36415 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus COL]" . . . . . 100.00 228 100.00 100.00 3.04e-99 . . . . 497 1 160 no GB ABD22328 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus USA300_FPR3757]" . . . . . 100.00 228 100.00 100.00 3.04e-99 . . . . 497 1 161 no GB ABD29945 . "thermonuclease precursor [Staphylococcus aureus subsp. aureus NCTC 8325]" . . . . . 100.00 228 100.00 100.00 3.04e-99 . . . . 497 1 162 no GB ABE02272 . "nuclease [Staphylococcus aureus]" . . . . . 100.00 227 99.30 99.30 1.43e-98 . . . . 497 1 163 no PRF 1109959A . nuclease,staphylococcal . . . . . 100.00 242 99.30 99.30 6.92e-98 . . . . 497 1 164 no PRF 710414A . nuclease . . . . . 100.00 149 99.30 99.30 1.46e-97 . . . . 497 1 165 no REF NP_371339 . "nuclease [Staphylococcus aureus subsp. aureus Mu50]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 166 no REF NP_374001 . "nuclease [Staphylococcus aureus subsp. aureus N315]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 167 no REF NP_645586 . "nuclease [Staphylococcus aureus subsp. aureus MW2]" . . . . . 100.00 228 100.00 100.00 3.21e-99 . . . . 497 1 168 no REF WP_000141556 . "thermonuclease [Staphylococcus aureus]" . . . . . 100.00 228 100.00 100.00 3.42e-99 . . . . 497 1 169 no REF WP_000141557 . "thermonuclease [Staphylococcus aureus]" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 170 no SP P00644 . "RecName: Full=Thermonuclease; Short=TNase; AltName: Full=Micrococcal nuclease; AltName: Full=Staphylococcal nuclease; Contains:" . . . . . 100.00 231 99.30 99.30 5.97e-98 . . . . 497 1 171 no SP Q5HHM4 . "RecName: Full=Thermonuclease; Short=TNase; AltName: Full=Micrococcal nuclease; AltName: Full=Staphylococcal nuclease; Flags: Pr" . . . . . 100.00 228 100.00 100.00 3.04e-99 . . . . 497 1 172 no SP Q6GB41 . "RecName: Full=Thermonuclease; Short=TNase; AltName: Full=Micrococcal nuclease; AltName: Full=Staphylococcal nuclease; Flags: Pr" . . . . . 100.00 228 100.00 100.00 3.21e-99 . . . . 497 1 173 no SP Q6GIK1 . "RecName: Full=Thermonuclease; Short=TNase; AltName: Full=Micrococcal nuclease; AltName: Full=Staphylococcal nuclease; Flags: Pr" . . . . . 100.00 228 100.00 100.00 2.36e-99 . . . . 497 1 174 no SP Q7A6P2 . "RecName: Full=Thermonuclease; Short=TNase; AltName: Full=Micrococcal nuclease; AltName: Full=Staphylococcal nuclease; Flags: Pr" . . . . . 100.00 228 99.30 99.30 9.86e-99 . . . . 497 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID H124L variant 497 1 'micrococcal nuclease' common 497 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 . ALA . 497 1 2 . THR . 497 1 3 . SER . 497 1 4 . THR . 497 1 5 . LYS . 497 1 6 . LYS . 497 1 7 . LEU . 497 1 8 . HIS . 497 1 9 . LYS . 497 1 10 . GLU . 497 1 11 . PRO . 497 1 12 . ALA . 497 1 13 . THR . 497 1 14 . LEU . 497 1 15 . ILE . 497 1 16 . LYS . 497 1 17 . ALA . 497 1 18 . ILE . 497 1 19 . ASP . 497 1 20 . GLY . 497 1 21 . ASP . 497 1 22 . THR . 497 1 23 . VAL . 497 1 24 . LYS . 497 1 25 . LEU . 497 1 26 . MET . 497 1 27 . TYR . 497 1 28 . LYS . 497 1 29 . GLY . 497 1 30 . GLN . 497 1 31 . PRO . 497 1 32 . MET . 497 1 33 . THR . 497 1 34 . PHE . 497 1 35 . ARG . 497 1 36 . LEU . 497 1 37 . LEU . 497 1 38 . LEU . 497 1 39 . VAL . 497 1 40 . ASP . 497 1 41 . THR . 497 1 42 . PRO . 497 1 43 . GLU . 497 1 44 . THR . 497 1 45 . LYS . 497 1 46 . HIS . 497 1 47 . PRO . 497 1 48 . LYS . 497 1 49 . LYS . 497 1 50 . GLY . 497 1 51 . VAL . 497 1 52 . GLU . 497 1 53 . LYS . 497 1 54 . TYR . 497 1 55 . GLY . 497 1 56 . PRO . 497 1 57 . GLU . 497 1 58 . ALA . 497 1 59 . SER . 497 1 60 . ALA . 497 1 61 . PHE . 497 1 62 . THR . 497 1 63 . LYS . 497 1 64 . LYS . 497 1 65 . MET . 497 1 66 . VAL . 497 1 67 . GLU . 497 1 68 . ASN . 497 1 69 . ALA . 497 1 70 . LYS . 497 1 71 . LYS . 497 1 72 . ILE . 497 1 73 . GLU . 497 1 74 . VAL . 497 1 75 . GLU . 497 1 76 . PHE . 497 1 77 . ASP . 497 1 78 . LYS . 497 1 79 . GLY . 497 1 80 . GLN . 497 1 81 . ARG . 497 1 82 . THR . 497 1 83 . ASP . 497 1 84 . LYS . 497 1 85 . TYR . 497 1 86 . GLY . 497 1 87 . ARG . 497 1 88 . GLY . 497 1 89 . LEU . 497 1 90 . ALA . 497 1 91 . TYR . 497 1 92 . ILE . 497 1 93 . TYR . 497 1 94 . ALA . 497 1 95 . ASP . 497 1 96 . GLY . 497 1 97 . LYS . 497 1 98 . MET . 497 1 99 . VAL . 497 1 100 . ASN . 497 1 101 . GLU . 497 1 102 . ALA . 497 1 103 . LEU . 497 1 104 . VAL . 497 1 105 . ARG . 497 1 106 . GLN . 497 1 107 . GLY . 497 1 108 . LEU . 497 1 109 . ALA . 497 1 110 . LYS . 497 1 111 . VAL . 497 1 112 . ALA . 497 1 113 . TYR . 497 1 114 . VAL . 497 1 115 . TYR . 497 1 116 . LYS . 497 1 117 . PRO . 497 1 118 . ASN . 497 1 119 . ASN . 497 1 120 . THR . 497 1 121 . HIS . 497 1 122 . GLU . 497 1 123 . GLN . 497 1 124 . LEU . 497 1 125 . LEU . 497 1 126 . ARG . 497 1 127 . LYS . 497 1 128 . SER . 497 1 129 . GLU . 497 1 130 . ALA . 497 1 131 . GLN . 497 1 132 . ALA . 497 1 133 . LYS . 497 1 134 . LYS . 497 1 135 . GLU . 497 1 136 . LYS . 497 1 137 . LEU . 497 1 138 . ASN . 497 1 139 . ILE . 497 1 140 . TRP . 497 1 141 . SER . 497 1 142 . GLU . 497 1 143 . ASP . 497 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 1 497 1 . THR 2 2 497 1 . SER 3 3 497 1 . THR 4 4 497 1 . LYS 5 5 497 1 . LYS 6 6 497 1 . LEU 7 7 497 1 . HIS 8 8 497 1 . LYS 9 9 497 1 . GLU 10 10 497 1 . PRO 11 11 497 1 . ALA 12 12 497 1 . THR 13 13 497 1 . LEU 14 14 497 1 . ILE 15 15 497 1 . LYS 16 16 497 1 . ALA 17 17 497 1 . ILE 18 18 497 1 . ASP 19 19 497 1 . GLY 20 20 497 1 . ASP 21 21 497 1 . THR 22 22 497 1 . VAL 23 23 497 1 . LYS 24 24 497 1 . LEU 25 25 497 1 . MET 26 26 497 1 . TYR 27 27 497 1 . LYS 28 28 497 1 . GLY 29 29 497 1 . GLN 30 30 497 1 . PRO 31 31 497 1 . MET 32 32 497 1 . THR 33 33 497 1 . PHE 34 34 497 1 . ARG 35 35 497 1 . LEU 36 36 497 1 . LEU 37 37 497 1 . LEU 38 38 497 1 . VAL 39 39 497 1 . ASP 40 40 497 1 . THR 41 41 497 1 . PRO 42 42 497 1 . GLU 43 43 497 1 . THR 44 44 497 1 . LYS 45 45 497 1 . HIS 46 46 497 1 . PRO 47 47 497 1 . LYS 48 48 497 1 . LYS 49 49 497 1 . GLY 50 50 497 1 . VAL 51 51 497 1 . GLU 52 52 497 1 . LYS 53 53 497 1 . TYR 54 54 497 1 . GLY 55 55 497 1 . PRO 56 56 497 1 . GLU 57 57 497 1 . ALA 58 58 497 1 . SER 59 59 497 1 . ALA 60 60 497 1 . PHE 61 61 497 1 . THR 62 62 497 1 . LYS 63 63 497 1 . LYS 64 64 497 1 . MET 65 65 497 1 . VAL 66 66 497 1 . GLU 67 67 497 1 . ASN 68 68 497 1 . ALA 69 69 497 1 . LYS 70 70 497 1 . LYS 71 71 497 1 . ILE 72 72 497 1 . GLU 73 73 497 1 . VAL 74 74 497 1 . GLU 75 75 497 1 . PHE 76 76 497 1 . ASP 77 77 497 1 . LYS 78 78 497 1 . GLY 79 79 497 1 . GLN 80 80 497 1 . ARG 81 81 497 1 . THR 82 82 497 1 . ASP 83 83 497 1 . LYS 84 84 497 1 . TYR 85 85 497 1 . GLY 86 86 497 1 . ARG 87 87 497 1 . GLY 88 88 497 1 . LEU 89 89 497 1 . ALA 90 90 497 1 . TYR 91 91 497 1 . ILE 92 92 497 1 . TYR 93 93 497 1 . ALA 94 94 497 1 . ASP 95 95 497 1 . GLY 96 96 497 1 . LYS 97 97 497 1 . MET 98 98 497 1 . VAL 99 99 497 1 . ASN 100 100 497 1 . GLU 101 101 497 1 . ALA 102 102 497 1 . LEU 103 103 497 1 . VAL 104 104 497 1 . ARG 105 105 497 1 . GLN 106 106 497 1 . GLY 107 107 497 1 . LEU 108 108 497 1 . ALA 109 109 497 1 . LYS 110 110 497 1 . VAL 111 111 497 1 . ALA 112 112 497 1 . TYR 113 113 497 1 . VAL 114 114 497 1 . TYR 115 115 497 1 . LYS 116 116 497 1 . PRO 117 117 497 1 . ASN 118 118 497 1 . ASN 119 119 497 1 . THR 120 120 497 1 . HIS 121 121 497 1 . GLU 122 122 497 1 . GLN 123 123 497 1 . LEU 124 124 497 1 . LEU 125 125 497 1 . ARG 126 126 497 1 . LYS 127 127 497 1 . SER 128 128 497 1 . GLU 129 129 497 1 . ALA 130 130 497 1 . GLN 131 131 497 1 . ALA 132 132 497 1 . LYS 133 133 497 1 . LYS 134 134 497 1 . GLU 135 135 497 1 . LYS 136 136 497 1 . LEU 137 137 497 1 . ASN 138 138 497 1 . ILE 139 139 497 1 . TRP 140 140 497 1 . SER 141 141 497 1 . GLU 142 142 497 1 . ASP 143 143 497 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 497 _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 $micrococcal_nuclease . 1280 organism . 'Staphylococcus aereus' . . . Bacteria . Staphylococcus aereus . . . . . . . . . . . . . . . . . . . . . 497 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 497 _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 $micrococcal_nuclease . 'not available' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 497 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 497 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . save_ ####################### # Sample conditions # ####################### save_sample_condition_set_one _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_condition_set_one _Sample_condition_list.Entry_ID 497 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.5 . na 497 1 temperature 318 . K 497 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_list _NMR_spectrometer.Entry_ID 497 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'spectrometer information not available' _NMR_spectrometer.Manufacturer unknown _NMR_spectrometer.Model unknown _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 0 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 497 _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 unknown unknown . 0 'spectrometer information not available' . . 497 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 497 _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 . . . . . . . . . . . . 1 $sample_one . . . 1 $sample_condition_set_one . . . 1 $spectrometer_list . . . . . . . . . . . . . . . . 497 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_par_set_one _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_par_set_one _Chem_shift_reference.Entry_ID 497 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C . TMS . . . . . ppm 0 . . . . . . 1 $entry_citation . . 1 $entry_citation 497 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_chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one' _Assigned_chem_shift_list.Entry_ID 497 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_one . 497 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 8 8 HIS CA C 13 53.4 . . 1 . . . . . . . . 497 1 2 . 1 1 8 8 HIS CB C 13 29.5 . . 1 . . . . . . . . 497 1 3 . 1 1 9 9 LYS CA C 13 54.5 . . 1 . . . . . . . . 497 1 4 . 1 1 10 10 GLU CA C 13 51.8 . . 1 . . . . . . . . 497 1 5 . 1 1 11 11 PRO CA C 13 61.7 . . 1 . . . . . . . . 497 1 6 . 1 1 11 11 PRO CD C 13 49.2 . . 1 . . . . . . . . 497 1 7 . 1 1 12 12 ALA CA C 13 49.9 . . 1 . . . . . . . . 497 1 8 . 1 1 12 12 ALA CB C 13 17.9 . . 1 . . . . . . . . 497 1 9 . 1 1 13 13 THR CA C 13 58.9 . . 1 . . . . . . . . 497 1 10 . 1 1 13 13 THR CB C 13 70 . . 1 . . . . . . . . 497 1 11 . 1 1 13 13 THR CG2 C 13 20.7 . . 1 . . . . . . . . 497 1 12 . 1 1 14 14 LEU CA C 13 55.1 . . 1 . . . . . . . . 497 1 13 . 1 1 15 15 ILE CA C 13 62.5 . . 1 . . . . . . . . 497 1 14 . 1 1 15 15 ILE CG2 C 13 15.3 . . 1 . . . . . . . . 497 1 15 . 1 1 15 15 ILE CD1 C 13 12.7 . . 1 . . . . . . . . 497 1 16 . 1 1 16 16 LYS CA C 13 54.9 . . 1 . . . . . . . . 497 1 17 . 1 1 17 17 ALA CA C 13 50.7 . . 1 . . . . . . . . 497 1 18 . 1 1 17 17 ALA CB C 13 16.7 . . 1 . . . . . . . . 497 1 19 . 1 1 18 18 ILE CA C 13 61.7 . . 1 . . . . . . . . 497 1 20 . 1 1 18 18 ILE CG2 C 13 15.2 . . 1 . . . . . . . . 497 1 21 . 1 1 18 18 ILE CD1 C 13 11.7 . . 1 . . . . . . . . 497 1 22 . 1 1 22 22 THR CA C 13 60.1 . . 1 . . . . . . . . 497 1 23 . 1 1 22 22 THR CB C 13 71.1 . . 1 . . . . . . . . 497 1 24 . 1 1 22 22 THR CG2 C 13 20.8 . . 1 . . . . . . . . 497 1 25 . 1 1 24 24 LYS CA C 13 54.5 . . 1 . . . . . . . . 497 1 26 . 1 1 25 25 LEU CA C 13 52.9 . . 1 . . . . . . . . 497 1 27 . 1 1 26 26 MET CA C 13 53.4 . . 1 . . . . . . . . 497 1 28 . 1 1 26 26 MET CB C 13 30.7 . . 1 . . . . . . . . 497 1 29 . 1 1 26 26 MET CG C 13 30.2 . . 1 . . . . . . . . 497 1 30 . 1 1 26 26 MET CE C 13 15.4 . . 1 . . . . . . . . 497 1 31 . 1 1 27 27 TYR CA C 13 55.2 . . 1 . . . . . . . . 497 1 32 . 1 1 27 27 TYR CB C 13 40.2 . . 1 . . . . . . . . 497 1 33 . 1 1 28 28 LYS CA C 13 55.7 . . 1 . . . . . . . . 497 1 34 . 1 1 29 29 GLY CA C 13 43.9 . . 1 . . . . . . . . 497 1 35 . 1 1 30 30 GLN CA C 13 50.7 . . 1 . . . . . . . . 497 1 36 . 1 1 31 31 PRO CA C 13 61.1 . . 1 . . . . . . . . 497 1 37 . 1 1 31 31 PRO CD C 13 49.3 . . 1 . . . . . . . . 497 1 38 . 1 1 32 32 MET CA C 13 54.3 . . 1 . . . . . . . . 497 1 39 . 1 1 32 32 MET CB C 13 35.6 . . 1 . . . . . . . . 497 1 40 . 1 1 32 32 MET CG C 13 30.5 . . 1 . . . . . . . . 497 1 41 . 1 1 32 32 MET CE C 13 15.3 . . 1 . . . . . . . . 497 1 42 . 1 1 33 33 THR CA C 13 62.3 . . 1 . . . . . . . . 497 1 43 . 1 1 33 33 THR CB C 13 66.7 . . 1 . . . . . . . . 497 1 44 . 1 1 33 33 THR CG2 C 13 21.3 . . 1 . . . . . . . . 497 1 45 . 1 1 34 34 PHE CA C 13 55.8 . . 1 . . . . . . . . 497 1 46 . 1 1 34 34 PHE CB C 13 40.8 . . 1 . . . . . . . . 497 1 47 . 1 1 35 35 ARG CA C 13 50.5 . . 1 . . . . . . . . 497 1 48 . 1 1 39 39 VAL CA C 13 55.9 . . 1 . . . . . . . . 497 1 49 . 1 1 41 41 THR CA C 13 56.9 . . 1 . . . . . . . . 497 1 50 . 1 1 41 41 THR CB C 13 66.6 . . 1 . . . . . . . . 497 1 51 . 1 1 41 41 THR CG2 C 13 21 . . 1 . . . . . . . . 497 1 52 . 1 1 42 42 PRO CD C 13 49.5 . . 1 . . . . . . . . 497 1 53 . 1 1 44 44 THR CA C 13 60.8 . . 1 . . . . . . . . 497 1 54 . 1 1 44 44 THR CB C 13 67.6 . . 1 . . . . . . . . 497 1 55 . 1 1 44 44 THR CG2 C 13 20.8 . . 1 . . . . . . . . 497 1 56 . 1 1 46 46 HIS CA C 13 52.8 . . 1 . . . . . . . . 497 1 57 . 1 1 46 46 HIS CB C 13 29 . . 1 . . . . . . . . 497 1 58 . 1 1 50 50 GLY CA C 13 44 . . 1 . . . . . . . . 497 1 59 . 1 1 54 54 TYR CA C 13 54.7 . . 1 . . . . . . . . 497 1 60 . 1 1 54 54 TYR CB C 13 37.1 . . 1 . . . . . . . . 497 1 61 . 1 1 55 55 GLY CA C 13 46.9 . . 1 . . . . . . . . 497 1 62 . 1 1 56 56 PRO CD C 13 48.1 . . 1 . . . . . . . . 497 1 63 . 1 1 58 58 ALA CA C 13 54.1 . . 1 . . . . . . . . 497 1 64 . 1 1 58 58 ALA CB C 13 16.8 . . 1 . . . . . . . . 497 1 65 . 1 1 59 59 SER CB C 13 64.4 . . 1 . . . . . . . . 497 1 66 . 1 1 60 60 ALA CA C 13 53.4 . . 1 . . . . . . . . 497 1 67 . 1 1 60 60 ALA CB C 13 16.7 . . 1 . . . . . . . . 497 1 68 . 1 1 61 61 PHE CA C 13 60.1 . . 1 . . . . . . . . 497 1 69 . 1 1 61 61 PHE CB C 13 38.3 . . 1 . . . . . . . . 497 1 70 . 1 1 62 62 THR CA C 13 66.1 . . 1 . . . . . . . . 497 1 71 . 1 1 62 62 THR CB C 13 66.5 . . 1 . . . . . . . . 497 1 72 . 1 1 62 62 THR CG2 C 13 20.7 . . 1 . . . . . . . . 497 1 73 . 1 1 63 63 LYS CA C 13 58.9 . . 1 . . . . . . . . 497 1 74 . 1 1 64 64 LYS CA C 13 57.8 . . 1 . . . . . . . . 497 1 75 . 1 1 65 65 MET CA C 13 58.1 . . 1 . . . . . . . . 497 1 76 . 1 1 65 65 MET CB C 13 31.5 . . 1 . . . . . . . . 497 1 77 . 1 1 65 65 MET CG C 13 31.1 . . 1 . . . . . . . . 497 1 78 . 1 1 65 65 MET CE C 13 16.3 . . 1 . . . . . . . . 497 1 79 . 1 1 69 69 ALA CA C 13 49.8 . . 1 . . . . . . . . 497 1 80 . 1 1 69 69 ALA CB C 13 17.8 . . 1 . . . . . . . . 497 1 81 . 1 1 70 70 LYS CA C 13 56.3 . . 1 . . . . . . . . 497 1 82 . 1 1 71 71 LYS CA C 13 53.9 . . 1 . . . . . . . . 497 1 83 . 1 1 72 72 ILE CA C 13 57.2 . . 1 . . . . . . . . 497 1 84 . 1 1 72 72 ILE CG2 C 13 16 . . 1 . . . . . . . . 497 1 85 . 1 1 72 72 ILE CD1 C 13 11.4 . . 1 . . . . . . . . 497 1 86 . 1 1 73 73 GLU CA C 13 52.2 . . 1 . . . . . . . . 497 1 87 . 1 1 74 74 VAL CA C 13 58 . . 1 . . . . . . . . 497 1 88 . 1 1 74 74 VAL CG1 C 13 18.8 . . 2 . . . . . . . . 497 1 89 . 1 1 74 74 VAL CG2 C 13 20.1 . . 2 . . . . . . . . 497 1 90 . 1 1 75 75 GLU CA C 13 52.9 . . 1 . . . . . . . . 497 1 91 . 1 1 76 76 PHE CA C 13 58 . . 1 . . . . . . . . 497 1 92 . 1 1 76 76 PHE CB C 13 38.2 . . 1 . . . . . . . . 497 1 93 . 1 1 78 78 LYS CA C 13 56.4 . . 1 . . . . . . . . 497 1 94 . 1 1 79 79 GLY CA C 13 43.1 . . 1 . . . . . . . . 497 1 95 . 1 1 81 81 ARG CA C 13 55.6 . . 1 . . . . . . . . 497 1 96 . 1 1 82 82 THR CA C 13 56.8 . . 1 . . . . . . . . 497 1 97 . 1 1 82 82 THR CB C 13 71.1 . . 1 . . . . . . . . 497 1 98 . 1 1 82 82 THR CG2 C 13 19.9 . . 1 . . . . . . . . 497 1 99 . 1 1 85 85 TYR CA C 13 55.9 . . 1 . . . . . . . . 497 1 100 . 1 1 85 85 TYR CB C 13 36.7 . . 1 . . . . . . . . 497 1 101 . 1 1 86 86 GLY CA C 13 43.8 . . 1 . . . . . . . . 497 1 102 . 1 1 87 87 ARG CA C 13 53.7 . . 1 . . . . . . . . 497 1 103 . 1 1 88 88 GLY CA C 13 43.4 . . 1 . . . . . . . . 497 1 104 . 1 1 90 90 ALA CA C 13 49.1 . . 1 . . . . . . . . 497 1 105 . 1 1 90 90 ALA CB C 13 20.2 . . 1 . . . . . . . . 497 1 106 . 1 1 91 91 TYR CA C 13 56.2 . . 1 . . . . . . . . 497 1 107 . 1 1 91 91 TYR CB C 13 36.2 . . 1 . . . . . . . . 497 1 108 . 1 1 92 92 ILE CA C 13 57.2 . . 1 . . . . . . . . 497 1 109 . 1 1 92 92 ILE CG2 C 13 15.1 . . 1 . . . . . . . . 497 1 110 . 1 1 92 92 ILE CD1 C 13 10.7 . . 1 . . . . . . . . 497 1 111 . 1 1 93 93 TYR CA C 13 54.7 . . 1 . . . . . . . . 497 1 112 . 1 1 93 93 TYR CB C 13 36.2 . . 1 . . . . . . . . 497 1 113 . 1 1 94 94 ALA CA C 13 48.2 . . 1 . . . . . . . . 497 1 114 . 1 1 94 94 ALA CB C 13 18.5 . . 1 . . . . . . . . 497 1 115 . 1 1 96 96 GLY CA C 13 43.7 . . 1 . . . . . . . . 497 1 116 . 1 1 97 97 LYS CA C 13 52.7 . . 1 . . . . . . . . 497 1 117 . 1 1 98 98 MET CA C 13 54.8 . . 1 . . . . . . . . 497 1 118 . 1 1 98 98 MET CB C 13 32.9 . . 1 . . . . . . . . 497 1 119 . 1 1 98 98 MET CG C 13 27.3 . . 1 . . . . . . . . 497 1 120 . 1 1 98 98 MET CE C 13 13 . . 1 . . . . . . . . 497 1 121 . 1 1 99 99 VAL CA C 13 61.1 . . 1 . . . . . . . . 497 1 122 . 1 1 99 99 VAL CG1 C 13 20.3 . . 2 . . . . . . . . 497 1 123 . 1 1 99 99 VAL CG2 C 13 21.2 . . 2 . . . . . . . . 497 1 124 . 1 1 101 101 GLU CA C 13 58 . . 1 . . . . . . . . 497 1 125 . 1 1 102 102 ALA CA C 13 53.7 . . 1 . . . . . . . . 497 1 126 . 1 1 102 102 ALA CB C 13 16.7 . . 1 . . . . . . . . 497 1 127 . 1 1 103 103 LEU CA C 13 56.3 . . 1 . . . . . . . . 497 1 128 . 1 1 105 105 ARG CA C 13 58.8 . . 1 . . . . . . . . 497 1 129 . 1 1 107 107 GLY CA C 13 44.9 . . 1 . . . . . . . . 497 1 130 . 1 1 109 109 ALA CA C 13 47.9 . . 1 . . . . . . . . 497 1 131 . 1 1 109 109 ALA CB C 13 20 . . 1 . . . . . . . . 497 1 132 . 1 1 110 110 LYS CA C 13 52.2 . . 1 . . . . . . . . 497 1 133 . 1 1 111 111 VAL CA C 13 61.6 . . 1 . . . . . . . . 497 1 134 . 1 1 112 112 ALA CA C 13 49.4 . . 1 . . . . . . . . 497 1 135 . 1 1 112 112 ALA CB C 13 18.6 . . 1 . . . . . . . . 497 1 136 . 1 1 113 113 TYR CA C 13 55.9 . . 1 . . . . . . . . 497 1 137 . 1 1 114 114 VAL CA C 13 61 . . 1 . . . . . . . . 497 1 138 . 1 1 114 114 VAL CG1 C 13 17.7 . . 2 . . . . . . . . 497 1 139 . 1 1 114 114 VAL CG2 C 13 18.6 . . 2 . . . . . . . . 497 1 140 . 1 1 115 115 TYR CA C 13 53.3 . . 1 . . . . . . . . 497 1 141 . 1 1 115 115 TYR CB C 13 36.8 . . 1 . . . . . . . . 497 1 142 . 1 1 116 116 LYS CA C 13 54.5 . . 1 . . . . . . . . 497 1 143 . 1 1 119 119 ASN CA C 13 50.7 . . 1 . . . . . . . . 497 1 144 . 1 1 120 120 THR CA C 13 62.3 . . 1 . . . . . . . . 497 1 145 . 1 1 120 120 THR CB C 13 65.1 . . 1 . . . . . . . . 497 1 146 . 1 1 120 120 THR CG2 C 13 20.1 . . 1 . . . . . . . . 497 1 147 . 1 1 121 121 HIS CA C 13 51.9 . . 1 . . . . . . . . 497 1 148 . 1 1 121 121 HIS CB C 13 27.2 . . 1 . . . . . . . . 497 1 149 . 1 1 126 126 ARG CA C 13 58.2 . . 1 . . . . . . . . 497 1 150 . 1 1 127 127 LYS CA C 13 58.4 . . 1 . . . . . . . . 497 1 151 . 1 1 130 130 ALA CA C 13 53.4 . . 1 . . . . . . . . 497 1 152 . 1 1 130 130 ALA CB C 13 16.1 . . 1 . . . . . . . . 497 1 153 . 1 1 132 132 ALA CA C 13 54.1 . . 1 . . . . . . . . 497 1 154 . 1 1 132 132 ALA CB C 13 17.1 . . 1 . . . . . . . . 497 1 155 . 1 1 133 133 LYS CA C 13 58.1 . . 1 . . . . . . . . 497 1 156 . 1 1 134 134 LYS CA C 13 57.7 . . 1 . . . . . . . . 497 1 157 . 1 1 136 136 LYS CA C 13 55.1 . . 1 . . . . . . . . 497 1 158 . 1 1 139 139 ILE CA C 13 64.1 . . 1 . . . . . . . . 497 1 159 . 1 1 139 139 ILE CG2 C 13 13.6 . . 1 . . . . . . . . 497 1 160 . 1 1 139 139 ILE CD1 C 13 11.8 . . 1 . . . . . . . . 497 1 161 . 1 1 140 140 TRP CA C 13 53.5 . . 1 . . . . . . . . 497 1 162 . 1 1 140 140 TRP CB C 13 28.5 . . 1 . . . . . . . . 497 1 163 . 1 1 141 141 SER CB C 13 67.3 . . 1 . . . . . . . . 497 1 stop_ save_