data_16742 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16742 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for Unfolded Bovine Pancreatic Ribonuclease A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-02-21 _Entry.Accession_date 2010-02-21 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 Simon Azeroual . . . 16742 2 Christian Dabrowski . . . 16742 3 Alexey Denisov . . . 16742 4 Kalle Gehring . . . 16742 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16742 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 213 16742 '15N chemical shifts' 108 16742 '1H chemical shifts' 108 16742 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 . . 2014-05-16 2010-02-21 update BMRB 'update entry citation' 16742 1 . . 2012-08-03 2010-02-21 original author 'original release' 16742 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16742 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20600112 _Citation.Full_citation . _Citation.Title 'Structure of the catalytic a(0)a fragment of the protein disulfide isomerase ERp72.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 401 _Citation.Journal_issue 4 _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 618 _Citation.Page_last 625 _Citation.Year 2010 _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 Guennadi Kozlov . . . 16742 1 2 Simon Azeroual . . . 16742 1 3 Angelika Rosenauer . . . 16742 1 4 Pekka Maattanen . . . 16742 1 5 'Alexey Yu' Denisov . . . 16742 1 6 David Thomas . Y. . 16742 1 7 Kalle Gehring . . . 16742 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Binding site of PDI' 16742 1 PDI 16742 1 RibonucleaseA 16742 1 'Unfolded Protein' 16742 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16742 _Assembly.ID 1 _Assembly.Name 'Ribonuclease A' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 'Ribonuclease A' 1 $entity A . yes unfolded no no . . . 16742 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16742 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Ribonuclease A' _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 ; MAKETAAAKFERQHMDSSTS AASSSNYCNQMMKSRNLTKD RCKPVNTFVHESLADVQAVC SQKNVACKNGQTNCYQSYST MSITDCRETGSSKYPNCAYK TTQANKHIIVACEGNPYVPV HFDASV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 1072 . "ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 2 no BMRB 16010 . ribonuclease_A . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 3 no BMRB 16011 . ribonuclease_A . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 4 no BMRB 16503 . RNase_A . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 5 no BMRB 17099 . ribonuclease . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 6 no BMRB 17172 . RNase_A_C-dimer . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 7 no BMRB 19065 . RnaseA . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 8 no BMRB 2928 . "ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 9 no BMRB 385 . "ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 10 no BMRB 4031 . "bovine pancreatic ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 11 no BMRB 4032 . "bovine pancreatic [C65S,C72S] ribonuclease A" . . . . . 98.41 124 98.39 98.39 1.61e-83 . . . . 16742 1 12 no BMRB 443 . "ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 13 no PDB 1A2W . "Crystal Structure Of A 3d Domain-Swapped Dimer Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 14 no PDB 1A5P . "C[40,95]a Variant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 98.39 98.39 9.35e-84 . . . . 16742 1 15 no PDB 1A5Q . "P93a Variant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.60e-84 . . . . 16742 1 16 no PDB 1AFK . "Crystal Structure Of Ribonuclease A In Complex With 5'- Diphosphoadenosine-3'-Phosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 17 no PDB 1AFL . "Ribonuclease A In Complex With 5'-Diphosphoadenosine 2'- Phosphate At 1.7 Angstrom Resolution" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 18 no PDB 1AFU . "Structure Of Ribonuclease A At 2.0 Angstroms From Monoclinic Crystals" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 19 no PDB 1AQP . "Ribonuclease A Copper Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 20 no PDB 1BEL . "Hydrolase Phosphoric Diester, Rna" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 21 no PDB 1BZQ . "Complex Of A Dromedary Single-Domain Vhh Antibody Fragment With Rnase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 22 no PDB 1C0B . "Bovine Pancreatic Ribonuclease A Desiccated For 2.5 Days" . . . . . 100.00 128 98.41 99.21 4.25e-86 . . . . 16742 1 23 no PDB 1C0C . "Bovine Pancreatic Ribonuclease A Desiccated For 4.0 Days" . . . . . 100.00 128 98.41 99.21 4.25e-86 . . . . 16742 1 24 no PDB 1C8W . "Thr45gly Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.12e-84 . . . . 16742 1 25 no PDB 1C9V . "H12a Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 2.78e-84 . . . . 16742 1 26 no PDB 1C9X . "H119a Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 2.78e-84 . . . . 16742 1 27 no PDB 1CJQ . "X-Ray Crystallographic Studies Of The Denaturation Of The Denaturation Of Ribonuclease S." . . . . . 80.16 101 100.00 100.00 1.62e-68 . . . . 16742 1 28 no PDB 1CJR . "X-Ray Crystallographic Studies Of Denaturation In Ribonuclease S" . . . . . 79.37 101 100.00 100.00 9.57e-68 . . . . 16742 1 29 no PDB 1D5D . "The Role Of Phenylalanine 8 In The Stabilization Of The S Protein-S Peptide Interaction: Packing And Cavities" . . . . . 80.16 101 100.00 100.00 1.62e-68 . . . . 16742 1 30 no PDB 1D5E . "The Role Of Phenylalanine 8 In The Stabilization Of The S Protein-S Peptide Interaction: Packing And Cavities" . . . . . 80.16 101 100.00 100.00 1.62e-68 . . . . 16742 1 31 no PDB 1D5H . "Rnase S(F8a). Mutant Ribonuclease S" . . . . . 80.16 101 100.00 100.00 1.62e-68 . . . . 16742 1 32 no PDB 1DFJ . "Ribonuclease Inhibitor Complexed With Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 33 no PDB 1DY5 . "Deamidated Derivative Of Bovine Pancreatic Ribonuclease" . . . . . 98.41 124 99.19 99.19 1.04e-84 . . . . 16742 1 34 no PDB 1EIC . "Crystal Structure Of F120a Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 2.44e-84 . . . . 16742 1 35 no PDB 1EID . "Crystal Structure Of F120g Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 3.17e-84 . . . . 16742 1 36 no PDB 1EIE . "Crystal Structure Of F120w Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 100.00 4.30e-85 . . . . 16742 1 37 no PDB 1EOS . "Crystal Structure Of Ribonuclease A Complexed With Uridylyl(2',5')guanosine (Productive Binding)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 38 no PDB 1EOW . "Crystal Structure Of Ribonuclease A Complexed With Uridylyl(2',5')guanosine (Non-Productive Binding)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 39 no PDB 1F0V . "Crystal Structure Of An Rnase A Dimer Displaying A New Type Of 3d Domain Swapping" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 40 no PDB 1FEV . "Crystal Structure Of The Ala4aib Mutation In Rnase S" . . . . . 80.16 101 100.00 100.00 1.62e-68 . . . . 16742 1 41 no PDB 1FS3 . "Crystal Structure Of Wild-Type Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 42 no PDB 1IZP . "F46l Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 6.31e-85 . . . . 16742 1 43 no PDB 1IZQ . "F46v Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.23e-84 . . . . 16742 1 44 no PDB 1IZR . "F46a Mutant Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 99.19 99.19 2.44e-84 . . . . 16742 1 45 no PDB 1J7Z . "Osmolyte Stabilization Of Ribonuclease" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 46 no PDB 1J80 . "Osmolyte Stabilization Of Rnase" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 47 no PDB 1J81 . "Osmolyte Stabilization Of Rnase" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 48 no PDB 1J82 . "Osmolyte Stabilization Of Rnase" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 49 no PDB 1JN4 . "The Crystal Structure Of Ribonuclease A In Complex With 2'- Deoxyuridine 3'-Pyrophosphate (P'-5') Adenosine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 50 no PDB 1JS0 . "Crystal Structure Of 3d Domain-Swapped Rnase A Minor Trimer" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 51 no PDB 1JVT . "Crystal Structure Of Ribonuclease A (Ligand-Free Form)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 52 no PDB 1JVU . "Crystal Structure Of Ribonuclease A (Complexed Form)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 53 no PDB 1JVV . "Crystal Structure Of Ribonuclease A (Retro-Soaked Form)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 54 no PDB 1KF2 . "Atomic Resolution Structure Of Rnase A At Ph 5.2" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 55 no PDB 1KF3 . "Atomic Resolution Structure Of Rnase A At Ph 5.9" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 56 no PDB 1KF4 . "Atomic Resolution Structure Of Rnase A At Ph 6.3" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 57 no PDB 1KF5 . "Atomic Resolution Structure Of Rnase A At Ph 7.1" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 58 no PDB 1KF7 . "Atomic Resolution Structure Of Rnase A At Ph 8.0" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 59 no PDB 1KF8 . "Atomic Resolution Structure Of Rnase A At Ph 8.8" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 60 no PDB 1KH8 . "Structure Of A Cis-Proline (P114) To Glycine Variant Of Ribonuclease A" . . . . . 98.41 125 99.19 99.19 2.29e-84 . . . . 16742 1 61 no PDB 1LSQ . "Ribonuclease A With Asn 67 Replaced By A Beta-Aspartyl Residue" . . . . . 98.41 124 99.19 99.19 1.04e-84 . . . . 16742 1 62 no PDB 1O0F . "Rnase A In Complex With 3',5'-Adp" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 63 no PDB 1O0H . "Ribonuclease A In Complex With 5'-Adp" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 64 no PDB 1O0M . "Ribonuclease A In Complex With Uridine-2'-Phosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 65 no PDB 1O0N . "Ribonuclease A In Complex With Uridine-3'-phosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 66 no PDB 1O0O . "Ribonuclease A In Complex With Adenosine-2',5'-Diphosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 67 no PDB 1QHC . "Crystal Structure Of Ribonuclease A In Complex With 5'- Phospho-2'-Deoxyuridine-3'-Pyrophosphate Adenosine-3'- Phosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 68 no PDB 1RAR . "Crystal Structure Of A Fluorescent Derivative Of Rnase A" . . . . . 97.62 123 100.00 100.00 8.66e-85 . . . . 16742 1 69 no PDB 1RAS . "Crystal Structure Of A Fluorescent Derivative Of Rnase A" . . . . . 97.62 123 100.00 100.00 8.66e-85 . . . . 16742 1 70 no PDB 1RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 71 no PDB 1RBB . "The Crystal Structure Of Ribonuclease B At 2.5-Angstroms Resolution" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 72 no PDB 1RBC . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 73 no PDB 1RBD . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 74 no PDB 1RBE . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 75 no PDB 1RBF . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 76 no PDB 1RBG . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 77 no PDB 1RBH . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 78 no PDB 1RBI . "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 79 no PDB 1RBJ . "Ribonuclease B Complex With D(Tetra-(Deoxy-Adenylate))" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 80 no PDB 1RBN . "The Structure Of Ribonuclease A Derivative Ii At 2.1 Angstroms Resolution" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 81 no PDB 1RBW . "Ribonuclease A (E.C.3.1.27.5) With Guanidinium" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 82 no PDB 1RBX . "Ribonuclease A (E.C.3.1.27.5) Control" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 83 no PDB 1RCA . "Structure Of The Crystalline Complex Of Deoxycytidylyl-3', 5'-Guanosine (3',5'-Dcpdg) Co-Crystalised With Ribonuclease At 1.9 A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 84 no PDB 1RCN . "Crystal Structure Of The Ribonuclease A D(Aptpapapg) Complex : Direct Evidence For Extended Substrate Recognition" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 85 no PDB 1RHA . "Water Dependent Domain Motion And Flexibility In Ribonuclease A And The Invariant Features In Its Hydration Shell. An X-Ray Stu" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 86 no PDB 1RHB . "Water Dependent Domain Motion And Flexibility In Ribonuclease A And The Invariant Features In Its Hydration Shell. An X-Ray Stu" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 87 no PDB 1RNC . "Newly Observed Binding Mode In Pancreatic Ribonuclease" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 88 no PDB 1RND . "Newly Observed Binding Mode In Pancreatic Ribonuclease" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 89 no PDB 1RNM . "Ribonuclease A Complex With Cytidylic Acid (5'cmp) Crystallized From 80% Ammonium Sulphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 90 no PDB 1RNN . "Ribonuclease A Complex With Cytidylic Acid (5'cmp) Crystallized From 8m Sodium Formate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 91 no PDB 1RNO . "Ribonuclease A Crystallized From 80% Ammonium Sulphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 92 no PDB 1RNQ . "Ribonuclease A Crystallized From 8m Sodium Formate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 93 no PDB 1RNU . "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 94 no PDB 1RNV . "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 95 no PDB 1RNW . "Recombinant Ribonuclease A Crystallized From 80% Ammonium Sulphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 96 no PDB 1RNX . "Ribonuclease A Crystallized From 3m Sodium Chloride, 30% Ammonium Sulfate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 97 no PDB 1RNY . "Ribonuclease A Crystallized From 3m Cesium Chloride, 30% Ammonium Sulfate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 98 no PDB 1RNZ . "Ribonuclease A Crystallized From 2.5m Sodium Chloride, 3.3m Sodium Formate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 99 no PDB 1ROB . "Structure Of The Crystalline Complex Of Cytidylic Acid (2'- Cmp) With Ribonuclease At 1.6 Angstroms Resolution" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 100 no PDB 1RPF . "The Structures Of Rnase Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 101 no PDB 1RPG . "Structures Of Rnase A Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 102 no PDB 1RPH . "Structures Of Rnase A Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 103 no PDB 1RSM . "The 2-Angstroms Resolution Structure Of A Thermostable Ribonuclease A Chemically Cross-Linked Between Lysine Residues 7 And 41" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 104 no PDB 1RTA . "Crystal Structure Disposition Of Thymidylic Acid Tetramer In Complex With Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 105 no PDB 1RTB . "Crystal Structure Disposition Of Thymidylic Acid Tetramer In Complex With Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 106 no PDB 1RUV . "Ribonuclease A-Uridine Vanadate Complex: High Resolution Resolution X-Ray Structure (1.3 A)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 107 no PDB 1SRN . "The Refined Crystal Structure Of A Fully Active Semisynthetic Ribonuclease At 1.8 Angstroms Resolution" . . . . . 93.65 118 100.00 100.00 1.44e-80 . . . . 16742 1 108 no PDB 1SSA . "A Structural Investigation Of Catalytically Modified F12ol And F12oy Semisynthetic Ribonucleases" . . . . . 93.65 118 100.00 100.00 1.44e-80 . . . . 16742 1 109 no PDB 1SSB . "A Structural Investigation Of Catalytically Modified F12ol And F12oy Semisynthetic Ribonucleases" . . . . . 93.65 118 100.00 100.00 1.44e-80 . . . . 16742 1 110 no PDB 1SSC . "The 1.6 Angstroms Structure Of A Semisynthetic Ribonuclease Crystallized From Aqueous Ethanol. Comparison With Crystals From Sa" . . . . . 88.89 112 100.00 100.00 3.67e-75 . . . . 16742 1 111 no PDB 1U1B . "Structure Of Bovine Pancreatic Ribonuclease A In Complex With 3'-phosphothymidine (3'-5')-pyrophosphate Adenosine 3'-phosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 112 no PDB 1W4O . "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 113 no PDB 1W4P . "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 114 no PDB 1W4Q . "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 115 no PDB 1WBU . "Fragment Based Lead Discovery Using Crystallography" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 116 no PDB 1XPS . "Bovine Ribonuclease A (Phosphate-Free) (93 % Humidity)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 117 no PDB 1XPT . "Bovine Ribonuclease A (Phosphate-Free)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 118 no PDB 1YMN . "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92l Mutant)" . . . . . 98.41 124 99.19 99.19 1.03e-84 . . . . 16742 1 119 no PDB 1YMR . "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92a Mutant)" . . . . . 98.41 124 99.19 99.19 1.98e-84 . . . . 16742 1 120 no PDB 1YMW . "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92g Mutant)" . . . . . 98.41 124 99.19 99.19 2.88e-84 . . . . 16742 1 121 no PDB 1Z3L . "X-Ray Crystal Structure Of A Mutant Ribonuclease S (F8anb)" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 122 no PDB 1Z3M . "Crystal Structure Of Mutant Ribonuclease S (F8nva)" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 123 no PDB 1Z3P . "X-Ray Crystal Structure Of A Mutant Ribonuclease S (M13nva)" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 124 no PDB 1Z6D . "Ribonuclease A- Imp Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 125 no PDB 1Z6S . "Ribonuclease A- Amp Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 126 no PDB 2AAS . "High-Resolution Three-Dimensional Structure Of Ribonuclease A In Solution By Nuclear Magnetic Resonance Spectroscopy" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 127 no PDB 2BLP . "Rnase Before Unattenuated X-Ray Burn" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 128 no PDB 2BLZ . 'Rnase After A High Dose X-Ray "burn"' . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 129 no PDB 2E33 . "Structural Basis For Selection Of Glycosylated Substrate By Scffbs1 Ubiquitin Ligase" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 130 no PDB 2E3W . "X-Ray Structure Of Native Rnase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 131 no PDB 2G4W . "Anomalous Substructure Of Ribonuclease A (c2)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 132 no PDB 2G4X . "Anomalous Substructure Od Ribonuclease A (P3221)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 133 no PDB 2G8Q . "The Crystal Structure Of Rnase A From Monoclinic Crystals At 100 K" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 134 no PDB 2G8R . "The Crystal Structure Of The Rnase A- 3-N-Piperidine-4- Carboxyl-3-Deoxy-Ara-Uridine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 135 no PDB 2NUI . "X-Ray Structure Of Synthetic [d83a]rnase A" . . . . . 98.41 124 99.19 99.19 1.88e-84 . . . . 16742 1 136 no PDB 2OP2 . "Crystal Structure Of Rnase Double-Mutant V43c R85c With Extra Disulphide Bond" . . . . . 98.41 124 98.39 98.39 1.01e-82 . . . . 16742 1 137 no PDB 2OQF . "Structure Of A Synthetic, Non-Natural Analogue Of Rnase A: [n71k(Ade), D83a]rnase A" . . . . . 98.41 124 98.39 98.39 1.45e-83 . . . . 16742 1 138 no PDB 2P42 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 1.8a Resolution: Se3-Mono-2 Crystal Form With Three Se" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 139 no PDB 2P43 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 1.65a Resolution: Se3-Mono-1 Crystal Form With Three S" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 140 no PDB 2P44 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 1.8a Resolution: Se5a-Mono-1 Crystal Form With Five Se" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 141 no PDB 2P45 . "Complex Of A Camelid Single-domain Vhh Antibody Fragment With Rnase A At 1.1a Resolution: Se5b-ortho-1 Crystal Form With Five S" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 142 no PDB 2P46 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 2.5a Resolution: Se5b-Ortho-2 Crystal Form With Five S" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 143 no PDB 2P47 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 2.5a Resolution: Se5b-Tri Crystal Form With Five Se-Me" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 144 no PDB 2P48 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 2.3a Resolution: Se5b-Tetra Crystal Form With Five Se-" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 145 no PDB 2P49 . "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 1.4a Resolution: Native Mono_1 Crystal Form" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 146 no PDB 2P4A . "X-Ray Structure Of A Camelid Affinity Matured Single-Domain Vhh Antibody Fragment In Complex With Rnase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 147 no PDB 2QCA . "A New Crystal Form Of Bovine Pancreatic Rnase A In Complex With 2'- Deoxyguanosine-5'-Monophosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 148 no PDB 2RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 149 no PDB 2RLN . "Thermodynamic And Structural Consequences Of Changing A Sulphur Atom To A Methylene Group In The M13nle Mutation In Ribonucleas" . . . . . 86.51 109 100.00 100.00 1.83e-73 . . . . 16742 1 150 no PDB 2RNS . "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 151 no PDB 2W5G . "Rnase A-5'-Atp Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 152 no PDB 2W5I . "Rnase A-Ap3a Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 153 no PDB 2W5K . "Rnase A-Nadph Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 154 no PDB 2W5L . "Rnase A-Nadp Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 155 no PDB 2W5M . "Rnase A-Pyrophosphate Ion Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 156 no PDB 2XOG . "Functional And Structural Analyses Of N-Acylsulfonamide- Linked Dinucleoside Inhibitors Of Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 157 no PDB 2XOI . "Functional And Structural Analyses Of N-Acylsulfonamide- Linked Dinucleoside Inhibitors Of Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 158 no PDB 3A1R . "Neutron Crystal Structure Analysis Of Bovine Pancreatic Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 159 no PDB 3D6O . "The Rnase A- 5'-Deoxy-5'-N-(Ethyl Isonipecotatyl)uridine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 160 no PDB 3D6P . "Rnase A- 5'-Deoxy-5'-N-Morpholinouridine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 161 no PDB 3D6Q . "The Rnase A- 5'-Deoxy-5'-N-Piperidinouridine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 162 no PDB 3D7B . "The Ribonuclease A- 5'-Deoxy-5'-N-Pyrrolidinouridine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 163 no PDB 3D8Y . "Rnase A- 5'-deoxy-5'-n-piperidinothymidine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 164 no PDB 3D8Z . "Rnase A- 5'-deoxy-5'-n-pyrrolidinothymidine Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 165 no PDB 3DH5 . "Crystal Structure Of Bovine Pancreatic Ribonuclease A (Wild- Type)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 166 no PDB 3DH6 . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V47a)" . . . . . 98.41 124 99.19 99.19 7.59e-85 . . . . 16742 1 167 no PDB 3DI7 . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V54a)" . . . . . 98.41 124 99.19 99.19 7.59e-85 . . . . 16742 1 168 no PDB 3DI8 . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V57a)" . . . . . 98.41 124 99.19 99.19 7.59e-85 . . . . 16742 1 169 no PDB 3DI9 . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (I81a)" . . . . . 98.41 124 99.19 99.19 1.20e-84 . . . . 16742 1 170 no PDB 3DIB . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (I106a)" . . . . . 98.41 124 99.19 99.19 1.20e-84 . . . . 16742 1 171 no PDB 3DIC . "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V108a)" . . . . . 98.41 124 99.19 99.19 7.59e-85 . . . . 16742 1 172 no PDB 3DXG . "Ribonuclease A- Uridine 5' Phosphate Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 173 no PDB 3DXH . "Ribonuclease A Uridine 5' Diphosphate Complex" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 174 no PDB 3EUX . "Crystal Structure Of Crosslinked Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 175 no PDB 3EUY . "Crystal Structure Of Ribonuclease A In 50% Dioxane" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 176 no PDB 3EUZ . "Crystal Structure Of Ribonuclease A In 50% Dimethylformamide" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 177 no PDB 3EV0 . "Crystal Structure Of Ribonuclease A In 70% Dimethyl Sulfoxide" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 178 no PDB 3EV1 . "Crystal Structure Of Ribonuclease A In 70% Hexanediol" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 179 no PDB 3EV2 . "Crystal Structure Of Ribonuclease A In 70% Isopropanol" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 180 no PDB 3EV3 . "Crystal Structure Of Ribonuclease A In 70% T-Butanol" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 181 no PDB 3EV4 . "Crystal Structure Of Ribonuclease A In 50% Trifluoroethanol" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 182 no PDB 3EV5 . "Crystal Structure Of Ribonuclease A In 1m Trimethylamine N-Oxide" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 183 no PDB 3EV6 . "Crystal Structure Of Ribonuclease A In 50% R,S,R-Bisfuranol" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 184 no PDB 3FL0 . "X-Ray Structure Of The Non Covalent Swapped Form Of The Q28lK31CS32C MUTANT OF BOVINE PANCREATIC RIBONUCLEASE IN Complex With 2" . . . . . 98.41 124 97.58 97.58 5.67e-83 . . . . 16742 1 185 no PDB 3I67 . "Ribonuclease A By Lb Nanotemplate Method After High X-Ray Dose On Esrf Id14-2 Beamline" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 186 no PDB 3I6F . "Ribonuclease A By Classical Hanging Drop Method Before High X-Ray Dose On Esrf Id14-2 Beamline" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 187 no PDB 3I6H . "Ribonuclease A By Lb Nanotemplate Method Before High X-Ray Dose On Esrf Id14-2 Beamline" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 188 no PDB 3I6J . "Ribonuclease A By Classical Hanging Drop Method After High X-Ray Dose On Esrf Id14-2 Beamline" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 189 no PDB 3I7W . "High Pressure Structure Of Wild-Type Rnase A (0.67 Gpa)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 190 no PDB 3I7X . "High Pressure Structure Of I106a Rnase A Variant (0.35 Gpa)" . . . . . 98.41 124 99.19 99.19 1.20e-84 . . . . 16742 1 191 no PDB 3I7Y . "High Pressure Structure Of I106a Variant Of Rnase A (0.48 Gpa)" . . . . . 98.41 124 99.19 99.19 1.20e-84 . . . . 16742 1 192 no PDB 3JW1 . "Crystal Structure Of Bovine Pancreatic Ribonuclease Complexed With Uridine-5'-monophosphate At 1.60 A Resolution" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 193 no PDB 3LXO . "The Crystal Structure Of Ribonuclease A In Complex With Thymidine-3'- Monophosphate" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 194 no PDB 3MWQ . "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" . . . . . 98.41 256 100.00 100.00 5.95e-84 . . . . 16742 1 195 no PDB 3MWR . "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" . . . . . 98.41 254 100.00 100.00 8.91e-84 . . . . 16742 1 196 no PDB 3MX8 . "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" . . . . . 98.41 252 100.00 100.00 1.21e-83 . . . . 16742 1 197 no PDB 3MZQ . "Rnase Crystals Grown By The Hanging Drop Method" . . . . . 100.00 128 98.41 99.21 4.25e-86 . . . . 16742 1 198 no PDB 3MZR . "Rnase Crystals Grown In Loops/micromounts" . . . . . 100.00 128 98.41 99.21 4.25e-86 . . . . 16742 1 199 no PDB 3OQY . "Semi-Synthetic Ribonuclease S: Para-Cyano-Phenylalanine At Position 8" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 200 no PDB 3OQZ . "Semi-Synthetic Ribonuclease S: Meta-Cyano-Phenylalanine At Position 8" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 201 no PDB 3OR0 . "Semi-Synthetic Ribonuclease S: Cyanylated Homocysteine At Position 13" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 202 no PDB 3QL1 . "Crystal Structure Of Ribonuclease A Variant A4c/d83e/v118c" . . . . . 98.41 124 97.58 98.39 7.45e-83 . . . . 16742 1 203 no PDB 3QL2 . "Crystal Structure Of Ribonuclease A Variant A4c/d83e/v118c" . . . . . 98.41 124 97.58 98.39 7.45e-83 . . . . 16742 1 204 no PDB 3QSK . "5 Histidine Variant Of The Anti-Rnase A Vhh In Complex With Rnase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 205 no PDB 3RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 206 no PDB 3RH1 . "X-ray Structure Of A Cis-proline (p114) To Alanine Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.60e-84 . . . . 16742 1 207 no PDB 3RID . "X-ray Structure Of The C-terminal Swapped Dimer Of P114a Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.60e-84 . . . . 16742 1 208 no PDB 3RN3 . "Segmented Anisotropic Refinement Of Bovine Ribonuclease A By The Application Of The Rigid-Body Tls Model" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 209 no PDB 3RSD . "Structure Of The D121n Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 100.00 6.81e-85 . . . . 16742 1 210 no PDB 3RSK . "Structure Of The K7aR10AK66A VARIANT OF RIBONUCLEASE A" . . . . . 98.41 124 97.58 97.58 6.75e-83 . . . . 16742 1 211 no PDB 3RSP . "Structure Of The P93g Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 2.47e-84 . . . . 16742 1 212 no PDB 3SRN . "Structural Changes That Accompany The Reduced Catalytic Efficiency Of Two Semisynthetic Ribonuclease Analogs" . . . . . 89.68 113 100.00 100.00 4.92e-76 . . . . 16742 1 213 no PDB 4AO1 . "High Resolution Crystal Structure Of Bovine Pancreatic Ribonuclease Crystallized Using Ionic Liquid" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 214 no PDB 4G8V . "Crystal Structure Of Ribonuclease A In Complex With 5a" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 215 no PDB 4G8Y . "Crystal Structure Of Ribonuclease A In Complex With 5b" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 216 no PDB 4G90 . "Crystal Structure Of Ribonuclease A In Complex With 5e" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 217 no PDB 4J5Z . "Crystal Structure Of Ribonuclease A In Aqueous Solution: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 218 no PDB 4J60 . "Crystal Structure Of Ribonuclease A Soaked In 25% Cyclopentanol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 219 no PDB 4J61 . "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclopentanone: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 220 no PDB 4J62 . "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclohexanol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 221 no PDB 4J63 . "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclohexanone: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 222 no PDB 4J64 . "Crystal Structure Of Ribonuclease A Soaked In 40% Dioxane: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 223 no PDB 4J65 . "Crystal Structure Of Ribonuclease A Soaked In 40% Dimethylformamide: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 224 no PDB 4J66 . "Crystal Structure Of Ribonuclease A Soaked In 25% Dimethyl Sulfoxide: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 225 no PDB 4J67 . "Crystal Structure Of Ribonuclease A Soaked In 50% 1,6-hexanediol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 226 no PDB 4J68 . "Crystal Structure Of Ribonuclease A Soaked In 40% Isopropanol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 227 no PDB 4J69 . "Crystal Structure Of Ribonuclease A Soaked In 50% S,r,s-bisfuranol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 228 no PDB 4J6A . "Crystal Structure Of Ribonuclease A Soaked In 40% 2,2,2- Trifluoroethanol: One Of Twelve In Mscs Set" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 229 no PDB 4K7L . "Crystal Structure Of Rnase S Variant (k7c/q11c)" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 230 no PDB 4L55 . "X-ray Structure Of The Adduct Between Bovine Pancreatic Ribonuclease And Aziru" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 231 no PDB 4MXF . "X-ray Structure Of The Adduct Between Bovine Pancreatic Ribonuclease And Auoxo6, A Dinuclear Gold(iii) Complex With -dioxo Brid" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 232 no PDB 4O36 . "Semisynthetic Rnase S1-15-h7/11-q10" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 233 no PDB 4O37 . "Seminsynthetic Rnase S1-15-3pl-7/11" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 234 no PDB 4OKF . "Rnase S In Complex With An Artificial Peptide" . . . . . 82.54 104 100.00 100.00 2.52e-70 . . . . 16742 1 235 no PDB 4OOH . "Structure Of Ribonuclease A At 40c" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 236 no PDB 4OT4 . "X-ray Structure Of The Adduct Formed Between Cisplatin And Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 237 no PDB 4PEQ . "Structure Of Bovine Ribonuclease Inhibitor Complexed With Bovine Ribonuclease I" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 238 no PDB 4POU . "Vhh-metal In Complex With Rnase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 239 no PDB 4QH3 . "X-ray Structure Of The Adduct Formed Between Bovine Pancreatic Ribonuclease And Trans-dimethylamine Methylamine Dichlorido Plat" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 240 no PDB 4RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 241 no PDB 4RSD . "Structure Of The D121a Variant Of Ribonuclease A" . . . . . 98.41 124 99.19 99.19 1.88e-84 . . . . 16742 1 242 no PDB 4RSK . "Structure Of The K7aR10AK66A VARIANT OF RIBONUCLEASE A Complexed With 3'-Ump" . . . . . 98.41 124 97.58 97.58 6.75e-83 . . . . 16742 1 243 no PDB 4RTE . "The X-ray Structure Of Bovine Pancreatic Ribonuclease Incubated In The Presence Of An Excess Of Cisplatin (1:10 Ratio)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 244 no PDB 4SRN . "Structural Changes That Accompany The Reduced Catalytic Efficiency Of Two Semisynthetic Ribonuclease Analogs" . . . . . 89.68 113 100.00 100.00 4.92e-76 . . . . 16742 1 245 no PDB 4YGW . "Rnase S In Complex With Stabilized S Peptide" . . . . . 81.75 103 100.00 100.00 1.14e-69 . . . . 16742 1 246 no PDB 5RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 247 no PDB 5RSA . "Comparison Of Two Independently Refined Models Of Ribonuclease-A" . . . . . 97.62 124 100.00 100.00 8.94e-85 . . . . 16742 1 248 no PDB 6RAT . "Effects Of Temperature On Protein Structure And Dynamics: X-Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine " . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 249 no PDB 6RSA . "Nuclear Magnetic Resonance And Neutron Diffraction Studies Of The Complex Of RibonucleaseA With Uridine Vanadate, A Transition-" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 250 no PDB 7RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 251 no PDB 7RSA . "Structure Of Phosphate-Free Ribonuclease A Refined At 1.26 Angstroms" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 252 no PDB 8RAT . "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 253 no PDB 8RSA . "Crystal Structure Of Two Covalent Nucleoside Derivatives Of Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 254 no PDB 9RAT . "Effects Of Temperature On Protein Structure And Dynamics: X-Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine " . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 255 no PDB 9RSA . "Crystal Structure Of Two Covalent Nucleoside Derivatives Of Ribonuclease A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 256 no EMBL CAA30263 . "ribonuclease [Bos taurus]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 257 no EMBL CAA33801 . "unnamed protein product [Bos taurus]" . . . . . 98.41 125 100.00 100.00 1.28e-85 . . . . 16742 1 258 no EMBL CAB37066 . "artificial [synthetic construct]" . . . . . 98.41 128 100.00 100.00 1.38e-85 . . . . 16742 1 259 no GB AAA72269 . "ribonuclease S [synthetic construct]" . . . . . 82.54 105 100.00 100.00 2.39e-70 . . . . 16742 1 260 no GB AAA72757 . "RNase A [synthetic construct]" . . . . . 99.21 156 99.20 99.20 2.75e-86 . . . . 16742 1 261 no GB AAB35594 . "ribonuclease A, partial [Bos taurus]" . . . . . 100.00 128 98.41 99.21 4.25e-86 . . . . 16742 1 262 no GB AAB36134 . "pancreatic-type ribonuclease, partial [Bos taurus]" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 263 no GB AAI49530 . "RNASE1 protein [Bos taurus]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 264 no PIR JC5560 . "pancreatic ribonuclease (EC 3.1.27.5) A - Aspergillus niger var. macrosporus" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 265 no PIR NRBOB . "pancreatic ribonuclease (EC 3.1.27.5) - American bison (tentative sequence)" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 266 no PRF 630436A . RNase . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 267 no REF NP_001014408 . "ribonuclease pancreatic precursor [Bos taurus]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 268 no REF XP_005211519 . "PREDICTED: ribonuclease pancreatic isoform X1 [Bos taurus]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 269 no REF XP_005901936 . "PREDICTED: ribonuclease pancreatic [Bos mutus]" . . . . . 100.00 150 97.62 99.21 1.49e-86 . . . . 16742 1 270 no REF XP_010837737 . "PREDICTED: ribonuclease pancreatic [Bison bison bison]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 271 no SP P61823 . "RecName: Full=Ribonuclease pancreatic; AltName: Full=RNase 1; AltName: Full=RNase A; Flags: Precursor" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 272 no SP P61824 . "RecName: Full=Ribonuclease pancreatic; AltName: Full=RNase 1; AltName: Full=RNase A" . . . . . 98.41 124 100.00 100.00 1.09e-85 . . . . 16742 1 273 no TPE CDG32088 . "TPA: ribonuclease A C2 [Bos taurus]" . . . . . 100.00 215 98.41 99.21 4.47e-87 . . . . 16742 1 274 no TPG DAA25470 . "TPA: ribonuclease pancreatic precursor [Bos taurus]" . . . . . 100.00 150 98.41 99.21 5.46e-87 . . . . 16742 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 16742 1 2 . ALA . 16742 1 3 . LYS . 16742 1 4 . GLU . 16742 1 5 . THR . 16742 1 6 . ALA . 16742 1 7 . ALA . 16742 1 8 . ALA . 16742 1 9 . LYS . 16742 1 10 . PHE . 16742 1 11 . GLU . 16742 1 12 . ARG . 16742 1 13 . GLN . 16742 1 14 . HIS . 16742 1 15 . MET . 16742 1 16 . ASP . 16742 1 17 . SER . 16742 1 18 . SER . 16742 1 19 . THR . 16742 1 20 . SER . 16742 1 21 . ALA . 16742 1 22 . ALA . 16742 1 23 . SER . 16742 1 24 . SER . 16742 1 25 . SER . 16742 1 26 . ASN . 16742 1 27 . TYR . 16742 1 28 . CYS . 16742 1 29 . ASN . 16742 1 30 . GLN . 16742 1 31 . MET . 16742 1 32 . MET . 16742 1 33 . LYS . 16742 1 34 . SER . 16742 1 35 . ARG . 16742 1 36 . ASN . 16742 1 37 . LEU . 16742 1 38 . THR . 16742 1 39 . LYS . 16742 1 40 . ASP . 16742 1 41 . ARG . 16742 1 42 . CYS . 16742 1 43 . LYS . 16742 1 44 . PRO . 16742 1 45 . VAL . 16742 1 46 . ASN . 16742 1 47 . THR . 16742 1 48 . PHE . 16742 1 49 . VAL . 16742 1 50 . HIS . 16742 1 51 . GLU . 16742 1 52 . SER . 16742 1 53 . LEU . 16742 1 54 . ALA . 16742 1 55 . ASP . 16742 1 56 . VAL . 16742 1 57 . GLN . 16742 1 58 . ALA . 16742 1 59 . VAL . 16742 1 60 . CYS . 16742 1 61 . SER . 16742 1 62 . GLN . 16742 1 63 . LYS . 16742 1 64 . ASN . 16742 1 65 . VAL . 16742 1 66 . ALA . 16742 1 67 . CYS . 16742 1 68 . LYS . 16742 1 69 . ASN . 16742 1 70 . GLY . 16742 1 71 . GLN . 16742 1 72 . THR . 16742 1 73 . ASN . 16742 1 74 . CYS . 16742 1 75 . TYR . 16742 1 76 . GLN . 16742 1 77 . SER . 16742 1 78 . TYR . 16742 1 79 . SER . 16742 1 80 . THR . 16742 1 81 . MET . 16742 1 82 . SER . 16742 1 83 . ILE . 16742 1 84 . THR . 16742 1 85 . ASP . 16742 1 86 . CYS . 16742 1 87 . ARG . 16742 1 88 . GLU . 16742 1 89 . THR . 16742 1 90 . GLY . 16742 1 91 . SER . 16742 1 92 . SER . 16742 1 93 . LYS . 16742 1 94 . TYR . 16742 1 95 . PRO . 16742 1 96 . ASN . 16742 1 97 . CYS . 16742 1 98 . ALA . 16742 1 99 . TYR . 16742 1 100 . LYS . 16742 1 101 . THR . 16742 1 102 . THR . 16742 1 103 . GLN . 16742 1 104 . ALA . 16742 1 105 . ASN . 16742 1 106 . LYS . 16742 1 107 . HIS . 16742 1 108 . ILE . 16742 1 109 . ILE . 16742 1 110 . VAL . 16742 1 111 . ALA . 16742 1 112 . CYS . 16742 1 113 . GLU . 16742 1 114 . GLY . 16742 1 115 . ASN . 16742 1 116 . PRO . 16742 1 117 . TYR . 16742 1 118 . VAL . 16742 1 119 . PRO . 16742 1 120 . VAL . 16742 1 121 . HIS . 16742 1 122 . PHE . 16742 1 123 . ASP . 16742 1 124 . ALA . 16742 1 125 . SER . 16742 1 126 . VAL . 16742 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 16742 1 . ALA 2 2 16742 1 . LYS 3 3 16742 1 . GLU 4 4 16742 1 . THR 5 5 16742 1 . ALA 6 6 16742 1 . ALA 7 7 16742 1 . ALA 8 8 16742 1 . LYS 9 9 16742 1 . PHE 10 10 16742 1 . GLU 11 11 16742 1 . ARG 12 12 16742 1 . GLN 13 13 16742 1 . HIS 14 14 16742 1 . MET 15 15 16742 1 . ASP 16 16 16742 1 . SER 17 17 16742 1 . SER 18 18 16742 1 . THR 19 19 16742 1 . SER 20 20 16742 1 . ALA 21 21 16742 1 . ALA 22 22 16742 1 . SER 23 23 16742 1 . SER 24 24 16742 1 . SER 25 25 16742 1 . ASN 26 26 16742 1 . TYR 27 27 16742 1 . CYS 28 28 16742 1 . ASN 29 29 16742 1 . GLN 30 30 16742 1 . MET 31 31 16742 1 . MET 32 32 16742 1 . LYS 33 33 16742 1 . SER 34 34 16742 1 . ARG 35 35 16742 1 . ASN 36 36 16742 1 . LEU 37 37 16742 1 . THR 38 38 16742 1 . LYS 39 39 16742 1 . ASP 40 40 16742 1 . ARG 41 41 16742 1 . CYS 42 42 16742 1 . LYS 43 43 16742 1 . PRO 44 44 16742 1 . VAL 45 45 16742 1 . ASN 46 46 16742 1 . THR 47 47 16742 1 . PHE 48 48 16742 1 . VAL 49 49 16742 1 . HIS 50 50 16742 1 . GLU 51 51 16742 1 . SER 52 52 16742 1 . LEU 53 53 16742 1 . ALA 54 54 16742 1 . ASP 55 55 16742 1 . VAL 56 56 16742 1 . GLN 57 57 16742 1 . ALA 58 58 16742 1 . VAL 59 59 16742 1 . CYS 60 60 16742 1 . SER 61 61 16742 1 . GLN 62 62 16742 1 . LYS 63 63 16742 1 . ASN 64 64 16742 1 . VAL 65 65 16742 1 . ALA 66 66 16742 1 . CYS 67 67 16742 1 . LYS 68 68 16742 1 . ASN 69 69 16742 1 . GLY 70 70 16742 1 . GLN 71 71 16742 1 . THR 72 72 16742 1 . ASN 73 73 16742 1 . CYS 74 74 16742 1 . TYR 75 75 16742 1 . GLN 76 76 16742 1 . SER 77 77 16742 1 . TYR 78 78 16742 1 . SER 79 79 16742 1 . THR 80 80 16742 1 . MET 81 81 16742 1 . SER 82 82 16742 1 . ILE 83 83 16742 1 . THR 84 84 16742 1 . ASP 85 85 16742 1 . CYS 86 86 16742 1 . ARG 87 87 16742 1 . GLU 88 88 16742 1 . THR 89 89 16742 1 . GLY 90 90 16742 1 . SER 91 91 16742 1 . SER 92 92 16742 1 . LYS 93 93 16742 1 . TYR 94 94 16742 1 . PRO 95 95 16742 1 . ASN 96 96 16742 1 . CYS 97 97 16742 1 . ALA 98 98 16742 1 . TYR 99 99 16742 1 . LYS 100 100 16742 1 . THR 101 101 16742 1 . THR 102 102 16742 1 . GLN 103 103 16742 1 . ALA 104 104 16742 1 . ASN 105 105 16742 1 . LYS 106 106 16742 1 . HIS 107 107 16742 1 . ILE 108 108 16742 1 . ILE 109 109 16742 1 . VAL 110 110 16742 1 . ALA 111 111 16742 1 . CYS 112 112 16742 1 . GLU 113 113 16742 1 . GLY 114 114 16742 1 . ASN 115 115 16742 1 . PRO 116 116 16742 1 . TYR 117 117 16742 1 . VAL 118 118 16742 1 . PRO 119 119 16742 1 . VAL 120 120 16742 1 . HIS 121 121 16742 1 . PHE 122 122 16742 1 . ASP 123 123 16742 1 . ALA 124 124 16742 1 . SER 125 125 16742 1 . VAL 126 126 16742 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 16742 _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 $entity . 9913 organism . 'Bos taurus' cattle . . Eukaryota Metazoa Bos taurus . . . . . . . . . . . . . . . . . . . . . 16742 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 16742 _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 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET22B(+) . . . . . . 16742 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16742 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _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 'Bovine Pancreatic Ribonuclease A' '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.2 . . mM . . . . 16742 1 2 MES 'nautral abundance' . . . . . . 25 . . mM . . . . 16742 1 3 NaCl 'nautral abundance' . . . . . . 70 . . mM . . . . 16742 1 4 DTT 'nautral abundance' . . . . . . 10 . . mM . . . . 16742 1 5 EDTA 'nautral abundance' . . . . . . 0.5 . . mM . . . . 16742 1 6 H2O 'nautral abundance' . . . . . . 90 . . % . . . . 16742 1 7 D2O 'nautral abundance' . . . . . . 10 . . % . . . . 16742 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 16742 _Sample_condition_list.ID 1 _Sample_condition_list.Details ; 25 mM MES pH=5.5 70 mM NaCl 10 mM DTT 0.5 mM EDTA ; 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' 70 . mM 16742 1 pH 5.5 . pH 16742 1 pressure 1 . atm 16742 1 temperature 313.15 . K 16742 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 16742 _Software.ID 1 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 16742 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16742 1 'peak picking' 16742 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16742 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16742 _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 . 800 . . . 16742 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 16742 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16742 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16742 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16742 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 16742 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 16742 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16742 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 16742 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 16742 _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' . . . 16742 1 2 '3D HNCACB' . . . 16742 1 3 '3D CBCA(CO)NH' . . . 16742 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 $XEASY . . 16742 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 4 4 GLU H H 1 8.174 0.003 . 1 . . . . 4 GLU HN . 16742 1 2 . 1 1 4 4 GLU CA C 13 56.432 0.000 . 1 . . . . 4 GLU CA . 16742 1 3 . 1 1 4 4 GLU CB C 13 30.568 0.000 . 1 . . . . 4 GLU CB . 16742 1 4 . 1 1 4 4 GLU N N 15 121.524 0.009 . 1 . . . . 4 GLU N . 16742 1 5 . 1 1 5 5 THR H H 1 8.298 0.000 . 1 . . . . 5 THR HN . 16742 1 6 . 1 1 5 5 THR CA C 13 61.810 0.000 . 1 . . . . 5 THR CA . 16742 1 7 . 1 1 5 5 THR CB C 13 69.989 0.000 . 1 . . . . 5 THR CB . 16742 1 8 . 1 1 5 5 THR N N 15 116.482 0.014 . 1 . . . . 5 THR N . 16742 1 9 . 1 1 6 6 ALA H H 1 8.341 0.000 . 1 . . . . 6 ALA HN . 16742 1 10 . 1 1 6 6 ALA CA C 13 52.747 0.000 . 1 . . . . 6 ALA CA . 16742 1 11 . 1 1 6 6 ALA CB C 13 19.221 0.000 . 1 . . . . 6 ALA CB . 16742 1 12 . 1 1 6 6 ALA N N 15 126.577 0.005 . 1 . . . . 6 ALA N . 16742 1 13 . 1 1 7 7 ALA H H 1 8.130 0.000 . 1 . . . . 7 ALA HN . 16742 1 14 . 1 1 7 7 ALA CA C 13 52.674 0.000 . 1 . . . . 7 ALA CA . 16742 1 15 . 1 1 7 7 ALA CB C 13 19.221 0.000 . 1 . . . . 7 ALA CB . 16742 1 16 . 1 1 7 7 ALA N N 15 123.049 0.007 . 1 . . . . 7 ALA N . 16742 1 17 . 1 1 8 8 ALA H H 1 8.066 0.001 . 1 . . . . 8 ALA HN . 16742 1 18 . 1 1 8 8 ALA CA C 13 52.747 0.000 . 1 . . . . 8 ALA CA . 16742 1 19 . 1 1 8 8 ALA CB C 13 19.221 0.000 . 1 . . . . 8 ALA CB . 16742 1 20 . 1 1 8 8 ALA N N 15 123.011 0.013 . 1 . . . . 8 ALA N . 16742 1 21 . 1 1 9 9 LYS H H 1 8.017 0.001 . 1 . . . . 9 LYS HN . 16742 1 22 . 1 1 9 9 LYS CA C 13 56.653 0.000 . 1 . . . . 9 LYS CA . 16742 1 23 . 1 1 9 9 LYS CB C 13 33.074 0.000 . 1 . . . . 9 LYS CB . 16742 1 24 . 1 1 9 9 LYS N N 15 119.784 0.007 . 1 . . . . 9 LYS N . 16742 1 25 . 1 1 10 10 PHE H H 1 8.129 0.140 . 1 . . . . 10 PHE HN . 16742 1 26 . 1 1 10 10 PHE CA C 13 57.758 0.000 . 1 . . . . 10 PHE CA . 16742 1 27 . 1 1 10 10 PHE CB C 13 39.263 0.295 . 1 . . . . 10 PHE CB . 16742 1 28 . 1 1 10 10 PHE N N 15 120.032 0.471 . 1 . . . . 10 PHE N . 16742 1 29 . 1 1 15 15 MET H H 1 8.260 0.000 . 1 . . . . 15 MET HN . 16742 1 30 . 1 1 15 15 MET CA C 13 55.547 0.000 . 1 . . . . 15 MET CA . 16742 1 31 . 1 1 15 15 MET CB C 13 33.221 0.000 . 1 . . . . 15 MET CB . 16742 1 32 . 1 1 15 15 MET N N 15 121.890 0.005 . 1 . . . . 15 MET N . 16742 1 33 . 1 1 16 16 ASP H H 1 8.361 0.001 . 1 . . . . 16 ASP HN . 16742 1 34 . 1 1 16 16 ASP CA C 13 54.295 0.000 . 1 . . . . 16 ASP CA . 16742 1 35 . 1 1 16 16 ASP CB C 13 41.547 0.000 . 1 . . . . 16 ASP CB . 16742 1 36 . 1 1 16 16 ASP N N 15 121.879 0.007 . 1 . . . . 16 ASP N . 16742 1 37 . 1 1 17 17 SER H H 1 8.281 0.000 . 1 . . . . 17 SER HN . 16742 1 38 . 1 1 17 17 SER CA C 13 58.642 0.000 . 1 . . . . 17 SER CA . 16742 1 39 . 1 1 17 17 SER CB C 13 63.726 0.000 . 1 . . . . 17 SER CB . 16742 1 40 . 1 1 17 17 SER N N 15 116.496 0.001 . 1 . . . . 17 SER N . 16742 1 41 . 1 1 18 18 SER H H 1 8.394 0.001 . 1 . . . . 18 SER HN . 16742 1 42 . 1 1 18 18 SER CA C 13 59.010 0.000 . 1 . . . . 18 SER CA . 16742 1 43 . 1 1 18 18 SER CB C 13 63.800 0.000 . 1 . . . . 18 SER CB . 16742 1 44 . 1 1 18 18 SER N N 15 117.833 0.010 . 1 . . . . 18 SER N . 16742 1 45 . 1 1 19 19 THR H H 1 8.042 0.001 . 1 . . . . 19 THR HN . 16742 1 46 . 1 1 19 19 THR CA C 13 62.105 0.000 . 1 . . . . 19 THR CA . 16742 1 47 . 1 1 19 19 THR CB C 13 69.547 0.000 . 1 . . . . 19 THR CB . 16742 1 48 . 1 1 19 19 THR N N 15 114.979 0.007 . 1 . . . . 19 THR N . 16742 1 49 . 1 1 20 20 SER H H 1 8.141 0.000 . 1 . . . . 20 SER HN . 16742 1 50 . 1 1 20 20 SER CA C 13 58.568 0.000 . 1 . . . . 20 SER CA . 16742 1 51 . 1 1 20 20 SER CB C 13 63.874 0.000 . 1 . . . . 20 SER CB . 16742 1 52 . 1 1 20 20 SER N N 15 117.776 0.007 . 1 . . . . 20 SER N . 16742 1 53 . 1 1 21 21 ALA H H 1 8.200 0.000 . 1 . . . . 21 ALA HN . 16742 1 54 . 1 1 21 21 ALA CA C 13 52.747 0.000 . 1 . . . . 21 ALA CA . 16742 1 55 . 1 1 21 21 ALA CB C 13 19.221 0.000 . 1 . . . . 21 ALA CB . 16742 1 56 . 1 1 21 21 ALA N N 15 125.883 0.014 . 1 . . . . 21 ALA N . 16742 1 57 . 1 1 22 22 ALA H H 1 8.098 0.001 . 1 . . . . 22 ALA HN . 16742 1 58 . 1 1 22 22 ALA CA C 13 52.747 0.000 . 1 . . . . 22 ALA CA . 16742 1 59 . 1 1 22 22 ALA CB C 13 19.221 0.000 . 1 . . . . 22 ALA CB . 16742 1 60 . 1 1 22 22 ALA N N 15 122.542 0.013 . 1 . . . . 22 ALA N . 16742 1 61 . 1 1 23 23 SER H H 1 8.080 0.001 . 1 . . . . 23 SER HN . 16742 1 62 . 1 1 23 23 SER CA C 13 58.421 0.000 . 1 . . . . 23 SER CA . 16742 1 63 . 1 1 23 23 SER CB C 13 63.800 0.000 . 1 . . . . 23 SER CB . 16742 1 64 . 1 1 23 23 SER N N 15 114.276 0.007 . 1 . . . . 23 SER N . 16742 1 65 . 1 1 24 24 SER H H 1 8.241 0.000 . 1 . . . . 24 SER HN . 16742 1 66 . 1 1 24 24 SER CA C 13 58.568 0.000 . 1 . . . . 24 SER CA . 16742 1 67 . 1 1 24 24 SER CB C 13 63.800 0.000 . 1 . . . . 24 SER CB . 16742 1 68 . 1 1 24 24 SER N N 15 117.494 0.004 . 1 . . . . 24 SER N . 16742 1 69 . 1 1 25 25 SER H H 1 8.212 0.001 . 1 . . . . 25 SER HN . 16742 1 70 . 1 1 25 25 SER CA C 13 58.642 0.000 . 1 . . . . 25 SER CA . 16742 1 71 . 1 1 25 25 SER CB C 13 63.726 0.000 . 1 . . . . 25 SER CB . 16742 1 72 . 1 1 25 25 SER N N 15 117.255 0.002 . 1 . . . . 25 SER N . 16742 1 73 . 1 1 26 26 ASN H H 1 8.223 0.001 . 1 . . . . 26 ASN HN . 16742 1 74 . 1 1 26 26 ASN CA C 13 53.558 0.000 . 1 . . . . 26 ASN CA . 16742 1 75 . 1 1 26 26 ASN CB C 13 38.821 0.000 . 1 . . . . 26 ASN CB . 16742 1 76 . 1 1 26 26 ASN N N 15 120.122 0.005 . 1 . . . . 26 ASN N . 16742 1 77 . 1 1 27 27 TYR H H 1 8.014 0.003 . 1 . . . . 27 TYR HN . 16742 1 78 . 1 1 27 27 TYR CA C 13 58.421 0.000 . 1 . . . . 27 TYR CA . 16742 1 79 . 1 1 27 27 TYR CB C 13 38.747 0.000 . 1 . . . . 27 TYR CB . 16742 1 80 . 1 1 27 27 TYR N N 15 120.374 0.013 . 1 . . . . 27 TYR N . 16742 1 81 . 1 1 28 28 CYS H H 1 8.089 0.000 . 1 . . . . 28 CYS HN . 16742 1 82 . 1 1 28 28 CYS CA C 13 58.937 0.000 . 1 . . . . 28 CYS CA . 16742 1 83 . 1 1 28 28 CYS CB C 13 27.768 0.000 . 1 . . . . 28 CYS CB . 16742 1 84 . 1 1 28 28 CYS N N 15 120.009 0.001 . 1 . . . . 28 CYS N . 16742 1 85 . 1 1 29 29 ASN H H 1 8.250 0.001 . 1 . . . . 29 ASN HN . 16742 1 86 . 1 1 29 29 ASN CA C 13 54.000 0.000 . 1 . . . . 29 ASN CA . 16742 1 87 . 1 1 29 29 ASN CB C 13 38.747 0.000 . 1 . . . . 29 ASN CB . 16742 1 88 . 1 1 29 29 ASN N N 15 120.656 0.001 . 1 . . . . 29 ASN N . 16742 1 89 . 1 1 32 32 MET H H 1 8.077 0.001 . 1 . . . . 32 MET HN . 16742 1 90 . 1 1 32 32 MET CA C 13 55.989 0.000 . 1 . . . . 32 MET CA . 16742 1 91 . 1 1 32 32 MET CB C 13 32.705 0.000 . 1 . . . . 32 MET CB . 16742 1 92 . 1 1 32 32 MET N N 15 120.253 0.008 . 1 . . . . 32 MET N . 16742 1 93 . 1 1 33 33 LYS H H 1 8.086 0.001 . 1 . . . . 33 LYS HN . 16742 1 94 . 1 1 33 33 LYS CA C 13 56.874 0.000 . 1 . . . . 33 LYS CA . 16742 1 95 . 1 1 33 33 LYS CB C 13 33.000 0.000 . 1 . . . . 33 LYS CB . 16742 1 96 . 1 1 33 33 LYS N N 15 121.520 0.013 . 1 . . . . 33 LYS N . 16742 1 97 . 1 1 34 34 SER H H 1 8.088 0.001 . 1 . . . . 34 SER HN . 16742 1 98 . 1 1 34 34 SER CA C 13 58.642 0.000 . 1 . . . . 34 SER CA . 16742 1 99 . 1 1 34 34 SER CB C 13 63.726 0.000 . 1 . . . . 34 SER CB . 16742 1 100 . 1 1 34 34 SER N N 15 115.685 0.010 . 1 . . . . 34 SER N . 16742 1 101 . 1 1 35 35 ARG H H 1 8.179 0.000 . 1 . . . . 35 ARG HN . 16742 1 102 . 1 1 35 35 ARG CA C 13 56.358 0.000 . 1 . . . . 35 ARG CA . 16742 1 103 . 1 1 35 35 ARG CB C 13 30.863 0.000 . 1 . . . . 35 ARG CB . 16742 1 104 . 1 1 35 35 ARG N N 15 122.281 0.014 . 1 . . . . 35 ARG N . 16742 1 105 . 1 1 37 37 LEU H H 1 8.153 0.001 . 1 . . . . 37 LEU HN . 16742 1 106 . 1 1 37 37 LEU CA C 13 55.400 0.000 . 1 . . . . 37 LEU CA . 16742 1 107 . 1 1 37 37 LEU CB C 13 42.358 0.000 . 1 . . . . 37 LEU CB . 16742 1 108 . 1 1 37 37 LEU N N 15 122.542 0.013 . 1 . . . . 37 LEU N . 16742 1 109 . 1 1 38 38 THR H H 1 7.977 0.000 . 1 . . . . 38 THR HN . 16742 1 110 . 1 1 38 38 THR CA C 13 62.032 0.000 . 1 . . . . 38 THR CA . 16742 1 111 . 1 1 38 38 THR CB C 13 69.695 0.000 . 1 . . . . 38 THR CB . 16742 1 112 . 1 1 38 38 THR N N 15 114.098 0.004 . 1 . . . . 38 THR N . 16742 1 113 . 1 1 39 39 LYS H H 1 8.165 0.002 . 1 . . . . 39 LYS HN . 16742 1 114 . 1 1 39 39 LYS CA C 13 56.726 0.000 . 1 . . . . 39 LYS CA . 16742 1 115 . 1 1 39 39 LYS CB C 13 33.000 0.000 . 1 . . . . 39 LYS CB . 16742 1 116 . 1 1 39 39 LYS N N 15 122.826 0.005 . 1 . . . . 39 LYS N . 16742 1 117 . 1 1 40 40 ASP H H 1 8.191 0.001 . 1 . . . . 40 ASP HN . 16742 1 118 . 1 1 40 40 ASP CA C 13 54.663 0.000 . 1 . . . . 40 ASP CA . 16742 1 119 . 1 1 40 40 ASP CB C 13 41.326 0.000 . 1 . . . . 40 ASP CB . 16742 1 120 . 1 1 40 40 ASP N N 15 120.596 0.000 . 1 . . . . 40 ASP N . 16742 1 121 . 1 1 41 41 ARG H H 1 8.141 0.002 . 1 . . . . 41 ARG HN . 16742 1 122 . 1 1 41 41 ARG CA C 13 56.284 0.000 . 1 . . . . 41 ARG CA . 16742 1 123 . 1 1 41 41 ARG CB C 13 30.789 0.000 . 1 . . . . 41 ARG CB . 16742 1 124 . 1 1 41 41 ARG N N 15 120.582 0.014 . 1 . . . . 41 ARG N . 16742 1 125 . 1 1 42 42 CYS H H 1 8.206 0.000 . 1 . . . . 42 CYS HN . 16742 1 126 . 1 1 42 42 CYS CA C 13 58.495 0.000 . 1 . . . . 42 CYS CA . 16742 1 127 . 1 1 42 42 CYS CB C 13 28.137 0.000 . 1 . . . . 42 CYS CB . 16742 1 128 . 1 1 42 42 CYS N N 15 119.305 0.001 . 1 . . . . 42 CYS N . 16742 1 129 . 1 1 43 43 LYS H H 1 8.158 0.000 . 1 . . . . 43 LYS HN . 16742 1 130 . 1 1 43 43 LYS CA C 13 54.295 0.000 . 1 . . . . 43 LYS CA . 16742 1 131 . 1 1 43 43 LYS CB C 13 32.705 0.000 . 1 . . . . 43 LYS CB . 16742 1 132 . 1 1 43 43 LYS N N 15 124.279 0.008 . 1 . . . . 43 LYS N . 16742 1 133 . 1 1 45 45 VAL H H 1 7.900 0.000 . 1 . . . . 45 VAL HN . 16742 1 134 . 1 1 45 45 VAL CA C 13 62.179 0.000 . 1 . . . . 45 VAL CA . 16742 1 135 . 1 1 45 45 VAL CB C 13 32.926 0.000 . 1 . . . . 45 VAL CB . 16742 1 136 . 1 1 45 45 VAL N N 15 119.540 0.001 . 1 . . . . 45 VAL N . 16742 1 137 . 1 1 46 46 ASN H H 1 8.355 0.001 . 1 . . . . 46 ASN HN . 16742 1 138 . 1 1 46 46 ASN CA C 13 53.116 0.000 . 1 . . . . 46 ASN CA . 16742 1 139 . 1 1 46 46 ASN CB C 13 39.116 0.000 . 1 . . . . 46 ASN CB . 16742 1 140 . 1 1 46 46 ASN N N 15 121.652 0.000 . 1 . . . . 46 ASN N . 16742 1 141 . 1 1 47 47 THR H H 1 7.924 0.002 . 1 . . . . 47 THR HN . 16742 1 142 . 1 1 47 47 THR CA C 13 61.884 0.000 . 1 . . . . 47 THR CA . 16742 1 143 . 1 1 47 47 THR CB C 13 69.621 0.000 . 1 . . . . 47 THR CB . 16742 1 144 . 1 1 47 47 THR N N 15 114.089 0.005 . 1 . . . . 47 THR N . 16742 1 145 . 1 1 48 48 PHE H H 1 8.106 0.001 . 1 . . . . 48 PHE HN . 16742 1 146 . 1 1 48 48 PHE CA C 13 57.610 0.000 . 1 . . . . 48 PHE CA . 16742 1 147 . 1 1 48 48 PHE CB C 13 39.484 0.000 . 1 . . . . 48 PHE CB . 16742 1 148 . 1 1 48 48 PHE N N 15 121.933 0.010 . 1 . . . . 48 PHE N . 16742 1 149 . 1 1 49 49 VAL H H 1 7.875 0.000 . 1 . . . . 49 VAL HN . 16742 1 150 . 1 1 49 49 VAL CA C 13 62.218 0.000 . 1 . . . . 49 VAL CA . 16742 1 151 . 1 1 49 49 VAL CB C 13 32.926 0.000 . 1 . . . . 49 VAL CB . 16742 1 152 . 1 1 49 49 VAL N N 15 121.311 0.012 . 1 . . . . 49 VAL N . 16742 1 153 . 1 1 50 50 HIS H H 1 8.382 0.001 . 1 . . . . 50 HIS HN . 16742 1 154 . 1 1 50 50 HIS CA C 13 55.469 0.000 . 1 . . . . 50 HIS CA . 16742 1 155 . 1 1 50 50 HIS CB C 13 29.537 0.000 . 1 . . . . 50 HIS CB . 16742 1 156 . 1 1 50 50 HIS N N 15 122.297 0.002 . 1 . . . . 50 HIS N . 16742 1 157 . 1 1 51 51 GLU H H 1 8.436 0.002 . 1 . . . . 51 GLU HN . 16742 1 158 . 1 1 51 51 GLU CA C 13 56.680 0.000 . 1 . . . . 51 GLU CA . 16742 1 159 . 1 1 51 51 GLU CB C 13 30.495 0.000 . 1 . . . . 51 GLU CB . 16742 1 160 . 1 1 51 51 GLU N N 15 122.749 0.014 . 1 . . . . 51 GLU N . 16742 1 161 . 1 1 52 52 SER H H 1 8.399 0.001 . 1 . . . . 52 SER HN . 16742 1 162 . 1 1 52 52 SER CA C 13 58.238 0.000 . 1 . . . . 52 SER CA . 16742 1 163 . 1 1 52 52 SER CB C 13 63.874 0.000 . 1 . . . . 52 SER CB . 16742 1 164 . 1 1 52 52 SER N N 15 117.128 0.011 . 1 . . . . 52 SER N . 16742 1 165 . 1 1 53 53 LEU H H 1 8.236 0.001 . 1 . . . . 53 LEU HN . 16742 1 166 . 1 1 53 53 LEU CA C 13 55.469 0.000 . 1 . . . . 53 LEU CA . 16742 1 167 . 1 1 53 53 LEU CB C 13 42.284 0.000 . 1 . . . . 53 LEU CB . 16742 1 168 . 1 1 53 53 LEU N N 15 124.279 0.008 . 1 . . . . 53 LEU N . 16742 1 169 . 1 1 54 54 ALA H H 1 8.080 0.000 . 1 . . . . 54 ALA HN . 16742 1 170 . 1 1 54 54 ALA CA C 13 52.959 0.000 . 1 . . . . 54 ALA CA . 16742 1 171 . 1 1 54 54 ALA CB C 13 19.295 0.000 . 1 . . . . 54 ALA CB . 16742 1 172 . 1 1 54 54 ALA N N 15 123.471 0.004 . 1 . . . . 54 ALA N . 16742 1 173 . 1 1 55 55 ASP H H 1 8.073 0.000 . 1 . . . . 55 ASP HN . 16742 1 174 . 1 1 55 55 ASP CA C 13 54.517 0.000 . 1 . . . . 55 ASP CA . 16742 1 175 . 1 1 55 55 ASP CB C 13 41.105 0.000 . 1 . . . . 55 ASP CB . 16742 1 176 . 1 1 55 55 ASP N N 15 118.967 0.011 . 1 . . . . 55 ASP N . 16742 1 177 . 1 1 56 56 VAL H H 1 7.864 0.002 . 1 . . . . 56 VAL HN . 16742 1 178 . 1 1 56 56 VAL CA C 13 62.823 0.000 . 1 . . . . 56 VAL CA . 16742 1 179 . 1 1 56 56 VAL CB C 13 32.558 0.000 . 1 . . . . 56 VAL CB . 16742 1 180 . 1 1 56 56 VAL N N 15 119.549 0.008 . 1 . . . . 56 VAL N . 16742 1 181 . 1 1 57 57 GLN H H 1 8.250 0.000 . 1 . . . . 57 GLN HN . 16742 1 182 . 1 1 57 57 GLN CA C 13 56.074 0.000 . 1 . . . . 57 GLN CA . 16742 1 183 . 1 1 57 57 GLN CB C 13 29.316 0.000 . 1 . . . . 57 GLN CB . 16742 1 184 . 1 1 57 57 GLN N N 15 122.289 0.006 . 1 . . . . 57 GLN N . 16742 1 185 . 1 1 58 58 ALA H H 1 8.069 0.000 . 1 . . . . 58 ALA HN . 16742 1 186 . 1 1 58 58 ALA CA C 13 52.747 0.000 . 1 . . . . 58 ALA CA . 16742 1 187 . 1 1 58 58 ALA CB C 13 19.295 0.000 . 1 . . . . 58 ALA CB . 16742 1 188 . 1 1 58 58 ALA N N 15 124.466 0.003 . 1 . . . . 58 ALA N . 16742 1 189 . 1 1 59 59 VAL H H 1 7.937 0.000 . 1 . . . . 59 VAL HN . 16742 1 190 . 1 1 59 59 VAL CA C 13 62.695 0.000 . 1 . . . . 59 VAL CA . 16742 1 191 . 1 1 59 59 VAL CB C 13 32.632 0.000 . 1 . . . . 59 VAL CB . 16742 1 192 . 1 1 59 59 VAL N N 15 118.377 0.007 . 1 . . . . 59 VAL N . 16742 1 193 . 1 1 60 60 CYS H H 1 8.277 0.001 . 1 . . . . 60 CYS HN . 16742 1 194 . 1 1 60 60 CYS CA C 13 58.789 0.000 . 1 . . . . 60 CYS CA . 16742 1 195 . 1 1 60 60 CYS CB C 13 27.916 0.000 . 1 . . . . 60 CYS CB . 16742 1 196 . 1 1 60 60 CYS N N 15 121.895 0.010 . 1 . . . . 60 CYS N . 16742 1 197 . 1 1 61 61 SER H H 1 8.262 0.000 . 1 . . . . 61 SER HN . 16742 1 198 . 1 1 61 61 SER CA C 13 58.789 0.000 . 1 . . . . 61 SER CA . 16742 1 199 . 1 1 61 61 SER CB C 13 63.726 0.000 . 1 . . . . 61 SER CB . 16742 1 200 . 1 1 61 61 SER N N 15 118.029 0.011 . 1 . . . . 61 SER N . 16742 1 201 . 1 1 62 62 GLN H H 1 8.228 0.000 . 1 . . . . 62 GLN HN . 16742 1 202 . 1 1 62 62 GLN CA C 13 56.137 0.000 . 1 . . . . 62 GLN CA . 16742 1 203 . 1 1 62 62 GLN CB C 13 29.463 0.000 . 1 . . . . 62 GLN CB . 16742 1 204 . 1 1 62 62 GLN N N 15 121.885 0.000 . 1 . . . . 62 GLN N . 16742 1 205 . 1 1 64 64 ASN H H 1 8.311 0.000 . 1 . . . . 64 ASN HN . 16742 1 206 . 1 1 64 64 ASN CA C 13 53.337 0.000 . 1 . . . . 64 ASN CA . 16742 1 207 . 1 1 64 64 ASN CB C 13 38.895 0.000 . 1 . . . . 64 ASN CB . 16742 1 208 . 1 1 64 64 ASN N N 15 119.136 0.005 . 1 . . . . 64 ASN N . 16742 1 209 . 1 1 65 65 VAL H H 1 7.925 0.000 . 1 . . . . 65 VAL HN . 16742 1 210 . 1 1 65 65 VAL CA C 13 62.218 0.000 . 1 . . . . 65 VAL CA . 16742 1 211 . 1 1 65 65 VAL CB C 13 32.853 0.000 . 1 . . . . 65 VAL CB . 16742 1 212 . 1 1 65 65 VAL N N 15 119.775 0.001 . 1 . . . . 65 VAL N . 16742 1 213 . 1 1 66 66 ALA H H 1 8.232 0.001 . 1 . . . . 66 ALA HN . 16742 1 214 . 1 1 66 66 ALA CA C 13 52.527 0.000 . 1 . . . . 66 ALA CA . 16742 1 215 . 1 1 66 66 ALA CB C 13 19.295 0.000 . 1 . . . . 66 ALA CB . 16742 1 216 . 1 1 66 66 ALA N N 15 126.738 0.011 . 1 . . . . 66 ALA N . 16742 1 217 . 1 1 67 67 CYS H H 1 8.133 0.000 . 1 . . . . 67 CYS HN . 16742 1 218 . 1 1 67 67 CYS CA C 13 58.411 0.000 . 1 . . . . 67 CYS CA . 16742 1 219 . 1 1 67 67 CYS CB C 13 28.137 0.000 . 1 . . . . 67 CYS CB . 16742 1 220 . 1 1 67 67 CYS N N 15 118.264 0.011 . 1 . . . . 67 CYS N . 16742 1 221 . 1 1 68 68 LYS H H 1 8.326 0.000 . 1 . . . . 68 LYS HN . 16742 1 222 . 1 1 68 68 LYS CA C 13 56.594 0.000 . 1 . . . . 68 LYS CA . 16742 1 223 . 1 1 68 68 LYS CB C 13 32.926 0.000 . 1 . . . . 68 LYS CB . 16742 1 224 . 1 1 68 68 LYS N N 15 123.715 0.014 . 1 . . . . 68 LYS N . 16742 1 225 . 1 1 69 69 ASN H H 1 8.298 0.001 . 1 . . . . 69 ASN HN . 16742 1 226 . 1 1 69 69 ASN CA C 13 53.306 0.000 . 1 . . . . 69 ASN CA . 16742 1 227 . 1 1 69 69 ASN CB C 13 38.968 0.000 . 1 . . . . 69 ASN CB . 16742 1 228 . 1 1 69 69 ASN N N 15 119.314 0.007 . 1 . . . . 69 ASN N . 16742 1 229 . 1 1 70 70 GLY H H 1 8.295 0.000 . 1 . . . . 70 GLY HN . 16742 1 230 . 1 1 70 70 GLY CA C 13 45.605 0.000 . 1 . . . . 70 GLY CA . 16742 1 231 . 1 1 70 70 GLY N N 15 109.910 0.000 . 1 . . . . 70 GLY N . 16742 1 232 . 1 1 71 71 GLN H H 1 8.123 0.000 . 1 . . . . 71 GLN HN . 16742 1 233 . 1 1 71 71 GLN CA C 13 55.901 0.000 . 1 . . . . 71 GLN CA . 16742 1 234 . 1 1 71 71 GLN CB C 13 29.610 0.000 . 1 . . . . 71 GLN CB . 16742 1 235 . 1 1 71 71 GLN N N 15 119.718 0.001 . 1 . . . . 71 GLN N . 16742 1 236 . 1 1 72 72 THR H H 1 8.122 0.002 . 1 . . . . 72 THR HN . 16742 1 237 . 1 1 72 72 THR CA C 13 61.958 0.000 . 1 . . . . 72 THR CA . 16742 1 238 . 1 1 72 72 THR CB C 13 69.695 0.000 . 1 . . . . 72 THR CB . 16742 1 239 . 1 1 72 72 THR N N 15 114.623 0.003 . 1 . . . . 72 THR N . 16742 1 240 . 1 1 73 73 ASN H H 1 8.372 0.000 . 1 . . . . 73 ASN HN . 16742 1 241 . 1 1 73 73 ASN CA C 13 53.263 0.000 . 1 . . . . 73 ASN CA . 16742 1 242 . 1 1 73 73 ASN CB C 13 38.895 0.000 . 1 . . . . 73 ASN CB . 16742 1 243 . 1 1 73 73 ASN N N 15 120.647 0.007 . 1 . . . . 73 ASN N . 16742 1 244 . 1 1 74 74 CYS H H 1 8.123 0.001 . 1 . . . . 74 CYS HN . 16742 1 245 . 1 1 74 74 CYS CA C 13 58.421 0.000 . 1 . . . . 74 CYS CA . 16742 1 246 . 1 1 74 74 CYS CB C 13 28.063 0.000 . 1 . . . . 74 CYS CB . 16742 1 247 . 1 1 74 74 CYS N N 15 118.885 0.012 . 1 . . . . 74 CYS N . 16742 1 248 . 1 1 75 75 TYR H H 1 8.136 0.001 . 1 . . . . 75 TYR HN . 16742 1 249 . 1 1 75 75 TYR CA C 13 58.126 0.000 . 1 . . . . 75 TYR CA . 16742 1 250 . 1 1 75 75 TYR CB C 13 38.600 0.000 . 1 . . . . 75 TYR CB . 16742 1 251 . 1 1 75 75 TYR N N 15 122.129 0.010 . 1 . . . . 75 TYR N . 16742 1 252 . 1 1 76 76 GLN H H 1 8.066 0.000 . 1 . . . . 76 GLN HN . 16742 1 253 . 1 1 76 76 GLN CA C 13 55.842 0.000 . 1 . . . . 76 GLN CA . 16742 1 254 . 1 1 76 76 GLN CB C 13 29.684 0.000 . 1 . . . . 76 GLN CB . 16742 1 255 . 1 1 76 76 GLN N N 15 121.473 0.002 . 1 . . . . 76 GLN N . 16742 1 256 . 1 1 77 77 SER H H 1 8.098 0.001 . 1 . . . . 77 SER HN . 16742 1 257 . 1 1 77 77 SER CA C 13 58.200 0.000 . 1 . . . . 77 SER CA . 16742 1 258 . 1 1 77 77 SER CB C 13 63.800 0.000 . 1 . . . . 77 SER CB . 16742 1 259 . 1 1 77 77 SER N N 15 116.499 0.004 . 1 . . . . 77 SER N . 16742 1 260 . 1 1 78 78 TYR H H 1 8.053 0.000 . 1 . . . . 78 TYR HN . 16742 1 261 . 1 1 78 78 TYR CA C 13 58.053 0.000 . 1 . . . . 78 TYR CA . 16742 1 262 . 1 1 78 78 TYR CB C 13 38.821 0.000 . 1 . . . . 78 TYR CB . 16742 1 263 . 1 1 78 78 TYR N N 15 121.660 0.009 . 1 . . . . 78 TYR N . 16742 1 264 . 1 1 79 79 SER H H 1 8.135 0.001 . 1 . . . . 79 SER HN . 16742 1 265 . 1 1 79 79 SER CA C 13 58.200 0.000 . 1 . . . . 79 SER CA . 16742 1 266 . 1 1 79 79 SER CB C 13 63.874 0.000 . 1 . . . . 79 SER CB . 16742 1 267 . 1 1 79 79 SER N N 15 116.499 0.004 . 1 . . . . 79 SER N . 16742 1 268 . 1 1 80 80 THR H H 1 8.035 0.000 . 1 . . . . 80 THR HN . 16742 1 269 . 1 1 80 80 THR CA C 13 62.032 0.000 . 1 . . . . 80 THR CA . 16742 1 270 . 1 1 80 80 THR CB C 13 69.547 0.000 . 1 . . . . 80 THR CB . 16742 1 271 . 1 1 80 80 THR N N 15 115.205 0.001 . 1 . . . . 80 THR N . 16742 1 272 . 1 1 81 81 MET H H 1 8.135 0.001 . 1 . . . . 81 MET HN . 16742 1 273 . 1 1 81 81 MET CA C 13 55.768 0.000 . 1 . . . . 81 MET CA . 16742 1 274 . 1 1 81 81 MET CB C 13 33.295 0.000 . 1 . . . . 81 MET CB . 16742 1 275 . 1 1 81 81 MET N N 15 121.942 0.001 . 1 . . . . 81 MET N . 16742 1 276 . 1 1 82 82 SER H H 1 8.240 0.001 . 1 . . . . 82 SER HN . 16742 1 277 . 1 1 82 82 SER CA C 13 58.126 0.000 . 1 . . . . 82 SER CA . 16742 1 278 . 1 1 82 82 SER CB C 13 63.800 0.000 . 1 . . . . 82 SER CB . 16742 1 279 . 1 1 82 82 SER N N 15 116.969 0.005 . 1 . . . . 82 SER N . 16742 1 280 . 1 1 83 83 ILE H H 1 8.109 0.000 . 1 . . . . 83 ILE HN . 16742 1 281 . 1 1 83 83 ILE CA C 13 61.516 0.000 . 1 . . . . 83 ILE CA . 16742 1 282 . 1 1 83 83 ILE CB C 13 38.821 0.000 . 1 . . . . 83 ILE CB . 16742 1 283 . 1 1 83 83 ILE N N 15 122.289 0.006 . 1 . . . . 83 ILE N . 16742 1 284 . 1 1 84 84 THR H H 1 8.037 0.001 . 1 . . . . 84 THR HN . 16742 1 285 . 1 1 84 84 THR CA C 13 61.958 0.000 . 1 . . . . 84 THR CA . 16742 1 286 . 1 1 84 84 THR CB C 13 69.695 0.000 . 1 . . . . 84 THR CB . 16742 1 287 . 1 1 84 84 THR N N 15 116.669 0.002 . 1 . . . . 84 THR N . 16742 1 288 . 1 1 85 85 ASP H H 1 8.156 0.001 . 1 . . . . 85 ASP HN . 16742 1 289 . 1 1 85 85 ASP CA C 13 54.295 0.000 . 1 . . . . 85 ASP CA . 16742 1 290 . 1 1 85 85 ASP CB C 13 41.474 0.000 . 1 . . . . 85 ASP CB . 16742 1 291 . 1 1 85 85 ASP N N 15 122.711 0.006 . 1 . . . . 85 ASP N . 16742 1 292 . 1 1 86 86 CYS H H 1 8.234 0.000 . 1 . . . . 86 CYS HN . 16742 1 293 . 1 1 86 86 CYS CA C 13 58.642 0.000 . 1 . . . . 86 CYS CA . 16742 1 294 . 1 1 86 86 CYS CB C 13 27.842 0.000 . 1 . . . . 86 CYS CB . 16742 1 295 . 1 1 86 86 CYS N N 15 119.906 0.013 . 1 . . . . 86 CYS N . 16742 1 296 . 1 1 87 87 ARG H H 1 8.337 0.000 . 1 . . . . 87 ARG HN . 16742 1 297 . 1 1 87 87 ARG CA C 13 56.579 0.000 . 1 . . . . 87 ARG CA . 16742 1 298 . 1 1 87 87 ARG CB C 13 30.716 0.000 . 1 . . . . 87 ARG CB . 16742 1 299 . 1 1 87 87 ARG N N 15 122.984 0.014 . 1 . . . . 87 ARG N . 16742 1 300 . 1 1 88 88 GLU H H 1 8.313 0.001 . 1 . . . . 88 GLU HN . 16742 1 301 . 1 1 88 88 GLU CA C 13 56.726 0.000 . 1 . . . . 88 GLU CA . 16742 1 302 . 1 1 88 88 GLU CB C 13 30.200 0.000 . 1 . . . . 88 GLU CB . 16742 1 303 . 1 1 88 88 GLU N N 15 121.070 0.004 . 1 . . . . 88 GLU N . 16742 1 304 . 1 1 89 89 THR H H 1 8.105 0.001 . 1 . . . . 89 THR HN . 16742 1 305 . 1 1 89 89 THR CA C 13 62.032 0.000 . 1 . . . . 89 THR CA . 16742 1 306 . 1 1 89 89 THR CB C 13 69.695 0.000 . 1 . . . . 89 THR CB . 16742 1 307 . 1 1 89 89 THR N N 15 114.314 0.013 . 1 . . . . 89 THR N . 16742 1 308 . 1 1 90 90 GLY H H 1 8.374 0.000 . 1 . . . . 90 GLY HN . 16742 1 309 . 1 1 90 90 GLY CA C 13 45.605 0.000 . 1 . . . . 90 GLY CA . 16742 1 310 . 1 1 90 90 GLY N N 15 109.910 0.000 . 1 . . . . 90 GLY N . 16742 1 311 . 1 1 91 91 SER H H 1 8.105 0.000 . 1 . . . . 91 SER HN . 16742 1 312 . 1 1 91 91 SER CA C 13 58.421 0.000 . 1 . . . . 91 SER CA . 16742 1 313 . 1 1 91 91 SER CB C 13 63.874 0.000 . 1 . . . . 91 SER CB . 16742 1 314 . 1 1 91 91 SER N N 15 115.309 0.014 . 1 . . . . 91 SER N . 16742 1 315 . 1 1 92 92 SER H H 1 8.180 0.001 . 1 . . . . 92 SER HN . 16742 1 316 . 1 1 92 92 SER CA C 13 58.568 0.000 . 1 . . . . 92 SER CA . 16742 1 317 . 1 1 92 92 SER CB C 13 63.800 0.000 . 1 . . . . 92 SER CB . 16742 1 318 . 1 1 92 92 SER N N 15 117.307 0.008 . 1 . . . . 92 SER N . 16742 1 319 . 1 1 93 93 LYS H H 1 8.065 0.000 . 1 . . . . 93 LYS HN . 16742 1 320 . 1 1 93 93 LYS CA C 13 56.358 0.000 . 1 . . . . 93 LYS CA . 16742 1 321 . 1 1 93 93 LYS CB C 13 33.147 0.000 . 1 . . . . 93 LYS CB . 16742 1 322 . 1 1 93 93 LYS N N 15 122.299 0.004 . 1 . . . . 93 LYS N . 16742 1 323 . 1 1 96 96 ASN H H 1 8.354 0.000 . 1 . . . . 96 ASN HN . 16742 1 324 . 1 1 96 96 ASN CA C 13 53.484 0.000 . 1 . . . . 96 ASN CA . 16742 1 325 . 1 1 96 96 ASN CB C 13 38.821 0.000 . 1 . . . . 96 ASN CB . 16742 1 326 . 1 1 96 96 ASN N N 15 118.124 0.012 . 1 . . . . 96 ASN N . 16742 1 327 . 1 1 97 97 CYS H H 1 8.145 0.003 . 1 . . . . 97 CYS HN . 16742 1 328 . 1 1 97 97 CYS CA C 13 58.568 0.000 . 1 . . . . 97 CYS CA . 16742 1 329 . 1 1 97 97 CYS CB C 13 28.063 0.000 . 1 . . . . 97 CYS CB . 16742 1 330 . 1 1 97 97 CYS N N 15 118.902 0.004 . 1 . . . . 97 CYS N . 16742 1 331 . 1 1 98 98 ALA H H 1 8.225 0.000 . 1 . . . . 98 ALA HN . 16742 1 332 . 1 1 98 98 ALA CA C 13 52.747 0.000 . 1 . . . . 98 ALA CA . 16742 1 333 . 1 1 98 98 ALA CB C 13 19.221 0.000 . 1 . . . . 98 ALA CB . 16742 1 334 . 1 1 98 98 ALA N N 15 125.808 0.002 . 1 . . . . 98 ALA N . 16742 1 335 . 1 1 99 99 TYR H H 1 7.851 0.000 . 1 . . . . 99 TYR HN . 16742 1 336 . 1 1 99 99 TYR CA C 13 57.832 0.000 . 1 . . . . 99 TYR CA . 16742 1 337 . 1 1 99 99 TYR CB C 13 38.821 0.000 . 1 . . . . 99 TYR CB . 16742 1 338 . 1 1 99 99 TYR N N 15 118.659 0.005 . 1 . . . . 99 TYR N . 16742 1 339 . 1 1 100 100 LYS H H 1 8.026 0.002 . 1 . . . . 100 LYS HN . 16742 1 340 . 1 1 100 100 LYS CA C 13 56.284 0.000 . 1 . . . . 100 LYS CA . 16742 1 341 . 1 1 100 100 LYS CB C 13 33.295 0.000 . 1 . . . . 100 LYS CB . 16742 1 342 . 1 1 100 100 LYS N N 15 122.299 0.004 . 1 . . . . 100 LYS N . 16742 1 343 . 1 1 101 101 THR H H 1 8.031 0.001 . 1 . . . . 101 THR HN . 16742 1 344 . 1 1 101 101 THR CA C 13 61.884 0.000 . 1 . . . . 101 THR CA . 16742 1 345 . 1 1 101 101 THR CB C 13 69.695 0.000 . 1 . . . . 101 THR CB . 16742 1 346 . 1 1 101 101 THR N N 15 114.744 0.007 . 1 . . . . 101 THR N . 16742 1 347 . 1 1 102 102 THR H H 1 8.075 0.000 . 1 . . . . 102 THR HN . 16742 1 348 . 1 1 102 102 THR CA C 13 61.884 0.000 . 1 . . . . 102 THR CA . 16742 1 349 . 1 1 102 102 THR CB C 13 69.768 0.000 . 1 . . . . 102 THR CB . 16742 1 350 . 1 1 102 102 THR N N 15 115.721 0.012 . 1 . . . . 102 THR N . 16742 1 351 . 1 1 103 103 GLN H H 1 8.249 0.000 . 1 . . . . 103 GLN HN . 16742 1 352 . 1 1 103 103 GLN CA C 13 56.063 0.000 . 1 . . . . 103 GLN CA . 16742 1 353 . 1 1 103 103 GLN CB C 13 29.389 0.000 . 1 . . . . 103 GLN CB . 16742 1 354 . 1 1 103 103 GLN N N 15 122.186 0.007 . 1 . . . . 103 GLN N . 16742 1 355 . 1 1 104 104 ALA H H 1 8.184 0.001 . 1 . . . . 104 ALA HN . 16742 1 356 . 1 1 104 104 ALA CA C 13 52.895 0.000 . 1 . . . . 104 ALA CA . 16742 1 357 . 1 1 104 104 ALA CB C 13 19.221 0.000 . 1 . . . . 104 ALA CB . 16742 1 358 . 1 1 104 104 ALA N N 15 124.531 0.010 . 1 . . . . 104 ALA N . 16742 1 359 . 1 1 107 107 HIS H H 1 8.359 0.000 . 1 . . . . 107 HIS HN . 16742 1 360 . 1 1 107 107 HIS CA C 13 55.400 0.000 . 1 . . . . 107 HIS CA . 16742 1 361 . 1 1 107 107 HIS CB C 13 29.389 0.000 . 1 . . . . 107 HIS CB . 16742 1 362 . 1 1 107 107 HIS N N 15 119.371 0.005 . 1 . . . . 107 HIS N . 16742 1 363 . 1 1 108 108 ILE H H 1 7.988 0.000 . 1 . . . . 108 ILE HN . 16742 1 364 . 1 1 108 108 ILE CA C 13 61.000 0.000 . 1 . . . . 108 ILE CA . 16742 1 365 . 1 1 108 108 ILE CB C 13 39.042 0.000 . 1 . . . . 108 ILE CB . 16742 1 366 . 1 1 108 108 ILE N N 15 122.242 0.006 . 1 . . . . 108 ILE N . 16742 1 367 . 1 1 109 109 ILE H H 1 8.160 0.001 . 1 . . . . 109 ILE HN . 16742 1 368 . 1 1 109 109 ILE CA C 13 60.853 0.000 . 1 . . . . 109 ILE CA . 16742 1 369 . 1 1 109 109 ILE CB C 13 38.674 0.000 . 1 . . . . 109 ILE CB . 16742 1 370 . 1 1 109 109 ILE N N 15 125.470 0.011 . 1 . . . . 109 ILE N . 16742 1 371 . 1 1 110 110 VAL H H 1 8.111 0.000 . 1 . . . . 110 VAL HN . 16742 1 372 . 1 1 110 110 VAL CA C 13 61.958 0.000 . 1 . . . . 110 VAL CA . 16742 1 373 . 1 1 110 110 VAL CB C 13 33.000 0.000 . 1 . . . . 110 VAL CB . 16742 1 374 . 1 1 110 110 VAL N N 15 124.748 0.008 . 1 . . . . 110 VAL N . 16742 1 375 . 1 1 111 111 ALA H H 1 8.279 0.000 . 1 . . . . 111 ALA HN . 16742 1 376 . 1 1 111 111 ALA CA C 13 52.526 0.000 . 1 . . . . 111 ALA CA . 16742 1 377 . 1 1 111 111 ALA CB C 13 19.368 0.000 . 1 . . . . 111 ALA CB . 16742 1 378 . 1 1 111 111 ALA N N 15 127.732 0.012 . 1 . . . . 111 ALA N . 16742 1 379 . 1 1 112 112 CYS H H 1 8.232 0.001 . 1 . . . . 112 CYS HN . 16742 1 380 . 1 1 112 112 CYS CA C 13 58.274 0.000 . 1 . . . . 112 CYS CA . 16742 1 381 . 1 1 112 112 CYS CB C 13 28.137 0.000 . 1 . . . . 112 CYS CB . 16742 1 382 . 1 1 112 112 CYS N N 15 118.377 0.007 . 1 . . . . 112 CYS N . 16742 1 383 . 1 1 113 113 GLU H H 1 8.457 0.000 . 1 . . . . 113 GLU HN . 16742 1 384 . 1 1 113 113 GLU CA C 13 56.947 0.000 . 1 . . . . 113 GLU CA . 16742 1 385 . 1 1 113 113 GLU CB C 13 30.274 0.000 . 1 . . . . 113 GLU CB . 16742 1 386 . 1 1 113 113 GLU N N 15 123.245 0.014 . 1 . . . . 113 GLU N . 16742 1 387 . 1 1 114 114 GLY H H 1 8.309 0.000 . 1 . . . . 114 GLY HN . 16742 1 388 . 1 1 114 114 GLY CA C 13 45.172 0.000 . 1 . . . . 114 GLY CA . 16742 1 389 . 1 1 114 114 GLY N N 15 109.910 0.000 . 1 . . . . 114 GLY N . 16742 1 390 . 1 1 115 115 ASN H H 1 8.127 0.001 . 1 . . . . 115 ASN HN . 16742 1 391 . 1 1 115 115 ASN CA C 13 51.126 0.000 . 1 . . . . 115 ASN CA . 16742 1 392 . 1 1 115 115 ASN CB C 13 39.189 0.000 . 1 . . . . 115 ASN CB . 16742 1 393 . 1 1 115 115 ASN N N 15 119.362 0.004 . 1 . . . . 115 ASN N . 16742 1 394 . 1 1 117 117 TYR H H 1 8.072 0.001 . 1 . . . . 117 TYR HN . 16742 1 395 . 1 1 117 117 TYR CA C 13 57.905 0.000 . 1 . . . . 117 TYR CA . 16742 1 396 . 1 1 117 117 TYR CB C 13 38.526 0.000 . 1 . . . . 117 TYR CB . 16742 1 397 . 1 1 117 117 TYR N N 15 119.948 0.005 . 1 . . . . 117 TYR N . 16742 1 398 . 1 1 118 118 VAL H H 1 7.618 0.000 . 1 . . . . 118 VAL HN . 16742 1 399 . 1 1 118 118 VAL CA C 13 59.232 0.000 . 1 . . . . 118 VAL CA . 16742 1 400 . 1 1 118 118 VAL CB C 13 33.221 0.000 . 1 . . . . 118 VAL CB . 16742 1 401 . 1 1 118 118 VAL N N 15 124.240 0.012 . 1 . . . . 118 VAL N . 16742 1 402 . 1 1 120 120 VAL H H 1 8.112 0.000 . 1 . . . . 120 VAL HN . 16742 1 403 . 1 1 120 120 VAL CA C 13 62.253 0.000 . 1 . . . . 120 VAL CA . 16742 1 404 . 1 1 120 120 VAL CB C 13 33.000 0.000 . 1 . . . . 120 VAL CB . 16742 1 405 . 1 1 120 120 VAL N N 15 119.704 0.013 . 1 . . . . 120 VAL N . 16742 1 406 . 1 1 121 121 HIS H H 1 8.274 0.000 . 1 . . . . 121 HIS HN . 16742 1 407 . 1 1 121 121 HIS CA C 13 54.958 0.000 . 1 . . . . 121 HIS CA . 16742 1 408 . 1 1 121 121 HIS CB C 13 29.684 0.000 . 1 . . . . 121 HIS CB . 16742 1 409 . 1 1 121 121 HIS N N 15 121.652 0.000 . 1 . . . . 121 HIS N . 16742 1 410 . 1 1 122 122 PHE H H 1 8.219 0.000 . 1 . . . . 122 PHE HN . 16742 1 411 . 1 1 122 122 PHE CA C 13 57.537 0.000 . 1 . . . . 122 PHE CA . 16742 1 412 . 1 1 122 122 PHE CB C 13 40.000 0.000 . 1 . . . . 122 PHE CB . 16742 1 413 . 1 1 122 122 PHE N N 15 122.777 0.013 . 1 . . . . 122 PHE N . 16742 1 414 . 1 1 123 123 ASP H H 1 8.263 0.000 . 1 . . . . 123 ASP HN . 16742 1 415 . 1 1 123 123 ASP CA C 13 54.000 0.000 . 1 . . . . 123 ASP CA . 16742 1 416 . 1 1 123 123 ASP CB C 13 41.474 0.000 . 1 . . . . 123 ASP CB . 16742 1 417 . 1 1 123 123 ASP N N 15 122.533 0.004 . 1 . . . . 123 ASP N . 16742 1 418 . 1 1 124 124 ALA H H 1 8.080 0.001 . 1 . . . . 124 ALA HN . 16742 1 419 . 1 1 124 124 ALA CA C 13 52.453 0.000 . 1 . . . . 124 ALA CA . 16742 1 420 . 1 1 124 124 ALA CB C 13 19.368 0.000 . 1 . . . . 124 ALA CB . 16742 1 421 . 1 1 124 124 ALA N N 15 124.477 0.014 . 1 . . . . 124 ALA N . 16742 1 422 . 1 1 125 125 SER H H 1 8.274 0.001 . 1 . . . . 125 SER HN . 16742 1 423 . 1 1 125 125 SER CA C 13 58.716 0.000 . 1 . . . . 125 SER CA . 16742 1 424 . 1 1 125 125 SER CB C 13 63.874 0.000 . 1 . . . . 125 SER CB . 16742 1 425 . 1 1 125 125 SER N N 15 115.721 0.012 . 1 . . . . 125 SER N . 16742 1 426 . 1 1 126 126 VAL H H 1 7.548 0.000 . 1 . . . . 126 VAL HN . 16742 1 427 . 1 1 126 126 VAL CA C 13 63.505 0.000 . 1 . . . . 126 VAL CA . 16742 1 428 . 1 1 126 126 VAL CB C 13 33.295 0.000 . 1 . . . . 126 VAL CB . 16742 1 429 . 1 1 126 126 VAL N N 15 124.992 0.001 . 1 . . . . 126 VAL N . 16742 1 stop_ save_