data_4032 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C and 15N Resonance Assignments for the Bovine Pancreatic [C65S, C72S] Ribonuclease A at pH* 4.6 and Temperature of 20 deg. C ; _BMRB_accession_number 4032 _BMRB_flat_file_name bmr4032.str _Entry_type update _Submission_date 1997-05-22 _Accession_date 1997-05-28 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shimotakahara Sakurako . . 2 Rios Carlos B. . 3 Laity John H. . 4 Zimmerman Diane E. . 5 Scheraga Harold A. . 6 Montelione Gaetano T. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 244 "13C chemical shifts" 363 "15N chemical shifts" 119 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 1997-06-25 original author 'Original release.' 2001-02-16 reformat BMRB 'Format updated to NMR-STAR version 2.1' 2002-07-12 update BMRB 'Modify the saveframe name.' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR Structural Analysis of an Analog of an Intermediate Formed in the Rate-Determining Step of One Pathway in the Oxidative Folding of Bovine Pancreatic Ribonuclease A: Automated Analysis of 1H, 13C and 15N Resonance Assignments for Wild-Type and [C65S, C72S] Mutant Forms. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 9188686 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shimotakahara Sakurako . . 2 Rios Carlos B. . 3 Laity John H. . 4 Zimmerman Diane E. . 5 Scheraga Harold A. . 6 Montelione Gaetano T. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 36 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 6915 _Page_last 6929 _Year 1997 _Details . save_ ################################## # Molecular system description # ################################## save_system_bovine_pancreatic_C65S_C72S_ribonuclease_A _Saveframe_category molecular_system _Mol_system_name 'bovine pancreatic [C65S,C72S] ribonuclease A' _Abbreviation_common 'RNAse A' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'bovine pancreatic [C65S,C72S] ribonuclease A' $bovine_pancreatic_C65S_C72S_ribonuclease_A stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not reported' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_bovine_pancreatic_C65S_C72S_ribonuclease_A _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'bovine pancreatic [C65S,C72S] ribonuclease A' _Name_variant '[C65S,C72S]-RNAse A' _Abbreviation_common 'RNAse A' _Molecular_mass . _Mol_thiol_state 'not reported' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 124 _Mol_residue_sequence ; KETAAAKFERQHMDSSTSAA SSSNYCNQMMKSRNLTKDRC KPVNTFVHESLADVQAVCSQ KNVASKNGQTNSYQSYSTMS ITDCRETGSSKYPNCAYKTT QANKHIIVACEGNPYVPVHF DASV ; loop_ _Residue_seq_code _Residue_label 1 LYS 2 GLU 3 THR 4 ALA 5 ALA 6 ALA 7 LYS 8 PHE 9 GLU 10 ARG 11 GLN 12 HIS 13 MET 14 ASP 15 SER 16 SER 17 THR 18 SER 19 ALA 20 ALA 21 SER 22 SER 23 SER 24 ASN 25 TYR 26 CYS 27 ASN 28 GLN 29 MET 30 MET 31 LYS 32 SER 33 ARG 34 ASN 35 LEU 36 THR 37 LYS 38 ASP 39 ARG 40 CYS 41 LYS 42 PRO 43 VAL 44 ASN 45 THR 46 PHE 47 VAL 48 HIS 49 GLU 50 SER 51 LEU 52 ALA 53 ASP 54 VAL 55 GLN 56 ALA 57 VAL 58 CYS 59 SER 60 GLN 61 LYS 62 ASN 63 VAL 64 ALA 65 SER 66 LYS 67 ASN 68 GLY 69 GLN 70 THR 71 ASN 72 SER 73 TYR 74 GLN 75 SER 76 TYR 77 SER 78 THR 79 MET 80 SER 81 ILE 82 THR 83 ASP 84 CYS 85 ARG 86 GLU 87 THR 88 GLY 89 SER 90 SER 91 LYS 92 TYR 93 PRO 94 ASN 95 CYS 96 ALA 97 TYR 98 LYS 99 THR 100 THR 101 GLN 102 ALA 103 ASN 104 LYS 105 HIS 106 ILE 107 ILE 108 VAL 109 ALA 110 CYS 111 GLU 112 GLY 113 ASN 114 PRO 115 TYR 116 VAL 117 PRO 118 VAL 119 HIS 120 PHE 121 ASP 122 ALA 123 SER 124 VAL stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-12 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 1072 "ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 BMRB 16010 ribonuclease_A 100.00 124 98.39 98.39 1.75e-83 BMRB 16011 ribonuclease_A 100.00 124 98.39 98.39 1.75e-83 BMRB 16503 RNase_A 100.00 124 98.39 98.39 1.75e-83 BMRB 16742 "Ribonuclease A" 100.00 126 98.39 98.39 1.42e-83 BMRB 17099 ribonuclease 100.00 124 98.39 98.39 1.75e-83 BMRB 17172 RNase_A_C-dimer 100.00 124 98.39 98.39 1.75e-83 BMRB 19065 RnaseA 100.00 124 98.39 98.39 1.75e-83 BMRB 2928 "ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 BMRB 385 "ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 BMRB 4031 "bovine pancreatic ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 BMRB 443 "ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1A2W "Crystal Structure Of A 3d Domain-Swapped Dimer Of Bovine Pancreatic Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1A5Q "P93a Variant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 2.21e-82 PDB 1AFK "Crystal Structure Of Ribonuclease A In Complex With 5'- Diphosphoadenosine-3'-Phosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1AFL "Ribonuclease A In Complex With 5'-Diphosphoadenosine 2'- Phosphate At 1.7 Angstrom Resolution" 100.00 124 98.39 98.39 1.75e-83 PDB 1AFU "Structure Of Ribonuclease A At 2.0 Angstroms From Monoclinic Crystals" 100.00 124 98.39 98.39 1.75e-83 PDB 1AQP "Ribonuclease A Copper Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 1BEL "Hydrolase Phosphoric Diester, Rna" 100.00 124 98.39 98.39 1.75e-83 PDB 1BZQ "Complex Of A Dromedary Single-Domain Vhh Antibody Fragment With Rnase A" 100.00 124 98.39 98.39 1.75e-83 PDB 1C0B "Bovine Pancreatic Ribonuclease A Desiccated For 2.5 Days" 100.00 128 98.39 98.39 2.43e-83 PDB 1C0C "Bovine Pancreatic Ribonuclease A Desiccated For 4.0 Days" 100.00 128 98.39 98.39 2.43e-83 PDB 1C8W "Thr45gly Variant Of Ribonuclease A" 100.00 124 97.58 97.58 1.49e-82 PDB 1C9V "H12a Variant Of Ribonuclease A" 100.00 124 97.58 97.58 3.45e-82 PDB 1C9X "H119a Variant Of Ribonuclease A" 100.00 124 97.58 97.58 3.45e-82 PDB 1CJQ "X-Ray Crystallographic Studies Of The Denaturation Of The Denaturation Of Ribonuclease S." 81.45 101 98.02 98.02 1.06e-66 PDB 1CJR "X-Ray Crystallographic Studies Of Denaturation In Ribonuclease S" 80.65 101 98.00 98.00 6.14e-66 PDB 1D5D "The Role Of Phenylalanine 8 In The Stabilization Of The S Protein-S Peptide Interaction: Packing And Cavities" 81.45 101 98.02 98.02 1.06e-66 PDB 1D5E "The Role Of Phenylalanine 8 In The Stabilization Of The S Protein-S Peptide Interaction: Packing And Cavities" 81.45 101 98.02 98.02 1.06e-66 PDB 1D5H "Rnase S(F8a). Mutant Ribonuclease S" 81.45 101 98.02 98.02 1.06e-66 PDB 1DFJ "Ribonuclease Inhibitor Complexed With Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1DY5 "Deamidated Derivative Of Bovine Pancreatic Ribonuclease" 100.00 124 97.58 97.58 1.35e-82 PDB 1EIC "Crystal Structure Of F120a Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 3.42e-82 PDB 1EID "Crystal Structure Of F120g Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 4.20e-82 PDB 1EIE "Crystal Structure Of F120w Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 98.39 5.64e-83 PDB 1EOS "Crystal Structure Of Ribonuclease A Complexed With Uridylyl(2',5')guanosine (Productive Binding)" 100.00 124 98.39 98.39 1.75e-83 PDB 1EOW "Crystal Structure Of Ribonuclease A Complexed With Uridylyl(2',5')guanosine (Non-Productive Binding)" 100.00 124 98.39 98.39 1.75e-83 PDB 1F0V "Crystal Structure Of An Rnase A Dimer Displaying A New Type Of 3d Domain Swapping" 100.00 124 98.39 98.39 1.75e-83 PDB 1FEV "Crystal Structure Of The Ala4aib Mutation In Rnase S" 81.45 101 98.02 98.02 1.06e-66 PDB 1FS3 "Crystal Structure Of Wild-Type Bovine Pancreatic Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1IZP "F46l Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 1.05e-82 PDB 1IZQ "F46v Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 1.94e-82 PDB 1IZR "F46a Mutant Of Bovine Pancreatic Ribonuclease A" 100.00 124 97.58 97.58 3.42e-82 PDB 1J7Z "Osmolyte Stabilization Of Ribonuclease" 83.87 104 98.08 98.08 2.30e-68 PDB 1J80 "Osmolyte Stabilization Of Rnase" 83.87 104 98.08 98.08 2.30e-68 PDB 1J81 "Osmolyte Stabilization Of Rnase" 83.87 104 98.08 98.08 2.30e-68 PDB 1J82 "Osmolyte Stabilization Of Rnase" 83.87 104 98.08 98.08 2.30e-68 PDB 1JN4 "The Crystal Structure Of Ribonuclease A In Complex With 2'- Deoxyuridine 3'-Pyrophosphate (P'-5') Adenosine" 100.00 124 98.39 98.39 1.75e-83 PDB 1JS0 "Crystal Structure Of 3d Domain-Swapped Rnase A Minor Trimer" 100.00 124 98.39 98.39 1.75e-83 PDB 1JVT "Crystal Structure Of Ribonuclease A (Ligand-Free Form)" 100.00 124 98.39 98.39 1.75e-83 PDB 1JVU "Crystal Structure Of Ribonuclease A (Complexed Form)" 100.00 124 98.39 98.39 1.75e-83 PDB 1JVV "Crystal Structure Of Ribonuclease A (Retro-Soaked Form)" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF2 "Atomic Resolution Structure Of Rnase A At Ph 5.2" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF3 "Atomic Resolution Structure Of Rnase A At Ph 5.9" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF4 "Atomic Resolution Structure Of Rnase A At Ph 6.3" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF5 "Atomic Resolution Structure Of Rnase A At Ph 7.1" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF7 "Atomic Resolution Structure Of Rnase A At Ph 8.0" 100.00 124 98.39 98.39 1.75e-83 PDB 1KF8 "Atomic Resolution Structure Of Rnase A At Ph 8.8" 100.00 124 98.39 98.39 1.75e-83 PDB 1KH8 "Structure Of A Cis-Proline (P114) To Glycine Variant Of Ribonuclease A" 100.00 125 97.58 97.58 3.16e-82 PDB 1LSQ "Ribonuclease A With Asn 67 Replaced By A Beta-Aspartyl Residue" 100.00 124 97.58 97.58 1.35e-82 PDB 1O0F "Rnase A In Complex With 3',5'-Adp" 100.00 124 98.39 98.39 1.75e-83 PDB 1O0H "Ribonuclease A In Complex With 5'-Adp" 100.00 124 98.39 98.39 1.75e-83 PDB 1O0M "Ribonuclease A In Complex With Uridine-2'-Phosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1O0N "Ribonuclease A In Complex With Uridine-3'-phosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1O0O "Ribonuclease A In Complex With Adenosine-2',5'-Diphosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1QHC "Crystal Structure Of Ribonuclease A In Complex With 5'- Phospho-2'-Deoxyuridine-3'-Pyrophosphate Adenosine-3'- Phosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RAR "Crystal Structure Of A Fluorescent Derivative Of Rnase A" 99.19 123 98.37 98.37 7.83e-83 PDB 1RAS "Crystal Structure Of A Fluorescent Derivative Of Rnase A" 99.19 123 98.37 98.37 7.83e-83 PDB 1RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 1RBB "The Crystal Structure Of Ribonuclease B At 2.5-Angstroms Resolution" 100.00 124 98.39 98.39 1.75e-83 PDB 1RBC "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBD "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBE "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBF "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBG "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBH "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBI "Crystallographic Structures Of Ribonuclease S Variants With Nonpolar Substitution At Position 13: Packing And Cavities" 83.87 104 98.08 98.08 2.30e-68 PDB 1RBJ "Ribonuclease B Complex With D(Tetra-(Deoxy-Adenylate))" 100.00 124 98.39 98.39 1.75e-83 PDB 1RBN "The Structure Of Ribonuclease A Derivative Ii At 2.1 Angstroms Resolution" 100.00 124 98.39 98.39 1.75e-83 PDB 1RBW "Ribonuclease A (E.C.3.1.27.5) With Guanidinium" 100.00 124 98.39 98.39 1.75e-83 PDB 1RBX "Ribonuclease A (E.C.3.1.27.5) Control" 100.00 124 98.39 98.39 1.75e-83 PDB 1RCA "Structure Of The Crystalline Complex Of Deoxycytidylyl-3', 5'-Guanosine (3',5'-Dcpdg) Co-Crystalised With Ribonuclease At 1.9 A" 100.00 124 98.39 98.39 1.75e-83 PDB 1RCN "Crystal Structure Of The Ribonuclease A D(Aptpapapg) Complex : Direct Evidence For Extended Substrate Recognition" 100.00 124 98.39 98.39 1.75e-83 PDB 1RHA "Water Dependent Domain Motion And Flexibility In Ribonuclease A And The Invariant Features In Its Hydration Shell. An X-Ray Stu" 100.00 124 98.39 98.39 1.75e-83 PDB 1RHB "Water Dependent Domain Motion And Flexibility In Ribonuclease A And The Invariant Features In Its Hydration Shell. An X-Ray Stu" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNC "Newly Observed Binding Mode In Pancreatic Ribonuclease" 100.00 124 98.39 98.39 1.75e-83 PDB 1RND "Newly Observed Binding Mode In Pancreatic Ribonuclease" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNM "Ribonuclease A Complex With Cytidylic Acid (5'cmp) Crystallized From 80% Ammonium Sulphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNN "Ribonuclease A Complex With Cytidylic Acid (5'cmp) Crystallized From 8m Sodium Formate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNO "Ribonuclease A Crystallized From 80% Ammonium Sulphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNQ "Ribonuclease A Crystallized From 8m Sodium Formate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNU "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNV "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNW "Recombinant Ribonuclease A Crystallized From 80% Ammonium Sulphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNX "Ribonuclease A Crystallized From 3m Sodium Chloride, 30% Ammonium Sulfate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNY "Ribonuclease A Crystallized From 3m Cesium Chloride, 30% Ammonium Sulfate" 100.00 124 98.39 98.39 1.75e-83 PDB 1RNZ "Ribonuclease A Crystallized From 2.5m Sodium Chloride, 3.3m Sodium Formate" 100.00 124 98.39 98.39 1.75e-83 PDB 1ROB "Structure Of The Crystalline Complex Of Cytidylic Acid (2'- Cmp) With Ribonuclease At 1.6 Angstroms Resolution" 100.00 124 98.39 98.39 1.75e-83 PDB 1RPF "The Structures Of Rnase Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" 100.00 124 98.39 98.39 1.75e-83 PDB 1RPG "Structures Of Rnase A Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" 100.00 124 98.39 98.39 1.75e-83 PDB 1RPH "Structures Of Rnase A Complexed With 3'-Cmp And D(Cpa): Active Site Conformation And Conserved Water Molecules" 100.00 124 98.39 98.39 1.75e-83 PDB 1RSM "The 2-Angstroms Resolution Structure Of A Thermostable Ribonuclease A Chemically Cross-Linked Between Lysine Residues 7 And 41" 100.00 124 98.39 98.39 1.75e-83 PDB 1RTA "Crystal Structure Disposition Of Thymidylic Acid Tetramer In Complex With Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1RTB "Crystal Structure Disposition Of Thymidylic Acid Tetramer In Complex With Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1RUV "Ribonuclease A-Uridine Vanadate Complex: High Resolution Resolution X-Ray Structure (1.3 A)" 100.00 124 98.39 98.39 1.75e-83 PDB 1SRN "The Refined Crystal Structure Of A Fully Active Semisynthetic Ribonuclease At 1.8 Angstroms Resolution" 95.16 118 98.31 98.31 1.65e-78 PDB 1SSA "A Structural Investigation Of Catalytically Modified F12ol And F12oy Semisynthetic Ribonucleases" 95.16 118 98.31 98.31 1.65e-78 PDB 1SSB "A Structural Investigation Of Catalytically Modified F12ol And F12oy Semisynthetic Ribonucleases" 95.16 118 98.31 98.31 1.65e-78 PDB 1SSC "The 1.6 Angstroms Structure Of A Semisynthetic Ribonuclease Crystallized From Aqueous Ethanol. Comparison With Crystals From Sa" 90.32 112 98.21 98.21 2.78e-73 PDB 1U1B "Structure Of Bovine Pancreatic Ribonuclease A In Complex With 3'-phosphothymidine (3'-5')-pyrophosphate Adenosine 3'-phosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 1W4O "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1W4P "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1W4Q "Binding Of Nonnatural 3'-Nucleotides To Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 1WBU "Fragment Based Lead Discovery Using Crystallography" 100.00 124 98.39 98.39 1.75e-83 PDB 1XPS "Bovine Ribonuclease A (Phosphate-Free) (93 % Humidity)" 100.00 124 98.39 98.39 1.75e-83 PDB 1XPT "Bovine Ribonuclease A (Phosphate-Free)" 100.00 124 98.39 98.39 1.75e-83 PDB 1YMN "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92l Mutant)" 100.00 124 97.58 97.58 1.61e-82 PDB 1YMR "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92a Mutant)" 100.00 124 97.58 97.58 2.49e-82 PDB 1YMW "The Study Of Reductive Unfolding Pathways Of Rnase A (Y92g Mutant)" 100.00 124 97.58 97.58 3.81e-82 PDB 1Z3L "X-Ray Crystal Structure Of A Mutant Ribonuclease S (F8anb)" 83.87 104 98.08 98.08 2.30e-68 PDB 1Z3M "Crystal Structure Of Mutant Ribonuclease S (F8nva)" 83.87 104 98.08 98.08 2.30e-68 PDB 1Z3P "X-Ray Crystal Structure Of A Mutant Ribonuclease S (M13nva)" 83.87 104 98.08 98.08 2.30e-68 PDB 1Z6D "Ribonuclease A- Imp Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 1Z6S "Ribonuclease A- Amp Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2AAS "High-Resolution Three-Dimensional Structure Of Ribonuclease A In Solution By Nuclear Magnetic Resonance Spectroscopy" 100.00 124 98.39 98.39 1.75e-83 PDB 2BLP "Rnase Before Unattenuated X-Ray Burn" 100.00 124 98.39 98.39 1.75e-83 PDB 2BLZ 'Rnase After A High Dose X-Ray "burn"' 100.00 124 98.39 98.39 1.75e-83 PDB 2E33 "Structural Basis For Selection Of Glycosylated Substrate By Scffbs1 Ubiquitin Ligase" 100.00 124 98.39 98.39 1.75e-83 PDB 2E3W "X-Ray Structure Of Native Rnase A" 100.00 124 98.39 98.39 1.75e-83 PDB 2G4W "Anomalous Substructure Of Ribonuclease A (c2)" 100.00 124 98.39 98.39 1.75e-83 PDB 2G4X "Anomalous Substructure Od Ribonuclease A (P3221)" 100.00 124 98.39 98.39 1.75e-83 PDB 2G8Q "The Crystal Structure Of Rnase A From Monoclinic Crystals At 100 K" 100.00 124 98.39 98.39 1.75e-83 PDB 2G8R "The Crystal Structure Of The Rnase A- 3-N-Piperidine-4- Carboxyl-3-Deoxy-Ara-Uridine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2NUI "X-Ray Structure Of Synthetic [d83a]rnase A" 100.00 124 97.58 97.58 2.23e-82 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" 100.00 124 98.39 98.39 1.75e-83 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" 100.00 124 98.39 98.39 1.75e-83 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" 100.00 124 98.39 98.39 1.75e-83 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" 100.00 124 98.39 98.39 1.75e-83 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" 100.00 124 98.39 98.39 1.75e-83 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" 100.00 124 98.39 98.39 1.75e-83 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-" 100.00 124 98.39 98.39 1.75e-83 PDB 2P49 "Complex Of A Camelid Single-Domain Vhh Antibody Fragment With Rnase A At 1.4a Resolution: Native Mono_1 Crystal Form" 100.00 124 98.39 98.39 1.75e-83 PDB 2P4A "X-Ray Structure Of A Camelid Affinity Matured Single-Domain Vhh Antibody Fragment In Complex With Rnase A" 100.00 124 98.39 98.39 1.75e-83 PDB 2QCA "A New Crystal Form Of Bovine Pancreatic Rnase A In Complex With 2'- Deoxyguanosine-5'-Monophosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 2RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 2RLN "Thermodynamic And Structural Consequences Of Changing A Sulphur Atom To A Methylene Group In The M13nle Mutation In Ribonucleas" 87.90 109 98.17 98.17 2.01e-71 PDB 2RNS "Refinement Of The Crystal Structure Of Ribonuclease S. Comparison With And Between The Various Ribonuclease A Structures" 100.00 124 98.39 98.39 1.75e-83 PDB 2W5G "Rnase A-5'-Atp Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2W5I "Rnase A-Ap3a Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2W5K "Rnase A-Nadph Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2W5L "Rnase A-Nadp Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2W5M "Rnase A-Pyrophosphate Ion Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 2XOG "Functional And Structural Analyses Of N-Acylsulfonamide- Linked Dinucleoside Inhibitors Of Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 2XOI "Functional And Structural Analyses Of N-Acylsulfonamide- Linked Dinucleoside Inhibitors Of Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 3A1R "Neutron Crystal Structure Analysis Of Bovine Pancreatic Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 3D6O "The Rnase A- 5'-Deoxy-5'-N-(Ethyl Isonipecotatyl)uridine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3D6P "Rnase A- 5'-Deoxy-5'-N-Morpholinouridine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3D6Q "The Rnase A- 5'-Deoxy-5'-N-Piperidinouridine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3D7B "The Ribonuclease A- 5'-Deoxy-5'-N-Pyrrolidinouridine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3D8Y "Rnase A- 5'-deoxy-5'-n-piperidinothymidine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3D8Z "Rnase A- 5'-deoxy-5'-n-pyrrolidinothymidine Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3DH5 "Crystal Structure Of Bovine Pancreatic Ribonuclease A (Wild- Type)" 100.00 124 98.39 98.39 1.75e-83 PDB 3DH6 "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V47a)" 100.00 124 97.58 97.58 8.08e-83 PDB 3DI7 "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V54a)" 100.00 124 97.58 97.58 8.08e-83 PDB 3DI8 "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V57a)" 100.00 124 97.58 97.58 8.08e-83 PDB 3DI9 "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (I81a)" 100.00 124 97.58 97.58 1.29e-82 PDB 3DIB "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (I106a)" 100.00 124 97.58 97.58 1.29e-82 PDB 3DIC "Crystal Structure Of Bovine Pancreatic Ribonuclease A Variant (V108a)" 100.00 124 97.58 97.58 8.08e-83 PDB 3DXG "Ribonuclease A- Uridine 5' Phosphate Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3DXH "Ribonuclease A Uridine 5' Diphosphate Complex" 100.00 124 98.39 98.39 1.75e-83 PDB 3EUX "Crystal Structure Of Crosslinked Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 3EUY "Crystal Structure Of Ribonuclease A In 50% Dioxane" 100.00 124 98.39 98.39 1.75e-83 PDB 3EUZ "Crystal Structure Of Ribonuclease A In 50% Dimethylformamide" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV0 "Crystal Structure Of Ribonuclease A In 70% Dimethyl Sulfoxide" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV1 "Crystal Structure Of Ribonuclease A In 70% Hexanediol" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV2 "Crystal Structure Of Ribonuclease A In 70% Isopropanol" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV3 "Crystal Structure Of Ribonuclease A In 70% T-Butanol" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV4 "Crystal Structure Of Ribonuclease A In 50% Trifluoroethanol" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV5 "Crystal Structure Of Ribonuclease A In 1m Trimethylamine N-Oxide" 100.00 124 98.39 98.39 1.75e-83 PDB 3EV6 "Crystal Structure Of Ribonuclease A In 50% R,S,R-Bisfuranol" 100.00 124 98.39 98.39 1.75e-83 PDB 3I67 "Ribonuclease A By Lb Nanotemplate Method After High X-Ray Dose On Esrf Id14-2 Beamline" 100.00 124 98.39 98.39 1.75e-83 PDB 3I6F "Ribonuclease A By Classical Hanging Drop Method Before High X-Ray Dose On Esrf Id14-2 Beamline" 100.00 124 98.39 98.39 1.75e-83 PDB 3I6H "Ribonuclease A By Lb Nanotemplate Method Before High X-Ray Dose On Esrf Id14-2 Beamline" 100.00 124 98.39 98.39 1.75e-83 PDB 3I6J "Ribonuclease A By Classical Hanging Drop Method After High X-Ray Dose On Esrf Id14-2 Beamline" 100.00 124 98.39 98.39 1.75e-83 PDB 3I7W "High Pressure Structure Of Wild-Type Rnase A (0.67 Gpa)" 100.00 124 98.39 98.39 1.75e-83 PDB 3I7X "High Pressure Structure Of I106a Rnase A Variant (0.35 Gpa)" 100.00 124 97.58 97.58 1.29e-82 PDB 3I7Y "High Pressure Structure Of I106a Variant Of Rnase A (0.48 Gpa)" 100.00 124 97.58 97.58 1.29e-82 PDB 3JW1 "Crystal Structure Of Bovine Pancreatic Ribonuclease Complexed With Uridine-5'-monophosphate At 1.60 A Resolution" 100.00 124 98.39 98.39 1.75e-83 PDB 3LXO "The Crystal Structure Of Ribonuclease A In Complex With Thymidine-3'- Monophosphate" 100.00 124 98.39 98.39 1.75e-83 PDB 3MWQ "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" 100.00 256 98.39 98.39 1.04e-81 PDB 3MWR "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" 100.00 254 98.39 98.39 8.54e-82 PDB 3MX8 "Crystal Structure Of Ribonuclease A Tandem Enzymes And Their Interaction With The Cytosolic Ribonuclease Inhibitor" 100.00 252 98.39 98.39 1.51e-81 PDB 3MZQ "Rnase Crystals Grown By The Hanging Drop Method" 100.00 128 98.39 98.39 2.43e-83 PDB 3MZR "Rnase Crystals Grown In Loops/micromounts" 100.00 128 98.39 98.39 2.43e-83 PDB 3OQY "Semi-Synthetic Ribonuclease S: Para-Cyano-Phenylalanine At Position 8" 83.87 104 98.08 98.08 2.30e-68 PDB 3OQZ "Semi-Synthetic Ribonuclease S: Meta-Cyano-Phenylalanine At Position 8" 83.87 104 98.08 98.08 2.30e-68 PDB 3OR0 "Semi-Synthetic Ribonuclease S: Cyanylated Homocysteine At Position 13" 83.87 104 98.08 98.08 2.30e-68 PDB 3QSK "5 Histidine Variant Of The Anti-Rnase A Vhh In Complex With Rnase A" 100.00 124 98.39 98.39 1.75e-83 PDB 3RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 3RH1 "X-ray Structure Of A Cis-proline (p114) To Alanine Variant Of Ribonuclease A" 100.00 124 97.58 97.58 2.21e-82 PDB 3RID "X-ray Structure Of The C-terminal Swapped Dimer Of P114a Variant Of Ribonuclease A" 100.00 124 97.58 97.58 2.21e-82 PDB 3RN3 "Segmented Anisotropic Refinement Of Bovine Ribonuclease A By The Application Of The Rigid-Body Tls Model" 100.00 124 98.39 98.39 1.75e-83 PDB 3RSD "Structure Of The D121n Variant Of Ribonuclease A" 100.00 124 97.58 98.39 1.13e-82 PDB 3RSP "Structure Of The P93g Variant Of Ribonuclease A" 100.00 124 97.58 97.58 3.69e-82 PDB 3SRN "Structural Changes That Accompany The Reduced Catalytic Efficiency Of Two Semisynthetic Ribonuclease Analogs" 91.13 113 98.23 98.23 6.02e-74 PDB 4AO1 "High Resolution Crystal Structure Of Bovine Pancreatic Ribonuclease Crystallized Using Ionic Liquid" 100.00 124 98.39 98.39 1.75e-83 PDB 4G8V "Crystal Structure Of Ribonuclease A In Complex With 5a" 100.00 124 98.39 98.39 1.75e-83 PDB 4G8Y "Crystal Structure Of Ribonuclease A In Complex With 5b" 100.00 124 98.39 98.39 1.75e-83 PDB 4G90 "Crystal Structure Of Ribonuclease A In Complex With 5e" 100.00 124 98.39 98.39 1.75e-83 PDB 4J5Z "Crystal Structure Of Ribonuclease A In Aqueous Solution: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J60 "Crystal Structure Of Ribonuclease A Soaked In 25% Cyclopentanol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J61 "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclopentanone: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J62 "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclohexanol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J63 "Crystal Structure Of Ribonuclease A Soaked In 40% Cyclohexanone: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J64 "Crystal Structure Of Ribonuclease A Soaked In 40% Dioxane: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J65 "Crystal Structure Of Ribonuclease A Soaked In 40% Dimethylformamide: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J66 "Crystal Structure Of Ribonuclease A Soaked In 25% Dimethyl Sulfoxide: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J67 "Crystal Structure Of Ribonuclease A Soaked In 50% 1,6-hexanediol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J68 "Crystal Structure Of Ribonuclease A Soaked In 40% Isopropanol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J69 "Crystal Structure Of Ribonuclease A Soaked In 50% S,r,s-bisfuranol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4J6A "Crystal Structure Of Ribonuclease A Soaked In 40% 2,2,2- Trifluoroethanol: One Of Twelve In Mscs Set" 100.00 124 98.39 98.39 1.75e-83 PDB 4K7L "Crystal Structure Of Rnase S Variant (k7c/q11c)" 83.87 104 98.08 98.08 2.30e-68 PDB 4L55 "X-ray Structure Of The Adduct Between Bovine Pancreatic Ribonuclease And Aziru" 100.00 124 98.39 98.39 1.75e-83 PDB 4MXF "X-ray Structure Of The Adduct Between Bovine Pancreatic Ribonuclease And Auoxo6, A Dinuclear Gold(iii) Complex With -dioxo Brid" 100.00 124 98.39 98.39 1.75e-83 PDB 4O36 "Semisynthetic Rnase S1-15-h7/11-q10" 83.87 104 98.08 98.08 2.30e-68 PDB 4O37 "Seminsynthetic Rnase S1-15-3pl-7/11" 83.87 104 98.08 98.08 2.30e-68 PDB 4OKF "Rnase S In Complex With An Artificial Peptide" 83.87 104 98.08 98.08 2.30e-68 PDB 4OOH "Structure Of Ribonuclease A At 40c" 100.00 124 98.39 98.39 1.75e-83 PDB 4OT4 "X-ray Structure Of The Adduct Formed Between Cisplatin And Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 4PEQ "Structure Of Bovine Ribonuclease Inhibitor Complexed With Bovine Ribonuclease I" 100.00 124 98.39 98.39 1.75e-83 PDB 4POU "Vhh-metal In Complex With Rnase A" 100.00 124 98.39 98.39 1.75e-83 PDB 4QH3 "X-ray Structure Of The Adduct Formed Between Bovine Pancreatic Ribonuclease And Trans-dimethylamine Methylamine Dichlorido Plat" 100.00 124 98.39 98.39 1.75e-83 PDB 4RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 4RSD "Structure Of The D121a Variant Of Ribonuclease A" 100.00 124 97.58 97.58 2.23e-82 PDB 4RTE "The X-ray Structure Of Bovine Pancreatic Ribonuclease Incubated In The Presence Of An Excess Of Cisplatin (1:10 Ratio)" 100.00 124 98.39 98.39 1.75e-83 PDB 4SRN "Structural Changes That Accompany The Reduced Catalytic Efficiency Of Two Semisynthetic Ribonuclease Analogs" 91.13 113 98.23 98.23 6.02e-74 PDB 4YGW "Rnase S In Complex With Stabilized S Peptide" 83.06 103 98.06 98.06 7.07e-68 PDB 5RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 5RSA "Comparison Of Two Independently Refined Models Of Ribonuclease-A" 99.19 124 98.37 98.37 8.08e-83 PDB 6RAT "Effects Of Temperature On Protein Structure And Dynamics: X-Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine " 100.00 124 98.39 98.39 1.75e-83 PDB 6RSA "Nuclear Magnetic Resonance And Neutron Diffraction Studies Of The Complex Of RibonucleaseA With Uridine Vanadate, A Transition-" 100.00 124 98.39 98.39 1.75e-83 PDB 7RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 7RSA "Structure Of Phosphate-Free Ribonuclease A Refined At 1.26 Angstroms" 100.00 124 98.39 98.39 1.75e-83 PDB 8RAT "Effects Of Temperature On Protein Structure And Dynamics: X- Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine" 100.00 124 98.39 98.39 1.75e-83 PDB 8RSA "Crystal Structure Of Two Covalent Nucleoside Derivatives Of Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 PDB 9RAT "Effects Of Temperature On Protein Structure And Dynamics: X-Ray Crystallographic Studies Of The Protein Ribonuclease-A At Nine " 100.00 124 98.39 98.39 1.75e-83 PDB 9RSA "Crystal Structure Of Two Covalent Nucleoside Derivatives Of Ribonuclease A" 100.00 124 98.39 98.39 1.75e-83 EMBL CAA30263 "ribonuclease [Bos taurus]" 100.00 150 98.39 98.39 3.48e-84 EMBL CAA33801 "unnamed protein product [Bos taurus]" 100.00 125 98.39 98.39 2.02e-83 EMBL CAB37066 "artificial [synthetic construct]" 100.00 128 98.39 98.39 1.73e-83 GB AAA72269 "ribonuclease S [synthetic construct]" 83.87 105 98.08 98.08 2.50e-68 GB AAA72757 "RNase A [synthetic construct]" 100.00 156 98.39 98.39 7.00e-84 GB AAB35594 "ribonuclease A, partial [Bos taurus]" 100.00 128 98.39 98.39 2.43e-83 GB AAB36134 "pancreatic-type ribonuclease, partial [Bos taurus]" 100.00 124 98.39 98.39 1.75e-83 GB AAI49530 "RNASE1 protein [Bos taurus]" 100.00 150 98.39 98.39 3.48e-84 PIR JC5560 "pancreatic ribonuclease (EC 3.1.27.5) A - Aspergillus niger var. macrosporus" 100.00 124 98.39 98.39 1.75e-83 PIR NRBOB "pancreatic ribonuclease (EC 3.1.27.5) - American bison (tentative sequence)" 100.00 124 98.39 98.39 1.75e-83 PRF 630436A RNase 100.00 124 98.39 98.39 1.75e-83 REF NP_001014408 "ribonuclease pancreatic precursor [Bos taurus]" 100.00 150 98.39 98.39 3.48e-84 REF XP_005211519 "PREDICTED: ribonuclease pancreatic isoform X1 [Bos taurus]" 100.00 150 98.39 98.39 3.48e-84 REF XP_005901936 "PREDICTED: ribonuclease pancreatic [Bos mutus]" 100.00 150 97.58 98.39 1.15e-83 REF XP_010837737 "PREDICTED: ribonuclease pancreatic [Bison bison bison]" 100.00 150 98.39 98.39 3.48e-84 SP P61823 "RecName: Full=Ribonuclease pancreatic; AltName: Full=RNase 1; AltName: Full=RNase A; Flags: Precursor" 100.00 150 98.39 98.39 3.48e-84 SP P61824 "RecName: Full=Ribonuclease pancreatic; AltName: Full=RNase 1; AltName: Full=RNase A" 100.00 124 98.39 98.39 1.75e-83 TPE CDG32088 "TPA: ribonuclease A C2 [Bos taurus]" 100.00 215 98.39 98.39 8.83e-84 TPG DAA25470 "TPA: ribonuclease pancreatic precursor [Bos taurus]" 100.00 150 98.39 98.39 3.48e-84 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Tissue $bovine_pancreatic_C65S_C72S_ribonuclease_A 9913 Eukaryota Metazoa . Bos taurus pancreas stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name _Details $bovine_pancreatic_C65S_C72S_ribonuclease_A 'recombinant technology' 'E. coli' Escherichia coli HMS174 (DE3) plasmid 'pMMII_[C65S, C72S]' stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $bovine_pancreatic_C65S_C72S_ribonuclease_A 2.7 mM [U-15N] D2O 10 % . H2O 90 % . NaCl 0.0 mM . KCl 0.0 mM . stop_ save_ save_sample_two _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $bovine_pancreatic_C65S_C72S_ribonuclease_A 3.0 mM [U-15N;U-13C] D2O 10 % . H2O 90 % . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _Saveframe_category NMR_spectrometer _Manufacturer unknown _Model unknown _Field_strength 0 _Details 'spectrometer information not available' save_ ####################### # Sample conditions # ####################### save_sample_conditions_one _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH* 4.6 . n/a temperature 293 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_one _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0 . indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0 . . . . . . DSS N 15 'methyl protons' ppm . . indirect . . . 0.101329118 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_chemical_shifts_one _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_one $sample_two stop_ _Sample_conditions_label $sample_conditions_one _Chem_shift_reference_set_label $chemical_shift_reference_one _Mol_system_component_name 'bovine pancreatic [C65S,C72S] ribonuclease A' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 LYS HA H 4.00 . 1 2 . 1 LYS C C 172.1 . 1 3 . 1 LYS CA C 55.5 . 1 4 . 1 LYS CB C 32.9 . 1 5 . 2 GLU H H 8.79 . 1 6 . 2 GLU HA H 4.53 . 1 7 . 2 GLU C C 176.7 . 1 8 . 2 GLU CA C 55.7 . 1 9 . 2 GLU CB C 31.5 . 1 10 . 2 GLU N N 125.9 . 1 11 . 3 THR H H 8.55 . 1 12 . 3 THR HA H 4.41 . 1 13 . 3 THR C C 174.7 . 1 14 . 3 THR CA C 61.3 . 1 15 . 3 THR CB C 70.7 . 1 16 . 3 THR N N 118.5 . 1 17 . 4 ALA H H 9.03 . 1 18 . 4 ALA HA H 4.2 . 1 19 . 4 ALA C C 181.4 . 1 20 . 4 ALA CA C 55.4 . 1 21 . 4 ALA CB C 17.8 . 1 22 . 4 ALA N N 124.1 . 1 23 . 5 ALA H H 8.88 . 1 24 . 5 ALA HA H 4.3 . 1 25 . 5 ALA C C 180.3 . 1 26 . 5 ALA CA C 55.2 . 1 27 . 5 ALA CB C 18.5 . 1 28 . 5 ALA N N 121.6 . 1 29 . 6 ALA H H 8.01 . 1 30 . 6 ALA HA H 4.21 . 1 31 . 6 ALA C C 181.00 . 1 32 . 6 ALA CA C 54.9 . 1 33 . 6 ALA CB C 18.3 . 1 34 . 6 ALA N N 122.5 . 1 35 . 7 LYS H H 8.78 . 1 36 . 7 LYS HA H 4.09 . 1 37 . 7 LYS C C 178.1 . 1 38 . 7 LYS CA C 60.1 . 1 39 . 7 LYS CB C 31.8 . 1 40 . 7 LYS N N 122.6 . 1 41 . 8 PHE H H 8.00 . 1 42 . 8 PHE HA H 4.49 . 1 43 . 8 PHE C C 177.6 . 1 44 . 8 PHE CA C 61.7 . 1 45 . 8 PHE CB C 38.7 . 1 46 . 8 PHE N N 119.9 . 1 47 . 9 GLU H H 7.91 . 1 48 . 9 GLU HA H 3.74 . 1 49 . 9 GLU C C 179.1 . 1 50 . 9 GLU CA C 60.2 . 1 51 . 9 GLU CB C 29.00 . 1 52 . 9 GLU N N 119.5 . 1 53 . 10 ARG H H 8.35 . 1 54 . 10 ARG HA H 4.25 . 1 55 . 10 ARG C C 178.3 . 1 56 . 10 ARG CA C 59.1 . 1 57 . 10 ARG CB C 30.00 . 1 58 . 10 ARG N N 120.8 . 1 59 . 11 GLN H H 8.63 . 1 60 . 11 GLN HA H 3.82 . 1 61 . 11 GLN C C 175.6 . 1 62 . 11 GLN CA C 58.7 . 1 63 . 11 GLN CB C 29.4 . 1 64 . 11 GLN N N 111.7 . 1 65 . 12 HIS H H 7.91 . 1 66 . 12 HIS HA H 4.97 . 1 67 . 12 HIS C C 174.7 . 1 68 . 12 HIS CA C 54.6 . 1 69 . 12 HIS CB C 29.9 . 1 70 . 12 HIS N N 105.00 . 1 71 . 13 MET H H 8.11 . 1 72 . 13 MET HA H 5.48 . 1 73 . 13 MET C C 176.8 . 1 74 . 13 MET CA C 52.9 . 1 75 . 13 MET CB C 29.7 . 1 76 . 13 MET N N 117.00 . 1 77 . 14 ASP H H 8.86 . 1 78 . 14 ASP HA H 5.01 . 1 79 . 14 ASP C C 175.00 . 1 80 . 14 ASP CA C 53.3 . 1 81 . 14 ASP CB C 39.8 . 1 82 . 14 ASP N N 121.00 . 1 83 . 15 SER H H 9.01 . 1 84 . 15 SER HA H 4.36 . 1 85 . 15 SER C C 174.6 . 1 86 . 15 SER CA C 59.9 . 1 87 . 15 SER CB C 62.9 . 1 88 . 15 SER N N 119.3 . 1 89 . 16 SER H H 8.06 . 1 90 . 16 SER HA H 4.4 . 1 91 . 16 SER C C 173.9 . 1 92 . 16 SER CA C 59.5 . 1 93 . 16 SER CB C 63.8 . 1 94 . 16 SER N N 115.00 . 1 95 . 17 THR H H 7.52 . 1 96 . 17 THR HA H 4.57 . 1 97 . 17 THR C C 174.6 . 1 98 . 17 THR CA C 59.8 . 1 99 . 17 THR CB C 70.7 . 1 100 . 17 THR N N 112.3 . 1 101 . 18 SER H H 8.64 . 1 102 . 18 SER HA H 4.32 . 1 103 . 18 SER C C 174.2 . 1 104 . 18 SER CA C 59.4 . 1 105 . 18 SER CB C 63.3 . 1 106 . 18 SER N N 118.3 . 1 107 . 19 ALA H H 7.55 . 1 108 . 19 ALA HA H 3.35 . 1 109 . 19 ALA C C 175.7 . 1 110 . 19 ALA CA C 51.1 . 1 111 . 19 ALA CB C 20.00 . 1 112 . 19 ALA N N 122.4 . 1 113 . 20 ALA H H 7.69 . 1 114 . 20 ALA HA H 3.51 . 1 115 . 20 ALA C C 177.7 . 1 116 . 20 ALA CA C 52.3 . 1 117 . 20 ALA CB C 18.2 . 1 118 . 20 ALA N N 121.6 . 1 119 . 21 SER H H 8.04 . 1 120 . 21 SER HA H 4.3 . 1 121 . 21 SER C C 173.9 . 1 122 . 21 SER CA C 58.3 . 1 123 . 21 SER CB C 63.8 . 1 124 . 21 SER N N 115.2 . 1 125 . 22 SER H H 7.71 . 1 126 . 22 SER HA H 4.76 . 1 127 . 22 SER C C 175.5 . 1 128 . 22 SER CA C 57.3 . 1 129 . 22 SER CB C 65.2 . 1 130 . 22 SER N N 114.6 . 1 131 . 23 SER H H 9.14 . 1 132 . 23 SER HA H 4.45 . 1 133 . 23 SER C C 176.00 . 1 134 . 23 SER CA C 60.5 . 1 135 . 23 SER CB C 62.8 . 1 136 . 23 SER N N 118.3 . 1 137 . 24 ASN H H 8.45 . 1 138 . 24 ASN HA H 5.01 . 1 139 . 24 ASN C C 174.5 . 1 140 . 24 ASN CA C 53.00 . 1 141 . 24 ASN CB C 39.4 . 1 142 . 24 ASN N N 120.5 . 1 143 . 25 TYR H H 7.7 . 1 144 . 25 TYR HA H 4.09 . 1 145 . 25 TYR C C 176.7 . 1 146 . 25 TYR CA C 61.8 . 1 147 . 25 TYR CB C 39.3 . 1 148 . 25 TYR N N 120.6 . 1 149 . 26 CYS H H 7.91 . 1 150 . 26 CYS HA H 3.88 . 1 151 . 26 CYS C C 175.5 . 1 152 . 26 CYS CA C 61.3 . 1 153 . 26 CYS CB C 39.6 . 1 154 . 26 CYS N N 114.6 . 1 155 . 27 ASN H H 8.05 . 1 156 . 27 ASN HA H 4.45 . 1 157 . 27 ASN C C 178.2 . 1 158 . 27 ASN CA C 56.5 . 1 159 . 27 ASN CB C 37.00 . 1 160 . 27 ASN N N 117.2 . 1 161 . 28 GLN H H 7.63 . 1 162 . 28 GLN HA H 4.02 . 1 163 . 28 GLN C C 178.8 . 1 164 . 28 GLN CA C 58.4 . 1 165 . 28 GLN CB C 28.1 . 1 166 . 28 GLN N N 117.2 . 1 167 . 29 MET H H 8.52 . 1 168 . 29 MET HA H 4.21 . 1 169 . 29 MET C C 178.7 . 1 170 . 29 MET CA C 55.6 . 1 171 . 29 MET CB C 30.9 . 1 172 . 29 MET N N 119.9 . 1 173 . 30 MET H H 8.77 . 1 174 . 30 MET HA H 4.29 . 1 175 . 30 MET C C 178.2 . 1 176 . 30 MET CA C 56.5 . 1 177 . 30 MET CB C 28.8 . 1 178 . 30 MET N N 116.00 . 1 179 . 31 LYS H H 6.6 . 1 180 . 31 LYS HA H 4.33 . 1 181 . 31 LYS C C 180.9 . 1 182 . 31 LYS CA C 58.4 . 1 183 . 31 LYS CB C 32.6 . 1 184 . 31 LYS N N 115.8 . 1 185 . 32 SER H H 8.62 . 1 186 . 32 SER HA H 4.22 . 1 187 . 32 SER C C 176.4 . 1 188 . 32 SER CA C 61.7 . 1 189 . 32 SER N N 117.2 . 1 190 . 33 ARG H H 7.87 . 1 191 . 33 ARG HA H 4.49 . 1 192 . 33 ARG C C 174.5 . 1 193 . 33 ARG CA C 53.3 . 1 194 . 33 ARG CB C 27.7 . 1 195 . 33 ARG N N 116.8 . 1 196 . 34 ASN H H 7.99 . 1 197 . 34 ASN HA H 4.88 . 1 198 . 34 ASN C C 175.8 . 1 199 . 34 ASN CA C 54.1 . 1 200 . 34 ASN CB C 36.3 . 1 201 . 34 ASN N N 113.3 . 1 202 . 35 LEU H H 8.16 . 1 203 . 35 LEU HA H 4.68 . 1 204 . 35 LEU C C 176.7 . 1 205 . 35 LEU CA C 54.9 . 1 206 . 35 LEU CB C 40.3 . 1 207 . 35 LEU N N 115.00 . 1 208 . 36 THR H H 7.68 . 1 209 . 36 THR HA H 5.47 . 1 210 . 36 THR C C 174.1 . 1 211 . 36 THR CA C 59.7 . 1 212 . 36 THR CB C 68.5 . 1 213 . 36 THR N N 107.1 . 1 214 . 37 LYS H H 7.06 . 1 215 . 37 LYS HA H 4.25 . 1 216 . 37 LYS C C 178.2 . 1 217 . 37 LYS CA C 58.4 . 1 218 . 37 LYS CB C 32.7 . 1 219 . 37 LYS N N 121.8 . 1 220 . 38 ASP H H 8.84 . 1 221 . 38 ASP HA H 4.4 . 1 222 . 38 ASP C C 174.00 . 1 223 . 38 ASP CA C 56.3 . 1 224 . 38 ASP CB C 40.8 . 1 225 . 38 ASP N N 119.7 . 1 226 . 39 ARG H H 7.76 . 1 227 . 39 ARG HA H 3.57 . 1 228 . 39 ARG C C 173.9 . 1 229 . 39 ARG CA C 54.2 . 1 230 . 39 ARG CB C 30.6 . 1 231 . 39 ARG N N 115.8 . 1 232 . 40 CYS H H 9.08 . 1 233 . 40 CYS HA H 4.78 . 1 234 . 40 CYS C C 174.3 . 1 235 . 40 CYS CA C 52.7 . 1 236 . 40 CYS CB C 36.00 . 1 237 . 40 CYS N N 117.5 . 1 238 . 41 LYS H H 7.42 . 1 239 . 41 LYS HA H 4.49 . 1 240 . 41 LYS C C 177.5 . 1 241 . 41 LYS CA C 55.8 . 1 242 . 41 LYS CB C 33.6 . 1 243 . 41 LYS N N 129.5 . 1 244 . 42 PRO HA H 4.64 . 1 245 . 42 PRO C C 176.7 . 1 246 . 42 PRO CA C 66.7 . 1 247 . 43 VAL H H 6.89 . 1 248 . 43 VAL HA H 5.11 . 1 249 . 43 VAL C C 174.7 . 1 250 . 43 VAL CA C 59.5 . 1 251 . 43 VAL CB C 35.9 . 1 252 . 43 VAL N N 113.9 . 1 253 . 44 ASN H H 8.92 . 1 254 . 44 ASN HA H 5.2 . 1 255 . 44 ASN C C 173.4 . 1 256 . 44 ASN CA C 54.00 . 1 257 . 44 ASN CB C 43.8 . 1 258 . 44 ASN N N 121.00 . 1 259 . 45 THR H H 7.53 . 1 260 . 45 THR HA H 5.04 . 1 261 . 45 THR C C 173.7 . 1 262 . 45 THR CA C 62.1 . 1 263 . 45 THR CB C 68.9 . 1 264 . 45 THR N N 122.00 . 1 265 . 46 PHE H H 9.19 . 1 266 . 46 PHE HA H 4.99 . 1 267 . 46 PHE C C 174.2 . 1 268 . 46 PHE CA C 56.8 . 1 269 . 46 PHE CB C 43.2 . 1 270 . 46 PHE N N 124.5 . 1 271 . 47 VAL H H 9.34 . 1 272 . 47 VAL HA H 4.3 . 1 273 . 47 VAL C C 175.4 . 1 274 . 47 VAL CA C 62.00 . 1 275 . 47 VAL CB C 32.5 . 1 276 . 47 VAL N N 121.6 . 1 277 . 48 HIS H H 9.18 . 1 278 . 48 HIS HA H 5.35 . 1 279 . 48 HIS C C 173.5 . 1 280 . 48 HIS CA C 52.4 . 1 281 . 48 HIS CB C 26.00 . 1 282 . 48 HIS N N 128.6 . 1 283 . 49 GLU H H 6.85 . 1 284 . 49 GLU HA H 4.88 . 1 285 . 49 GLU C C 174.6 . 1 286 . 49 GLU CA C 52.5 . 1 287 . 49 GLU CB C 33.00 . 1 288 . 49 GLU N N 115.6 . 1 289 . 50 SER H H 9.62 . 1 290 . 50 SER HA H 4.29 . 1 291 . 50 SER C C 174.5 . 1 292 . 50 SER CA C 57.8 . 1 293 . 50 SER CB C 64.1 . 1 294 . 50 SER N N 116.8 . 1 295 . 51 LEU H H 8.86 . 1 296 . 51 LEU HA H 4.13 . 1 297 . 51 LEU C C 179.1 . 1 298 . 51 LEU CA C 58.00 . 1 299 . 51 LEU CB C 40.7 . 1 300 . 51 LEU N N 123.2 . 1 301 . 52 ALA H H 8.57 . 1 302 . 52 ALA HA H 4.17 . 1 303 . 52 ALA C C 180.7 . 1 304 . 52 ALA CA C 55.2 . 1 305 . 52 ALA CB C 17.9 . 1 306 . 52 ALA N N 119.7 . 1 307 . 53 ASP H H 7.87 . 1 308 . 53 ASP HA H 4.38 . 1 309 . 53 ASP C C 178.4 . 1 310 . 53 ASP CA C 56.8 . 1 311 . 53 ASP CB C 39.00 . 1 312 . 53 ASP N N 118.9 . 1 313 . 54 VAL H H 7.77 . 1 314 . 54 VAL HA H 3.71 . 1 315 . 54 VAL C C 178.00 . 1 316 . 54 VAL CA C 66.7 . 1 317 . 54 VAL CB C 31.5 . 1 318 . 54 VAL N N 120.5 . 1 319 . 55 GLN H H 9.18 . 1 320 . 55 GLN HA H 3.62 . 1 321 . 55 GLN C C 179.4 . 1 322 . 55 GLN CA C 59.1 . 1 323 . 55 GLN CB C 27.2 . 1 324 . 55 GLN N N 118.3 . 1 325 . 56 ALA H H 7.7 . 1 326 . 56 ALA HA H 4.09 . 1 327 . 56 ALA C C 178.9 . 1 328 . 56 ALA CA C 53.8 . 1 329 . 56 ALA CB C 17.7 . 1 330 . 56 ALA N N 119.3 . 1 331 . 57 VAL H H 7.58 . 1 332 . 57 VAL HA H 2.98 . 1 333 . 57 VAL C C 175.9 . 1 334 . 57 VAL CA C 65.8 . 1 335 . 57 VAL CB C 30.7 . 1 336 . 57 VAL N N 119.9 . 1 337 . 58 CYS H H 6.79 . 1 338 . 58 CYS HA H 3.54 . 1 339 . 58 CYS C C 172.4 . 1 340 . 58 CYS CA C 54.7 . 1 341 . 58 CYS CB C 40.1 . 1 342 . 58 CYS N N 112.5 . 1 343 . 59 SER H H 7.46 . 1 344 . 59 SER HA H 4.53 . 1 345 . 59 SER C C 174.6 . 1 346 . 59 SER CA C 57.1 . 1 347 . 59 SER CB C 63.9 . 1 348 . 59 SER N N 110.8 . 1 349 . 60 GLN H H 7.59 . 1 350 . 60 GLN HA H 4.38 . 1 351 . 60 GLN C C 174.1 . 1 352 . 60 GLN CA C 55.3 . 1 353 . 60 GLN CB C 23.8 . 1 354 . 60 GLN N N 123.4 . 1 355 . 61 LYS H H 7.43 . 1 356 . 61 LYS HA H 4.37 . 1 357 . 61 LYS C C 175.2 . 1 358 . 61 LYS CA C 56.7 . 1 359 . 61 LYS CB C 32.9 . 1 360 . 61 LYS N N 122.00 . 1 361 . 62 ASN H H 9.05 . 1 362 . 62 ASN HA H 4.14 . 1 363 . 62 ASN C C 174.7 . 1 364 . 62 ASN CA C 54.2 . 1 365 . 62 ASN CB C 39.4 . 1 366 . 62 ASN N N 128.00 . 1 367 . 63 VAL H H 8.05 . 1 368 . 63 VAL HA H 4.14 . 1 369 . 63 VAL C C 174.4 . 1 370 . 63 VAL CA C 60.9 . 1 371 . 63 VAL CB C 32.8 . 1 372 . 63 VAL N N 123.7 . 1 373 . 64 ALA H H 8.2 . 1 374 . 64 ALA HA H 4.32 . 1 375 . 64 ALA C C 177.4 . 1 376 . 64 ALA CA C 52.2 . 1 377 . 64 ALA CB C 19.00 . 1 378 . 64 ALA N N 127.00 . 1 379 . 65 SER H H 8.44 . 1 380 . 65 SER HA H 4.57 . 1 381 . 65 SER C C 175.3 . 1 382 . 65 SER CA C 57.1 . 1 383 . 65 SER CB C 64.7 . 1 384 . 65 SER N N 115.8 . 1 385 . 66 LYS H H 8.65 . 1 386 . 66 LYS HA H 4.25 . 1 387 . 66 LYS C C 176.7 . 1 388 . 66 LYS CA C 57.2 . 1 389 . 66 LYS CB C 32.1 . 1 390 . 66 LYS N N 123.5 . 1 391 . 67 ASN H H 8.3 . 1 392 . 67 ASN HA H 4.72 . 1 393 . 67 ASN C C 175.6 . 1 394 . 67 ASN CA C 53.00 . 1 395 . 67 ASN CB C 38.3 . 1 396 . 67 ASN N N 116.4 . 1 397 . 68 GLY H H 8.09 . 1 398 . 68 GLY HA2 H 4.16 . 2 399 . 68 GLY HA3 H 3.81 . 2 400 . 68 GLY C C 173.9 . 1 401 . 68 GLY CA C 45.3 . 1 402 . 68 GLY N N 108.2 . 1 403 . 69 GLN H H 8.12 . 1 404 . 69 GLN HA H 4.45 . 1 405 . 69 GLN C C 176.9 . 1 406 . 69 GLN CA C 56.00 . 1 407 . 69 GLN CB C 29.3 . 1 408 . 69 GLN N N 119.7 . 1 409 . 70 THR H H 8.42 . 1 410 . 70 THR HA H 4.71 . 1 411 . 70 THR C C 174.5 . 1 412 . 70 THR CA C 61.5 . 1 413 . 70 THR CB C 69.8 . 1 414 . 70 THR N N 113.3 . 1 415 . 71 ASN H H 8.56 . 1 416 . 71 ASN HA H 4.96 . 1 417 . 71 ASN C C 173.7 . 1 418 . 71 ASN CA C 53.00 . 1 419 . 71 ASN CB C 38.9 . 1 420 . 71 ASN N N 120.1 . 1 421 . 72 SER H H 8.15 . 1 422 . 72 SER HA H 5.5 . 1 423 . 72 SER C C 172.9 . 1 424 . 72 SER CA C 58.3 . 1 425 . 72 SER CB C 64.1 . 1 426 . 72 SER N N 116.2 . 1 427 . 73 TYR H H 9.2 . 1 428 . 73 TYR HA H 5.04 . 1 429 . 73 TYR C C 172.7 . 1 430 . 73 TYR CA C 56.8 . 1 431 . 73 TYR CB C 44.5 . 1 432 . 73 TYR N N 123.00 . 1 433 . 74 GLN H H 9.6 . 1 434 . 74 GLN HA H 5.55 . 1 435 . 74 GLN C C 175.4 . 1 436 . 74 GLN CA C 52.1 . 1 437 . 74 GLN CB C 33.2 . 1 438 . 74 GLN N N 121.8 . 1 439 . 75 SER H H 9.18 . 1 440 . 75 SER HA H 4.68 . 1 441 . 75 SER C C 176.8 . 1 442 . 75 SER CA C 57.5 . 1 443 . 75 SER CB C 64.5 . 1 444 . 75 SER N N 121.00 . 1 445 . 76 TYR H H 8.73 . 1 446 . 76 TYR HA H 4.69 . 1 447 . 76 TYR C C 178.7 . 1 448 . 76 TYR CA C 59.5 . 1 449 . 76 TYR CB C 37.8 . 1 450 . 76 TYR N N 124.1 . 1 451 . 77 SER H H 9.05 . 1 452 . 77 SER HA H 4.92 . 1 453 . 77 SER C C 175.2 . 1 454 . 77 SER CA C 56.8 . 1 455 . 77 SER CB C 64.3 . 1 456 . 77 SER N N 113.3 . 1 457 . 78 THR H H 8.35 . 1 458 . 78 THR HA H 3.38 . 1 459 . 78 THR C C 173.2 . 1 460 . 78 THR CA C 61.8 . 1 461 . 78 THR CB C 69.5 . 1 462 . 78 THR N N 113.7 . 1 463 . 79 MET H H 8.67 . 1 464 . 79 MET HA H 4.61 . 1 465 . 79 MET C C 173.8 . 1 466 . 79 MET CA C 55.00 . 1 467 . 79 MET CB C 36.6 . 1 468 . 79 MET N N 121.2 . 1 469 . 80 SER H H 8.77 . 1 470 . 80 SER HA H 4.85 . 1 471 . 80 SER C C 174.6 . 1 472 . 80 SER CA C 57.1 . 1 473 . 80 SER CB C 62.7 . 1 474 . 80 SER N N 115.00 . 1 475 . 81 ILE H H 9.19 . 1 476 . 81 ILE HA H 5.54 . 1 477 . 81 ILE C C 174.9 . 1 478 . 81 ILE CA C 58.6 . 1 479 . 81 ILE CB C 43.1 . 1 480 . 81 ILE N N 122.4 . 1 481 . 82 THR H H 9.45 . 1 482 . 82 THR HA H 5.07 . 1 483 . 82 THR C C 172.2 . 1 484 . 82 THR CA C 61.7 . 1 485 . 82 THR N N 116.00 . 1 486 . 83 ASP H H 9.32 . 1 487 . 83 ASP HA H 4.88 . 1 488 . 83 ASP C C 174.4 . 1 489 . 83 ASP CA C 53.7 . 1 490 . 83 ASP CB C 43.4 . 1 491 . 83 ASP N N 128.6 . 1 492 . 84 CYS H H 8.44 . 1 493 . 84 CYS HA H 5.99 . 1 494 . 84 CYS C C 173.7 . 1 495 . 84 CYS CA C 51.5 . 1 496 . 84 CYS CB C 38.6 . 1 497 . 84 CYS N N 122.4 . 1 498 . 85 ARG H H 8.15 . 1 499 . 85 ARG HA H 5.51 . 1 500 . 85 ARG C C 175.4 . 1 501 . 85 ARG CA C 54.5 . 1 502 . 85 ARG CB C 33.3 . 1 503 . 85 ARG N N 120.2 . 1 504 . 86 GLU H H 8.45 . 1 505 . 86 GLU HA H 4.32 . 1 506 . 86 GLU C C 177.6 . 1 507 . 86 GLU CA C 57.6 . 1 508 . 86 GLU CB C 31.2 . 1 509 . 86 GLU N N 125.7 . 1 510 . 87 THR H H 8.02 . 1 511 . 87 THR HA H 4.52 . 1 512 . 87 THR C C 176.3 . 1 513 . 87 THR CA C 60.3 . 1 514 . 87 THR CB C 70.00 . 1 515 . 87 THR N N 113.9 . 1 516 . 88 GLY H H 8.88 . 1 517 . 88 GLY HA2 H 3.94 . 2 518 . 88 GLY C C 174.7 . 1 519 . 88 GLY CA C 46.4 . 1 520 . 88 GLY N N 106.9 . 1 521 . 89 SER H H 7.64 . 1 522 . 89 SER HA H 4.53 . 1 523 . 89 SER C C 173.9 . 1 524 . 89 SER CA C 57.4 . 1 525 . 89 SER CB C 63.4 . 1 526 . 89 SER N N 112.00 . 1 527 . 90 SER H H 7.02 . 1 528 . 90 SER HA H 3.97 . 1 529 . 90 SER C C 175.1 . 1 530 . 90 SER CA C 58.9 . 1 531 . 90 SER CB C 62.7 . 1 532 . 90 SER N N 117.4 . 1 533 . 91 LYS H H 7.53 . 1 534 . 91 LYS HA H 4.44 . 1 535 . 91 LYS C C 174.2 . 1 536 . 91 LYS CA C 56.00 . 1 537 . 91 LYS CB C 33.6 . 1 538 . 91 LYS N N 129.4 . 1 539 . 92 TYR H H 9.44 . 1 540 . 92 TYR HA H 3.78 . 1 541 . 92 TYR CA C 58.2 . 1 542 . 92 TYR CB C 38.4 . 1 543 . 92 TYR N N 131.5 . 1 544 . 93 PRO HA H 3.27 . 1 545 . 93 PRO C C 175.1 . 1 546 . 93 PRO CA C 63.7 . 1 547 . 93 PRO CB C 33.5 . 1 548 . 94 ASN H H 8.85 . 1 549 . 94 ASN HA H 4.96 . 1 550 . 94 ASN C C 174.4 . 1 551 . 94 ASN CA C 52.1 . 1 552 . 94 ASN CB C 37.3 . 1 553 . 94 ASN N N 130.7 . 1 554 . 95 CYS H H 7.63 . 1 555 . 95 CYS HA H 4.88 . 1 556 . 95 CYS C C 174.3 . 1 557 . 95 CYS CA C 53.8 . 1 558 . 95 CYS CB C 38.8 . 1 559 . 95 CYS N N 121.4 . 1 560 . 96 ALA H H 8.66 . 1 561 . 96 ALA HA H 4.76 . 1 562 . 96 ALA C C 175.3 . 1 563 . 96 ALA CA C 51.6 . 1 564 . 96 ALA CB C 21.8 . 1 565 . 96 ALA N N 128.2 . 1 566 . 97 TYR H H 9.38 . 1 567 . 97 TYR HA H 4.89 . 1 568 . 97 TYR C C 176.1 . 1 569 . 97 TYR CA C 58.4 . 1 570 . 97 TYR CB C 43.7 . 1 571 . 97 TYR N N 117.2 . 1 572 . 98 LYS H H 9.52 . 1 573 . 98 LYS HA H 4.81 . 1 574 . 98 LYS C C 176.3 . 1 575 . 98 LYS CA C 54.8 . 1 576 . 98 LYS CB C 34.00 . 1 577 . 98 LYS N N 125.3 . 1 578 . 99 THR H H 9.27 . 1 579 . 99 THR HA H 5.29 . 1 580 . 99 THR C C 174.9 . 1 581 . 99 THR CA C 62.6 . 1 582 . 99 THR CB C 71.9 . 1 583 . 99 THR N N 126.2 . 1 584 . 100 THR H H 8.94 . 1 585 . 100 THR HA H 4.66 . 1 586 . 100 THR C C 172.5 . 1 587 . 100 THR CA C 62.2 . 1 588 . 100 THR CB C 70.1 . 1 589 . 100 THR N N 123.5 . 1 590 . 101 GLN H H 9.12 . 1 591 . 101 GLN HA H 4.99 . 1 592 . 101 GLN C C 174.6 . 1 593 . 101 GLN CA C 54.5 . 1 594 . 101 GLN CB C 29.3 . 1 595 . 101 GLN N N 129.7 . 1 596 . 102 ALA H H 9.11 . 1 597 . 102 ALA HA H 4.69 . 1 598 . 102 ALA C C 173.9 . 1 599 . 102 ALA CA C 51.8 . 1 600 . 102 ALA CB C 22.9 . 1 601 . 102 ALA N N 128.2 . 1 602 . 103 ASN H H 8.47 . 1 603 . 103 ASN HA H 5.83 . 1 604 . 103 ASN C C 174.7 . 1 605 . 103 ASN CA C 52.6 . 1 606 . 103 ASN CB C 39.5 . 1 607 . 103 ASN N N 118.7 . 1 608 . 104 LYS H H 8.59 . 1 609 . 104 LYS HA H 4.89 . 1 610 . 104 LYS C C 177.2 . 1 611 . 104 LYS CA C 54.2 . 1 612 . 104 LYS CB C 39.00 . 1 613 . 104 LYS N N 120.5 . 1 614 . 105 HIS H H 9.23 . 1 615 . 105 HIS HA H 4.48 . 1 616 . 105 HIS C C 174.7 . 1 617 . 105 HIS CA C 56.7 . 1 618 . 105 HIS CB C 27.4 . 1 619 . 105 HIS N N 118.5 . 1 620 . 106 ILE H H 8.48 . 1 621 . 106 ILE HA H 5.00 . 1 622 . 106 ILE C C 173.3 . 1 623 . 106 ILE CA C 59.9 . 1 624 . 106 ILE CB C 40.6 . 1 625 . 106 ILE N N 113.9 . 1 626 . 107 ILE H H 8.16 . 1 627 . 107 ILE HA H 5.39 . 1 628 . 107 ILE C C 176.00 . 1 629 . 107 ILE CA C 60.00 . 1 630 . 107 ILE CB C 38.9 . 1 631 . 107 ILE N N 121.2 . 1 632 . 108 VAL H H 8.95 . 1 633 . 108 VAL HA H 4.8 . 1 634 . 108 VAL C C 172.6 . 1 635 . 108 VAL CA C 57.5 . 1 636 . 108 VAL CB C 34.8 . 1 637 . 108 VAL N N 117.5 . 1 638 . 109 ALA H H 8.2 . 1 639 . 109 ALA HA H 5.39 . 1 640 . 109 ALA C C 177.7 . 1 641 . 109 ALA CA C 49.9 . 1 642 . 109 ALA CB C 21.00 . 1 643 . 109 ALA N N 122.8 . 1 644 . 110 CYS H H 8.59 . 1 645 . 110 CYS HA H 5.28 . 1 646 . 110 CYS C C 172.3 . 1 647 . 110 CYS CA C 55.9 . 1 648 . 110 CYS N N 120.4 . 1 649 . 111 GLU H H 8.63 . 1 650 . 111 GLU HA H 4.61 . 1 651 . 111 GLU C C 175.8 . 1 652 . 111 GLU CA C 56.4 . 1 653 . 111 GLU CB C 35.2 . 1 654 . 111 GLU N N 120.1 . 1 655 . 112 GLY H H 8.81 . 1 656 . 112 GLY HA2 H 3.77 . 2 657 . 112 GLY C C 173.2 . 1 658 . 112 GLY CA C 44.1 . 1 659 . 112 GLY N N 109.8 . 1 660 . 113 ASN H H 7.81 . 1 661 . 113 ASN HA H 4.77 . 1 662 . 113 ASN C C 173.2 . 1 663 . 113 ASN CA C 50.4 . 1 664 . 113 ASN CB C 40.1 . 1 665 . 113 ASN N N 113.9 . 1 666 . 114 PRO HA H 4.68 . 1 667 . 114 PRO C C 173.9 . 1 668 . 114 PRO CA C 63.1 . 1 669 . 114 PRO CB C 34.00 . 1 670 . 115 TYR H H 8.55 . 1 671 . 115 TYR HA H 4.28 . 1 672 . 115 TYR C C 174.4 . 1 673 . 115 TYR CA C 58.2 . 1 674 . 115 TYR CB C 37.7 . 1 675 . 115 TYR N N 125.5 . 1 676 . 116 VAL H H 7.48 . 1 677 . 116 VAL HA H 4.88 . 1 678 . 116 VAL C C 173.00 . 1 679 . 116 VAL CB C 33.1 . 1 680 . 116 VAL N N 118.9 . 1 681 . 117 PRO HA H 4.4 . 1 682 . 117 PRO C C 176.4 . 1 683 . 117 PRO CA C 62.4 . 1 684 . 117 PRO CB C 29.7 . 1 685 . 118 VAL H H 9.05 . 1 686 . 118 VAL HA H 4.52 . 1 687 . 118 VAL C C 176.5 . 1 688 . 118 VAL CA C 60.8 . 1 689 . 118 VAL CB C 34.2 . 1 690 . 118 VAL N N 110.00 . 1 691 . 119 HIS H H 7.68 . 1 692 . 119 HIS HA H 5.43 . 1 693 . 119 HIS C C 172.5 . 1 694 . 119 HIS CA C 55.00 . 1 695 . 119 HIS CB C 32.1 . 1 696 . 119 HIS N N 117.4 . 1 697 . 120 PHE H H 8.77 . 1 698 . 120 PHE HA H 4.44 . 1 699 . 120 PHE C C 173.00 . 1 700 . 120 PHE CA C 57.6 . 1 701 . 120 PHE CB C 38.2 . 1 702 . 120 PHE N N 127.00 . 1 703 . 121 ASP H H 8.64 . 1 704 . 121 ASP HA H 4.76 . 1 705 . 121 ASP C C 175.8 . 1 706 . 121 ASP CA C 56.1 . 1 707 . 121 ASP CB C 40.7 . 1 708 . 121 ASP N N 128.3 . 1 709 . 122 ALA H H 7.35 . 1 710 . 122 ALA HA H 4.64 . 1 711 . 122 ALA C C 173.9 . 1 712 . 122 ALA CA C 52.1 . 1 713 . 122 ALA CB C 21.7 . 1 714 . 122 ALA N N 118.3 . 1 715 . 123 SER H H 8.25 . 1 716 . 123 SER HA H 5.4 . 1 717 . 123 SER C C 173.5 . 1 718 . 123 SER CA C 56.8 . 1 719 . 123 SER CB C 66.1 . 1 720 . 123 SER N N 112.3 . 1 721 . 124 VAL H H 8.78 . 1 722 . 124 VAL HA H 4.3 . 1 723 . 124 VAL C C 179.4 . 1 724 . 124 VAL CA C 63.2 . 1 725 . 124 VAL CB C 35.2 . 1 726 . 124 VAL N N 123.5 . 1 stop_ save_