NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
636885 | 6if9 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 112 |
data_6if9_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6if9 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_6if9 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6if9 _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6if9 "Master copy" parsed_6if9 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6if9 _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 6if9.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6if9 1 1 6if9.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 112 parsed_6if9 1 1 6if9.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_6if9 1 1 6if9.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6if9 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6if9 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . parsed_6if9 1 2 1 . . . parsed_6if9 1 3 1 . . . parsed_6if9 1 4 1 . . . parsed_6if9 1 5 1 . . . parsed_6if9 1 6 1 . . . parsed_6if9 1 7 1 . . . parsed_6if9 1 8 1 . . . parsed_6if9 1 9 1 . . . parsed_6if9 1 10 1 . . . parsed_6if9 1 11 1 . . . parsed_6if9 1 12 1 . . . parsed_6if9 1 13 1 . . . parsed_6if9 1 14 1 . . . parsed_6if9 1 15 1 . . . parsed_6if9 1 16 1 . . . parsed_6if9 1 17 1 . . . parsed_6if9 1 18 1 . . . parsed_6if9 1 19 1 . . . parsed_6if9 1 20 1 . . . parsed_6if9 1 21 1 . . . parsed_6if9 1 22 1 . . . parsed_6if9 1 23 1 . . . parsed_6if9 1 24 1 . . . parsed_6if9 1 25 1 . . . parsed_6if9 1 26 1 . . . parsed_6if9 1 27 1 . . . parsed_6if9 1 28 1 . . . parsed_6if9 1 29 1 . . . parsed_6if9 1 30 1 . . . parsed_6if9 1 31 1 . . . parsed_6if9 1 32 1 . . . parsed_6if9 1 33 1 . . . parsed_6if9 1 34 1 . . . parsed_6if9 1 35 1 . . . parsed_6if9 1 36 1 . . . parsed_6if9 1 37 1 . . . parsed_6if9 1 38 1 . . . parsed_6if9 1 39 1 . . . parsed_6if9 1 40 1 . . . parsed_6if9 1 41 1 . . . parsed_6if9 1 42 1 . . . parsed_6if9 1 43 1 . . . parsed_6if9 1 44 1 . . . parsed_6if9 1 45 1 . . . parsed_6if9 1 46 1 . . . parsed_6if9 1 47 1 . . . parsed_6if9 1 48 1 . . . parsed_6if9 1 49 1 . . . parsed_6if9 1 50 1 . . . parsed_6if9 1 51 1 . . . parsed_6if9 1 52 1 . . . parsed_6if9 1 53 1 . . . parsed_6if9 1 54 1 . . . parsed_6if9 1 55 1 . . . parsed_6if9 1 56 1 . . . parsed_6if9 1 57 1 . . . parsed_6if9 1 58 1 . . . parsed_6if9 1 59 1 . . . parsed_6if9 1 60 1 . . . parsed_6if9 1 61 1 . . . parsed_6if9 1 62 1 . . . parsed_6if9 1 63 1 . . . parsed_6if9 1 64 1 . . . parsed_6if9 1 65 1 . . . parsed_6if9 1 66 1 . . . parsed_6if9 1 67 1 . . . parsed_6if9 1 68 1 . . . parsed_6if9 1 69 1 . . . parsed_6if9 1 70 1 . . . parsed_6if9 1 71 1 . . . parsed_6if9 1 72 1 . . . parsed_6if9 1 73 1 . . . parsed_6if9 1 74 1 . . . parsed_6if9 1 75 1 . . . parsed_6if9 1 76 1 . . . parsed_6if9 1 77 1 . . . parsed_6if9 1 78 1 . . . parsed_6if9 1 79 1 . . . parsed_6if9 1 80 1 . . . parsed_6if9 1 81 1 . . . parsed_6if9 1 82 1 . . . parsed_6if9 1 83 1 . . . parsed_6if9 1 84 1 . . . parsed_6if9 1 85 1 . . . parsed_6if9 1 86 1 . . . parsed_6if9 1 87 1 . . . parsed_6if9 1 88 1 . . . parsed_6if9 1 89 1 . . . parsed_6if9 1 90 1 . . . parsed_6if9 1 91 1 . . . parsed_6if9 1 92 1 . . . parsed_6if9 1 93 1 . . . parsed_6if9 1 94 1 . . . parsed_6if9 1 95 1 . . . parsed_6if9 1 96 1 . . . parsed_6if9 1 97 1 . . . parsed_6if9 1 98 1 . . . parsed_6if9 1 99 1 . . . parsed_6if9 1 100 1 . . . parsed_6if9 1 101 1 . . . parsed_6if9 1 102 1 . . . parsed_6if9 1 103 1 . . . parsed_6if9 1 104 1 . . . parsed_6if9 1 105 1 . . . parsed_6if9 1 106 1 . . . parsed_6if9 1 107 1 . . . parsed_6if9 1 108 1 . . . parsed_6if9 1 109 1 . . . parsed_6if9 1 110 1 . . . parsed_6if9 1 111 1 . . . parsed_6if9 1 112 1 . . . parsed_6if9 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 . . . . . . . . . 44 GLY O parsed_6if9 1 1 1 2 . . . . . . . . . 7 LYS H parsed_6if9 1 2 1 1 . . . . . . . . . 23 CYS O parsed_6if9 1 2 1 2 . . . . . . . . . 8 ILE H parsed_6if9 1 3 1 1 . . . . . . . . . 41 LYS O parsed_6if9 1 3 1 2 . . . . . . . . . 9 THR H parsed_6if9 1 4 1 1 . . . . . . . . . 21 TYR O parsed_6if9 1 4 1 2 . . . . . . . . . 10 PHE H parsed_6if9 1 5 1 1 . . . . . . . . . 39 SER O parsed_6if9 1 5 1 2 . . . . . . . . . 11 TYR H parsed_6if9 1 6 1 1 . . . . . . . . . 19 ARG O parsed_6if9 1 6 1 2 . . . . . . . . . 12 GLU H parsed_6if9 1 7 1 1 . . . . . . . . . 17 GLN O parsed_6if9 1 7 1 2 . . . . . . . . . 13 ASP H parsed_6if9 1 8 1 1 . . . . . . . . . 68 PRO O parsed_6if9 1 8 1 2 . . . . . . . . . 15 ASN H parsed_6if9 1 9 1 1 . . . . . . . . . 39 SER OG parsed_6if9 1 9 1 2 . . . . . . . . . 16 PHE H parsed_6if9 1 10 1 1 . . . . . . . . . 14 LYS O parsed_6if9 1 10 1 2 . . . . . . . . . 17 GLN H parsed_6if9 1 11 1 1 . . . . . . . . . 10 PHE O parsed_6if9 1 11 1 2 . . . . . . . . . 21 TYR H parsed_6if9 1 12 1 1 . . . . . . . . . 8 ILE O parsed_6if9 1 12 1 2 . . . . . . . . . 23 CYS H parsed_6if9 1 13 1 1 . . . . . . . . . 26 ASP O parsed_6if9 1 13 1 2 . . . . . . . . . 25 CYS HG parsed_6if9 1 14 1 1 . . . . . . . . . 83 CYS O parsed_6if9 1 14 1 2 . . . . . . . . . 27 CYS H parsed_6if9 1 15 1 1 . . . . . . . . . 81 SER O parsed_6if9 1 15 1 2 . . . . . . . . . 30 PHE H parsed_6if9 1 16 1 1 . . . . . . . . . 29 ASP OD1 parsed_6if9 1 16 1 2 . . . . . . . . . 31 HIS H parsed_6if9 1 17 1 1 . . . . . . . . . 30 PHE O parsed_6if9 1 17 1 2 . . . . . . . . . 33 TYR H parsed_6if9 1 18 1 1 . . . . . . . . . 30 PHE O parsed_6if9 1 18 1 2 . . . . . . . . . 34 LEU H parsed_6if9 1 19 1 1 . . . . . . . . . 12 GLU O parsed_6if9 1 19 1 2 . . . . . . . . . 36 ARG HE parsed_6if9 1 20 1 1 . . . . . . . . . 13 ASP OD1 parsed_6if9 1 20 1 2 . . . . . . . . . 36 ARG HE parsed_6if9 1 21 1 1 . . . . . . . . . 78 ASP O parsed_6if9 1 21 1 2 . . . . . . . . . 37 CYS H parsed_6if9 1 22 1 1 . . . . . . . . . 11 TYR O parsed_6if9 1 22 1 2 . . . . . . . . . 38 ASN H parsed_6if9 1 23 1 1 . . . . . . . . . 11 TYR O parsed_6if9 1 23 1 2 . . . . . . . . . 39 SER H parsed_6if9 1 24 1 1 . . . . . . . . . 13 ASP O parsed_6if9 1 24 1 2 . . . . . . . . . 39 SER HG parsed_6if9 1 25 1 1 . . . . . . . . . 67 TYR O parsed_6if9 1 25 1 2 . . . . . . . . . 40 ILE H parsed_6if9 1 26 1 1 . . . . . . . . . 9 THR O parsed_6if9 1 26 1 2 . . . . . . . . . 41 LYS H parsed_6if9 1 27 1 1 . . . . . . . . . 65 GLY O parsed_6if9 1 27 1 2 . . . . . . . . . 42 VAL H parsed_6if9 1 28 1 1 . . . . . . . . . 7 LYS O parsed_6if9 1 28 1 2 . . . . . . . . . 43 GLU H parsed_6if9 1 29 1 1 . . . . . . . . . 7 LYS O parsed_6if9 1 29 1 2 . . . . . . . . . 44 GLY H parsed_6if9 1 30 1 1 . . . . . . . . . 62 LEU O parsed_6if9 1 30 1 2 . . . . . . . . . 47 TRP H parsed_6if9 1 31 1 1 . . . . . . . . . 84 ARG O parsed_6if9 1 31 1 2 . . . . . . . . . 48 ALA H parsed_6if9 1 32 1 1 . . . . . . . . . 60 TYR O parsed_6if9 1 32 1 2 . . . . . . . . . 49 VAL H parsed_6if9 1 33 1 1 . . . . . . . . . 82 SER O parsed_6if9 1 33 1 2 . . . . . . . . . 50 TYR H parsed_6if9 1 34 1 1 . . . . . . . . . 58 TYR O parsed_6if9 1 34 1 2 . . . . . . . . . 51 GLU H parsed_6if9 1 35 1 1 . . . . . . . . . 56 ALA O parsed_6if9 1 35 1 2 . . . . . . . . . 52 ARG H parsed_6if9 1 36 1 1 . . . . . . . . . 28 ALA O parsed_6if9 1 36 1 2 . . . . . . . . . 54 ASN H parsed_6if9 1 37 1 1 . . . . . . . . . 82 SER OG parsed_6if9 1 37 1 2 . . . . . . . . . 55 PHE H parsed_6if9 1 38 1 1 . . . . . . . . . 51 GLU OE1 parsed_6if9 1 38 1 2 . . . . . . . . . 58 TYR H parsed_6if9 1 39 1 1 . . . . . . . . . 49 VAL O parsed_6if9 1 39 1 2 . . . . . . . . . 60 TYR H parsed_6if9 1 40 1 1 . . . . . . . . . 149 GLN OE1 parsed_6if9 1 40 1 2 . . . . . . . . . 61 ILE H parsed_6if9 1 41 1 1 . . . . . . . . . 47 TRP O parsed_6if9 1 41 1 2 . . . . . . . . . 62 LEU H parsed_6if9 1 42 1 1 . . . . . . . . . 42 VAL O parsed_6if9 1 42 1 2 . . . . . . . . . 65 GLY H parsed_6if9 1 43 1 1 . . . . . . . . . 40 ILE O parsed_6if9 1 43 1 2 . . . . . . . . . 67 TYR H parsed_6if9 1 44 1 1 . . . . . . . . . 63 PRO O parsed_6if9 1 44 1 2 . . . . . . . . . 67 TYR HH parsed_6if9 1 45 1 1 . . . . . . . . . 69 GLU O parsed_6if9 1 45 1 2 . . . . . . . . . 72 ARG H parsed_6if9 1 46 1 1 . . . . . . . . . 70 TYR O parsed_6if9 1 46 1 2 . . . . . . . . . 73 TRP H parsed_6if9 1 47 1 1 . . . . . . . . . 71 GLN O parsed_6if9 1 47 1 2 . . . . . . . . . 74 MET H parsed_6if9 1 48 1 1 . . . . . . . . . 70 TYR O parsed_6if9 1 48 1 2 . . . . . . . . . 75 GLY H parsed_6if9 1 49 1 1 . . . . . . . . . 60 TYR OH parsed_6if9 1 49 1 2 . . . . . . . . . 76 LEU H parsed_6if9 1 50 1 1 . . . . . . . . . 77 ASN OD1 parsed_6if9 1 50 1 2 . . . . . . . . . 79 ARG H parsed_6if9 1 51 1 1 . . . . . . . . . 50 TYR O parsed_6if9 1 51 1 2 . . . . . . . . . 81 SER H parsed_6if9 1 52 1 1 . . . . . . . . . 31 HIS NE2 parsed_6if9 1 52 1 2 . . . . . . . . . 81 SER HG parsed_6if9 1 53 1 1 . . . . . . . . . 50 TYR O parsed_6if9 1 53 1 2 . . . . . . . . . 82 SER H parsed_6if9 1 54 1 1 . . . . . . . . . 52 ARG O parsed_6if9 1 54 1 2 . . . . . . . . . 82 SER HG parsed_6if9 1 55 1 1 . . . . . . . . . 27 CYS O parsed_6if9 1 55 1 2 . . . . . . . . . 83 CYS H parsed_6if9 1 56 1 1 . . . . . . . . . 48 ALA O parsed_6if9 1 56 1 2 . . . . . . . . . 84 ARG H parsed_6if9 1 57 1 1 . . . . . . . . . 46 THR O parsed_6if9 1 57 1 2 . . . . . . . . . 86 VAL H parsed_6if9 1 58 1 1 . . . . . . . . . 111 THR O parsed_6if9 1 58 1 2 . . . . . . . . . 96 ILE H parsed_6if9 1 59 1 1 . . . . . . . . . 131 LYS O parsed_6if9 1 59 1 2 . . . . . . . . . 97 GLN H parsed_6if9 1 60 1 1 . . . . . . . . . 109 TYR O parsed_6if9 1 60 1 2 . . . . . . . . . 98 ILE H parsed_6if9 1 61 1 1 . . . . . . . . . 129 SER O parsed_6if9 1 61 1 2 . . . . . . . . . 99 PHE H parsed_6if9 1 62 1 1 . . . . . . . . . 107 GLN O parsed_6if9 1 62 1 2 . . . . . . . . . 100 GLU H parsed_6if9 1 63 1 1 . . . . . . . . . 105 SER O parsed_6if9 1 63 1 2 . . . . . . . . . 101 LYS H parsed_6if9 1 64 1 1 . . . . . . . . . 158 ARG O parsed_6if9 1 64 1 2 . . . . . . . . . 103 ASP H parsed_6if9 1 65 1 1 . . . . . . . . . 129 SER OG parsed_6if9 1 65 1 2 . . . . . . . . . 104 PHE H parsed_6if9 1 66 1 1 . . . . . . . . . 102 GLY O parsed_6if9 1 66 1 2 . . . . . . . . . 105 SER H parsed_6if9 1 67 1 1 . . . . . . . . . 100 GLU OE1 parsed_6if9 1 67 1 2 . . . . . . . . . 107 GLN H parsed_6if9 1 68 1 1 . . . . . . . . . 98 ILE O parsed_6if9 1 68 1 2 . . . . . . . . . 109 TYR H parsed_6if9 1 69 1 1 . . . . . . . . . 96 ILE O parsed_6if9 1 69 1 2 . . . . . . . . . 111 THR H parsed_6if9 1 70 1 1 . . . . . . . . . 173 PHE O parsed_6if9 1 70 1 2 . . . . . . . . . 115 CYS H parsed_6if9 1 71 1 1 . . . . . . . . . 171 GLN O parsed_6if9 1 71 1 2 . . . . . . . . . 118 ILE H parsed_6if9 1 72 1 1 . . . . . . . . . 117 SER OG parsed_6if9 1 72 1 2 . . . . . . . . . 120 GLU H parsed_6if9 1 73 1 1 . . . . . . . . . 117 SER O parsed_6if9 1 73 1 2 . . . . . . . . . 121 GLN H parsed_6if9 1 74 1 1 . . . . . . . . . 118 ILE O parsed_6if9 1 74 1 2 . . . . . . . . . 122 PHE H parsed_6if9 1 75 1 1 . . . . . . . . . 119 MET O parsed_6if9 1 75 1 2 . . . . . . . . . 123 HIS H parsed_6if9 1 76 1 1 . . . . . . . . . 168 PRO O parsed_6if9 1 76 1 2 . . . . . . . . . 127 ILE H parsed_6if9 1 77 1 1 . . . . . . . . . 99 PHE O parsed_6if9 1 77 1 2 . . . . . . . . . 128 HIS H parsed_6if9 1 78 1 1 . . . . . . . . . 101 LYS O parsed_6if9 1 78 1 2 . . . . . . . . . 129 SER HG parsed_6if9 1 79 1 1 . . . . . . . . . 157 TYR O parsed_6if9 1 79 1 2 . . . . . . . . . 130 CYS H parsed_6if9 1 80 1 1 . . . . . . . . . 97 GLN O parsed_6if9 1 80 1 2 . . . . . . . . . 131 LYS H parsed_6if9 1 81 1 1 . . . . . . . . . 155 LYS O parsed_6if9 1 81 1 2 . . . . . . . . . 132 VAL H parsed_6if9 1 82 1 1 . . . . . . . . . 95 LYS O parsed_6if9 1 82 1 2 . . . . . . . . . 133 LEU H parsed_6if9 1 83 1 1 . . . . . . . . . 95 LYS O parsed_6if9 1 83 1 2 . . . . . . . . . 134 GLU H parsed_6if9 1 84 1 1 . . . . . . . . . 152 LEU O parsed_6if9 1 84 1 2 . . . . . . . . . 137 TRP H parsed_6if9 1 85 1 1 . . . . . . . . . 174 ARG O parsed_6if9 1 85 1 2 . . . . . . . . . 138 ILE H parsed_6if9 1 86 1 1 . . . . . . . . . 150 TYR O parsed_6if9 1 86 1 2 . . . . . . . . . 139 PHE H parsed_6if9 1 87 1 1 . . . . . . . . . 172 SER O parsed_6if9 1 87 1 2 . . . . . . . . . 140 TYR H parsed_6if9 1 88 1 1 . . . . . . . . . 148 ARG O parsed_6if9 1 88 1 2 . . . . . . . . . 141 GLU H parsed_6if9 1 89 1 1 . . . . . . . . . 146 ARG O parsed_6if9 1 89 1 2 . . . . . . . . . 142 LEU H parsed_6if9 1 90 1 1 . . . . . . . . . 116 PRO O parsed_6if9 1 90 1 2 . . . . . . . . . 144 ASN H parsed_6if9 1 91 1 1 . . . . . . . . . 172 SER OG parsed_6if9 1 91 1 2 . . . . . . . . . 145 TYR H parsed_6if9 1 92 1 1 . . . . . . . . . 142 LEU O parsed_6if9 1 92 1 2 . . . . . . . . . 146 ARG H parsed_6if9 1 93 1 1 . . . . . . . . . 141 GLU OE1 parsed_6if9 1 93 1 2 . . . . . . . . . 148 ARG H parsed_6if9 1 94 1 1 . . . . . . . . . 139 PHE O parsed_6if9 1 94 1 2 . . . . . . . . . 150 TYR H parsed_6if9 1 95 1 1 . . . . . . . . . 137 TRP O parsed_6if9 1 95 1 2 . . . . . . . . . 152 LEU H parsed_6if9 1 96 1 1 . . . . . . . . . 132 VAL O parsed_6if9 1 96 1 2 . . . . . . . . . 155 LYS H parsed_6if9 1 97 1 1 . . . . . . . . . 130 CYS O parsed_6if9 1 97 1 2 . . . . . . . . . 155 LYS H parsed_6if9 1 98 1 1 . . . . . . . . . 153 ASP O parsed_6if9 1 98 1 2 . . . . . . . . . 157 TYR HH parsed_6if9 1 99 1 1 . . . . . . . . . 156 GLU OE1 parsed_6if9 1 99 1 2 . . . . . . . . . 158 ARG HE parsed_6if9 1 100 1 1 . . . . . . . . . 159 LYS O parsed_6if9 1 100 1 2 . . . . . . . . . 162 ASP H parsed_6if9 1 101 1 1 . . . . . . . . . 160 PRO O parsed_6if9 1 101 1 2 . . . . . . . . . 163 TRP H parsed_6if9 1 102 1 1 . . . . . . . . . 161 ILE O parsed_6if9 1 102 1 2 . . . . . . . . . 164 GLY H parsed_6if9 1 103 1 1 . . . . . . . . . 125 ARG O parsed_6if9 1 103 1 2 . . . . . . . . . 170 VAL H parsed_6if9 1 104 1 1 . . . . . . . . . 140 TYR O parsed_6if9 1 104 1 2 . . . . . . . . . 171 GLN H parsed_6if9 1 105 1 1 . . . . . . . . . 140 TYR O parsed_6if9 1 105 1 2 . . . . . . . . . 172 SER H parsed_6if9 1 106 1 1 . . . . . . . . . 142 LEU O parsed_6if9 1 106 1 2 . . . . . . . . . 172 SER HG parsed_6if9 1 107 1 1 . . . . . . . . . 171 GLN OE1 parsed_6if9 1 107 1 2 . . . . . . . . . 172 SER HG parsed_6if9 1 108 1 1 . . . . . . . . . 115 CYS O parsed_6if9 1 108 1 2 . . . . . . . . . 173 PHE H parsed_6if9 1 109 1 1 . . . . . . . . . 138 ILE O parsed_6if9 1 109 1 2 . . . . . . . . . 174 ARG H parsed_6if9 1 110 1 1 . . . . . . . . . 140 TYR OH parsed_6if9 1 110 1 2 . . . . . . . . . 174 ARG HE parsed_6if9 1 111 1 1 . . . . . . . . . 114 ASP OD1 parsed_6if9 1 111 1 2 . . . . . . . . . 175 ARG H parsed_6if9 1 112 1 1 . . . . . . . . . 114 ASP OD1 parsed_6if9 1 112 1 2 . . . . . . . . . 175 ARG HE parsed_6if9 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.003 parsed_6if9 1 2 1 . . . . . . . 2.002 parsed_6if9 1 3 1 . . . . . . . 1.975 parsed_6if9 1 4 1 . . . . . . . 1.854 parsed_6if9 1 5 1 . . . . . . . 1.874 parsed_6if9 1 6 1 . . . . . . . 1.747 parsed_6if9 1 7 1 . . . . . . . 2.160 parsed_6if9 1 8 1 . . . . . . . 1.879 parsed_6if9 1 9 1 . . . . . . . 1.896 parsed_6if9 1 10 1 . . . . . . . 2.530 parsed_6if9 1 11 1 . . . . . . . 2.080 parsed_6if9 1 12 1 . . . . . . . 1.867 parsed_6if9 1 13 1 . . . . . . . 2.287 parsed_6if9 1 14 1 . . . . . . . 1.974 parsed_6if9 1 15 1 . . . . . . . 1.910 parsed_6if9 1 16 1 . . . . . . . 2.512 parsed_6if9 1 17 1 . . . . . . . 1.899 parsed_6if9 1 18 1 . . . . . . . 2.530 parsed_6if9 1 19 1 . . . . . . . 2.672 parsed_6if9 1 20 1 . . . . . . . 2.376 parsed_6if9 1 21 1 . . . . . . . 1.863 parsed_6if9 1 22 1 . . . . . . . 2.035 parsed_6if9 1 23 1 . . . . . . . 2.3565 parsed_6if9 1 24 1 . . . . . . . 1.713 parsed_6if9 1 25 1 . . . . . . . 2.027 parsed_6if9 1 26 1 . . . . . . . 1.996 parsed_6if9 1 27 1 . . . . . . . 1.898 parsed_6if9 1 28 1 . . . . . . . 1.935 parsed_6if9 1 29 1 . . . . . . . 2.3502 parsed_6if9 1 30 1 . . . . . . . 1.883 parsed_6if9 1 31 1 . . . . . . . 1.934 parsed_6if9 1 32 1 . . . . . . . 1.769 parsed_6if9 1 33 1 . . . . . . . 1.991 parsed_6if9 1 34 1 . . . . . . . 2.257 parsed_6if9 1 35 1 . . . . . . . 2.089 parsed_6if9 1 36 1 . . . . . . . 1.840 parsed_6if9 1 37 1 . . . . . . . 2.068 parsed_6if9 1 38 1 . . . . . . . 1.813 parsed_6if9 1 39 1 . . . . . . . 1.925 parsed_6if9 1 40 1 . . . . . . . 1.958 parsed_6if9 1 41 1 . . . . . . . 1.891 parsed_6if9 1 42 1 . . . . . . . 2.059 parsed_6if9 1 43 1 . . . . . . . 1.918 parsed_6if9 1 44 1 . . . . . . . 1.935 parsed_6if9 1 45 1 . . . . . . . 1.933 parsed_6if9 1 46 1 . . . . . . . 2.215 parsed_6if9 1 47 1 . . . . . . . 2.068 parsed_6if9 1 48 1 . . . . . . . 1.931 parsed_6if9 1 49 1 . . . . . . . 2.024 parsed_6if9 1 50 1 . . . . . . . 2.045 parsed_6if9 1 51 1 . . . . . . . 1.984 parsed_6if9 1 52 1 . . . . . . . 1.813 parsed_6if9 1 53 1 . . . . . . . 2.541 parsed_6if9 1 54 1 . . . . . . . 1.776 parsed_6if9 1 55 1 . . . . . . . 2.050 parsed_6if9 1 56 1 . . . . . . . 1.943 parsed_6if9 1 57 1 . . . . . . . 1.962 parsed_6if9 1 58 1 . . . . . . . 2.279 parsed_6if9 1 59 1 . . . . . . . 1.874 parsed_6if9 1 60 1 . . . . . . . 2.125 parsed_6if9 1 61 1 . . . . . . . 1.902 parsed_6if9 1 62 1 . . . . . . . 2.223 parsed_6if9 1 63 1 . . . . . . . 2.082 parsed_6if9 1 64 1 . . . . . . . 1.891 parsed_6if9 1 65 1 . . . . . . . 2.051 parsed_6if9 1 66 1 . . . . . . . 2.560 parsed_6if9 1 67 1 . . . . . . . 1.899 parsed_6if9 1 68 1 . . . . . . . 1.944 parsed_6if9 1 69 1 . . . . . . . 1.934 parsed_6if9 1 70 1 . . . . . . . 2.078 parsed_6if9 1 71 1 . . . . . . . 2.047 parsed_6if9 1 72 1 . . . . . . . 2.072 parsed_6if9 1 73 1 . . . . . . . 2.170 parsed_6if9 1 74 1 . . . . . . . 1.717 parsed_6if9 1 75 1 . . . . . . . 1.832 parsed_6if9 1 76 1 . . . . . . . 2.130 parsed_6if9 1 77 1 . . . . . . . 2.3523 parsed_6if9 1 78 1 . . . . . . . 1.711 parsed_6if9 1 79 1 . . . . . . . 1.943 parsed_6if9 1 80 1 . . . . . . . 2.105 parsed_6if9 1 81 1 . . . . . . . 2.003 parsed_6if9 1 82 1 . . . . . . . 2.069 parsed_6if9 1 83 1 . . . . . . . 2.157 parsed_6if9 1 84 1 . . . . . . . 1.990 parsed_6if9 1 85 1 . . . . . . . 1.829 parsed_6if9 1 86 1 . . . . . . . 1.819 parsed_6if9 1 87 1 . . . . . . . 1.963 parsed_6if9 1 88 1 . . . . . . . 2.017 parsed_6if9 1 89 1 . . . . . . . 1.988 parsed_6if9 1 90 1 . . . . . . . 1.791 parsed_6if9 1 91 1 . . . . . . . 1.996 parsed_6if9 1 92 1 . . . . . . . 2.3574 parsed_6if9 1 93 1 . . . . . . . 1.906 parsed_6if9 1 94 1 . . . . . . . 1.929 parsed_6if9 1 95 1 . . . . . . . 1.732 parsed_6if9 1 96 1 . . . . . . . 2.018 parsed_6if9 1 97 1 . . . . . . . 2.232 parsed_6if9 1 98 1 . . . . . . . 2.030 parsed_6if9 1 99 1 . . . . . . . 1.753 parsed_6if9 1 100 1 . . . . . . . 1.905 parsed_6if9 1 101 1 . . . . . . . 1.998 parsed_6if9 1 102 1 . . . . . . . 1.882 parsed_6if9 1 103 1 . . . . . . . 2.338 parsed_6if9 1 104 1 . . . . . . . 1.771 parsed_6if9 1 105 1 . . . . . . . 2.3505 parsed_6if9 1 106 1 . . . . . . . 1.868 parsed_6if9 1 107 1 . . . . . . . 2.368 parsed_6if9 1 108 1 . . . . . . . 2.033 parsed_6if9 1 109 1 . . . . . . . 1.900 parsed_6if9 1 110 1 . . . . . . . 2.293 parsed_6if9 1 111 1 . . . . . . . 1.825 parsed_6if9 1 112 1 . . . . . . . 1.858 parsed_6if9 1 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 "Restraints file 1: G57W_cara.upl" 1 1 1 34 parsed_6if9 1 2 "69 GLU OE2 14 LYS 3HZ 1.800" 9 2 9 39 parsed_6if9 1 3 "15 ASN O 17 GLN 2HE2 1.983" 13 2 13 37 parsed_6if9 1 4 "12 GLU OE2 19 ARG HE 2.145" 14 2 14 37 parsed_6if9 1 5 "12 GLU OE2 19 ARG 1HH2 2.002" 15 2 15 36 parsed_6if9 1 6 "12 GLU OE2 35 SER H 1.868" 24 2 24 36 parsed_6if9 1 7 "12 GLU OE2 35 SER HG 2.293" 25 2 25 38 parsed_6if9 1 8 "13 ASP OD1 36 ARG 1HH2 1.801" 28 2 28 36 parsed_6if9 1 9 "13 ASP OD2 36 ARG 1HH2 2.581" 29 2 29 35 parsed_6if9 1 10 "12 GLU O 38 ASN 2HD2 1.851" 32 2 32 36 parsed_6if9 1 11 "78 ASP OD2 38 ASN 1HD2 2.267" 33 2 33 37 parsed_6if9 1 12 "178 GLU OE1 45 GLY H 2.3563" 41 2 41 36 parsed_6if9 1 13 "44 GLY O 47 TRP HE1 1.996" 43 2 43 36 parsed_6if9 1 14 "178 GLU OE2 64 GLN H 2.271" 55 2 55 37 parsed_6if9 1 15 "51 GLU OE2 79 ARG 1HH2 1.664" 65 2 65 38 parsed_6if9 1 16 "50 TYR OH 84 ARG 1HH1 2.379" 72 2 72 36 parsed_6if9 1 17 "26 ASP OD1 85 ALA H 1.899" 73 2 73 38 parsed_6if9 1 18 "126 GLU OE1 128 HIS HE2 1.942" 95 2 95 38 parsed_6if9 1 19 "143 PRO O 146 ARG 1HH1 1.922" 111 2 111 38 parsed_6if9 1 20 "103 ASP OD1 158 ARG 1HH1 1.810" 119 2 119 37 parsed_6if9 1 21 "156 GLU OE1 158 ARG 1HH2 1.944" 120 2 120 37 parsed_6if9 1 22 "162 ASP OD2 159 LYS H 2.501" 121 2 121 36 parsed_6if9 1 23 "162 ASP OD1 159 LYS 2HZ 1.525" 122 2 122 38 parsed_6if9 1 24 "140 TYR OH 174 ARG 1HH2 2.283" 134 2 134 37 parsed_6if9 1 25 "114 ASP OD2 175 ARG 1HH2 2.159" 137 2 137 35 parsed_6if9 1 stop_ save_
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