NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
31569 | 1eka | cing | 2-parsed | STAR | entry | full | 306 |
data_1eka_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1eka _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_1eka 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1eka _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 1eka "Master copy" parsed_1eka stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1eka _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 1eka.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1eka 1 1 1eka.mr . . DISCOVER 2 distance NOE simple 186 parsed_1eka 1 1 1eka.mr . . DISCOVER 3 distance "hydrogen bond" simple 20 parsed_1eka 1 1 1eka.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 100 parsed_1eka 1 1 1eka.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1eka 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1eka _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER RNA 07-MAR-00 1EKA *TITLE NMR AND MOLECULAR MODELING REVEAL THAT DIFFERENT HYDROGEN *TITLE 2 BONDING PATTERNS ARE POSSIBLE FOR GU PAIRS: ONE HYDROGEN *TITLE 3 BOND FOR EACH GU PAIR IN R(GGCGUGCC)2 AND TWO FOR EACH GU *TITLE 4 PAIR IN R(GAGUGCUC)2 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: RNA (5'-R(*GP*AP*GP*UP*GP*CP*UP*C)-3'); *COMPND 3 CHAIN: A, B; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES *KEYWDS RNA, GU PAIR, HYDROGEN BONDS, DUBLE HELIX *EXPDTA NMR *AUTHOR X.CHEN, J.A.MCDOWELL, R.KIERZEK, T.R.KRUGH, D.H.TURNER *REVDAT 1 13-NOV-00 1EKA 0 !BIOSYM restraint 1 ! ; save_ save_Discover_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1eka _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _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_1eka 1 2 1 . . . parsed_1eka 1 3 1 . . . parsed_1eka 1 4 1 . . . parsed_1eka 1 5 1 . . . parsed_1eka 1 6 1 . . . parsed_1eka 1 7 1 . . . parsed_1eka 1 8 1 . . . parsed_1eka 1 9 1 . . . parsed_1eka 1 10 1 . . . parsed_1eka 1 11 1 . . . parsed_1eka 1 12 1 . . . parsed_1eka 1 13 1 . . . parsed_1eka 1 14 1 . . . parsed_1eka 1 15 1 . . . parsed_1eka 1 16 1 . . . parsed_1eka 1 17 1 . . . parsed_1eka 1 18 1 . . . parsed_1eka 1 19 1 . . . parsed_1eka 1 20 1 . . . parsed_1eka 1 21 1 . . . parsed_1eka 1 22 1 . . . parsed_1eka 1 23 1 . . . parsed_1eka 1 24 1 . . . parsed_1eka 1 25 1 . . . parsed_1eka 1 26 1 . . . parsed_1eka 1 27 1 . . . parsed_1eka 1 28 1 . . . parsed_1eka 1 29 1 . . . parsed_1eka 1 30 1 . . . parsed_1eka 1 31 1 . . . parsed_1eka 1 32 1 . . . parsed_1eka 1 33 1 . . . parsed_1eka 1 34 1 . . . parsed_1eka 1 35 1 . . . parsed_1eka 1 36 1 . . . parsed_1eka 1 37 1 . . . parsed_1eka 1 38 1 . . . parsed_1eka 1 39 1 . . . parsed_1eka 1 40 1 . . . parsed_1eka 1 41 1 . . . parsed_1eka 1 42 1 . . . parsed_1eka 1 43 1 . . . parsed_1eka 1 44 1 . . . parsed_1eka 1 45 1 . . . parsed_1eka 1 46 1 . . . parsed_1eka 1 47 1 . . . parsed_1eka 1 48 1 . . . parsed_1eka 1 49 1 . . . parsed_1eka 1 50 1 . . . parsed_1eka 1 51 1 . . . parsed_1eka 1 52 1 . . . parsed_1eka 1 53 1 . . . parsed_1eka 1 54 1 . . . parsed_1eka 1 55 1 . . . parsed_1eka 1 56 1 . . . parsed_1eka 1 57 1 . . . parsed_1eka 1 58 1 . . . parsed_1eka 1 59 1 . . . parsed_1eka 1 60 1 . . . parsed_1eka 1 61 1 . . . parsed_1eka 1 62 1 . . . parsed_1eka 1 63 1 . . . parsed_1eka 1 64 1 . . . parsed_1eka 1 65 1 . . . parsed_1eka 1 66 1 . . . parsed_1eka 1 67 1 . . . parsed_1eka 1 68 1 . . . parsed_1eka 1 69 1 . . . parsed_1eka 1 70 1 . . . parsed_1eka 1 71 1 . . . parsed_1eka 1 72 1 . . . parsed_1eka 1 73 1 . . . parsed_1eka 1 74 1 . . . parsed_1eka 1 75 1 . . . parsed_1eka 1 76 1 . . . parsed_1eka 1 77 1 . . . parsed_1eka 1 78 1 . . . parsed_1eka 1 79 1 . . . parsed_1eka 1 80 1 . . . parsed_1eka 1 81 1 . . . parsed_1eka 1 82 1 . . . parsed_1eka 1 83 1 . . . parsed_1eka 1 84 1 . . . parsed_1eka 1 85 1 . . . parsed_1eka 1 86 1 . . . parsed_1eka 1 87 1 . . . parsed_1eka 1 88 1 . . . parsed_1eka 1 89 1 . . . parsed_1eka 1 90 1 . . . parsed_1eka 1 91 1 . . . parsed_1eka 1 92 1 . . . parsed_1eka 1 93 1 . . . parsed_1eka 1 94 1 . . . parsed_1eka 1 95 1 . . . parsed_1eka 1 96 1 . . . parsed_1eka 1 97 1 . . . parsed_1eka 1 98 1 . . . parsed_1eka 1 99 1 . . . parsed_1eka 1 100 1 . . . parsed_1eka 1 101 1 . . . parsed_1eka 1 102 1 . . . parsed_1eka 1 103 1 . . . parsed_1eka 1 104 1 . . . parsed_1eka 1 105 1 . . . parsed_1eka 1 106 1 . . . parsed_1eka 1 107 1 . . . parsed_1eka 1 108 1 . . . parsed_1eka 1 109 1 . . . parsed_1eka 1 110 1 . . . parsed_1eka 1 111 1 . . . parsed_1eka 1 112 1 . . . parsed_1eka 1 113 1 . . . parsed_1eka 1 114 1 . . . parsed_1eka 1 115 1 . . . parsed_1eka 1 116 1 . . . parsed_1eka 1 117 1 . . . parsed_1eka 1 118 1 . . . parsed_1eka 1 119 1 . . . parsed_1eka 1 120 1 . . . parsed_1eka 1 121 1 . . . parsed_1eka 1 122 1 . . . parsed_1eka 1 123 1 . . . parsed_1eka 1 124 1 . . . parsed_1eka 1 125 1 . . . parsed_1eka 1 126 1 . . . parsed_1eka 1 127 1 . . . parsed_1eka 1 128 1 . . . parsed_1eka 1 129 1 . . . parsed_1eka 1 130 1 . . . parsed_1eka 1 131 1 . . . parsed_1eka 1 132 1 . . . parsed_1eka 1 133 1 . . . parsed_1eka 1 134 1 . . . parsed_1eka 1 135 1 . . . parsed_1eka 1 136 1 . . . parsed_1eka 1 137 1 . . . parsed_1eka 1 138 1 . . . parsed_1eka 1 139 1 . . . parsed_1eka 1 140 1 . . . parsed_1eka 1 141 1 . . . parsed_1eka 1 142 1 . . . parsed_1eka 1 143 1 . . . parsed_1eka 1 144 1 . . . parsed_1eka 1 145 1 . . . parsed_1eka 1 146 1 . . . parsed_1eka 1 147 1 . . . parsed_1eka 1 148 1 . . . parsed_1eka 1 149 1 . . . parsed_1eka 1 150 1 . . . parsed_1eka 1 151 1 . . . parsed_1eka 1 152 1 . . . parsed_1eka 1 153 1 . . . parsed_1eka 1 154 1 . . . parsed_1eka 1 155 1 . . . parsed_1eka 1 156 1 . . . parsed_1eka 1 157 1 . . . parsed_1eka 1 158 1 . . . parsed_1eka 1 159 1 . . . parsed_1eka 1 160 1 . . . parsed_1eka 1 161 1 . . . parsed_1eka 1 162 1 . . . parsed_1eka 1 163 1 . . . parsed_1eka 1 164 1 . . . parsed_1eka 1 165 1 . . . parsed_1eka 1 166 1 . . . parsed_1eka 1 167 1 . . . parsed_1eka 1 168 1 . . . parsed_1eka 1 169 1 . . . parsed_1eka 1 170 1 . . . parsed_1eka 1 171 1 . . . parsed_1eka 1 172 1 . . . parsed_1eka 1 173 1 . . . parsed_1eka 1 174 1 . . . parsed_1eka 1 175 1 . . . parsed_1eka 1 176 1 . . . parsed_1eka 1 177 1 . . . parsed_1eka 1 178 1 . . . parsed_1eka 1 179 1 . . . parsed_1eka 1 180 1 . . . parsed_1eka 1 181 1 . . . parsed_1eka 1 182 1 . . . parsed_1eka 1 183 1 . . . parsed_1eka 1 184 1 . . . parsed_1eka 1 185 1 . . . parsed_1eka 1 186 1 . . . parsed_1eka 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 . . . . . . . . 1 1 G5' H1' parsed_1eka 1 1 1 2 . . . . . . . . 1 1 G5' H8 parsed_1eka 1 2 1 1 . . . . . . . . 1 2 A H1' parsed_1eka 1 2 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 3 1 1 . . . . . . . . 1 2 A H1' parsed_1eka 1 3 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 4 1 1 . . . . . . . . 1 3 G H1' parsed_1eka 1 4 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 5 1 1 . . . . . . . . 1 3 G H1' parsed_1eka 1 5 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 6 1 1 . . . . . . . . 1 4 U H1' parsed_1eka 1 6 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 7 1 1 . . . . . . . . 1 5 G H1' parsed_1eka 1 7 1 2 . . . . . . . . 1 5 G H8 parsed_1eka 1 8 1 1 . . . . . . . . 1 5 G H1' parsed_1eka 1 8 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 9 1 1 . . . . . . . . 1 6 C H1' parsed_1eka 1 9 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 10 1 1 . . . . . . . . 1 7 U H1' parsed_1eka 1 10 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 11 1 1 . . . . . . . . 1 8 C3' H1' parsed_1eka 1 11 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 12 1 1 . . . . . . . . 1 8 C3' H1' parsed_1eka 1 12 1 2 . . . . . . . . B 2 A H2 parsed_1eka 1 13 1 1 . . . . . . . . 1 3 G H1' parsed_1eka 1 13 1 2 . . . . . . . . 1 2 A H2 parsed_1eka 1 14 1 1 . . . . . . . . 1 2 A H1' parsed_1eka 1 14 1 2 . . . . . . . . 1 2 A H2 parsed_1eka 1 15 1 1 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 15 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 16 1 1 . . . . . . . . 1 7 U H5 parsed_1eka 1 16 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 17 1 1 . . . . . . . . 1 6 C H5 parsed_1eka 1 17 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 18 1 1 . . . . . . . . 1 4 U H5 parsed_1eka 1 18 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 19 1 1 . . . . . . . . 1 5 G H8 parsed_1eka 1 19 1 2 . . . . . . . . 1 4 U H1' parsed_1eka 1 20 1 1 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 20 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 21 1 1 . . . . . . . . 1 6 C H5 parsed_1eka 1 21 1 2 . . . . . . . . 1 5 G H8 parsed_1eka 1 22 1 1 . . . . . . . . 1 4 U H5 parsed_1eka 1 22 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 23 1 1 . . . . . . . . 1 1 G5' H2' parsed_1eka 1 23 1 2 . . . . . . . . 1 1 G5' H1' parsed_1eka 1 24 1 1 . . . . . . . . 1 2 A H2' parsed_1eka 1 24 1 2 . . . . . . . . 1 2 A H1' parsed_1eka 1 25 1 1 . . . . . . . . 1 3 G H2' parsed_1eka 1 25 1 2 . . . . . . . . 1 3 G H1' parsed_1eka 1 26 1 1 . . . . . . . . 1 6 C H2' parsed_1eka 1 26 1 2 . . . . . . . . 1 6 C H1' parsed_1eka 1 27 1 1 . . . . . . . . 1 7 U H2' parsed_1eka 1 27 1 2 . . . . . . . . 1 7 U H1' parsed_1eka 1 28 1 1 . . . . . . . . 1 8 C3' H2' parsed_1eka 1 28 1 2 . . . . . . . . 1 8 C3' H1' parsed_1eka 1 29 1 1 . . . . . . . . 1 3 G H4' parsed_1eka 1 29 1 2 . . . . . . . . 1 3 G H1' parsed_1eka 1 30 1 1 . . . . . . . . 1 6 C H4' parsed_1eka 1 30 1 2 . . . . . . . . 1 6 C H1' parsed_1eka 1 31 1 1 . . . . . . . . 1 8 C3' H3' parsed_1eka 1 31 1 2 . . . . . . . . 1 8 C3' H1' parsed_1eka 1 32 1 1 . . . . . . . . 1 8 C3' H3' parsed_1eka 1 32 1 2 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 33 1 1 . . . . . . . . 1 5 G H3' parsed_1eka 1 33 1 2 . . . . . . . . 1 5 G H1' parsed_1eka 1 34 1 1 . . . . . . . . 1 5 G H4' parsed_1eka 1 34 1 2 . . . . . . . . 1 5 G H1' parsed_1eka 1 35 1 1 . . . . . . . . 1 6 C H3' parsed_1eka 1 35 1 2 . . . . . . . . 1 6 C H1' parsed_1eka 1 36 1 1 . . . . . . . . 1 5 G H3' parsed_1eka 1 36 1 2 . . . . . . . . 1 6 C H5 parsed_1eka 1 37 1 1 . . . . . . . . 1 6 C H2' parsed_1eka 1 37 1 2 . . . . . . . . 1 7 U H5 parsed_1eka 1 38 1 1 . . . . . . . . 1 3 G H2' parsed_1eka 1 38 1 2 . . . . . . . . 1 4 U H5 parsed_1eka 1 39 1 1 . . . . . . . . 1 2 A H2' parsed_1eka 1 39 1 2 . . . . . . . . 1 3 G H1' parsed_1eka 1 40 1 1 . . . . . . . . 1 3 G H2' parsed_1eka 1 40 1 2 . . . . . . . . 1 4 U H1' parsed_1eka 1 41 1 1 . . . . . . . . 1 6 C H2' parsed_1eka 1 41 1 2 . . . . . . . . 1 7 U H1' parsed_1eka 1 42 1 1 . . . . . . . . 1 7 U H2' parsed_1eka 1 42 1 2 . . . . . . . . 1 8 C3' H1' parsed_1eka 1 43 1 1 . . . . . . . . 1 1 G5' H4' parsed_1eka 1 43 1 2 . . . . . . . . 1 1 G5' H1' parsed_1eka 1 44 1 1 . . . . . . . . 1 7 U H3' parsed_1eka 1 44 1 2 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 45 1 1 . . . . . . . . 1 7 U H2' parsed_1eka 1 45 1 2 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 46 1 1 . . . . . . . . 1 8 C3' H2' parsed_1eka 1 46 1 2 . . . . . . . . 1 8 C3' H5 parsed_1eka 1 47 1 1 . . . . . . . . 1 1 G5' H2' parsed_1eka 1 47 1 2 . . . . . . . . 1 1 G5' H8 parsed_1eka 1 48 1 1 . . . . . . . . 1 1 G5' H5'1 parsed_1eka 1 48 1 2 . . . . . . . . 1 1 G5' H8 parsed_1eka 1 49 1 1 . . . . . . . . 1 1 G5' H2' parsed_1eka 1 49 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 50 1 1 . . . . . . . . 1 1 G5' H3' parsed_1eka 1 50 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 51 1 1 . . . . . . . . 1 3 G H2' parsed_1eka 1 51 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 52 1 1 . . . . . . . . 1 3 G H3' parsed_1eka 1 52 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 53 1 1 . . . . . . . . 1 3 G H5'1 parsed_1eka 1 53 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 54 1 1 . . . . . . . . 1 3 G H2' parsed_1eka 1 54 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 55 1 1 . . . . . . . . 1 4 U H2' parsed_1eka 1 55 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 56 1 1 . . . . . . . . 1 3 G H3' parsed_1eka 1 56 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 57 1 1 . . . . . . . . 1 4 U H3' parsed_1eka 1 57 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 58 1 1 . . . . . . . . 1 4 U H5'1 parsed_1eka 1 58 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 59 1 1 . . . . . . . . 1 4 U H2' parsed_1eka 1 59 1 2 . . . . . . . . 1 5 G H8 parsed_1eka 1 60 1 1 . . . . . . . . 1 7 U H3' parsed_1eka 1 60 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 61 1 1 . . . . . . . . 1 5 G H3' parsed_1eka 1 61 1 2 . . . . . . . . 1 5 G H8 parsed_1eka 1 62 1 1 . . . . . . . . 1 5 G H3' parsed_1eka 1 62 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 63 1 1 . . . . . . . . 1 6 C H2' parsed_1eka 1 63 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 64 1 1 . . . . . . . . 1 7 U H4' parsed_1eka 1 64 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 65 1 1 . . . . . . . . 1 7 U H2' parsed_1eka 1 65 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 66 1 1 . . . . . . . . 1 6 C H3' parsed_1eka 1 66 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 67 1 1 . . . . . . . . 1 7 U H5'1 parsed_1eka 1 67 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 68 1 1 . . . . . . . . 1 2 A H5'1 parsed_1eka 1 68 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 69 1 1 . . . . . . . . 1 7 U H2' parsed_1eka 1 69 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 70 1 1 . . . . . . . . 1 8 C3' H3' parsed_1eka 1 70 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 71 1 1 . . . . . . . . 1 8 C3' H2' parsed_1eka 1 71 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 72 1 1 . . . . . . . . 1 8 C3' H4' parsed_1eka 1 72 1 2 . . . . . . . . 1 8 C3' H6 parsed_1eka 1 73 1 1 . . . . . . . . 1 5 G H2' parsed_1eka 1 73 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 74 1 1 . . . . . . . . 1 5 G H2' parsed_1eka 1 74 1 2 . . . . . . . . 1 5 G H1' parsed_1eka 1 75 1 1 . . . . . . . . 1 3 G H8 parsed_1eka 1 75 1 2 . . . . . . . . 1 4 U H6 parsed_1eka 1 76 1 1 . . . . . . . . 1 3 G H8 parsed_1eka 1 76 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 77 1 1 . . . . . . . . 1 1 G5' H2' parsed_1eka 1 77 1 2 . . . . . . . . 1 2 A H1' parsed_1eka 1 78 1 1 . . . . . . . . 1 1 G5' H3' parsed_1eka 1 78 1 2 . . . . . . . . 1 1 G5' H1' parsed_1eka 1 79 1 1 . . . . . . . . 1 3 G H3' parsed_1eka 1 79 1 2 . . . . . . . . 1 4 U H5 parsed_1eka 1 80 1 1 . . . . . . . . 1 4 U H2' parsed_1eka 1 80 1 2 . . . . . . . . 1 4 U H5 parsed_1eka 1 81 1 1 . . . . . . . . 1 4 U H2' parsed_1eka 1 81 1 2 . . . . . . . . 1 4 U H1' parsed_1eka 1 82 1 1 . . . . . . . . 1 7 U H4' parsed_1eka 1 82 1 2 . . . . . . . . 1 7 U H1' parsed_1eka 1 83 1 1 . . . . . . . . 1 4 U H3' parsed_1eka 1 83 1 2 . . . . . . . . 1 4 U H1' parsed_1eka 1 84 1 1 . . . . . . . . 1 4 U H3' parsed_1eka 1 84 1 2 . . . . . . . . 1 4 U H5 parsed_1eka 1 85 1 1 . . . . . . . . 1 7 U H3' parsed_1eka 1 85 1 2 . . . . . . . . 1 7 U H1' parsed_1eka 1 86 1 1 . . . . . . . . 1 7 U H3' parsed_1eka 1 86 1 2 . . . . . . . . 1 7 U H5 parsed_1eka 1 87 1 1 . . . . . . . . 1 1 G5' H3' parsed_1eka 1 87 1 2 . . . . . . . . 1 1 G5' H8 parsed_1eka 1 88 1 1 . . . . . . . . 1 2 A H2' parsed_1eka 1 88 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 89 1 1 . . . . . . . . 1 2 A H3' parsed_1eka 1 89 1 2 . . . . . . . . 1 2 A H8 parsed_1eka 1 90 1 1 . . . . . . . . 1 2 A H2' parsed_1eka 1 90 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 91 1 1 . . . . . . . . 1 2 A H3' parsed_1eka 1 91 1 2 . . . . . . . . 1 3 G H8 parsed_1eka 1 92 1 1 . . . . . . . . 1 6 C H3' parsed_1eka 1 92 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 93 1 1 . . . . . . . . 1 6 C H2' parsed_1eka 1 93 1 2 . . . . . . . . 1 6 C H6 parsed_1eka 1 94 1 1 . . . . . . . . 1 7 U H3' parsed_1eka 1 94 1 2 . . . . . . . . 1 7 U H6 parsed_1eka 1 95 1 1 . . . . . . . . B 1 G5' H1' parsed_1eka 1 95 1 2 . . . . . . . . B 1 G5' H8 parsed_1eka 1 96 1 1 . . . . . . . . B 2 A H1' parsed_1eka 1 96 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 97 1 1 . . . . . . . . B 2 A H1' parsed_1eka 1 97 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 98 1 1 . . . . . . . . B 3 G H1' parsed_1eka 1 98 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 99 1 1 . . . . . . . . B 3 G H1' parsed_1eka 1 99 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 100 1 1 . . . . . . . . B 4 U H1' parsed_1eka 1 100 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 101 1 1 . . . . . . . . B 5 G H1' parsed_1eka 1 101 1 2 . . . . . . . . B 5 G H8 parsed_1eka 1 102 1 1 . . . . . . . . B 5 G H1' parsed_1eka 1 102 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 103 1 1 . . . . . . . . B 6 C H1' parsed_1eka 1 103 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 104 1 1 . . . . . . . . B 7 U H1' parsed_1eka 1 104 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 105 1 1 . . . . . . . . B 8 C3' H1' parsed_1eka 1 105 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 106 1 1 . . . . . . . . B 8 C3' H1' parsed_1eka 1 106 1 2 . . . . . . . . 1 2 A H2 parsed_1eka 1 107 1 1 . . . . . . . . B 3 G H1' parsed_1eka 1 107 1 2 . . . . . . . . B 2 A H2 parsed_1eka 1 108 1 1 . . . . . . . . B 2 A H1' parsed_1eka 1 108 1 2 . . . . . . . . B 2 A H2 parsed_1eka 1 109 1 1 . . . . . . . . B 8 C3' H5 parsed_1eka 1 109 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 110 1 1 . . . . . . . . B 7 U H5 parsed_1eka 1 110 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 111 1 1 . . . . . . . . B 6 C H5 parsed_1eka 1 111 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 112 1 1 . . . . . . . . B 4 U H5 parsed_1eka 1 112 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 113 1 1 . . . . . . . . B 5 G H8 parsed_1eka 1 113 1 2 . . . . . . . . B 4 U H1' parsed_1eka 1 114 1 1 . . . . . . . . B 8 C3' H6 parsed_1eka 1 114 1 2 . . . . . . . . B 7 U H1' parsed_1eka 1 115 1 1 . . . . . . . . B 8 C3' H5 parsed_1eka 1 115 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 116 1 1 . . . . . . . . B 6 C H5 parsed_1eka 1 116 1 2 . . . . . . . . B 5 G H8 parsed_1eka 1 117 1 1 . . . . . . . . B 4 U H5 parsed_1eka 1 117 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 118 1 1 . . . . . . . . B 1 G5' H2' parsed_1eka 1 118 1 2 . . . . . . . . B 1 G5' H1' parsed_1eka 1 119 1 1 . . . . . . . . B 2 A H2' parsed_1eka 1 119 1 2 . . . . . . . . B 2 A H1' parsed_1eka 1 120 1 1 . . . . . . . . B 3 G H2' parsed_1eka 1 120 1 2 . . . . . . . . B 3 G H1' parsed_1eka 1 121 1 1 . . . . . . . . B 6 C H2' parsed_1eka 1 121 1 2 . . . . . . . . B 6 C H1' parsed_1eka 1 122 1 1 . . . . . . . . B 7 U H2' parsed_1eka 1 122 1 2 . . . . . . . . B 7 U H1' parsed_1eka 1 123 1 1 . . . . . . . . B 8 C3' H2' parsed_1eka 1 123 1 2 . . . . . . . . B 8 C3' H1' parsed_1eka 1 124 1 1 . . . . . . . . B 3 G H4' parsed_1eka 1 124 1 2 . . . . . . . . B 3 G H1' parsed_1eka 1 125 1 1 . . . . . . . . B 6 C H4' parsed_1eka 1 125 1 2 . . . . . . . . B 6 C H1' parsed_1eka 1 126 1 1 . . . . . . . . B 8 C3' H3' parsed_1eka 1 126 1 2 . . . . . . . . B 8 C3' H1' parsed_1eka 1 127 1 1 . . . . . . . . B 8 C3' H3' parsed_1eka 1 127 1 2 . . . . . . . . B 8 C3' H5 parsed_1eka 1 128 1 1 . . . . . . . . B 5 G H3' parsed_1eka 1 128 1 2 . . . . . . . . B 5 G H1' parsed_1eka 1 129 1 1 . . . . . . . . B 6 C H3' parsed_1eka 1 129 1 2 . . . . . . . . B 6 C H1' parsed_1eka 1 130 1 1 . . . . . . . . B 5 G H3' parsed_1eka 1 130 1 2 . . . . . . . . B 6 C H5 parsed_1eka 1 131 1 1 . . . . . . . . B 6 C H2' parsed_1eka 1 131 1 2 . . . . . . . . B 7 U H5 parsed_1eka 1 132 1 1 . . . . . . . . B 3 G H2' parsed_1eka 1 132 1 2 . . . . . . . . B 4 U H5 parsed_1eka 1 133 1 1 . . . . . . . . B 2 A H2' parsed_1eka 1 133 1 2 . . . . . . . . B 3 G H1' parsed_1eka 1 134 1 1 . . . . . . . . B 3 G H2' parsed_1eka 1 134 1 2 . . . . . . . . B 4 U H1' parsed_1eka 1 135 1 1 . . . . . . . . B 6 C H2' parsed_1eka 1 135 1 2 . . . . . . . . B 7 U H1' parsed_1eka 1 136 1 1 . . . . . . . . B 7 U H2' parsed_1eka 1 136 1 2 . . . . . . . . B 8 C3' H1' parsed_1eka 1 137 1 1 . . . . . . . . B 1 G5' H4' parsed_1eka 1 137 1 2 . . . . . . . . B 1 G5' H1' parsed_1eka 1 138 1 1 . . . . . . . . B 7 U H3' parsed_1eka 1 138 1 2 . . . . . . . . B 8 C3' H5 parsed_1eka 1 139 1 1 . . . . . . . . B 7 U H2' parsed_1eka 1 139 1 2 . . . . . . . . B 8 C3' H5 parsed_1eka 1 140 1 1 . . . . . . . . B 1 G5' H5'1 parsed_1eka 1 140 1 2 . . . . . . . . B 1 G5' H8 parsed_1eka 1 141 1 1 . . . . . . . . B 1 G5' H2' parsed_1eka 1 141 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 142 1 1 . . . . . . . . B 1 G5' H3' parsed_1eka 1 142 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 143 1 1 . . . . . . . . B 3 G H2' parsed_1eka 1 143 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 144 1 1 . . . . . . . . B 3 G H3' parsed_1eka 1 144 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 145 1 1 . . . . . . . . B 3 G H5'1 parsed_1eka 1 145 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 146 1 1 . . . . . . . . B 3 G H2' parsed_1eka 1 146 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 147 1 1 . . . . . . . . B 4 U H2' parsed_1eka 1 147 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 148 1 1 . . . . . . . . B 3 G H3' parsed_1eka 1 148 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 149 1 1 . . . . . . . . B 4 U H3' parsed_1eka 1 149 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 150 1 1 . . . . . . . . B 4 U H5'1 parsed_1eka 1 150 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 151 1 1 . . . . . . . . B 4 U H2' parsed_1eka 1 151 1 2 . . . . . . . . B 5 G H8 parsed_1eka 1 152 1 1 . . . . . . . . B 7 U H3' parsed_1eka 1 152 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 153 1 1 . . . . . . . . B 5 G H3' parsed_1eka 1 153 1 2 . . . . . . . . B 5 G H8 parsed_1eka 1 154 1 1 . . . . . . . . B 5 G H3' parsed_1eka 1 154 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 155 1 1 . . . . . . . . B 6 C H2' parsed_1eka 1 155 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 156 1 1 . . . . . . . . B 7 U H4' parsed_1eka 1 156 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 157 1 1 . . . . . . . . B 7 U H2' parsed_1eka 1 157 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 158 1 1 . . . . . . . . B 6 C H3' parsed_1eka 1 158 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 159 1 1 . . . . . . . . B 7 U H5'1 parsed_1eka 1 159 1 2 . . . . . . . . B 7 U H6 parsed_1eka 1 160 1 1 . . . . . . . . B 2 A H5'1 parsed_1eka 1 160 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 161 1 1 . . . . . . . . B 7 U H2' parsed_1eka 1 161 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 162 1 1 . . . . . . . . B 8 C3' H3' parsed_1eka 1 162 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 163 1 1 . . . . . . . . B 8 C3' H2' parsed_1eka 1 163 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 164 1 1 . . . . . . . . B 8 C3' H4' parsed_1eka 1 164 1 2 . . . . . . . . B 8 C3' H6 parsed_1eka 1 165 1 1 . . . . . . . . B 5 G H2' parsed_1eka 1 165 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 166 1 1 . . . . . . . . B 5 G H2' parsed_1eka 1 166 1 2 . . . . . . . . B 5 G H1' parsed_1eka 1 167 1 1 . . . . . . . . B 3 G H8 parsed_1eka 1 167 1 2 . . . . . . . . B 4 U H6 parsed_1eka 1 168 1 1 . . . . . . . . B 3 G H8 parsed_1eka 1 168 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 169 1 1 . . . . . . . . B 1 G5' H2' parsed_1eka 1 169 1 2 . . . . . . . . B 2 A H1' parsed_1eka 1 170 1 1 . . . . . . . . B 1 G5' H3' parsed_1eka 1 170 1 2 . . . . . . . . B 1 G5' H1' parsed_1eka 1 171 1 1 . . . . . . . . B 3 G H3' parsed_1eka 1 171 1 2 . . . . . . . . B 4 U H5 parsed_1eka 1 172 1 1 . . . . . . . . B 4 U H2' parsed_1eka 1 172 1 2 . . . . . . . . B 4 U H5 parsed_1eka 1 173 1 1 . . . . . . . . B 4 U H2' parsed_1eka 1 173 1 2 . . . . . . . . B 4 U H1' parsed_1eka 1 174 1 1 . . . . . . . . B 7 U H4' parsed_1eka 1 174 1 2 . . . . . . . . B 7 U H1' parsed_1eka 1 175 1 1 . . . . . . . . B 4 U H3' parsed_1eka 1 175 1 2 . . . . . . . . B 4 U H1' parsed_1eka 1 176 1 1 . . . . . . . . B 4 U H3' parsed_1eka 1 176 1 2 . . . . . . . . B 4 U H5 parsed_1eka 1 177 1 1 . . . . . . . . B 7 U H3' parsed_1eka 1 177 1 2 . . . . . . . . B 7 U H1' parsed_1eka 1 178 1 1 . . . . . . . . B 7 U H3' parsed_1eka 1 178 1 2 . . . . . . . . B 7 U H5 parsed_1eka 1 179 1 1 . . . . . . . . B 1 G5' H3' parsed_1eka 1 179 1 2 . . . . . . . . B 1 G5' H8 parsed_1eka 1 180 1 1 . . . . . . . . B 2 A H2' parsed_1eka 1 180 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 181 1 1 . . . . . . . . B 2 A H3' parsed_1eka 1 181 1 2 . . . . . . . . B 2 A H8 parsed_1eka 1 182 1 1 . . . . . . . . B 2 A H2' parsed_1eka 1 182 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 183 1 1 . . . . . . . . B 2 A H3' parsed_1eka 1 183 1 2 . . . . . . . . B 3 G H8 parsed_1eka 1 184 1 1 . . . . . . . . B 6 C H3' parsed_1eka 1 184 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 185 1 1 . . . . . . . . B 6 C H2' parsed_1eka 1 185 1 2 . . . . . . . . B 6 C H6 parsed_1eka 1 186 1 1 . . . . . . . . B 7 U H3' parsed_1eka 1 186 1 2 . . . . . . . . B 7 U H6 parsed_1eka 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 . . . . . . 2.917 4.375 parsed_1eka 1 2 1 . . . . . . 2.887 4.331 parsed_1eka 1 3 1 . . . . . . 3.158 4.736 parsed_1eka 1 4 1 . . . . . . 2.818 4.226 parsed_1eka 1 5 1 . . . . . . 3.196 4.794 parsed_1eka 1 6 1 . . . . . . 2.943 4.415 parsed_1eka 1 7 1 . . . . . . 2.867 4.301 parsed_1eka 1 8 1 . . . . . . 3.166 4.749 parsed_1eka 1 9 1 . . . . . . 2.913 4.370 parsed_1eka 1 10 1 . . . . . . 2.806 4.209 parsed_1eka 1 11 1 . . . . . . 2.823 4.235 parsed_1eka 1 12 1 . . . . . . 2.899 4.349 parsed_1eka 1 13 1 . . . . . . 2.537 3.806 parsed_1eka 1 14 1 . . . . . . 4.286 5.000 parsed_1eka 1 15 1 . . . . . . 1.902 2.853 parsed_1eka 1 16 1 . . . . . . 1.942 2.913 parsed_1eka 1 17 1 . . . . . . 2.057 3.085 parsed_1eka 1 18 1 . . . . . . 1.961 2.942 parsed_1eka 1 19 1 . . . . . . 2.721 5.000 parsed_1eka 1 20 1 . . . . . . 3.113 4.670 parsed_1eka 1 21 1 . . . . . . 3.021 4.531 parsed_1eka 1 22 1 . . . . . . 3.560 5.000 parsed_1eka 1 23 1 . . . . . . 2.102 3.152 parsed_1eka 1 24 1 . . . . . . 2.271 3.407 parsed_1eka 1 25 1 . . . . . . 2.061 3.091 parsed_1eka 1 26 1 . . . . . . 1.860 3.455 parsed_1eka 1 27 1 . . . . . . 2.001 3.001 parsed_1eka 1 28 1 . . . . . . 2.079 3.118 parsed_1eka 1 29 1 . . . . . . 2.735 5.000 parsed_1eka 1 30 1 . . . . . . 2.760 4.140 parsed_1eka 1 31 1 . . . . . . 2.432 3.648 parsed_1eka 1 32 1 . . . . . . 3.185 4.777 parsed_1eka 1 33 1 . . . . . . 3.302 4.953 parsed_1eka 1 34 1 . . . . . . 3.511 5.000 parsed_1eka 1 35 1 . . . . . . 2.737 5.000 parsed_1eka 1 36 1 . . . . . . 2.612 4.850 parsed_1eka 1 37 1 . . . . . . 2.239 4.158 parsed_1eka 1 38 1 . . . . . . 2.320 4.309 parsed_1eka 1 39 1 . . . . . . 2.977 4.465 parsed_1eka 1 40 1 . . . . . . 3.515 5.000 parsed_1eka 1 41 1 . . . . . . 2.426 4.506 parsed_1eka 1 42 1 . . . . . . 3.733 5.000 parsed_1eka 1 43 1 . . . . . . 2.438 4.529 parsed_1eka 1 44 1 . . . . . . 3.486 5.000 parsed_1eka 1 45 1 . . . . . . 2.651 3.977 parsed_1eka 1 46 1 . . . . . . 3.223 4.834 parsed_1eka 1 47 1 . . . . . . 2.250 4.178 parsed_1eka 1 48 1 . . . . . . 2.766 4.149 parsed_1eka 1 49 1 . . . . . . 1.681 3.121 parsed_1eka 1 50 1 . . . . . . 1.954 3.629 parsed_1eka 1 51 1 . . . . . . 2.971 4.457 parsed_1eka 1 52 1 . . . . . . 2.432 3.648 parsed_1eka 1 53 1 . . . . . . 3.086 4.629 parsed_1eka 1 54 1 . . . . . . 1.611 3.991 parsed_1eka 1 55 1 . . . . . . 1.614 4.767 parsed_1eka 1 56 1 . . . . . . 1.654 4.860 parsed_1eka 1 57 1 . . . . . . 1.744 3.239 parsed_1eka 1 58 1 . . . . . . 2.759 4.138 parsed_1eka 1 59 1 . . . . . . 1.962 2.943 parsed_1eka 1 60 1 . . . . . . 1.926 3.576 parsed_1eka 1 61 1 . . . . . . 1.859 3.453 parsed_1eka 1 62 1 . . . . . . 1.846 3.428 parsed_1eka 1 63 1 . . . . . . 1.782 2.673 parsed_1eka 1 64 1 . . . . . . 2.716 4.074 parsed_1eka 1 65 1 . . . . . . 2.823 4.235 parsed_1eka 1 66 1 . . . . . . 2.419 3.629 parsed_1eka 1 67 1 . . . . . . 2.809 4.213 parsed_1eka 1 68 1 . . . . . . 2.730 4.095 parsed_1eka 1 69 1 . . . . . . 1.585 2.944 parsed_1eka 1 70 1 . . . . . . 1.653 3.070 parsed_1eka 1 71 1 . . . . . . 2.106 3.911 parsed_1eka 1 72 1 . . . . . . 2.262 4.201 parsed_1eka 1 73 1 . . . . . . 1.836 3.409 parsed_1eka 1 74 1 . . . . . . 2.567 4.767 parsed_1eka 1 75 1 . . . . . . 3.731 5.000 parsed_1eka 1 76 1 . . . . . . 3.708 5.000 parsed_1eka 1 77 1 . . . . . . 1.6 6.0 parsed_1eka 1 78 1 . . . . . . 1.6 6.0 parsed_1eka 1 79 1 . . . . . . 2.7 6.0 parsed_1eka 1 80 1 . . . . . . 2.3 6.0 parsed_1eka 1 81 1 . . . . . . 1.6 3.5 parsed_1eka 1 82 1 . . . . . . 1.6 6.0 parsed_1eka 1 83 1 . . . . . . 1.6 6.0 parsed_1eka 1 84 1 . . . . . . 1.6 6.0 parsed_1eka 1 85 1 . . . . . . 1.6 6.0 parsed_1eka 1 86 1 . . . . . . 1.6 6.0 parsed_1eka 1 87 1 . . . . . . 1.6 6.0 parsed_1eka 1 88 1 . . . . . . 1.6 6.0 parsed_1eka 1 89 1 . . . . . . 1.6 6.0 parsed_1eka 1 90 1 . . . . . . 1.6 4.0 parsed_1eka 1 91 1 . . . . . . 1.6 6.0 parsed_1eka 1 92 1 . . . . . . 1.6 6.0 parsed_1eka 1 93 1 . . . . . . 1.6 6.0 parsed_1eka 1 94 1 . . . . . . 1.6 6.0 parsed_1eka 1 95 1 . . . . . . 2.917 4.375 parsed_1eka 1 96 1 . . . . . . 2.887 4.331 parsed_1eka 1 97 1 . . . . . . 3.158 4.736 parsed_1eka 1 98 1 . . . . . . 2.818 4.226 parsed_1eka 1 99 1 . . . . . . 3.196 4.794 parsed_1eka 1 100 1 . . . . . . 2.943 4.415 parsed_1eka 1 101 1 . . . . . . 2.867 4.301 parsed_1eka 1 102 1 . . . . . . 3.166 4.749 parsed_1eka 1 103 1 . . . . . . 2.913 4.370 parsed_1eka 1 104 1 . . . . . . 2.806 4.209 parsed_1eka 1 105 1 . . . . . . 2.823 4.235 parsed_1eka 1 106 1 . . . . . . 2.899 4.349 parsed_1eka 1 107 1 . . . . . . 2.537 3.806 parsed_1eka 1 108 1 . . . . . . 4.286 5.000 parsed_1eka 1 109 1 . . . . . . 1.902 2.853 parsed_1eka 1 110 1 . . . . . . 1.942 2.913 parsed_1eka 1 111 1 . . . . . . 2.057 3.085 parsed_1eka 1 112 1 . . . . . . 1.961 2.942 parsed_1eka 1 113 1 . . . . . . 2.721 5.000 parsed_1eka 1 114 1 . . . . . . 2.503 4.648 parsed_1eka 1 115 1 . . . . . . 3.113 4.670 parsed_1eka 1 116 1 . . . . . . 3.021 4.531 parsed_1eka 1 117 1 . . . . . . 3.560 5.000 parsed_1eka 1 118 1 . . . . . . 2.102 3.152 parsed_1eka 1 119 1 . . . . . . 2.271 3.407 parsed_1eka 1 120 1 . . . . . . 2.061 3.091 parsed_1eka 1 121 1 . . . . . . 1.860 3.455 parsed_1eka 1 122 1 . . . . . . 2.001 3.001 parsed_1eka 1 123 1 . . . . . . 2.079 3.118 parsed_1eka 1 124 1 . . . . . . 2.735 5.000 parsed_1eka 1 125 1 . . . . . . 2.760 4.140 parsed_1eka 1 126 1 . . . . . . 2.432 3.648 parsed_1eka 1 127 1 . . . . . . 3.185 4.777 parsed_1eka 1 128 1 . . . . . . 3.302 4.953 parsed_1eka 1 129 1 . . . . . . 2.737 5.000 parsed_1eka 1 130 1 . . . . . . 2.612 4.850 parsed_1eka 1 131 1 . . . . . . 2.239 4.158 parsed_1eka 1 132 1 . . . . . . 2.320 4.309 parsed_1eka 1 133 1 . . . . . . 2.977 4.465 parsed_1eka 1 134 1 . . . . . . 3.515 5.000 parsed_1eka 1 135 1 . . . . . . 2.426 4.506 parsed_1eka 1 136 1 . . . . . . 3.733 5.000 parsed_1eka 1 137 1 . . . . . . 2.438 4.529 parsed_1eka 1 138 1 . . . . . . 3.486 5.000 parsed_1eka 1 139 1 . . . . . . 2.651 3.977 parsed_1eka 1 140 1 . . . . . . 2.766 4.149 parsed_1eka 1 141 1 . . . . . . 1.681 3.121 parsed_1eka 1 142 1 . . . . . . 1.954 3.629 parsed_1eka 1 143 1 . . . . . . 2.971 4.457 parsed_1eka 1 144 1 . . . . . . 2.432 3.648 parsed_1eka 1 145 1 . . . . . . 3.086 4.629 parsed_1eka 1 146 1 . . . . . . 1.611 2.991 parsed_1eka 1 147 1 . . . . . . 1.614 4.767 parsed_1eka 1 148 1 . . . . . . 1.654 4.860 parsed_1eka 1 149 1 . . . . . . 1.744 3.239 parsed_1eka 1 150 1 . . . . . . 2.759 4.138 parsed_1eka 1 151 1 . . . . . . 1.962 2.943 parsed_1eka 1 152 1 . . . . . . 1.926 3.576 parsed_1eka 1 153 1 . . . . . . 1.859 3.453 parsed_1eka 1 154 1 . . . . . . 1.846 3.428 parsed_1eka 1 155 1 . . . . . . 1.782 2.673 parsed_1eka 1 156 1 . . . . . . 2.716 4.074 parsed_1eka 1 157 1 . . . . . . 2.823 4.235 parsed_1eka 1 158 1 . . . . . . 2.419 3.629 parsed_1eka 1 159 1 . . . . . . 2.809 4.213 parsed_1eka 1 160 1 . . . . . . 2.730 4.095 parsed_1eka 1 161 1 . . . . . . 1.585 2.944 parsed_1eka 1 162 1 . . . . . . 1.653 3.070 parsed_1eka 1 163 1 . . . . . . 2.106 3.911 parsed_1eka 1 164 1 . . . . . . 2.262 4.201 parsed_1eka 1 165 1 . . . . . . 1.836 3.409 parsed_1eka 1 166 1 . . . . . . 2.567 4.767 parsed_1eka 1 167 1 . . . . . . 3.731 5.000 parsed_1eka 1 168 1 . . . . . . 3.708 5.000 parsed_1eka 1 169 1 . . . . . . 1.6 6.0 parsed_1eka 1 170 1 . . . . . . 1.6 6.0 parsed_1eka 1 171 1 . . . . . . 2.7 6.0 parsed_1eka 1 172 1 . . . . . . 2.3 6.0 parsed_1eka 1 173 1 . . . . . . 1.6 3.5 parsed_1eka 1 174 1 . . . . . . 1.6 6.0 parsed_1eka 1 175 1 . . . . . . 1.6 6.0 parsed_1eka 1 176 1 . . . . . . 1.6 6.0 parsed_1eka 1 177 1 . . . . . . 1.6 6.0 parsed_1eka 1 178 1 . . . . . . 1.6 6.0 parsed_1eka 1 179 1 . . . . . . 1.6 6.0 parsed_1eka 1 180 1 . . . . . . 1.6 6.0 parsed_1eka 1 181 1 . . . . . . 1.6 6.0 parsed_1eka 1 182 1 . . . . . . 1.6 4.0 parsed_1eka 1 183 1 . . . . . . 1.6 6.0 parsed_1eka 1 184 1 . . . . . . 1.6 6.0 parsed_1eka 1 185 1 . . . . . . 1.6 6.0 parsed_1eka 1 186 1 . . . . . . 1.6 6.0 parsed_1eka 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 distance 1 1 1 9 parsed_1eka 1 2 "Sugar H1' to H2' region begins" 24 1 26 1 parsed_1eka 1 3 "Base to sugar begins here" 51 1 53 1 parsed_1eka 1 4 "1:G_5:H5'1 1:G_5:H8 1.833 3.404 25.000 25.000 1000.000" 69 1 69 71 parsed_1eka 1 5 ; some specail begins here because of severe overlap, the distance is limited between 1.6 and 6 Angstroms. suagr H1' to H2' region ; 85 1 92 1 parsed_1eka 1 6 "base to sugar region" 103 1 104 21 parsed_1eka 1 7 "The second strand begins here!" 113 1 116 1 parsed_1eka 1 8 ; 1:C3'_8B:H2' 1:G5'_1:H1' 2.835 4.253 25.000 25.000 1000.000 1:A_2B:H4' 1:A_2B:H1' 3.590 5.000 25.000 25.000 1000.000 ; 146 1 147 71 parsed_1eka 1 9 "1:G_5B:H5'1 1:G_5B:H8 1.833 3.404 25.000 25.000 1000.000" 178 1 178 71 parsed_1eka 1 10 ; some specail begins here because of severe overlap, the distance is limited between 1.6 and 6 Angstroms. suagr H1' to H2' region ; 194 1 201 1 parsed_1eka 1 11 "base to sugar region" 212 1 212 21 parsed_1eka 1 stop_ save_ save_Discover_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1eka _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 3 _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_1eka 2 2 1 . . . parsed_1eka 2 3 1 . . . parsed_1eka 2 4 1 . . . parsed_1eka 2 5 1 . . . parsed_1eka 2 6 1 . . . parsed_1eka 2 7 1 . . . parsed_1eka 2 8 1 . . . parsed_1eka 2 9 1 . . . parsed_1eka 2 10 1 . . . parsed_1eka 2 11 1 . . . parsed_1eka 2 12 1 . . . parsed_1eka 2 13 1 . . . parsed_1eka 2 14 1 . . . parsed_1eka 2 15 1 . . . parsed_1eka 2 16 1 . . . parsed_1eka 2 17 1 . . . parsed_1eka 2 18 1 . . . parsed_1eka 2 19 1 . . . parsed_1eka 2 20 1 . . . parsed_1eka 2 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 . . . . . . . . 1 1 G5' O6 parsed_1eka 2 1 1 2 . . . . . . . . B 8 C3' N4 parsed_1eka 2 2 1 1 . . . . . . . . 1 1 G5' N1 parsed_1eka 2 2 1 2 . . . . . . . . B 8 C3' N3 parsed_1eka 2 3 1 1 . . . . . . . . 1 1 G5' N2 parsed_1eka 2 3 1 2 . . . . . . . . B 8 C3' O2 parsed_1eka 2 4 1 1 . . . . . . . . 1 3 G O6 parsed_1eka 2 4 1 2 . . . . . . . . B 6 C N4 parsed_1eka 2 5 1 1 . . . . . . . . 1 3 G N1 parsed_1eka 2 5 1 2 . . . . . . . . B 6 C N3 parsed_1eka 2 6 1 1 . . . . . . . . 1 3 G N2 parsed_1eka 2 6 1 2 . . . . . . . . B 6 C O2 parsed_1eka 2 7 1 1 . . . . . . . . 1 8 C3' N4 parsed_1eka 2 7 1 2 . . . . . . . . B 1 G5' O6 parsed_1eka 2 8 1 1 . . . . . . . . 1 8 C3' N3 parsed_1eka 2 8 1 2 . . . . . . . . B 1 G5' N1 parsed_1eka 2 9 1 1 . . . . . . . . 1 8 C3' O2 parsed_1eka 2 9 1 2 . . . . . . . . B 1 G5' N2 parsed_1eka 2 10 1 1 . . . . . . . . 1 6 C N4 parsed_1eka 2 10 1 2 . . . . . . . . B 3 G O6 parsed_1eka 2 11 1 1 . . . . . . . . 1 6 C N3 parsed_1eka 2 11 1 2 . . . . . . . . B 3 G N1 parsed_1eka 2 12 1 1 . . . . . . . . 1 6 C O2 parsed_1eka 2 12 1 2 . . . . . . . . B 3 G N2 parsed_1eka 2 13 1 1 . . . . . . . . 1 2 A N6 parsed_1eka 2 13 1 2 . . . . . . . . B 7 U O4 parsed_1eka 2 14 1 1 . . . . . . . . 1 2 A N1 parsed_1eka 2 14 1 2 . . . . . . . . B 7 U N3 parsed_1eka 2 15 1 1 . . . . . . . . 1 7 U O4 parsed_1eka 2 15 1 2 . . . . . . . . B 2 A N6 parsed_1eka 2 16 1 1 . . . . . . . . 1 7 U N3 parsed_1eka 2 16 1 2 . . . . . . . . B 2 A N1 parsed_1eka 2 17 1 1 . . . . . . . . 1 5 G O6 parsed_1eka 2 17 1 2 . . . . . . . . B 4 U N3 parsed_1eka 2 18 1 1 . . . . . . . . 1 5 G N1 parsed_1eka 2 18 1 2 . . . . . . . . B 4 U O2 parsed_1eka 2 19 1 1 . . . . . . . . 1 4 U N3 parsed_1eka 2 19 1 2 . . . . . . . . B 5 G O6 parsed_1eka 2 20 1 1 . . . . . . . . 1 4 U O2 parsed_1eka 2 20 1 2 . . . . . . . . B 5 G N1 parsed_1eka 2 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 . . . . . . 2.81 3.01 parsed_1eka 2 2 1 . . . . . . 2.85 3.05 parsed_1eka 2 3 1 . . . . . . 2.76 2.96 parsed_1eka 2 4 1 . . . . . . 2.81 3.01 parsed_1eka 2 5 1 . . . . . . 2.85 3.05 parsed_1eka 2 6 1 . . . . . . 2.76 2.96 parsed_1eka 2 7 1 . . . . . . 2.81 3.01 parsed_1eka 2 8 1 . . . . . . 2.85 3.05 parsed_1eka 2 9 1 . . . . . . 2.76 2.96 parsed_1eka 2 10 1 . . . . . . 2.81 3.01 parsed_1eka 2 11 1 . . . . . . 2.85 3.05 parsed_1eka 2 12 1 . . . . . . 2.76 2.96 parsed_1eka 2 13 1 . . . . . . 2.85 3.05 parsed_1eka 2 14 1 . . . . . . 2.72 2.92 parsed_1eka 2 15 1 . . . . . . 2.85 3.05 parsed_1eka 2 16 1 . . . . . . 2.72 2.92 parsed_1eka 2 17 1 . . . . . . 2.76 3.05 parsed_1eka 2 18 1 . . . . . . 2.76 3.05 parsed_1eka 2 19 1 . . . . . . 2.76 3.05 parsed_1eka 2 20 1 . . . . . . 2.76 3.05 parsed_1eka 2 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 "big atom restraints" 1 1 2 1 parsed_1eka 2 2 "A_U Watson_Crisk" 16 1 18 1 parsed_1eka 2 3 ; !!!!!!!!!!!!!! ********* G_U Mismatch ; 24 1 28 1 parsed_1eka 2 stop_ save_ save_Discover_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1eka _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 1 G5' O3' 1 2 A P 1 2 A O5' 1 2 A C5' parsed_1eka 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 2 A O3' 1 3 G P 1 3 G O5' 1 3 G C5' parsed_1eka 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 3 G O3' 1 4 U P 1 4 U O5' 1 4 U C5' parsed_1eka 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 4 U O3' 1 5 G P 1 5 G O5' 1 5 G C5' parsed_1eka 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 5 G O3' 1 6 C P 1 6 C O5' 1 6 C C5' parsed_1eka 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 6 C O3' 1 7 U P 1 7 U O5' 1 7 U C5' parsed_1eka 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 7 U O3' 1 8 C3' P 1 8 C3' O5' 1 8 C3' C5' parsed_1eka 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 2 A P 1 2 A O5' 1 2 A C5' 1 2 A C4' parsed_1eka 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 3 G P 1 3 G O5' 1 3 G C5' 1 3 G C4' parsed_1eka 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 4 U P 1 4 U O5' 1 4 U C5' 1 4 U C4' parsed_1eka 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 5 G P 1 5 G O5' 1 5 G C5' 1 5 G C4' parsed_1eka 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 6 C P 1 6 C O5' 1 6 C C5' 1 6 C C4' parsed_1eka 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 7 U P 1 7 U O5' 1 7 U C5' 1 7 U C4' parsed_1eka 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 8 C3' P 1 8 C3' O5' 1 8 C3' C5' 1 8 C3' C4' parsed_1eka 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 1 G5' O5' 1 1 G5' C5' 1 1 G5' C4' 1 1 G5' C3' parsed_1eka 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 2 A O5' 1 2 A C5' 1 2 A C4' 1 2 A C3' parsed_1eka 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 3 G O5' 1 3 G C5' 1 3 G C4' 1 3 G C3' parsed_1eka 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 5 G O5' 1 5 G C5' 1 5 G C4' 1 5 G C3' parsed_1eka 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 6 C O5' 1 6 C C5' 1 6 C C4' 1 6 C C3' parsed_1eka 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . 1 7 U O5' 1 7 U C5' 1 7 U C4' 1 7 U C3' parsed_1eka 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 1 G5' C5' 1 1 G5' C4' 1 1 G5' C3' 1 1 G5' O3' parsed_1eka 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 2 A C5' 1 2 A C4' 1 2 A C3' 1 2 A O3' parsed_1eka 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 3 G C5' 1 3 G C4' 1 3 G C3' 1 3 G O3' parsed_1eka 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 4 U C5' 1 4 U C4' 1 4 U C3' 1 4 U O3' parsed_1eka 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 5 G C5' 1 5 G C4' 1 5 G C3' 1 5 G O3' parsed_1eka 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 6 C C5' 1 6 C C4' 1 6 C C3' 1 6 C O3' parsed_1eka 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 7 U C5' 1 7 U C4' 1 7 U C3' 1 7 U O3' parsed_1eka 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . 1 8 C3' C5' 1 8 C3' C4' 1 8 C3' C3' 1 8 C3' O3' parsed_1eka 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 1 G5' C4' 1 1 G5' C3' 1 1 G5' O3' 1 2 A P parsed_1eka 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 2 A C4' 1 2 A C3' 1 2 A O3' 1 3 G P parsed_1eka 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 3 G C4' 1 3 G C3' 1 3 G O3' 1 4 U P parsed_1eka 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 4 U C4' 1 4 U C3' 1 4 U O3' 1 5 G P parsed_1eka 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 5 G C4' 1 5 G C3' 1 5 G O3' 1 6 C P parsed_1eka 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 6 C C4' 1 6 C C3' 1 6 C O3' 1 7 U P parsed_1eka 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . 1 7 U C4' 1 7 U C3' 1 7 U O3' 1 8 C3' P parsed_1eka 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 1 G5' C3' 1 1 G5' O3' 1 2 A P 1 2 A O5' parsed_1eka 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 2 A C3' 1 2 A O3' 1 3 G P 1 3 G O5' parsed_1eka 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 3 G C3' 1 3 G O3' 1 4 U P 1 4 U O5' parsed_1eka 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 4 U C3' 1 4 U O3' 1 5 G P 1 5 G O5' parsed_1eka 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 5 G C3' 1 5 G O3' 1 6 C P 1 6 C O5' parsed_1eka 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 6 C C3' 1 6 C O3' 1 7 U P 1 7 U O5' parsed_1eka 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . 1 7 U C3' 1 7 U O3' 1 8 C3' P 1 8 C3' O5' parsed_1eka 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 1 G5' O4' 1 1 G5' C1' 1 1 G5' N9 1 1 G5' C4 parsed_1eka 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 2 A O4' 1 2 A C1' 1 2 A N9 1 2 A C4 parsed_1eka 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 3 G O4' 1 3 G C1' 1 3 G N9 1 3 G C4 parsed_1eka 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 4 U O4' 1 4 U C1' 1 4 U N1 1 4 U C2 parsed_1eka 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 5 G O4' 1 5 G C1' 1 5 G N9 1 5 G C4 parsed_1eka 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 6 C O4' 1 6 C C1' 1 6 C N1 1 6 C C2 parsed_1eka 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 7 U O4' 1 7 U C1' 1 7 U N1 1 7 U C2 parsed_1eka 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . 1 8 C3' O4' 1 8 C3' C1' 1 8 C3' N1 1 8 C3' C2 parsed_1eka 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 1 G5' O3' B 2 A P B 2 A O5' B 2 A C5' parsed_1eka 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 2 A O3' B 3 G P B 3 G O5' B 3 G C5' parsed_1eka 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 3 G O3' B 4 U P B 4 U O5' B 4 U C5' parsed_1eka 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 4 U O3' B 5 G P B 5 G O5' B 5 G C5' parsed_1eka 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 5 G O3' B 6 C P B 6 C O5' B 6 C C5' parsed_1eka 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 6 C O3' B 7 U P B 7 U O5' B 7 U C5' parsed_1eka 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 7 U O3' B 8 C3' P B 8 C3' O5' B 8 C3' C5' parsed_1eka 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 2 A P B 2 A O5' B 2 A C5' B 2 A C4' parsed_1eka 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 3 G P B 3 G O5' B 3 G C5' B 3 G C4' parsed_1eka 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 4 U P B 4 U O5' B 4 U C5' B 4 U C4' parsed_1eka 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 5 G P B 5 G O5' B 5 G C5' B 5 G C4' parsed_1eka 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 6 C P B 6 C O5' B 6 C C5' B 6 C C4' parsed_1eka 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 7 U P B 7 U O5' B 7 U C5' B 7 U C4' parsed_1eka 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 8 C3' P B 8 C3' O5' B 8 C3' C5' B 8 C3' C4' parsed_1eka 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 1 G5' O5' B 1 G5' C5' B 1 G5' C4' B 1 G5' C3' parsed_1eka 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 2 A O5' B 2 A C5' B 2 A C4' B 2 A C3' parsed_1eka 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 3 G O5' B 3 G C5' B 3 G C4' B 3 G C3' parsed_1eka 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 5 G O5' B 5 G C5' B 5 G C4' B 5 G C3' parsed_1eka 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 6 C O5' B 6 C C5' B 6 C C4' B 6 C C3' parsed_1eka 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . B 7 U O5' B 7 U C5' B 7 U C4' B 7 U C3' parsed_1eka 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 1 G5' C5' B 1 G5' C4' B 1 G5' C3' B 1 G5' O3' parsed_1eka 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 2 A C5' B 2 A C4' B 2 A C3' B 2 A O3' parsed_1eka 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 3 G C5' B 3 G C4' B 3 G C3' B 3 G O3' parsed_1eka 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 4 U C5' B 4 U C4' B 4 U C3' B 4 U O3' parsed_1eka 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 5 G C5' B 5 G C4' B 5 G C3' B 5 G O3' parsed_1eka 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 6 C C5' B 6 C C4' B 6 C C3' B 6 C O3' parsed_1eka 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 7 U C5' B 7 U C4' B 7 U C3' B 7 U O3' parsed_1eka 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 110 . B 8 C3' C5' B 8 C3' C4' B 8 C3' C3' B 8 C3' O3' parsed_1eka 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 1 G5' C4' B 1 G5' C3' B 1 G5' O3' B 2 A P parsed_1eka 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 2 A C4' B 2 A C3' B 2 A O3' B 3 G P parsed_1eka 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 3 G C4' B 3 G C3' B 3 G O3' B 4 U P parsed_1eka 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 4 U C4' B 4 U C3' B 4 U O3' B 5 G P parsed_1eka 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 5 G C4' B 5 G C3' B 5 G O3' B 6 C P parsed_1eka 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 6 C C4' B 6 C C3' B 6 C O3' B 7 U P parsed_1eka 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -100 . B 7 U C4' B 7 U C3' B 7 U O3' B 8 C3' P parsed_1eka 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 1 G5' C3' B 1 G5' O3' B 2 A P B 2 A O5' parsed_1eka 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 2 A C3' B 2 A O3' B 3 G P B 3 G O5' parsed_1eka 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 3 G C3' B 3 G O3' B 4 U P B 4 U O5' parsed_1eka 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 4 U C3' B 4 U O3' B 5 G P B 5 G O5' parsed_1eka 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 5 G C3' B 5 G O3' B 6 C P B 6 C O5' parsed_1eka 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 6 C C3' B 6 C O3' B 7 U P B 7 U O5' parsed_1eka 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 150 . B 7 U C3' B 7 U O3' B 8 C3' P B 8 C3' O5' parsed_1eka 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 1 G5' O4' B 1 G5' C1' B 1 G5' N9 B 1 G5' C4 parsed_1eka 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 2 A O4' B 2 A C1' B 2 A N9 B 2 A C4 parsed_1eka 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 3 G O4' B 3 G C1' B 3 G N9 B 3 G C4 parsed_1eka 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 4 U O4' B 4 U C1' B 4 U N1 B 4 U C2 parsed_1eka 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 5 G O4' B 5 G C1' B 5 G N9 B 5 G C4 parsed_1eka 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 6 C O4' B 6 C C1' B 6 C N1 B 6 C C2 parsed_1eka 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 7 U O4' B 7 U C1' B 7 U N1 B 7 U C2 parsed_1eka 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150 . B 8 C3' O4' B 8 C3' C1' B 8 C3' N1 B 8 C3' C2 parsed_1eka 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; NMR_dihedral alpha ; 1 1 2 6 parsed_1eka 1 2 Belta 10 1 10 6 parsed_1eka 1 3 Gamma 18 1 18 6 parsed_1eka 1 4 "1:U_4:O5' 1:U_4:C5' 1:U_4:C4' 1:U_4:C3' 30 90 25 25 1000" 22 1 22 73 parsed_1eka 1 5 ; 1:C3'_8:O5' 1:C3'_8:C5' 1:C3'_8:C4' 1:C3'_8:C3' 30 90 25 25 1000 Delta ; 26 1 27 6 parsed_1eka 1 6 Episilon 36 1 36 9 parsed_1eka 1 7 kesi 44 1 44 5 parsed_1eka 1 8 Chi 52 1 52 4 parsed_1eka 1 9 ; second copy begins here alpha ; 61 1 64 6 parsed_1eka 1 10 Belta 72 1 72 6 parsed_1eka 1 11 Gamma 80 1 80 6 parsed_1eka 1 12 "1:U_4B:O5' 1:U_4B:C5' 1:U_4B:C4' 1:U_4B:C3' 30 90 25 25 1000" 84 1 84 77 parsed_1eka 1 13 ; 1:C3'_8B:O5' 1:C3'_8B:C5' 1:C3'_8B:C4' 1:C3'_8B:C3' 30 90 25 25 1000 Delta ; 88 1 89 6 parsed_1eka 1 14 Episilon 98 1 98 9 parsed_1eka 1 15 kesi 106 1 106 5 parsed_1eka 1 16 Chi 114 1 114 4 parsed_1eka 1 stop_ save_
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