NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
512174 | 2l7d | 17351 | cing | 2-parsed | STAR | entry | full | 532 |
data_2l7d_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2l7d _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_2l7d 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2l7d _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 2l7d "Master copy" parsed_2l7d stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2l7d _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 2l7d.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 2 distance NOE simple 212 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 72 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 68 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 5 "chemical shift anisotropy" "Not applicable" "Not applicable" 0 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 158 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 22 parsed_2l7d 1 1 2l7d.mr . . XPLOR/CNS 8 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2l7d 1 1 2l7d.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2l7d 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_2l7d _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 DNA, RNA 07-DEC-10 2L7D *TITLE RIBONUCLEOTIDE PERTURBATION OF DNA STRUCTURE: SOLUTION STRUCTURE OF *TITLE 2 [D(CGC)R(G)D(AATTCGCG)]2 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: 5'-D(*CP*GP*C)-R(P*G)-D(P*AP*AP*TP*TP*CP*GP*CP*G)-3'; *COMPND 3 CHAIN: A, B; *COMPND 4 ENGINEERED: YES; *COMPND 5 OTHER_DETAILS: RG4 SUBSTITUTED DREW DICKERSON DODECAMER *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES *KEYWDS RIBONUCLEOTIDE SUBSTITUTED DNA, DNA, RNA *EXPDTA SOLUTION NMR *NUMMDL 5 *AUTHOR E.F.DEROSE, L.PERERA, M.S.MURRAY, T.A.KUNKEL, R.E.LONDON *REVDAT 1 01-JUN-11 2L7D 0 ; save_ save_CNS/XPLOR_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2l7d _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_2l7d 1 2 1 . . . parsed_2l7d 1 3 1 . . . parsed_2l7d 1 4 1 . . . parsed_2l7d 1 5 1 . . . parsed_2l7d 1 6 1 . . . parsed_2l7d 1 7 1 . . . parsed_2l7d 1 8 1 . . . parsed_2l7d 1 9 1 . . . parsed_2l7d 1 10 1 . . . parsed_2l7d 1 11 1 . . . parsed_2l7d 1 12 1 . . . parsed_2l7d 1 13 1 . . . parsed_2l7d 1 14 1 . . . parsed_2l7d 1 15 1 . . . parsed_2l7d 1 16 1 . . . parsed_2l7d 1 17 1 . . . parsed_2l7d 1 18 1 . . . parsed_2l7d 1 19 1 . . . parsed_2l7d 1 20 1 . . . parsed_2l7d 1 21 1 . . . parsed_2l7d 1 22 1 . . . parsed_2l7d 1 23 1 . . . parsed_2l7d 1 24 1 . . . parsed_2l7d 1 25 1 . . . parsed_2l7d 1 26 1 . . . parsed_2l7d 1 27 1 . . . parsed_2l7d 1 28 1 . . . parsed_2l7d 1 29 1 . . . parsed_2l7d 1 30 1 . . . parsed_2l7d 1 31 1 . . . parsed_2l7d 1 32 1 . . . parsed_2l7d 1 33 1 . . . parsed_2l7d 1 34 1 . . . parsed_2l7d 1 35 1 . . . parsed_2l7d 1 36 1 . . . parsed_2l7d 1 37 1 . . . parsed_2l7d 1 38 1 . . . parsed_2l7d 1 39 1 . . . parsed_2l7d 1 40 1 . . . parsed_2l7d 1 41 1 . . . parsed_2l7d 1 42 1 . . . parsed_2l7d 1 43 1 . . . parsed_2l7d 1 44 1 . . . parsed_2l7d 1 45 1 . . . parsed_2l7d 1 46 1 . . . parsed_2l7d 1 47 1 . . . parsed_2l7d 1 48 1 . . . parsed_2l7d 1 49 1 . . . parsed_2l7d 1 50 1 . . . parsed_2l7d 1 51 1 . . . parsed_2l7d 1 52 1 . . . parsed_2l7d 1 53 1 . . . parsed_2l7d 1 54 1 . . . parsed_2l7d 1 55 1 . . . parsed_2l7d 1 56 1 . . . parsed_2l7d 1 57 1 . . . parsed_2l7d 1 58 1 . . . parsed_2l7d 1 59 1 . . . parsed_2l7d 1 60 1 . . . parsed_2l7d 1 61 1 . . . parsed_2l7d 1 62 1 . . . parsed_2l7d 1 63 1 . . . parsed_2l7d 1 64 1 . . . parsed_2l7d 1 65 1 . . . parsed_2l7d 1 66 1 . . . parsed_2l7d 1 67 1 . . . parsed_2l7d 1 68 1 . . . parsed_2l7d 1 69 1 . . . parsed_2l7d 1 70 1 . . . parsed_2l7d 1 71 1 . . . parsed_2l7d 1 72 1 . . . parsed_2l7d 1 73 1 . . . parsed_2l7d 1 74 1 . . . parsed_2l7d 1 75 1 . . . parsed_2l7d 1 76 1 . . . parsed_2l7d 1 77 1 . . . parsed_2l7d 1 78 1 . . . parsed_2l7d 1 79 1 . . . parsed_2l7d 1 80 1 . . . parsed_2l7d 1 81 1 . . . parsed_2l7d 1 82 1 . . . parsed_2l7d 1 83 1 . . . parsed_2l7d 1 84 1 . . . parsed_2l7d 1 85 1 . . . parsed_2l7d 1 86 1 . . . parsed_2l7d 1 87 1 . . . parsed_2l7d 1 88 1 . . . parsed_2l7d 1 89 1 . . . parsed_2l7d 1 90 1 . . . parsed_2l7d 1 91 1 . . . parsed_2l7d 1 92 1 . . . parsed_2l7d 1 93 1 . . . parsed_2l7d 1 94 1 . . . parsed_2l7d 1 95 1 . . . parsed_2l7d 1 96 1 . . . parsed_2l7d 1 97 1 . . . parsed_2l7d 1 98 1 . . . parsed_2l7d 1 99 1 . . . parsed_2l7d 1 100 1 . . . parsed_2l7d 1 101 1 . . . parsed_2l7d 1 102 1 . . . parsed_2l7d 1 103 1 . . . parsed_2l7d 1 104 1 . . . parsed_2l7d 1 105 1 . . . parsed_2l7d 1 106 1 . . . parsed_2l7d 1 107 1 . . . parsed_2l7d 1 108 1 . . . parsed_2l7d 1 109 1 . . . parsed_2l7d 1 110 1 . . . parsed_2l7d 1 111 1 . . . parsed_2l7d 1 112 1 . . . parsed_2l7d 1 113 1 . . . parsed_2l7d 1 114 1 . . . parsed_2l7d 1 115 1 . . . parsed_2l7d 1 116 1 . . . parsed_2l7d 1 117 1 . . . parsed_2l7d 1 118 1 . . . parsed_2l7d 1 119 1 . . . parsed_2l7d 1 120 1 . . . parsed_2l7d 1 121 1 . . . parsed_2l7d 1 122 1 . . . parsed_2l7d 1 123 1 . . . parsed_2l7d 1 124 1 . . . parsed_2l7d 1 125 1 . . . parsed_2l7d 1 126 1 . . . parsed_2l7d 1 127 1 . . . parsed_2l7d 1 128 1 . . . parsed_2l7d 1 129 1 . . . parsed_2l7d 1 130 1 . . . parsed_2l7d 1 131 1 . . . parsed_2l7d 1 132 1 . . . parsed_2l7d 1 133 1 . . . parsed_2l7d 1 134 1 . . . parsed_2l7d 1 135 1 . . . parsed_2l7d 1 136 1 . . . parsed_2l7d 1 137 1 . . . parsed_2l7d 1 138 1 . . . parsed_2l7d 1 139 1 . . . parsed_2l7d 1 140 1 . . . parsed_2l7d 1 141 1 . . . parsed_2l7d 1 142 1 . . . parsed_2l7d 1 143 1 . . . parsed_2l7d 1 144 1 . . . parsed_2l7d 1 145 1 . . . parsed_2l7d 1 146 1 . . . parsed_2l7d 1 147 1 . . . parsed_2l7d 1 148 1 . . . parsed_2l7d 1 149 1 . . . parsed_2l7d 1 150 1 . . . parsed_2l7d 1 151 1 . . . parsed_2l7d 1 152 1 . . . parsed_2l7d 1 153 1 . . . parsed_2l7d 1 154 1 . . . parsed_2l7d 1 155 1 . . . parsed_2l7d 1 156 1 . . . parsed_2l7d 1 157 1 . . . parsed_2l7d 1 158 1 . . . parsed_2l7d 1 159 1 . . . parsed_2l7d 1 160 1 . . . parsed_2l7d 1 161 1 . . . parsed_2l7d 1 162 1 . . . parsed_2l7d 1 163 1 . . . parsed_2l7d 1 164 1 . . . parsed_2l7d 1 165 1 . . . parsed_2l7d 1 166 1 . . . parsed_2l7d 1 167 1 . . . parsed_2l7d 1 168 1 . . . parsed_2l7d 1 169 1 . . . parsed_2l7d 1 170 1 . . . parsed_2l7d 1 171 1 . . . parsed_2l7d 1 172 1 . . . parsed_2l7d 1 173 1 . . . parsed_2l7d 1 174 1 . . . parsed_2l7d 1 175 1 . . . parsed_2l7d 1 176 1 . . . parsed_2l7d 1 177 1 . . . parsed_2l7d 1 178 1 . . . parsed_2l7d 1 179 1 . . . parsed_2l7d 1 180 1 . . . parsed_2l7d 1 181 1 . . . parsed_2l7d 1 182 1 . . . parsed_2l7d 1 183 1 . . . parsed_2l7d 1 184 1 . . . parsed_2l7d 1 185 1 . . . parsed_2l7d 1 186 1 . . . parsed_2l7d 1 187 1 . . . parsed_2l7d 1 188 1 . . . parsed_2l7d 1 189 1 . . . parsed_2l7d 1 190 1 . . . parsed_2l7d 1 191 1 . . . parsed_2l7d 1 192 1 . . . parsed_2l7d 1 193 1 . . . parsed_2l7d 1 194 1 . . . parsed_2l7d 1 195 1 . . . parsed_2l7d 1 196 1 . . . parsed_2l7d 1 197 1 . . . parsed_2l7d 1 198 1 . . . parsed_2l7d 1 199 1 . . . parsed_2l7d 1 200 1 . . . parsed_2l7d 1 201 1 . . . parsed_2l7d 1 202 1 . . . parsed_2l7d 1 203 1 . . . parsed_2l7d 1 204 1 . . . parsed_2l7d 1 205 1 . . . parsed_2l7d 1 206 1 . . . parsed_2l7d 1 207 1 . . . parsed_2l7d 1 208 1 . . . parsed_2l7d 1 209 1 . . . parsed_2l7d 1 210 1 . . . parsed_2l7d 1 211 1 . . . parsed_2l7d 1 212 1 . . . parsed_2l7d 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 . . . . . . . . . 5 . H8 parsed_2l7d 1 1 1 2 . . . . . . . . . 5 . H1' parsed_2l7d 1 2 1 1 . . . . . . . . . 17 . H8 parsed_2l7d 1 2 1 2 . . . . . . . . . 17 . H1' parsed_2l7d 1 3 1 1 . . . . . . . . . 5 . H8 parsed_2l7d 1 3 1 2 . . . . . . . . . 4 . H2'' parsed_2l7d 1 4 1 1 . . . . . . . . . 17 . H8 parsed_2l7d 1 4 1 2 . . . . . . . . . 16 . H2'' parsed_2l7d 1 5 1 1 . . . . . . . . . 6 . H8 parsed_2l7d 1 5 1 2 . . . . . . . . . 5 . H1' parsed_2l7d 1 6 1 1 . . . . . . . . . 18 . H8 parsed_2l7d 1 6 1 2 . . . . . . . . . 17 . H1' parsed_2l7d 1 7 1 1 . . . . . . . . . 12 . H8 parsed_2l7d 1 7 1 2 . . . . . . . . . 12 . H1' parsed_2l7d 1 8 1 1 . . . . . . . . . 24 . H8 parsed_2l7d 1 8 1 2 . . . . . . . . . 24 . H1' parsed_2l7d 1 9 1 1 . . . . . . . . . 2 . H8 parsed_2l7d 1 9 1 2 . . . . . . . . . 2 . H1' parsed_2l7d 1 10 1 1 . . . . . . . . . 14 . H8 parsed_2l7d 1 10 1 2 . . . . . . . . . 14 . H1' parsed_2l7d 1 11 1 1 . . . . . . . . . 10 . H8 parsed_2l7d 1 11 1 2 . . . . . . . . . 10 . H1' parsed_2l7d 1 12 1 1 . . . . . . . . . 22 . H8 parsed_2l7d 1 12 1 2 . . . . . . . . . 22 . H1' parsed_2l7d 1 13 1 1 . . . . . . . . . 4 . H8 parsed_2l7d 1 13 1 2 . . . . . . . . . 3 . H1' parsed_2l7d 1 14 1 1 . . . . . . . . . 16 . H8 parsed_2l7d 1 14 1 2 . . . . . . . . . 15 . H1' parsed_2l7d 1 15 1 1 . . . . . . . . . 12 . H8 parsed_2l7d 1 15 1 2 . . . . . . . . . 11 . H1' parsed_2l7d 1 16 1 1 . . . . . . . . . 24 . H8 parsed_2l7d 1 16 1 2 . . . . . . . . . 23 . H1' parsed_2l7d 1 17 1 1 . . . . . . . . . 10 . H8 parsed_2l7d 1 17 1 2 . . . . . . . . . 9 . H1' parsed_2l7d 1 18 1 1 . . . . . . . . . 22 . H8 parsed_2l7d 1 18 1 2 . . . . . . . . . 21 . H1' parsed_2l7d 1 19 1 1 . . . . . . . . . 10 . H8 parsed_2l7d 1 19 1 2 . . . . . . . . . 11 . H5 parsed_2l7d 1 20 1 1 . . . . . . . . . 22 . H8 parsed_2l7d 1 20 1 2 . . . . . . . . . 23 . H5 parsed_2l7d 1 21 1 1 . . . . . . . . . 2 . H8 parsed_2l7d 1 21 1 2 . . . . . . . . . 3 . H5 parsed_2l7d 1 22 1 1 . . . . . . . . . 14 . H8 parsed_2l7d 1 22 1 2 . . . . . . . . . 15 . H5 parsed_2l7d 1 23 1 1 . . . . . . . . . 6 . H2 parsed_2l7d 1 23 1 2 . . . . . . . . . 6 . H1' parsed_2l7d 1 24 1 1 . . . . . . . . . 18 . H2 parsed_2l7d 1 24 1 2 . . . . . . . . . 18 . H1' parsed_2l7d 1 25 1 1 . . . . . . . . . 9 . H6 parsed_2l7d 1 25 1 2 . . . . . . . . . 8 . H1' parsed_2l7d 1 26 1 1 . . . . . . . . . 21 . H6 parsed_2l7d 1 26 1 2 . . . . . . . . . 20 . H1' parsed_2l7d 1 27 1 1 . . . . . . . . . 8 . H6 parsed_2l7d 1 27 1 2 . . . . . . . . . 8 . H1' parsed_2l7d 1 28 1 1 . . . . . . . . . 20 . H6 parsed_2l7d 1 28 1 2 . . . . . . . . . 20 . H1' parsed_2l7d 1 29 1 1 . . . . . . . . . 5 . H2 parsed_2l7d 1 29 1 2 . . . . . . . . . 5 . H1' parsed_2l7d 1 30 1 1 . . . . . . . . . 17 . H2 parsed_2l7d 1 30 1 2 . . . . . . . . . 17 . H1' parsed_2l7d 1 31 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 31 1 2 . . . . . . . . . 6 . H1' parsed_2l7d 1 32 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 32 1 2 . . . . . . . . . 18 . H1' parsed_2l7d 1 33 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 33 1 2 . . . . . . . . . 6 . H1' parsed_2l7d 1 34 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 34 1 2 . . . . . . . . . 18 . H1' parsed_2l7d 1 35 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 35 1 2 . . . . . . . . . 6 . H1' parsed_2l7d 1 36 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 36 1 2 . . . . . . . . . 18 . H1' parsed_2l7d 1 37 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 37 1 2 . . . . . . . . . 7 . H1' parsed_2l7d 1 38 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 38 1 2 . . . . . . . . . 19 . H1' parsed_2l7d 1 39 1 1 . . . . . . . . . 3 . H6 parsed_2l7d 1 39 1 2 . . . . . . . . . 2 . H1' parsed_2l7d 1 40 1 1 . . . . . . . . . 15 . H6 parsed_2l7d 1 40 1 2 . . . . . . . . . 14 . H1' parsed_2l7d 1 41 1 1 . . . . . . . . . 3 . H6 parsed_2l7d 1 41 1 2 . . . . . . . . . 3 . H1' parsed_2l7d 1 42 1 1 . . . . . . . . . 15 . H6 parsed_2l7d 1 42 1 2 . . . . . . . . . 15 . H1' parsed_2l7d 1 43 1 1 . . . . . . . . . 11 . H6 parsed_2l7d 1 43 1 2 . . . . . . . . . 11 . H1' parsed_2l7d 1 44 1 1 . . . . . . . . . 23 . H6 parsed_2l7d 1 44 1 2 . . . . . . . . . 23 . H1' parsed_2l7d 1 45 1 1 . . . . . . . . . 11 . H6 parsed_2l7d 1 45 1 2 . . . . . . . . . 10 . H1' parsed_2l7d 1 46 1 1 . . . . . . . . . 23 . H6 parsed_2l7d 1 46 1 2 . . . . . . . . . 22 . H1' parsed_2l7d 1 47 1 1 . . . . . . . . . 8 . H6 parsed_2l7d 1 47 1 2 . . . . . . . . . 7 . H1' parsed_2l7d 1 48 1 1 . . . . . . . . . 20 . H6 parsed_2l7d 1 48 1 2 . . . . . . . . . 19 . H1' parsed_2l7d 1 49 1 1 . . . . . . . . . 8 . H6 parsed_2l7d 1 49 1 2 . . . . . . . . . 9 . H5 parsed_2l7d 1 50 1 1 . . . . . . . . . 20 . H6 parsed_2l7d 1 50 1 2 . . . . . . . . . 21 . H5 parsed_2l7d 1 51 1 1 . . . . . . . . . 9 . H6 parsed_2l7d 1 51 1 2 . . . . . . . . . 9 . H1' parsed_2l7d 1 52 1 1 . . . . . . . . . 21 . H6 parsed_2l7d 1 52 1 2 . . . . . . . . . 21 . H1' parsed_2l7d 1 53 1 1 . . . . . . . . . 5 . H2 parsed_2l7d 1 53 1 2 . . . . . . . . . 21 . H1' parsed_2l7d 1 54 1 1 . . . . . . . . . 17 . H2 parsed_2l7d 1 54 1 2 . . . . . . . . . 9 . H1' parsed_2l7d 1 55 1 1 . . . . . . . . . 1 . H6 parsed_2l7d 1 55 1 2 . . . . . . . . . 1 . H1' parsed_2l7d 1 56 1 1 . . . . . . . . . 13 . H6 parsed_2l7d 1 56 1 2 . . . . . . . . . 13 . H1' parsed_2l7d 1 57 1 1 . . . . . . . . . 6 . H8 parsed_2l7d 1 57 1 2 . . . . . . . . . 6 . H1' parsed_2l7d 1 58 1 1 . . . . . . . . . 18 . H8 parsed_2l7d 1 58 1 2 . . . . . . . . . 18 . H1' parsed_2l7d 1 59 1 1 . . . . . . . . . 5 . H8 parsed_2l7d 1 59 1 2 . . . . . . . . . 5 . H2' parsed_2l7d 1 60 1 1 . . . . . . . . . 17 . H8 parsed_2l7d 1 60 1 2 . . . . . . . . . 17 . H2' parsed_2l7d 1 61 1 1 . . . . . . . . . 6 . H8 parsed_2l7d 1 61 1 2 . . . . . . . . . 6 . H2' parsed_2l7d 1 62 1 1 . . . . . . . . . 18 . H8 parsed_2l7d 1 62 1 2 . . . . . . . . . 18 . H2' parsed_2l7d 1 63 1 1 . . . . . . . . . 6 . H8 parsed_2l7d 1 63 1 2 . . . . . . . . . 5 . H2'' parsed_2l7d 1 64 1 1 . . . . . . . . . 18 . H8 parsed_2l7d 1 64 1 2 . . . . . . . . . 17 . H2'' parsed_2l7d 1 65 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 65 1 2 . . . . . . . . . 6 . H2'' parsed_2l7d 1 66 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 66 1 2 . . . . . . . . . 18 . H2'' parsed_2l7d 1 67 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 67 1 2 . . . . . . . . . 7 . H2' parsed_2l7d 1 68 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 68 1 2 . . . . . . . . . 19 . H2' parsed_2l7d 1 69 1 1 . . . . . . . . . 7 . H6 parsed_2l7d 1 69 1 2 . . . . . . . . . 8 . H5# parsed_2l7d 1 70 1 1 . . . . . . . . . 19 . H6 parsed_2l7d 1 70 1 2 . . . . . . . . . 20 . H5# parsed_2l7d 1 71 1 1 . . . . . . . . . 6 . H8 parsed_2l7d 1 71 1 2 . . . . . . . . . 7 . H5# parsed_2l7d 1 72 1 1 . . . . . . . . . 18 . H8 parsed_2l7d 1 72 1 2 . . . . . . . . . 19 . H5# parsed_2l7d 1 73 1 1 . . . . . . . . . 3 . H6 parsed_2l7d 1 73 1 2 . . . . . . . . . 2 . H2'' parsed_2l7d 1 74 1 1 . . . . . . . . . 15 . H6 parsed_2l7d 1 74 1 2 . . . . . . . . . 14 . H2'' parsed_2l7d 1 75 1 1 . . . . . . . . . 3 . H6 parsed_2l7d 1 75 1 2 . . . . . . . . . 3 . H2' parsed_2l7d 1 76 1 1 . . . . . . . . . 15 . H6 parsed_2l7d 1 76 1 2 . . . . . . . . . 15 . H2' parsed_2l7d 1 77 1 1 . . . . . . . . . 11 . H6 parsed_2l7d 1 77 1 2 . . . . . . . . . 11 . H2' parsed_2l7d 1 78 1 1 . . . . . . . . . 23 . H6 parsed_2l7d 1 78 1 2 . . . . . . . . . 23 . H2' parsed_2l7d 1 79 1 1 . . . . . . . . . 8 . H6 parsed_2l7d 1 79 1 2 . . . . . . . . . 8 . H2' parsed_2l7d 1 80 1 1 . . . . . . . . . 20 . H6 parsed_2l7d 1 80 1 2 . . . . . . . . . 20 . H2' parsed_2l7d 1 81 1 1 . . . . . . . . . 11 . H6 parsed_2l7d 1 81 1 2 . . . . . . . . . 10 . H2'' parsed_2l7d 1 82 1 1 . . . . . . . . . 23 . H6 parsed_2l7d 1 82 1 2 . . . . . . . . . 22 . H2'' parsed_2l7d 1 83 1 1 . . . . . . . . . 8 . H6 parsed_2l7d 1 83 1 2 . . . . . . . . . 7 . H2'' parsed_2l7d 1 84 1 1 . . . . . . . . . 20 . H6 parsed_2l7d 1 84 1 2 . . . . . . . . . 19 . H2'' parsed_2l7d 1 85 1 1 . . . . . . . . . 9 . H6 parsed_2l7d 1 85 1 2 . . . . . . . . . 8 . H2'' parsed_2l7d 1 86 1 1 . . . . . . . . . 21 . H6 parsed_2l7d 1 86 1 2 . . . . . . . . . 20 . H2'' parsed_2l7d 1 87 1 1 . . . . . . . . . 9 . H6 parsed_2l7d 1 87 1 2 . . . . . . . . . 9 . H2' parsed_2l7d 1 88 1 1 . . . . . . . . . 21 . H6 parsed_2l7d 1 88 1 2 . . . . . . . . . 21 . H2' parsed_2l7d 1 89 1 1 . . . . . . . . . 1 . H6 parsed_2l7d 1 89 1 2 . . . . . . . . . 1 . H2' parsed_2l7d 1 90 1 1 . . . . . . . . . 13 . H6 parsed_2l7d 1 90 1 2 . . . . . . . . . 13 . H2' parsed_2l7d 1 91 1 1 . . . . . . . . . 4 . H8 parsed_2l7d 1 91 1 2 . . . . . . . . . 3 . H2'' parsed_2l7d 1 92 1 1 . . . . . . . . . 16 . H8 parsed_2l7d 1 92 1 2 . . . . . . . . . 15 . H2'' parsed_2l7d 1 93 1 1 . . . . . . . . . 10 . H8 parsed_2l7d 1 93 1 2 . . . . . . . . . 9 . H2'' parsed_2l7d 1 94 1 1 . . . . . . . . . 22 . H8 parsed_2l7d 1 94 1 2 . . . . . . . . . 21 . H2'' parsed_2l7d 1 95 1 1 . . . . . . . . . 2 . H8 parsed_2l7d 1 95 1 2 . . . . . . . . . 1 . H2'' parsed_2l7d 1 96 1 1 . . . . . . . . . 14 . H8 parsed_2l7d 1 96 1 2 . . . . . . . . . 13 . H2'' parsed_2l7d 1 97 1 1 . . . . . . . . . 12 . H8 parsed_2l7d 1 97 1 2 . . . . . . . . . 11 . H2' parsed_2l7d 1 98 1 1 . . . . . . . . . 24 . H8 parsed_2l7d 1 98 1 2 . . . . . . . . . 23 . H2' parsed_2l7d 1 99 1 1 . . . . . . . . . 2 . H8 parsed_2l7d 1 99 1 2 . . . . . . . . . 1 . H2' parsed_2l7d 1 100 1 1 . . . . . . . . . 14 . H8 parsed_2l7d 1 100 1 2 . . . . . . . . . 13 . H2' parsed_2l7d 1 101 1 1 . . . . . . . . . 12 . H8 parsed_2l7d 1 101 1 2 . . . . . . . . . 11 . H2'' parsed_2l7d 1 102 1 1 . . . . . . . . . 24 . H8 parsed_2l7d 1 102 1 2 . . . . . . . . . 23 . H2'' parsed_2l7d 1 103 1 1 . . . . . . . . . 10 . H8 parsed_2l7d 1 103 1 2 . . . . . . . . . 10 . H2' parsed_2l7d 1 104 1 1 . . . . . . . . . 22 . H8 parsed_2l7d 1 104 1 2 . . . . . . . . . 22 . H2' parsed_2l7d 1 105 1 1 . . . . . . . . . 2 . H8 parsed_2l7d 1 105 1 2 . . . . . . . . . 2 . H2' parsed_2l7d 1 106 1 1 . . . . . . . . . 14 . H8 parsed_2l7d 1 106 1 2 . . . . . . . . . 14 . H2' parsed_2l7d 1 107 1 1 . . . . . . . . . 12 . H8 parsed_2l7d 1 107 1 2 . . . . . . . . . 12 . H2' parsed_2l7d 1 108 1 1 . . . . . . . . . 24 . H8 parsed_2l7d 1 108 1 2 . . . . . . . . . 24 . H2' parsed_2l7d 1 109 1 1 . . . . . . . . . 12 . H1' parsed_2l7d 1 109 1 2 . . . . . . . . . 12 . H2'' parsed_2l7d 1 110 1 1 . . . . . . . . . 24 . H1' parsed_2l7d 1 110 1 2 . . . . . . . . . 24 . H2'' parsed_2l7d 1 111 1 1 . . . . . . . . . 8 . H1' parsed_2l7d 1 111 1 2 . . . . . . . . . 8 . H2'' parsed_2l7d 1 112 1 1 . . . . . . . . . 20 . H1' parsed_2l7d 1 112 1 2 . . . . . . . . . 20 . H2'' parsed_2l7d 1 113 1 1 . . . . . . . . . 5 . H1' parsed_2l7d 1 113 1 2 . . . . . . . . . 5 . H2'' parsed_2l7d 1 114 1 1 . . . . . . . . . 17 . H1' parsed_2l7d 1 114 1 2 . . . . . . . . . 17 . H2'' parsed_2l7d 1 115 1 1 . . . . . . . . . 6 . H1' parsed_2l7d 1 115 1 2 . . . . . . . . . 6 . H2'' parsed_2l7d 1 116 1 1 . . . . . . . . . 18 . H1' parsed_2l7d 1 116 1 2 . . . . . . . . . 18 . H2'' parsed_2l7d 1 117 1 1 . . . . . . . . . 3 . H1' parsed_2l7d 1 117 1 2 . . . . . . . . . 3 . H2'' parsed_2l7d 1 118 1 1 . . . . . . . . . 15 . H1' parsed_2l7d 1 118 1 2 . . . . . . . . . 15 . H2'' parsed_2l7d 1 119 1 1 . . . . . . . . . 9 . H1' parsed_2l7d 1 119 1 2 . . . . . . . . . 9 . H2'' parsed_2l7d 1 120 1 1 . . . . . . . . . 21 . H1' parsed_2l7d 1 120 1 2 . . . . . . . . . 21 . H2'' parsed_2l7d 1 121 1 1 . . . . . . . . . 11 . H1' parsed_2l7d 1 121 1 2 . . . . . . . . . 11 . H2'' parsed_2l7d 1 122 1 1 . . . . . . . . . 23 . H1' parsed_2l7d 1 122 1 2 . . . . . . . . . 23 . H2'' parsed_2l7d 1 123 1 1 . . . . . . . . . 1 . H1' parsed_2l7d 1 123 1 2 . . . . . . . . . 1 . H2'' parsed_2l7d 1 124 1 1 . . . . . . . . . 13 . H1' parsed_2l7d 1 124 1 2 . . . . . . . . . 13 . H2'' parsed_2l7d 1 125 1 1 . . . . . . . . . 11 . H5 parsed_2l7d 1 125 1 2 . . . . . . . . . 10 . H2' parsed_2l7d 1 126 1 1 . . . . . . . . . 23 . H5 parsed_2l7d 1 126 1 2 . . . . . . . . . 22 . H2' parsed_2l7d 1 127 1 1 . . . . . . . . . 11 . H5 parsed_2l7d 1 127 1 2 . . . . . . . . . 10 . H2' parsed_2l7d 1 128 1 1 . . . . . . . . . 23 . H5 parsed_2l7d 1 128 1 2 . . . . . . . . . 22 . H2' parsed_2l7d 1 129 1 1 . . . . . . . . . 3 . H5 parsed_2l7d 1 129 1 2 . . . . . . . . . 2 . H2' parsed_2l7d 1 130 1 1 . . . . . . . . . 15 . H5 parsed_2l7d 1 130 1 2 . . . . . . . . . 14 . H2' parsed_2l7d 1 131 1 1 . . . . . . . . . 3 . H5 parsed_2l7d 1 131 1 2 . . . . . . . . . 2 . H2'' parsed_2l7d 1 132 1 1 . . . . . . . . . 15 . H5 parsed_2l7d 1 132 1 2 . . . . . . . . . 14 . H2'' parsed_2l7d 1 133 1 1 . . . . . . . . . 6 . H3' parsed_2l7d 1 133 1 2 . . . . . . . . . 7 . H5# parsed_2l7d 1 134 1 1 . . . . . . . . . 18 . H3' parsed_2l7d 1 134 1 2 . . . . . . . . . 19 . H5# parsed_2l7d 1 135 1 1 . . . . . . . . . 1 . H3' parsed_2l7d 1 135 1 2 . . . . . . . . . 1 . H2' parsed_2l7d 1 136 1 1 . . . . . . . . . 13 . H3' parsed_2l7d 1 136 1 2 . . . . . . . . . 13 . H2' parsed_2l7d 1 137 1 1 . . . . . . . . . 3 . H3' parsed_2l7d 1 137 1 2 . . . . . . . . . 3 . H2' parsed_2l7d 1 138 1 1 . . . . . . . . . 15 . H3' parsed_2l7d 1 138 1 2 . . . . . . . . . 15 . H2' parsed_2l7d 1 139 1 1 . . . . . . . . . 12 . H3' parsed_2l7d 1 139 1 2 . . . . . . . . . 12 . H2' parsed_2l7d 1 140 1 1 . . . . . . . . . 24 . H3' parsed_2l7d 1 140 1 2 . . . . . . . . . 24 . H2' parsed_2l7d 1 141 1 1 . . . . . . . . . 7 . H1' parsed_2l7d 1 141 1 2 . . . . . . . . . 7 . H2'' parsed_2l7d 1 142 1 1 . . . . . . . . . 19 . H1' parsed_2l7d 1 142 1 2 . . . . . . . . . 19 . H2'' parsed_2l7d 1 143 1 1 . . . . . . . . . 9 . H5 parsed_2l7d 1 143 1 2 . . . . . . . . . 8 . H2'' parsed_2l7d 1 144 1 1 . . . . . . . . . 21 . H5 parsed_2l7d 1 144 1 2 . . . . . . . . . 20 . H2'' parsed_2l7d 1 145 1 1 . . . . . . . . . 9 . H5 parsed_2l7d 1 145 1 2 . . . . . . . . . 8 . H2' parsed_2l7d 1 146 1 1 . . . . . . . . . 21 . H5 parsed_2l7d 1 146 1 2 . . . . . . . . . 20 . H2' parsed_2l7d 1 147 1 1 . . . . . . . . . 6 . H3' parsed_2l7d 1 147 1 2 . . . . . . . . . 6 . H2' parsed_2l7d 1 148 1 1 . . . . . . . . . 18 . H3' parsed_2l7d 1 148 1 2 . . . . . . . . . 18 . H2' parsed_2l7d 1 149 1 1 . . . . . . . . . 5 . H3' parsed_2l7d 1 149 1 2 . . . . . . . . . 5 . H2' parsed_2l7d 1 150 1 1 . . . . . . . . . 17 . H3' parsed_2l7d 1 150 1 2 . . . . . . . . . 17 . H2' parsed_2l7d 1 151 1 1 . . . . . . . . . 10 . H3' parsed_2l7d 1 151 1 2 . . . . . . . . . 10 . H2' parsed_2l7d 1 152 1 1 . . . . . . . . . 22 . H3' parsed_2l7d 1 152 1 2 . . . . . . . . . 22 . H2' parsed_2l7d 1 153 1 1 . . . . . . . . . 2 . H3' parsed_2l7d 1 153 1 2 . . . . . . . . . 2 . H2' parsed_2l7d 1 154 1 1 . . . . . . . . . 14 . H3' parsed_2l7d 1 154 1 2 . . . . . . . . . 14 . H2' parsed_2l7d 1 155 1 1 . . . . . . . . . 4 . H3' parsed_2l7d 1 155 1 2 . . . . . . . . . 3 . H2' parsed_2l7d 1 156 1 1 . . . . . . . . . 16 . H3' parsed_2l7d 1 156 1 2 . . . . . . . . . 15 . H2' parsed_2l7d 1 157 1 1 . . . . . . . . . 8 . H3' parsed_2l7d 1 157 1 2 . . . . . . . . . 8 . H2' parsed_2l7d 1 158 1 1 . . . . . . . . . 20 . H3' parsed_2l7d 1 158 1 2 . . . . . . . . . 20 . H2' parsed_2l7d 1 159 1 1 . . . . . . . . . 9 . H3' parsed_2l7d 1 159 1 2 . . . . . . . . . 9 . H2' parsed_2l7d 1 160 1 1 . . . . . . . . . 21 . H3' parsed_2l7d 1 160 1 2 . . . . . . . . . 21 . H2' parsed_2l7d 1 161 1 1 . . . . . . . . . 7 . H5' parsed_2l7d 1 161 1 2 . . . . . . . . . 6 . H2'' parsed_2l7d 1 162 1 1 . . . . . . . . . 19 . H5' parsed_2l7d 1 162 1 2 . . . . . . . . . 18 . H2'' parsed_2l7d 1 163 1 1 . . . . . . . . . 4 . H5' parsed_2l7d 1 163 1 2 . . . . . . . . . 3 . H2'' parsed_2l7d 1 164 1 1 . . . . . . . . . 16 . H5' parsed_2l7d 1 164 1 2 . . . . . . . . . 15 . H2'' parsed_2l7d 1 165 1 1 . . . . . . . . . 1 . H3' parsed_2l7d 1 165 1 2 . . . . . . . . . 1 . H5' parsed_2l7d 1 166 1 1 . . . . . . . . . 13 . H3' parsed_2l7d 1 166 1 2 . . . . . . . . . 13 . H5' parsed_2l7d 1 167 1 1 . . . . . . . . . 12 . H3' parsed_2l7d 1 167 1 2 . . . . . . . . . 12 . H4' parsed_2l7d 1 168 1 1 . . . . . . . . . 24 . H3' parsed_2l7d 1 168 1 2 . . . . . . . . . 24 . H4' parsed_2l7d 1 169 1 1 . . . . . . . . . 12 . H3' parsed_2l7d 1 169 1 2 . . . . . . . . . 12 . H5'' parsed_2l7d 1 170 1 1 . . . . . . . . . 24 . H3' parsed_2l7d 1 170 1 2 . . . . . . . . . 24 . H5'' parsed_2l7d 1 171 1 1 . . . . . . . . . 1 . H3' parsed_2l7d 1 171 1 2 . . . . . . . . . 1 . H4' parsed_2l7d 1 172 1 1 . . . . . . . . . 13 . H3' parsed_2l7d 1 172 1 2 . . . . . . . . . 13 . H4' parsed_2l7d 1 173 1 1 . . . . . . . . . 4 . H3' parsed_2l7d 1 173 1 2 . . . . . . . . . 4 . H2'' parsed_2l7d 1 174 1 1 . . . . . . . . . 16 . H3' parsed_2l7d 1 174 1 2 . . . . . . . . . 16 . H2'' parsed_2l7d 1 175 1 1 . . . . . . . . . 5 . H3' parsed_2l7d 1 175 1 2 . . . . . . . . . 5 . H4' parsed_2l7d 1 176 1 1 . . . . . . . . . 17 . H3' parsed_2l7d 1 176 1 2 . . . . . . . . . 17 . H4' parsed_2l7d 1 177 1 1 . . . . . . . . . 6 . H3' parsed_2l7d 1 177 1 2 . . . . . . . . . 6 . H4' parsed_2l7d 1 178 1 1 . . . . . . . . . 18 . H3' parsed_2l7d 1 178 1 2 . . . . . . . . . 18 . H4' parsed_2l7d 1 179 1 1 . . . . . . . . . 10 . H3' parsed_2l7d 1 179 1 2 . . . . . . . . . 10 . H4' parsed_2l7d 1 180 1 1 . . . . . . . . . 22 . H3' parsed_2l7d 1 180 1 2 . . . . . . . . . 22 . H4' parsed_2l7d 1 181 1 1 . . . . . . . . . 2 . H3' parsed_2l7d 1 181 1 2 . . . . . . . . . 2 . H4' parsed_2l7d 1 182 1 1 . . . . . . . . . 14 . H3' parsed_2l7d 1 182 1 2 . . . . . . . . . 14 . H4' parsed_2l7d 1 183 1 1 . . . . . . . . . 8 . H3' parsed_2l7d 1 183 1 2 . . . . . . . . . 8 . H4' parsed_2l7d 1 184 1 1 . . . . . . . . . 20 . H3' parsed_2l7d 1 184 1 2 . . . . . . . . . 20 . H4' parsed_2l7d 1 185 1 1 . . . . . . . . . 3 . H3' parsed_2l7d 1 185 1 2 . . . . . . . . . 3 . H4' parsed_2l7d 1 186 1 1 . . . . . . . . . 15 . H3' parsed_2l7d 1 186 1 2 . . . . . . . . . 15 . H4' parsed_2l7d 1 187 1 1 . . . . . . . . . 2 . H3' parsed_2l7d 1 187 1 2 . . . . . . . . . 2 . H5'' parsed_2l7d 1 188 1 1 . . . . . . . . . 14 . H3' parsed_2l7d 1 188 1 2 . . . . . . . . . 14 . H5'' parsed_2l7d 1 189 1 1 . . . . . . . . . 10 . H3' parsed_2l7d 1 189 1 2 . . . . . . . . . 10 . H5'' parsed_2l7d 1 190 1 1 . . . . . . . . . 22 . H3' parsed_2l7d 1 190 1 2 . . . . . . . . . 22 . H5'' parsed_2l7d 1 191 1 1 . . . . . . . . . 6 . H3' parsed_2l7d 1 191 1 2 . . . . . . . . . 6 . H5'' parsed_2l7d 1 192 1 1 . . . . . . . . . 18 . H3' parsed_2l7d 1 192 1 2 . . . . . . . . . 18 . H5'' parsed_2l7d 1 193 1 1 . . . . . . . . . 5 . H3' parsed_2l7d 1 193 1 2 . . . . . . . . . 5 . H5'' parsed_2l7d 1 194 1 1 . . . . . . . . . 17 . H3' parsed_2l7d 1 194 1 2 . . . . . . . . . 17 . H5'' parsed_2l7d 1 195 1 1 . . . . . . . . . 6 . H1' parsed_2l7d 1 195 1 2 . . . . . . . . . 7 . H5' parsed_2l7d 1 196 1 1 . . . . . . . . . 18 . H1' parsed_2l7d 1 196 1 2 . . . . . . . . . 19 . H5' parsed_2l7d 1 197 1 1 . . . . . . . . . 5 . H1' parsed_2l7d 1 197 1 2 . . . . . . . . . 6 . H5' parsed_2l7d 1 198 1 1 . . . . . . . . . 17 . H1' parsed_2l7d 1 198 1 2 . . . . . . . . . 18 . H5' parsed_2l7d 1 199 1 1 . . . . . . . . . 8 . H1' parsed_2l7d 1 199 1 2 . . . . . . . . . 9 . H5' parsed_2l7d 1 200 1 1 . . . . . . . . . 20 . H1' parsed_2l7d 1 200 1 2 . . . . . . . . . 21 . H5' parsed_2l7d 1 201 1 1 . . . . . . . . . 9 . H1' parsed_2l7d 1 201 1 2 . . . . . . . . . 10 . H5'' parsed_2l7d 1 202 1 1 . . . . . . . . . 21 . H1' parsed_2l7d 1 202 1 2 . . . . . . . . . 22 . H5'' parsed_2l7d 1 203 1 1 . . . . . . . . . 6 . H2'' parsed_2l7d 1 203 1 2 . . . . . . . . . 7 . H5# parsed_2l7d 1 204 1 1 . . . . . . . . . 18 . H2'' parsed_2l7d 1 204 1 2 . . . . . . . . . 19 . H5# parsed_2l7d 1 205 1 1 . . . . . . . . . 7 . H2'' parsed_2l7d 1 205 1 2 . . . . . . . . . 8 . H5# parsed_2l7d 1 206 1 1 . . . . . . . . . 19 . H2'' parsed_2l7d 1 206 1 2 . . . . . . . . . 20 . H5# parsed_2l7d 1 207 1 1 . . . . . . . . . 7 . H2' parsed_2l7d 1 207 1 2 . . . . . . . . . 8 . H5# parsed_2l7d 1 208 1 1 . . . . . . . . . 19 . H2' parsed_2l7d 1 208 1 2 . . . . . . . . . 20 . H5# parsed_2l7d 1 209 1 1 . . . . . . . . . 4 . H3' parsed_2l7d 1 209 1 2 . . . . . . . . . 5 . H8 parsed_2l7d 1 210 1 1 . . . . . . . . . 16 . H3' parsed_2l7d 1 210 1 2 . . . . . . . . . 17 . H8 parsed_2l7d 1 211 1 1 . . . . . . . . . 4 . H3' parsed_2l7d 1 211 1 2 . . . . . . . . . 4 . H8 parsed_2l7d 1 212 1 1 . . . . . . . . . 16 . H3' parsed_2l7d 1 212 1 2 . . . . . . . . . 16 . H8 parsed_2l7d 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 . . . . . 4.53 1.80 4.53 parsed_2l7d 1 2 1 . . . . . 4.53 1.80 4.53 parsed_2l7d 1 3 1 . . . . . 4.30 1.80 4.30 parsed_2l7d 1 4 1 . . . . . 4.30 1.80 4.30 parsed_2l7d 1 5 1 . . . . . 4.44 1.80 4.44 parsed_2l7d 1 6 1 . . . . . 4.44 1.80 4.44 parsed_2l7d 1 7 1 . . . . . 4.89 1.80 4.89 parsed_2l7d 1 8 1 . . . . . 4.89 1.80 4.89 parsed_2l7d 1 9 1 . . . . . 4.43 1.80 4.43 parsed_2l7d 1 10 1 . . . . . 4.43 1.80 4.43 parsed_2l7d 1 11 1 . . . . . 4.41 1.80 4.41 parsed_2l7d 1 12 1 . . . . . 4.41 1.80 4.41 parsed_2l7d 1 13 1 . . . . . 4.01 1.80 4.01 parsed_2l7d 1 14 1 . . . . . 4.01 1.80 4.01 parsed_2l7d 1 15 1 . . . . . 4.02 1.80 4.02 parsed_2l7d 1 16 1 . . . . . 4.02 1.80 4.02 parsed_2l7d 1 17 1 . . . . . 4.32 1.80 4.32 parsed_2l7d 1 18 1 . . . . . 4.32 1.80 4.32 parsed_2l7d 1 19 1 . . . . . 5.02 1.80 5.02 parsed_2l7d 1 20 1 . . . . . 5.02 1.80 5.02 parsed_2l7d 1 21 1 . . . . . 5.65 1.80 5.65 parsed_2l7d 1 22 1 . . . . . 5.65 1.80 5.65 parsed_2l7d 1 23 1 . . . . . 4.40 1.80 4.40 parsed_2l7d 1 24 1 . . . . . 4.40 1.80 4.40 parsed_2l7d 1 25 1 . . . . . 4.39 1.80 4.39 parsed_2l7d 1 26 1 . . . . . 4.39 1.80 4.39 parsed_2l7d 1 27 1 . . . . . 4.27 1.80 4.27 parsed_2l7d 1 28 1 . . . . . 4.27 1.80 4.27 parsed_2l7d 1 29 1 . . . . . 5.30 1.80 5.30 parsed_2l7d 1 30 1 . . . . . 5.30 1.80 5.30 parsed_2l7d 1 31 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 32 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 33 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 34 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 35 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 36 1 . . . . . 4.79 1.80 4.79 parsed_2l7d 1 37 1 . . . . . 4.70 1.80 4.70 parsed_2l7d 1 38 1 . . . . . 4.70 1.80 4.70 parsed_2l7d 1 39 1 . . . . . 3.73 1.80 3.73 parsed_2l7d 1 40 1 . . . . . 3.73 1.80 3.73 parsed_2l7d 1 41 1 . . . . . 4.34 1.80 4.34 parsed_2l7d 1 42 1 . . . . . 4.34 1.80 4.34 parsed_2l7d 1 43 1 . . . . . 5.08 1.80 5.08 parsed_2l7d 1 44 1 . . . . . 5.08 1.80 5.08 parsed_2l7d 1 45 1 . . . . . 3.96 1.80 3.96 parsed_2l7d 1 46 1 . . . . . 3.96 1.80 3.96 parsed_2l7d 1 47 1 . . . . . 4.58 1.80 4.58 parsed_2l7d 1 48 1 . . . . . 4.58 1.80 4.58 parsed_2l7d 1 49 1 . . . . . 5.57 1.80 5.57 parsed_2l7d 1 50 1 . . . . . 5.57 1.80 5.57 parsed_2l7d 1 51 1 . . . . . 5.01 1.80 5.01 parsed_2l7d 1 52 1 . . . . . 5.01 1.80 5.01 parsed_2l7d 1 53 1 . . . . . 5.80 1.80 5.80 parsed_2l7d 1 54 1 . . . . . 5.80 1.80 5.80 parsed_2l7d 1 55 1 . . . . . 3.34 1.80 3.34 parsed_2l7d 1 56 1 . . . . . 3.34 1.80 3.34 parsed_2l7d 1 57 1 . . . . . 3.44 1.80 3.44 parsed_2l7d 1 58 1 . . . . . 3.44 1.80 3.44 parsed_2l7d 1 59 1 . . . . . 2.25 1.80 2.25 parsed_2l7d 1 60 1 . . . . . 2.25 1.80 2.25 parsed_2l7d 1 61 1 . . . . . 2.32 1.80 2.32 parsed_2l7d 1 62 1 . . . . . 2.32 1.80 2.32 parsed_2l7d 1 63 1 . . . . . 2.67 1.80 2.67 parsed_2l7d 1 64 1 . . . . . 2.67 1.80 2.67 parsed_2l7d 1 65 1 . . . . . 2.81 1.80 2.81 parsed_2l7d 1 66 1 . . . . . 2.81 1.80 2.81 parsed_2l7d 1 67 1 . . . . . 2.46 1.80 2.46 parsed_2l7d 1 68 1 . . . . . 2.46 1.80 2.46 parsed_2l7d 1 69 1 . . . . . 4.21 1.80 4.21 parsed_2l7d 1 70 1 . . . . . 4.21 1.80 4.21 parsed_2l7d 1 71 1 . . . . . 3.84 1.80 3.84 parsed_2l7d 1 72 1 . . . . . 3.84 1.80 3.84 parsed_2l7d 1 73 1 . . . . . 2.86 1.80 2.86 parsed_2l7d 1 74 1 . . . . . 2.86 1.80 2.86 parsed_2l7d 1 75 1 . . . . . 2.31 1.80 2.31 parsed_2l7d 1 76 1 . . . . . 2.31 1.80 2.31 parsed_2l7d 1 77 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 78 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 79 1 . . . . . 2.21 1.80 2.21 parsed_2l7d 1 80 1 . . . . . 2.21 1.80 2.21 parsed_2l7d 1 81 1 . . . . . 2.67 1.80 2.67 parsed_2l7d 1 82 1 . . . . . 2.67 1.80 2.67 parsed_2l7d 1 83 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 84 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 85 1 . . . . . 2.81 1.80 2.81 parsed_2l7d 1 86 1 . . . . . 2.81 1.80 2.81 parsed_2l7d 1 87 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 88 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 89 1 . . . . . 2.40 1.80 2.40 parsed_2l7d 1 90 1 . . . . . 2.40 1.80 2.40 parsed_2l7d 1 91 1 . . . . . 2.54 1.80 2.54 parsed_2l7d 1 92 1 . . . . . 2.54 1.80 2.54 parsed_2l7d 1 93 1 . . . . . 3.07 1.80 3.07 parsed_2l7d 1 94 1 . . . . . 3.07 1.80 3.07 parsed_2l7d 1 95 1 . . . . . 2.79 1.80 2.79 parsed_2l7d 1 96 1 . . . . . 2.79 1.80 2.79 parsed_2l7d 1 97 1 . . . . . 3.52 1.80 3.52 parsed_2l7d 1 98 1 . . . . . 3.52 1.80 3.52 parsed_2l7d 1 99 1 . . . . . 3.42 1.80 3.42 parsed_2l7d 1 100 1 . . . . . 3.42 1.80 3.42 parsed_2l7d 1 101 1 . . . . . 2.79 1.80 2.79 parsed_2l7d 1 102 1 . . . . . 2.79 1.80 2.79 parsed_2l7d 1 103 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 104 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 105 1 . . . . . 2.23 1.80 2.23 parsed_2l7d 1 106 1 . . . . . 2.23 1.80 2.23 parsed_2l7d 1 107 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 108 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 109 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 110 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 111 1 . . . . . 2.26 1.80 2.26 parsed_2l7d 1 112 1 . . . . . 2.26 1.80 2.26 parsed_2l7d 1 113 1 . . . . . 2.38 1.80 2.38 parsed_2l7d 1 114 1 . . . . . 2.38 1.80 2.38 parsed_2l7d 1 115 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 116 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 117 1 . . . . . 2.54 1.80 2.54 parsed_2l7d 1 118 1 . . . . . 2.54 1.80 2.54 parsed_2l7d 1 119 1 . . . . . 2.72 1.80 2.72 parsed_2l7d 1 120 1 . . . . . 2.72 1.80 2.72 parsed_2l7d 1 121 1 . . . . . 2.56 1.80 2.56 parsed_2l7d 1 122 1 . . . . . 2.56 1.80 2.56 parsed_2l7d 1 123 1 . . . . . 2.47 1.80 2.47 parsed_2l7d 1 124 1 . . . . . 2.47 1.80 2.47 parsed_2l7d 1 125 1 . . . . . 3.39 1.80 3.39 parsed_2l7d 1 126 1 . . . . . 3.39 1.80 3.39 parsed_2l7d 1 127 1 . . . . . 4.76 1.80 4.76 parsed_2l7d 1 128 1 . . . . . 4.76 1.80 4.76 parsed_2l7d 1 129 1 . . . . . 3.62 1.80 3.62 parsed_2l7d 1 130 1 . . . . . 3.62 1.80 3.62 parsed_2l7d 1 131 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 132 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 133 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 134 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 135 1 . . . . . 3.73 1.80 3.73 parsed_2l7d 1 136 1 . . . . . 3.73 1.80 3.73 parsed_2l7d 1 137 1 . . . . . 3.89 1.80 3.89 parsed_2l7d 1 138 1 . . . . . 3.89 1.80 3.89 parsed_2l7d 1 139 1 . . . . . 3.93 1.80 3.93 parsed_2l7d 1 140 1 . . . . . 3.93 1.80 3.93 parsed_2l7d 1 141 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 142 1 . . . . . 2.20 1.80 2.20 parsed_2l7d 1 143 1 . . . . . 3.92 1.80 3.92 parsed_2l7d 1 144 1 . . . . . 3.92 1.80 3.92 parsed_2l7d 1 145 1 . . . . . 3.41 1.80 3.41 parsed_2l7d 1 146 1 . . . . . 3.41 1.80 3.41 parsed_2l7d 1 147 1 . . . . . 2.51 1.80 2.51 parsed_2l7d 1 148 1 . . . . . 2.51 1.80 2.51 parsed_2l7d 1 149 1 . . . . . 2.45 1.80 2.45 parsed_2l7d 1 150 1 . . . . . 2.45 1.80 2.45 parsed_2l7d 1 151 1 . . . . . 2.37 1.80 2.37 parsed_2l7d 1 152 1 . . . . . 2.37 1.80 2.37 parsed_2l7d 1 153 1 . . . . . 2.28 1.80 2.28 parsed_2l7d 1 154 1 . . . . . 2.28 1.80 2.28 parsed_2l7d 1 155 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 156 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 157 1 . . . . . 2.89 1.80 2.89 parsed_2l7d 1 158 1 . . . . . 2.89 1.80 2.89 parsed_2l7d 1 159 1 . . . . . 2.92 1.80 2.92 parsed_2l7d 1 160 1 . . . . . 2.92 1.80 2.92 parsed_2l7d 1 161 1 . . . . . 5.13 1.80 5.13 parsed_2l7d 1 162 1 . . . . . 5.13 1.80 5.13 parsed_2l7d 1 163 1 . . . . . 5.26 1.80 5.26 parsed_2l7d 1 164 1 . . . . . 5.26 1.80 5.26 parsed_2l7d 1 165 1 . . . . . 4.62 1.80 4.62 parsed_2l7d 1 166 1 . . . . . 4.62 1.80 4.62 parsed_2l7d 1 167 1 . . . . . 5.69 1.80 5.69 parsed_2l7d 1 168 1 . . . . . 5.69 1.80 5.69 parsed_2l7d 1 169 1 . . . . . 4.37 1.80 4.37 parsed_2l7d 1 170 1 . . . . . 4.37 1.80 4.37 parsed_2l7d 1 171 1 . . . . . 4.84 1.80 4.84 parsed_2l7d 1 172 1 . . . . . 4.84 1.80 4.84 parsed_2l7d 1 173 1 . . . . . 5.32 1.80 5.32 parsed_2l7d 1 174 1 . . . . . 5.32 1.80 5.32 parsed_2l7d 1 175 1 . . . . . 4.02 1.80 4.02 parsed_2l7d 1 176 1 . . . . . 4.02 1.80 4.02 parsed_2l7d 1 177 1 . . . . . 3.50 1.80 3.50 parsed_2l7d 1 178 1 . . . . . 3.50 1.80 3.50 parsed_2l7d 1 179 1 . . . . . 3.15 1.80 3.15 parsed_2l7d 1 180 1 . . . . . 3.15 1.80 3.15 parsed_2l7d 1 181 1 . . . . . 3.50 1.80 3.50 parsed_2l7d 1 182 1 . . . . . 3.50 1.80 3.50 parsed_2l7d 1 183 1 . . . . . 3.71 1.80 3.71 parsed_2l7d 1 184 1 . . . . . 3.71 1.80 3.71 parsed_2l7d 1 185 1 . . . . . 3.28 1.80 3.28 parsed_2l7d 1 186 1 . . . . . 3.28 1.80 3.28 parsed_2l7d 1 187 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 188 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 189 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 190 1 . . . . . 3.23 1.80 3.23 parsed_2l7d 1 191 1 . . . . . 2.98 1.80 2.98 parsed_2l7d 1 192 1 . . . . . 2.98 1.80 2.98 parsed_2l7d 1 193 1 . . . . . 3.28 1.80 3.28 parsed_2l7d 1 194 1 . . . . . 3.28 1.80 3.28 parsed_2l7d 1 195 1 . . . . . 3.90 1.80 3.90 parsed_2l7d 1 196 1 . . . . . 3.90 1.80 3.90 parsed_2l7d 1 197 1 . . . . . 3.41 1.80 3.41 parsed_2l7d 1 198 1 . . . . . 3.41 1.80 3.41 parsed_2l7d 1 199 1 . . . . . 3.61 1.80 3.61 parsed_2l7d 1 200 1 . . . . . 3.61 1.80 3.61 parsed_2l7d 1 201 1 . . . . . 5.46 1.80 5.46 parsed_2l7d 1 202 1 . . . . . 5.46 1.80 5.46 parsed_2l7d 1 203 1 . . . . . 3.88 1.80 3.88 parsed_2l7d 1 204 1 . . . . . 3.88 1.80 3.88 parsed_2l7d 1 205 1 . . . . . 3.99 1.80 3.99 parsed_2l7d 1 206 1 . . . . . 3.99 1.80 3.99 parsed_2l7d 1 207 1 . . . . . 3.27 1.80 3.27 parsed_2l7d 1 208 1 . . . . . 3.27 1.80 3.27 parsed_2l7d 1 209 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 210 1 . . . . . 6.00 1.80 6.00 parsed_2l7d 1 211 1 . . . . . 3.93 1.80 3.93 parsed_2l7d 1 212 1 . . . . . 3.93 1.80 3.93 parsed_2l7d 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 dna_dodecamer_4rG_tnnoesy_082709_100ms.1 1 68 1 112 parsed_2l7d 1 2 dna_dodecamer_4rG_tnnoesy_082709_100ms.1 2 70 2 113 parsed_2l7d 1 3 dna_dodecamer_4rG_tnnoesy_082709_100ms.2 3 69 3 113 parsed_2l7d 1 4 ; dna_dodecamer_4rG_tnnoesy_082709_100ms.2 assign (resid 6 and name H8) (resid 5 and name H1') 3.44 1.64 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.3 assign (resid 18 and name H8) (resid 17 and name H1') 3.44 1.64 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.3 ; 4 71 6 114 parsed_2l7d 1 5 dna_dodecamer_4rG_tnnoesy_082709_100ms.3 7 68 7 112 parsed_2l7d 1 6 dna_dodecamer_4rG_tnnoesy_082709_100ms.3 8 70 8 113 parsed_2l7d 1 7 dna_dodecamer_4rG_tnnoesy_082709_100ms.4 9 70 9 114 parsed_2l7d 1 8 dna_dodecamer_4rG_tnnoesy_082709_100ms.4 10 70 10 113 parsed_2l7d 1 9 dna_dodecamer_4rG_tnnoesy_082709_100ms.5 11 68 11 112 parsed_2l7d 1 10 dna_dodecamer_4rG_tnnoesy_082709_100ms.5 12 70 12 113 parsed_2l7d 1 11 dna_dodecamer_4rG_tnnoesy_082709_100ms.6 13 70 13 114 parsed_2l7d 1 12 dna_dodecamer_4rG_tnnoesy_082709_100ms.6 14 70 14 113 parsed_2l7d 1 13 dna_dodecamer_4rG_tnnoesy_082709_100ms.7 15 68 15 112 parsed_2l7d 1 14 dna_dodecamer_4rG_tnnoesy_082709_100ms.7 16 70 16 113 parsed_2l7d 1 15 dna_dodecamer_4rG_tnnoesy_082709_100ms.8 17 70 17 114 parsed_2l7d 1 16 dna_dodecamer_4rG_tnnoesy_082709_100ms.8 18 70 18 113 parsed_2l7d 1 17 dna_dodecamer_4rG_tnnoesy_082709_100ms.9 19 69 19 113 parsed_2l7d 1 18 dna_dodecamer_4rG_tnnoesy_082709_100ms.9 20 70 20 113 parsed_2l7d 1 19 dna_dodecamer_4rG_tnnoesy_082709_100ms.10 21 69 21 114 parsed_2l7d 1 20 dna_dodecamer_4rG_tnnoesy_082709_100ms.10 22 69 22 113 parsed_2l7d 1 21 dna_dodecamer_4rG_tnnoesy_082709_100ms.11 23 67 23 112 parsed_2l7d 1 22 ; dna_dodecamer_4rG_tnnoesy_082709_100ms.11 assign (resid 4 and name H8) (resid 4 and name H3') 6.00 4.20 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.16 assign (resid 16 and name H8) (resid 16 and name H3') 6.00 4.20 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.16 ; 24 69 26 115 parsed_2l7d 1 23 dna_dodecamer_4rG_tnnoesy_082709_100ms.18 27 68 27 113 parsed_2l7d 1 24 dna_dodecamer_4rG_tnnoesy_082709_100ms.18 28 70 28 114 parsed_2l7d 1 25 dna_dodecamer_4rG_tnnoesy_082709_100ms.19 29 68 29 113 parsed_2l7d 1 26 dna_dodecamer_4rG_tnnoesy_082709_100ms.19 30 70 30 114 parsed_2l7d 1 27 dna_dodecamer_4rG_tnnoesy_082709_100ms.20 31 68 31 113 parsed_2l7d 1 28 dna_dodecamer_4rG_tnnoesy_082709_100ms.20 32 70 32 114 parsed_2l7d 1 29 dna_dodecamer_4rG_tnnoesy_082709_100ms.21 33 68 33 113 parsed_2l7d 1 30 dna_dodecamer_4rG_tnnoesy_082709_100ms.21 34 70 34 114 parsed_2l7d 1 31 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 35 68 35 113 parsed_2l7d 1 32 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 36 70 36 114 parsed_2l7d 1 33 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 37 68 37 113 parsed_2l7d 1 34 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 38 70 38 114 parsed_2l7d 1 35 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 39 68 39 113 parsed_2l7d 1 36 dna_dodecamer_4rG_tnnoesy_082709_100ms.22 40 70 40 114 parsed_2l7d 1 37 dna_dodecamer_4rG_tnnoesy_082709_100ms.23 41 68 41 113 parsed_2l7d 1 38 dna_dodecamer_4rG_tnnoesy_082709_100ms.23 42 70 42 114 parsed_2l7d 1 39 dna_dodecamer_4rG_tnnoesy_082709_100ms.24 43 68 43 113 parsed_2l7d 1 40 dna_dodecamer_4rG_tnnoesy_082709_100ms.24 44 70 44 114 parsed_2l7d 1 41 dna_dodecamer_4rG_tnnoesy_082709_100ms.25 45 68 45 113 parsed_2l7d 1 42 dna_dodecamer_4rG_tnnoesy_082709_100ms.25 46 70 46 114 parsed_2l7d 1 43 dna_dodecamer_4rG_tnnoesy_082709_100ms.26 47 70 47 115 parsed_2l7d 1 44 dna_dodecamer_4rG_tnnoesy_082709_100ms.26 48 70 48 114 parsed_2l7d 1 45 dna_dodecamer_4rG_tnnoesy_082709_100ms.27 49 70 49 115 parsed_2l7d 1 46 dna_dodecamer_4rG_tnnoesy_082709_100ms.27 50 70 50 114 parsed_2l7d 1 47 dna_dodecamer_4rG_tnnoesy_082709_100ms.28 51 68 51 113 parsed_2l7d 1 48 dna_dodecamer_4rG_tnnoesy_082709_100ms.28 52 70 52 114 parsed_2l7d 1 49 dna_dodecamer_4rG_tnnoesy_082709_100ms.29 53 67 53 112 parsed_2l7d 1 50 dna_dodecamer_4rG_tnnoesy_082709_100ms.29 54 69 54 113 parsed_2l7d 1 51 dna_dodecamer_4rG_tnnoesy_082709_100ms.30 55 68 55 113 parsed_2l7d 1 52 dna_dodecamer_4rG_tnnoesy_082709_100ms.30 56 70 56 114 parsed_2l7d 1 53 dna_dodecamer_4rG_tnnoesy_082709_100ms.31 57 69 57 114 parsed_2l7d 1 54 dna_dodecamer_4rG_tnnoesy_082709_100ms.31 58 69 58 113 parsed_2l7d 1 55 dna_dodecamer_4rG_tnnoesy_082709_100ms.32 59 68 59 113 parsed_2l7d 1 56 dna_dodecamer_4rG_tnnoesy_082709_100ms.32 60 70 60 114 parsed_2l7d 1 57 dna_dodecamer_4rG_tnnoesy_082709_100ms.33 61 68 61 113 parsed_2l7d 1 58 dna_dodecamer_4rG_tnnoesy_082709_100ms.33 62 70 62 114 parsed_2l7d 1 59 dna_dodecamer_4rG_tnnoesy_082709_100ms.34 63 68 63 113 parsed_2l7d 1 60 dna_dodecamer_4rG_tnnoesy_082709_100ms.34 64 70 64 114 parsed_2l7d 1 61 dna_dodecamer_4rG_tnnoesy_082709_100ms.35 65 68 65 113 parsed_2l7d 1 62 dna_dodecamer_4rG_tnnoesy_082709_100ms.35 66 70 66 114 parsed_2l7d 1 63 dna_dodecamer_4rG_tnnoesy_082709_100ms.36 67 69 67 114 parsed_2l7d 1 64 dna_dodecamer_4rG_tnnoesy_082709_100ms.36 68 71 68 115 parsed_2l7d 1 65 dna_dodecamer_4rG_tnnoesy_082709_100ms.37 69 69 69 114 parsed_2l7d 1 66 dna_dodecamer_4rG_tnnoesy_082709_100ms.37 70 71 70 115 parsed_2l7d 1 67 dna_dodecamer_4rG_tnnoesy_082709_100ms.38 71 68 71 113 parsed_2l7d 1 68 dna_dodecamer_4rG_tnnoesy_082709_100ms.38 72 70 72 114 parsed_2l7d 1 69 dna_dodecamer_4rG_tnnoesy_082709_100ms.39 73 68 73 113 parsed_2l7d 1 70 dna_dodecamer_4rG_tnnoesy_082709_100ms.39 74 70 74 114 parsed_2l7d 1 71 dna_dodecamer_4rG_tnnoesy_082709_100ms.42 75 68 75 113 parsed_2l7d 1 72 dna_dodecamer_4rG_tnnoesy_082709_100ms.42 76 70 76 114 parsed_2l7d 1 73 dna_dodecamer_4rG_tnnoesy_082709_100ms.43 77 69 77 114 parsed_2l7d 1 74 dna_dodecamer_4rG_tnnoesy_082709_100ms.43 78 71 78 115 parsed_2l7d 1 75 dna_dodecamer_4rG_tnnoesy_082709_100ms.44 79 68 79 113 parsed_2l7d 1 76 dna_dodecamer_4rG_tnnoesy_082709_100ms.44 80 70 80 114 parsed_2l7d 1 77 dna_dodecamer_4rG_tnnoesy_082709_100ms.45 81 70 81 115 parsed_2l7d 1 78 dna_dodecamer_4rG_tnnoesy_082709_100ms.45 82 70 82 114 parsed_2l7d 1 79 dna_dodecamer_4rG_tnnoesy_082709_100ms.46 83 68 83 113 parsed_2l7d 1 80 dna_dodecamer_4rG_tnnoesy_082709_100ms.46 84 70 84 114 parsed_2l7d 1 81 dna_dodecamer_4rG_tnnoesy_082709_100ms.47 85 71 85 116 parsed_2l7d 1 82 dna_dodecamer_4rG_tnnoesy_082709_100ms.47 86 71 86 115 parsed_2l7d 1 83 dna_dodecamer_4rG_tnnoesy_082709_100ms.48 87 69 87 114 parsed_2l7d 1 84 dna_dodecamer_4rG_tnnoesy_082709_100ms.48 88 71 88 115 parsed_2l7d 1 85 dna_dodecamer_4rG_tnnoesy_082709_100ms.49 89 69 89 114 parsed_2l7d 1 86 dna_dodecamer_4rG_tnnoesy_082709_100ms.49 90 71 90 115 parsed_2l7d 1 87 dna_dodecamer_4rG_tnnoesy_082709_100ms.50 91 68 91 113 parsed_2l7d 1 88 dna_dodecamer_4rG_tnnoesy_082709_100ms.50 92 70 92 114 parsed_2l7d 1 89 dna_dodecamer_4rG_tnnoesy_082709_100ms.51 93 68 93 113 parsed_2l7d 1 90 dna_dodecamer_4rG_tnnoesy_082709_100ms.51 94 70 94 114 parsed_2l7d 1 91 dna_dodecamer_4rG_tnnoesy_082709_100ms.52 95 69 95 114 parsed_2l7d 1 92 dna_dodecamer_4rG_tnnoesy_082709_100ms.52 96 71 96 115 parsed_2l7d 1 93 dna_dodecamer_4rG_tnnoesy_082709_100ms.53 97 70 97 115 parsed_2l7d 1 94 dna_dodecamer_4rG_tnnoesy_082709_100ms.53 98 71 98 115 parsed_2l7d 1 95 dna_dodecamer_4rG_tnnoesy_082709_100ms.54 99 69 99 114 parsed_2l7d 1 96 dna_dodecamer_4rG_tnnoesy_082709_100ms.54 100 71 100 115 parsed_2l7d 1 97 dna_dodecamer_4rG_tnnoesy_082709_100ms.55 101 70 101 115 parsed_2l7d 1 98 dna_dodecamer_4rG_tnnoesy_082709_100ms.55 102 70 102 114 parsed_2l7d 1 99 dna_dodecamer_4rG_tnnoesy_082709_100ms.56 103 68 103 113 parsed_2l7d 1 100 dna_dodecamer_4rG_tnnoesy_082709_100ms.56 104 70 104 114 parsed_2l7d 1 101 dna_dodecamer_4rG_tnnoesy_082709_100ms.57 105 71 105 116 parsed_2l7d 1 102 dna_dodecamer_4rG_tnnoesy_082709_100ms.57 106 71 106 115 parsed_2l7d 1 103 dna_dodecamer_4rG_tnnoesy_082709_100ms.58 107 70 107 115 parsed_2l7d 1 104 dna_dodecamer_4rG_tnnoesy_082709_100ms.58 108 70 108 114 parsed_2l7d 1 105 dna_dodecamer_4rG_tnnoesy_082709_100ms.59 109 68 109 113 parsed_2l7d 1 106 dna_dodecamer_4rG_tnnoesy_082709_100ms.59 110 70 110 114 parsed_2l7d 1 107 dna_dodecamer_4rG_tnnoesy_082709_100ms.60 111 70 111 115 parsed_2l7d 1 108 dna_dodecamer_4rG_tnnoesy_082709_100ms.60 112 70 112 114 parsed_2l7d 1 109 dna_dodecamer_4rG_tnnoesy_082709_100ms.61 113 72 113 117 parsed_2l7d 1 110 dna_dodecamer_4rG_tnnoesy_082709_100ms.61 114 72 114 116 parsed_2l7d 1 111 dna_dodecamer_4rG_tnnoesy_082709_100ms.62 115 70 115 115 parsed_2l7d 1 112 dna_dodecamer_4rG_tnnoesy_082709_100ms.62 116 72 116 116 parsed_2l7d 1 113 dna_dodecamer_4rG_tnnoesy_082709_100ms.63 117 70 117 115 parsed_2l7d 1 114 dna_dodecamer_4rG_tnnoesy_082709_100ms.63 118 72 118 116 parsed_2l7d 1 115 dna_dodecamer_4rG_tnnoesy_082709_100ms.64 119 70 119 115 parsed_2l7d 1 116 dna_dodecamer_4rG_tnnoesy_082709_100ms.64 120 72 120 116 parsed_2l7d 1 117 dna_dodecamer_4rG_tnnoesy_082709_100ms.65 121 70 121 115 parsed_2l7d 1 118 dna_dodecamer_4rG_tnnoesy_082709_100ms.65 122 72 122 116 parsed_2l7d 1 119 dna_dodecamer_4rG_tnnoesy_082709_100ms.66 123 70 123 115 parsed_2l7d 1 120 dna_dodecamer_4rG_tnnoesy_082709_100ms.66 124 72 124 116 parsed_2l7d 1 121 dna_dodecamer_4rG_tnnoesy_082709_100ms.67 125 72 125 117 parsed_2l7d 1 122 dna_dodecamer_4rG_tnnoesy_082709_100ms.67 126 72 126 116 parsed_2l7d 1 123 dna_dodecamer_4rG_tnnoesy_082709_100ms.68 127 70 127 115 parsed_2l7d 1 124 dna_dodecamer_4rG_tnnoesy_082709_100ms.68 128 72 128 116 parsed_2l7d 1 125 dna_dodecamer_4rG_tnnoesy_082709_100ms.69 129 70 129 115 parsed_2l7d 1 126 dna_dodecamer_4rG_tnnoesy_082709_100ms.69 130 70 130 114 parsed_2l7d 1 127 dna_dodecamer_4rG_tnnoesy_082709_100ms.70 131 70 131 115 parsed_2l7d 1 128 dna_dodecamer_4rG_tnnoesy_082709_100ms.70 132 70 132 114 parsed_2l7d 1 129 dna_dodecamer_4rG_tnnoesy_082709_100ms.71 133 68 133 113 parsed_2l7d 1 130 dna_dodecamer_4rG_tnnoesy_082709_100ms.71 134 70 134 114 parsed_2l7d 1 131 dna_dodecamer_4rG_tnnoesy_082709_100ms.72 135 69 135 114 parsed_2l7d 1 132 dna_dodecamer_4rG_tnnoesy_082709_100ms.72 136 71 136 115 parsed_2l7d 1 133 dna_dodecamer_4rG_tnnoesy_082709_100ms.73 137 69 137 114 parsed_2l7d 1 134 dna_dodecamer_4rG_tnnoesy_082709_100ms.73 138 71 138 115 parsed_2l7d 1 135 dna_dodecamer_4rG_tnnoesy_082709_100ms.74 139 69 139 114 parsed_2l7d 1 136 dna_dodecamer_4rG_tnnoesy_082709_100ms.74 140 71 140 115 parsed_2l7d 1 137 dna_dodecamer_4rG_tnnoesy_082709_100ms.75 141 69 141 114 parsed_2l7d 1 138 dna_dodecamer_4rG_tnnoesy_082709_100ms.75 142 71 142 115 parsed_2l7d 1 139 dna_dodecamer_4rG_tnnoesy_082709_100ms.76 143 71 143 116 parsed_2l7d 1 140 dna_dodecamer_4rG_tnnoesy_082709_100ms.76 144 71 144 115 parsed_2l7d 1 141 dna_dodecamer_4rG_tnnoesy_082709_100ms.77 145 70 145 115 parsed_2l7d 1 142 dna_dodecamer_4rG_tnnoesy_082709_100ms.77 146 72 146 116 parsed_2l7d 1 143 dna_dodecamer_4rG_tnnoesy_082709_100ms.78 147 69 147 114 parsed_2l7d 1 144 dna_dodecamer_4rG_tnnoesy_082709_100ms.78 148 71 148 115 parsed_2l7d 1 145 dna_dodecamer_4rG_tnnoesy_082709_100ms.79 149 68 149 113 parsed_2l7d 1 146 dna_dodecamer_4rG_tnnoesy_082709_100ms.79 150 70 150 114 parsed_2l7d 1 147 dna_dodecamer_4rG_tnnoesy_082709_100ms.80 151 69 151 114 parsed_2l7d 1 148 dna_dodecamer_4rG_tnnoesy_082709_100ms.80 152 71 152 115 parsed_2l7d 1 149 dna_dodecamer_4rG_tnnoesy_082709_100ms.81 153 69 153 114 parsed_2l7d 1 150 dna_dodecamer_4rG_tnnoesy_082709_100ms.81 154 71 154 115 parsed_2l7d 1 151 dna_dodecamer_4rG_tnnoesy_082709_100ms.82 155 71 155 116 parsed_2l7d 1 152 dna_dodecamer_4rG_tnnoesy_082709_100ms.82 156 71 156 115 parsed_2l7d 1 153 dna_dodecamer_4rG_tnnoesy_082709_100ms.85 157 69 157 114 parsed_2l7d 1 154 dna_dodecamer_4rG_tnnoesy_082709_100ms.85 158 71 158 115 parsed_2l7d 1 155 dna_dodecamer_4rG_tnnoesy_082709_100ms.87 159 69 159 114 parsed_2l7d 1 156 dna_dodecamer_4rG_tnnoesy_082709_100ms.87 160 71 160 115 parsed_2l7d 1 157 dna_dodecamer_4rG_tnnoesy_082709_100ms.88 161 69 161 114 parsed_2l7d 1 158 dna_dodecamer_4rG_tnnoesy_082709_100ms.88 162 71 162 115 parsed_2l7d 1 159 dna_dodecamer_4rG_tnnoesy_082709_100ms.89 163 69 163 114 parsed_2l7d 1 160 dna_dodecamer_4rG_tnnoesy_082709_100ms.89 164 71 164 115 parsed_2l7d 1 161 dna_dodecamer_4rG_tnnoesy_082709_100ms.90 165 70 165 115 parsed_2l7d 1 162 dna_dodecamer_4rG_tnnoesy_082709_100ms.90 166 72 166 116 parsed_2l7d 1 163 dna_dodecamer_4rG_tnnoesy_082709_100ms.91 167 70 167 115 parsed_2l7d 1 164 dna_dodecamer_4rG_tnnoesy_082709_100ms.91 168 72 168 116 parsed_2l7d 1 165 dna_dodecamer_4rG_tnnoesy_082709_100ms.92 169 69 169 114 parsed_2l7d 1 166 dna_dodecamer_4rG_tnnoesy_082709_100ms.92 170 71 170 115 parsed_2l7d 1 167 dna_dodecamer_4rG_tnnoesy_082709_100ms.93 171 71 171 116 parsed_2l7d 1 168 dna_dodecamer_4rG_tnnoesy_082709_100ms.93 172 71 172 115 parsed_2l7d 1 169 dna_dodecamer_4rG_tnnoesy_082709_100ms.94 173 72 173 117 parsed_2l7d 1 170 dna_dodecamer_4rG_tnnoesy_082709_100ms.94 174 72 174 116 parsed_2l7d 1 171 dna_dodecamer_4rG_tnnoesy_082709_100ms.95 175 69 175 114 parsed_2l7d 1 172 dna_dodecamer_4rG_tnnoesy_082709_100ms.95 176 71 176 115 parsed_2l7d 1 173 dna_dodecamer_4rG_tnnoesy_082709_100ms.96 177 70 177 115 parsed_2l7d 1 174 dna_dodecamer_4rG_tnnoesy_082709_100ms.96 178 72 178 116 parsed_2l7d 1 175 dna_dodecamer_4rG_tnnoesy_082709_100ms.97 179 69 179 114 parsed_2l7d 1 176 dna_dodecamer_4rG_tnnoesy_082709_100ms.97 180 71 180 115 parsed_2l7d 1 177 dna_dodecamer_4rG_tnnoesy_082709_100ms.98 181 69 181 114 parsed_2l7d 1 178 dna_dodecamer_4rG_tnnoesy_082709_100ms.98 182 71 182 115 parsed_2l7d 1 179 dna_dodecamer_4rG_tnnoesy_082709_100ms.99 183 71 183 116 parsed_2l7d 1 180 dna_dodecamer_4rG_tnnoesy_082709_100ms.99 184 71 184 115 parsed_2l7d 1 181 dna_dodecamer_4rG_tnnoesy_082709_100ms.100 185 69 185 115 parsed_2l7d 1 182 dna_dodecamer_4rG_tnnoesy_082709_100ms.100 186 71 186 116 parsed_2l7d 1 183 dna_dodecamer_4rG_tnnoesy_082709_100ms.101 187 69 187 115 parsed_2l7d 1 184 dna_dodecamer_4rG_tnnoesy_082709_100ms.101 188 71 188 116 parsed_2l7d 1 185 dna_dodecamer_4rG_tnnoesy_082709_100ms.102 189 69 189 115 parsed_2l7d 1 186 dna_dodecamer_4rG_tnnoesy_082709_100ms.102 190 71 190 116 parsed_2l7d 1 187 dna_dodecamer_4rG_tnnoesy_082709_100ms.105 191 70 191 116 parsed_2l7d 1 188 dna_dodecamer_4rG_tnnoesy_082709_100ms.105 192 72 192 117 parsed_2l7d 1 189 dna_dodecamer_4rG_tnnoesy_082709_100ms.108 193 72 193 118 parsed_2l7d 1 190 dna_dodecamer_4rG_tnnoesy_082709_100ms.108 194 72 194 117 parsed_2l7d 1 191 dna_dodecamer_4rG_tnnoesy_082709_100ms.109 195 70 195 116 parsed_2l7d 1 192 dna_dodecamer_4rG_tnnoesy_082709_100ms.109 196 72 196 117 parsed_2l7d 1 193 dna_dodecamer_4rG_tnnoesy_082709_100ms.111 197 70 197 116 parsed_2l7d 1 194 dna_dodecamer_4rG_tnnoesy_082709_100ms.111 198 72 198 117 parsed_2l7d 1 195 dna_dodecamer_4rG_tnnoesy_082709_100ms.113 199 69 199 115 parsed_2l7d 1 196 dna_dodecamer_4rG_tnnoesy_082709_100ms.113 200 71 200 116 parsed_2l7d 1 197 dna_dodecamer_4rG_tnnoesy_082709_100ms.114 201 69 201 115 parsed_2l7d 1 198 dna_dodecamer_4rG_tnnoesy_082709_100ms.114 202 71 202 116 parsed_2l7d 1 199 dna_dodecamer_4rG_tnnoesy_082709_100ms.115 203 69 203 115 parsed_2l7d 1 200 dna_dodecamer_4rG_tnnoesy_082709_100ms.115 204 71 204 116 parsed_2l7d 1 201 dna_dodecamer_4rG_tnnoesy_082709_100ms.119 205 71 205 117 parsed_2l7d 1 202 dna_dodecamer_4rG_tnnoesy_082709_100ms.119 206 72 206 117 parsed_2l7d 1 203 dna_dodecamer_4rG_tnnoesy_082709_100ms.131 207 70 207 116 parsed_2l7d 1 204 dna_dodecamer_4rG_tnnoesy_082709_100ms.131 208 72 208 117 parsed_2l7d 1 205 dna_dodecamer_4rG_tnnoesy_082709_100ms.132 209 70 209 116 parsed_2l7d 1 206 dna_dodecamer_4rG_tnnoesy_082709_100ms.132 210 72 210 117 parsed_2l7d 1 207 dna_dodecamer_4rG_tnnoesy_082709_100ms.133 211 69 211 115 parsed_2l7d 1 208 dna_dodecamer_4rG_tnnoesy_082709_100ms.133 212 71 212 116 parsed_2l7d 1 209 dna_dodecamer_4rG_tnnoesy_082709_100ms.134 213 68 213 114 parsed_2l7d 1 210 ; dna_dodecamer_4rG_tnnoesy_082709_100ms.134 assign (resid 4 and name H2'') (resid 5 and name H8) 5.00 3.20 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.135 assign (resid 16 and name H2'') (resid 17 and name H8) 5.00 3.20 0.0 ! dna_dodecamer_4rG_tnnoesy_082709_100ms.135 ; 214 70 216 117 parsed_2l7d 1 211 dna_dodecamer_4rG_tnnoesy_082709_100ms.136 217 68 217 114 parsed_2l7d 1 212 ; dna_dodecamer_4rG_tnnoesy_082709_100ms.136 dickfnl.noe provided by Brian Reid's group April 20, 1993 ; 218 70 221 2 parsed_2l7d 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2l7d _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_2l7d 2 2 1 . . . parsed_2l7d 2 3 1 . . . parsed_2l7d 2 4 1 . . . parsed_2l7d 2 5 1 . . . parsed_2l7d 2 6 1 . . . parsed_2l7d 2 7 1 . . . parsed_2l7d 2 8 1 . . . parsed_2l7d 2 9 1 . . . parsed_2l7d 2 10 1 . . . parsed_2l7d 2 11 1 . . . parsed_2l7d 2 12 1 . . . parsed_2l7d 2 13 1 . . . parsed_2l7d 2 14 1 . . . parsed_2l7d 2 15 1 . . . parsed_2l7d 2 16 1 . . . parsed_2l7d 2 17 1 . . . parsed_2l7d 2 18 1 . . . parsed_2l7d 2 19 1 . . . parsed_2l7d 2 20 1 . . . parsed_2l7d 2 21 1 . . . parsed_2l7d 2 22 1 . . . parsed_2l7d 2 23 1 . . . parsed_2l7d 2 24 1 . . . parsed_2l7d 2 25 1 . . . parsed_2l7d 2 26 1 . . . parsed_2l7d 2 27 1 . . . parsed_2l7d 2 28 1 . . . parsed_2l7d 2 29 1 . . . parsed_2l7d 2 30 1 . . . parsed_2l7d 2 31 1 . . . parsed_2l7d 2 32 1 . . . parsed_2l7d 2 33 1 . . . parsed_2l7d 2 34 1 . . . parsed_2l7d 2 35 1 . . . parsed_2l7d 2 36 1 . . . parsed_2l7d 2 37 1 . . . parsed_2l7d 2 38 1 . . . parsed_2l7d 2 39 1 . . . parsed_2l7d 2 40 1 . . . parsed_2l7d 2 41 1 . . . parsed_2l7d 2 42 1 . . . parsed_2l7d 2 43 1 . . . parsed_2l7d 2 44 1 . . . parsed_2l7d 2 45 1 . . . parsed_2l7d 2 46 1 . . . parsed_2l7d 2 47 1 . . . parsed_2l7d 2 48 1 . . . parsed_2l7d 2 49 1 . . . parsed_2l7d 2 50 1 . . . parsed_2l7d 2 51 1 . . . parsed_2l7d 2 52 1 . . . parsed_2l7d 2 53 1 . . . parsed_2l7d 2 54 1 . . . parsed_2l7d 2 55 1 . . . parsed_2l7d 2 56 1 . . . parsed_2l7d 2 57 1 . . . parsed_2l7d 2 58 1 . . . parsed_2l7d 2 59 1 . . . parsed_2l7d 2 60 1 . . . parsed_2l7d 2 61 1 . . . parsed_2l7d 2 62 1 . . . parsed_2l7d 2 63 1 . . . parsed_2l7d 2 64 1 . . . parsed_2l7d 2 65 1 . . . parsed_2l7d 2 66 1 . . . parsed_2l7d 2 67 1 . . . parsed_2l7d 2 68 1 . . . parsed_2l7d 2 69 1 . . . parsed_2l7d 2 70 1 . . . parsed_2l7d 2 71 1 . . . parsed_2l7d 2 72 1 . . . parsed_2l7d 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 . . . . . . . . . 24 . n1 parsed_2l7d 2 1 1 2 . . . . . . . . . 1 . n3 parsed_2l7d 2 2 1 1 . . . . . . . . . 24 . h1 parsed_2l7d 2 2 1 2 . . . . . . . . . 1 . n3 parsed_2l7d 2 3 1 1 . . . . . . . . . 24 . o6 parsed_2l7d 2 3 1 2 . . . . . . . . . 1 . n4 parsed_2l7d 2 4 1 1 . . . . . . . . . 24 . n2 parsed_2l7d 2 4 1 2 . . . . . . . . . 1 . o2 parsed_2l7d 2 5 1 1 . . . . . . . . . 24 . n2 parsed_2l7d 2 5 1 2 . . . . . . . . . 1 . n3 parsed_2l7d 2 6 1 1 . . . . . . . . . 24 . o6 parsed_2l7d 2 6 1 2 . . . . . . . . . 1 . n3 parsed_2l7d 2 7 1 1 . . . . . . . . . 2 . n1 parsed_2l7d 2 7 1 2 . . . . . . . . . 23 . n3 parsed_2l7d 2 8 1 1 . . . . . . . . . 2 . h1 parsed_2l7d 2 8 1 2 . . . . . . . . . 23 . n3 parsed_2l7d 2 9 1 1 . . . . . . . . . 2 . o6 parsed_2l7d 2 9 1 2 . . . . . . . . . 23 . n4 parsed_2l7d 2 10 1 1 . . . . . . . . . 2 . n2 parsed_2l7d 2 10 1 2 . . . . . . . . . 23 . o2 parsed_2l7d 2 11 1 1 . . . . . . . . . 2 . n2 parsed_2l7d 2 11 1 2 . . . . . . . . . 23 . n3 parsed_2l7d 2 12 1 1 . . . . . . . . . 2 . o6 parsed_2l7d 2 12 1 2 . . . . . . . . . 23 . n3 parsed_2l7d 2 13 1 1 . . . . . . . . . 22 . n1 parsed_2l7d 2 13 1 2 . . . . . . . . . 3 . n3 parsed_2l7d 2 14 1 1 . . . . . . . . . 22 . h1 parsed_2l7d 2 14 1 2 . . . . . . . . . 3 . n3 parsed_2l7d 2 15 1 1 . . . . . . . . . 22 . o6 parsed_2l7d 2 15 1 2 . . . . . . . . . 3 . n4 parsed_2l7d 2 16 1 1 . . . . . . . . . 22 . n2 parsed_2l7d 2 16 1 2 . . . . . . . . . 3 . o2 parsed_2l7d 2 17 1 1 . . . . . . . . . 22 . n2 parsed_2l7d 2 17 1 2 . . . . . . . . . 3 . n3 parsed_2l7d 2 18 1 1 . . . . . . . . . 22 . o6 parsed_2l7d 2 18 1 2 . . . . . . . . . 3 . n3 parsed_2l7d 2 19 1 1 . . . . . . . . . 4 . n1 parsed_2l7d 2 19 1 2 . . . . . . . . . 21 . n3 parsed_2l7d 2 20 1 1 . . . . . . . . . 4 . h1 parsed_2l7d 2 20 1 2 . . . . . . . . . 21 . n3 parsed_2l7d 2 21 1 1 . . . . . . . . . 4 . o6 parsed_2l7d 2 21 1 2 . . . . . . . . . 21 . n4 parsed_2l7d 2 22 1 1 . . . . . . . . . 4 . n2 parsed_2l7d 2 22 1 2 . . . . . . . . . 21 . o2 parsed_2l7d 2 23 1 1 . . . . . . . . . 4 . n2 parsed_2l7d 2 23 1 2 . . . . . . . . . 21 . n3 parsed_2l7d 2 24 1 1 . . . . . . . . . 4 . o6 parsed_2l7d 2 24 1 2 . . . . . . . . . 21 . n3 parsed_2l7d 2 25 1 1 . . . . . . . . . 16 . n1 parsed_2l7d 2 25 1 2 . . . . . . . . . 9 . n3 parsed_2l7d 2 26 1 1 . . . . . . . . . 16 . h1 parsed_2l7d 2 26 1 2 . . . . . . . . . 9 . n3 parsed_2l7d 2 27 1 1 . . . . . . . . . 16 . o6 parsed_2l7d 2 27 1 2 . . . . . . . . . 9 . n4 parsed_2l7d 2 28 1 1 . . . . . . . . . 16 . n2 parsed_2l7d 2 28 1 2 . . . . . . . . . 9 . o2 parsed_2l7d 2 29 1 1 . . . . . . . . . 16 . n2 parsed_2l7d 2 29 1 2 . . . . . . . . . 9 . n3 parsed_2l7d 2 30 1 1 . . . . . . . . . 16 . o6 parsed_2l7d 2 30 1 2 . . . . . . . . . 9 . n3 parsed_2l7d 2 31 1 1 . . . . . . . . . 10 . n1 parsed_2l7d 2 31 1 2 . . . . . . . . . 15 . n3 parsed_2l7d 2 32 1 1 . . . . . . . . . 10 . h1 parsed_2l7d 2 32 1 2 . . . . . . . . . 15 . n3 parsed_2l7d 2 33 1 1 . . . . . . . . . 10 . o6 parsed_2l7d 2 33 1 2 . . . . . . . . . 15 . n4 parsed_2l7d 2 34 1 1 . . . . . . . . . 10 . n2 parsed_2l7d 2 34 1 2 . . . . . . . . . 15 . o2 parsed_2l7d 2 35 1 1 . . . . . . . . . 10 . n2 parsed_2l7d 2 35 1 2 . . . . . . . . . 15 . n3 parsed_2l7d 2 36 1 1 . . . . . . . . . 10 . o6 parsed_2l7d 2 36 1 2 . . . . . . . . . 15 . n3 parsed_2l7d 2 37 1 1 . . . . . . . . . 14 . n1 parsed_2l7d 2 37 1 2 . . . . . . . . . 11 . n3 parsed_2l7d 2 38 1 1 . . . . . . . . . 14 . h1 parsed_2l7d 2 38 1 2 . . . . . . . . . 11 . n3 parsed_2l7d 2 39 1 1 . . . . . . . . . 14 . o6 parsed_2l7d 2 39 1 2 . . . . . . . . . 11 . n4 parsed_2l7d 2 40 1 1 . . . . . . . . . 14 . n2 parsed_2l7d 2 40 1 2 . . . . . . . . . 11 . o2 parsed_2l7d 2 41 1 1 . . . . . . . . . 14 . n2 parsed_2l7d 2 41 1 2 . . . . . . . . . 11 . n3 parsed_2l7d 2 42 1 1 . . . . . . . . . 14 . o6 parsed_2l7d 2 42 1 2 . . . . . . . . . 11 . n3 parsed_2l7d 2 43 1 1 . . . . . . . . . 12 . n1 parsed_2l7d 2 43 1 2 . . . . . . . . . 13 . n3 parsed_2l7d 2 44 1 1 . . . . . . . . . 12 . h1 parsed_2l7d 2 44 1 2 . . . . . . . . . 13 . n3 parsed_2l7d 2 45 1 1 . . . . . . . . . 12 . o6 parsed_2l7d 2 45 1 2 . . . . . . . . . 13 . n4 parsed_2l7d 2 46 1 1 . . . . . . . . . 12 . n2 parsed_2l7d 2 46 1 2 . . . . . . . . . 13 . o2 parsed_2l7d 2 47 1 1 . . . . . . . . . 12 . n2 parsed_2l7d 2 47 1 2 . . . . . . . . . 13 . n3 parsed_2l7d 2 48 1 1 . . . . . . . . . 12 . o6 parsed_2l7d 2 48 1 2 . . . . . . . . . 13 . n3 parsed_2l7d 2 49 1 1 . . . . . . . . . 5 . n1 parsed_2l7d 2 49 1 2 . . . . . . . . . 20 . n3 parsed_2l7d 2 50 1 1 . . . . . . . . . 5 . n1 parsed_2l7d 2 50 1 2 . . . . . . . . . 20 . h3 parsed_2l7d 2 51 1 1 . . . . . . . . . 5 . n6 parsed_2l7d 2 51 1 2 . . . . . . . . . 20 . o4 parsed_2l7d 2 52 1 1 . . . . . . . . . 5 . h2 parsed_2l7d 2 52 1 2 . . . . . . . . . 20 . o2 parsed_2l7d 2 53 1 1 . . . . . . . . . 5 . n1 parsed_2l7d 2 53 1 2 . . . . . . . . . 20 . o4 parsed_2l7d 2 54 1 1 . . . . . . . . . 5 . n1 parsed_2l7d 2 54 1 2 . . . . . . . . . 20 . o2 parsed_2l7d 2 55 1 1 . . . . . . . . . 6 . n1 parsed_2l7d 2 55 1 2 . . . . . . . . . 19 . n3 parsed_2l7d 2 56 1 1 . . . . . . . . . 6 . n1 parsed_2l7d 2 56 1 2 . . . . . . . . . 19 . h3 parsed_2l7d 2 57 1 1 . . . . . . . . . 6 . n6 parsed_2l7d 2 57 1 2 . . . . . . . . . 19 . o4 parsed_2l7d 2 58 1 1 . . . . . . . . . 6 . h2 parsed_2l7d 2 58 1 2 . . . . . . . . . 19 . o2 parsed_2l7d 2 59 1 1 . . . . . . . . . 6 . n1 parsed_2l7d 2 59 1 2 . . . . . . . . . 19 . o4 parsed_2l7d 2 60 1 1 . . . . . . . . . 6 . n1 parsed_2l7d 2 60 1 2 . . . . . . . . . 19 . o2 parsed_2l7d 2 61 1 1 . . . . . . . . . 18 . n1 parsed_2l7d 2 61 1 2 . . . . . . . . . 7 . n3 parsed_2l7d 2 62 1 1 . . . . . . . . . 18 . n1 parsed_2l7d 2 62 1 2 . . . . . . . . . 7 . h3 parsed_2l7d 2 63 1 1 . . . . . . . . . 18 . n6 parsed_2l7d 2 63 1 2 . . . . . . . . . 7 . o4 parsed_2l7d 2 64 1 1 . . . . . . . . . 18 . h2 parsed_2l7d 2 64 1 2 . . . . . . . . . 7 . o2 parsed_2l7d 2 65 1 1 . . . . . . . . . 18 . n1 parsed_2l7d 2 65 1 2 . . . . . . . . . 7 . o4 parsed_2l7d 2 66 1 1 . . . . . . . . . 18 . n1 parsed_2l7d 2 66 1 2 . . . . . . . . . 7 . o2 parsed_2l7d 2 67 1 1 . . . . . . . . . 17 . n1 parsed_2l7d 2 67 1 2 . . . . . . . . . 8 . n3 parsed_2l7d 2 68 1 1 . . . . . . . . . 17 . n1 parsed_2l7d 2 68 1 2 . . . . . . . . . 8 . h3 parsed_2l7d 2 69 1 1 . . . . . . . . . 17 . n6 parsed_2l7d 2 69 1 2 . . . . . . . . . 8 . o4 parsed_2l7d 2 70 1 1 . . . . . . . . . 17 . h2 parsed_2l7d 2 70 1 2 . . . . . . . . . 8 . o2 parsed_2l7d 2 71 1 1 . . . . . . . . . 17 . n1 parsed_2l7d 2 71 1 2 . . . . . . . . . 8 . o4 parsed_2l7d 2 72 1 1 . . . . . . . . . 17 . n1 parsed_2l7d 2 72 1 2 . . . . . . . . . 8 . o2 parsed_2l7d 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 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 2 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 3 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 4 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 5 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 6 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 7 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 8 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 9 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 10 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 11 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 12 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 13 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 14 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 15 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 16 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 17 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 18 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 19 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 20 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 21 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 22 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 23 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 24 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 25 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 26 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 27 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 28 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 29 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 30 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 31 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 32 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 33 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 34 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 35 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 36 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 37 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 38 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 39 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 40 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 41 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 42 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 43 1 . . . . . 2.87 2.67 3.07 parsed_2l7d 2 44 1 . . . . . 1.86 1.66 2.06 parsed_2l7d 2 45 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 46 1 . . . . . 2.81 2.61 3.01 parsed_2l7d 2 47 1 . . . . . 3.58 3.38 3.78 parsed_2l7d 2 48 1 . . . . . 3.63 3.43 3.83 parsed_2l7d 2 49 1 . . . . . 2.92 2.72 3.12 parsed_2l7d 2 50 1 . . . . . 1.81 1.61 2.01 parsed_2l7d 2 51 1 . . . . . 2.89 2.69 3.09 parsed_2l7d 2 52 1 . . . . . 2.94 2.74 3.14 parsed_2l7d 2 53 1 . . . . . 3.69 3.49 3.89 parsed_2l7d 2 54 1 . . . . . 3.67 3.47 3.87 parsed_2l7d 2 55 1 . . . . . 2.92 2.72 3.12 parsed_2l7d 2 56 1 . . . . . 1.81 1.61 2.01 parsed_2l7d 2 57 1 . . . . . 2.89 2.69 3.09 parsed_2l7d 2 58 1 . . . . . 2.94 2.74 3.14 parsed_2l7d 2 59 1 . . . . . 3.69 3.49 3.89 parsed_2l7d 2 60 1 . . . . . 3.67 3.47 3.87 parsed_2l7d 2 61 1 . . . . . 2.92 2.72 3.12 parsed_2l7d 2 62 1 . . . . . 1.81 1.61 2.01 parsed_2l7d 2 63 1 . . . . . 2.89 2.69 3.09 parsed_2l7d 2 64 1 . . . . . 2.94 2.74 3.14 parsed_2l7d 2 65 1 . . . . . 3.69 3.49 3.89 parsed_2l7d 2 66 1 . . . . . 3.67 3.47 3.87 parsed_2l7d 2 67 1 . . . . . 2.92 2.72 3.12 parsed_2l7d 2 68 1 . . . . . 1.81 1.61 2.01 parsed_2l7d 2 69 1 . . . . . 2.89 2.69 3.09 parsed_2l7d 2 70 1 . . . . . 2.94 2.74 3.14 parsed_2l7d 2 71 1 . . . . . 3.69 3.49 3.89 parsed_2l7d 2 72 1 . . . . . 3.67 3.47 3.87 parsed_2l7d 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 ; H-bond ---------------------------------- GC basepairs ; 1 1 4 14 parsed_2l7d 2 2 "assign (resid 24 and name o6) (resid 1 and name HN') 1.80 .2 .2" 8 1 8 65 parsed_2l7d 2 3 "assign (resid 24 and name HN'') (resid 1 and name o2) 1.79 0.2 0.2" 10 1 10 68 parsed_2l7d 2 4 "assign (resid 2 and name o6) (resid 23 and name HN') 1.80 .2 .2" 17 1 17 65 parsed_2l7d 2 5 "assign (resid 2 and name HN'') (resid 23 and name o2) 1.79 0.2 0.2" 19 1 19 68 parsed_2l7d 2 6 "assign (resid 22 and name o6) (resid 3 and name HN'') 1.80 .2 .2" 26 1 26 66 parsed_2l7d 2 7 "assign (resid 22 and name HN') (resid 3 and name o2) 1.79 0.2 0.2" 28 1 28 67 parsed_2l7d 2 8 "assign (resid 4 and name o6) (resid 21 and name HN'') 1.80 .2 .2" 35 1 35 66 parsed_2l7d 2 9 "assign (resid 4 and name HN') (resid 21 and name o2) 1.79 0.2 0.2" 37 1 37 67 parsed_2l7d 2 10 "assign (resid 16 and name o6) (resid 9 and name HN') 1.80 .2 .2" 45 1 45 65 parsed_2l7d 2 11 "assign (resid 16 and name HN'') (resid 9 and name o2) 1.79 0.2 0.2" 47 1 47 68 parsed_2l7d 2 12 "assign (resid 10 and name o6) (resid 15 and name HN') 1.80 .2 .2" 54 1 54 66 parsed_2l7d 2 13 "assign (resid 10 and name HN'') (resid 15 and name o2) 1.79 0.2 0.2" 56 1 56 69 parsed_2l7d 2 14 "assign (resid 14 and name o6) (resid 11 and name HN') 1.80 .2 .2" 63 1 63 66 parsed_2l7d 2 15 "assign (resid 14 and name HN'') (resid 11 and name o2) 1.79 0.2 0.2" 65 1 65 69 parsed_2l7d 2 16 "assign (resid 12 and name o6) (resid 13 and name HN') 1.80 .2 .2" 72 1 72 66 parsed_2l7d 2 17 "assign (resid 12 and name HN'') (resid 13 and name o2) 1.79 0.2 0.2" 74 1 74 69 parsed_2l7d 2 18 "AT bastpairs" 79 1 79 14 parsed_2l7d 2 19 "assign (resid 5 and name HN') (resid 20 and name o4) 1.87 0.2 0.2" 83 1 83 67 parsed_2l7d 2 20 "assign (resid 6 and name HN'') (resid 19 and name o4) 1.87 0.2 0.2" 91 1 91 68 parsed_2l7d 2 21 "assign (resid 18 and name HN') (resid 7 and name o4) 1.87 0.2 0.2" 99 1 99 67 parsed_2l7d 2 22 "assign (resid 17 and name HN') (resid 8 and name o4) 1.87 0.2 0.2" 108 1 108 67 parsed_2l7d 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2l7d _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_2l7d 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_2l7d 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2l7d 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 4 . O3' . 5 . P . 5 . O5' . 5 . C5' parsed_2l7d 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_2l7d 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 6 . O3' . 7 . P . 7 . O5' . 7 . C5' parsed_2l7d 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 7 . O3' . 8 . P . 8 . O5' . 8 . C5' parsed_2l7d 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 8 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_2l7d 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 9 . O3' . 10 . P . 10 . O5' . 10 . C5' parsed_2l7d 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 10 . O3' . 11 . P . 11 . O5' . 11 . C5' parsed_2l7d 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 11 . O3' . 12 . P . 12 . O5' . 12 . C5' parsed_2l7d 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_2l7d 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 14 . O3' . 15 . P . 15 . O5' . 15 . C5' parsed_2l7d 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_2l7d 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2l7d 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2l7d 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 18 . O3' . 19 . P . 19 . O5' . 19 . C5' parsed_2l7d 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 19 . O3' . 20 . P . 20 . O5' . 20 . C5' parsed_2l7d 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 20 . O3' . 21 . P . 21 . O5' . 21 . C5' parsed_2l7d 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 21 . O3' . 22 . P . 22 . O5' . 22 . C5' parsed_2l7d 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' parsed_2l7d 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' parsed_2l7d 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_2l7d 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_2l7d 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_2l7d 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' parsed_2l7d 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' parsed_2l7d 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' parsed_2l7d 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' parsed_2l7d 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 9 . P . 9 . O5' . 9 . C5' . 9 . C4' parsed_2l7d 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 10 . P . 10 . O5' . 10 . C5' . 10 . C4' parsed_2l7d 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_2l7d 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' parsed_2l7d 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2l7d 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_2l7d 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2l7d 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2l7d 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_2l7d 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' parsed_2l7d 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' parsed_2l7d 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 21 . P . 21 . O5' . 21 . C5' . 21 . C4' parsed_2l7d 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 22 . P . 22 . O5' . 22 . C5' . 22 . C4' parsed_2l7d 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' parsed_2l7d 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' parsed_2l7d 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 1 . O5' . 1 . C5' . 1 . C4' . 1 . C3' parsed_2l7d 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' parsed_2l7d 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_2l7d 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' parsed_2l7d 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 5 . O5' . 5 . C5' . 5 . C4' . 5 . C3' parsed_2l7d 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 6 . O5' . 6 . C5' . 6 . C4' . 6 . C3' parsed_2l7d 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 7 . O5' . 7 . C5' . 7 . C4' . 7 . C3' parsed_2l7d 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 8 . O5' . 8 . C5' . 8 . C4' . 8 . C3' parsed_2l7d 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 9 . O5' . 9 . C5' . 9 . C4' . 9 . C3' parsed_2l7d 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 10 . O5' . 10 . C5' . 10 . C4' . 10 . C3' parsed_2l7d 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' parsed_2l7d 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' parsed_2l7d 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' parsed_2l7d 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2l7d 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' parsed_2l7d 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2l7d 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2l7d 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' parsed_2l7d 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 19 . O5' . 19 . C5' . 19 . C4' . 19 . C3' parsed_2l7d 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 20 . O5' . 20 . C5' . 20 . C4' . 20 . C3' parsed_2l7d 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 21 . O5' . 21 . C5' . 21 . C4' . 21 . C3' parsed_2l7d 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 22 . O5' . 22 . C5' . 22 . C4' . 22 . C3' parsed_2l7d 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' parsed_2l7d 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 95.0 . . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' parsed_2l7d 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 ; Ideal dihedral values for a B-DNA Alpha dihedral ; 1 1 6 2 parsed_2l7d 1 2 "Beta dihedral" 119 1 121 2 parsed_2l7d 1 3 "Gamma dihedrals" 233 1 235 2 parsed_2l7d 1 4 ; Delta dihedrals Use Bax & Lerner's JMR 79, 429-438 values. CDS 06/04/18 - disabled - this forces B-form DNA assign ( resid 1 and name C5' ) ( resid 1 and name C4' ) ( resid 1 and name C3' ) ( resid 1 and name O3' ) 1.0 140.0 35.0 2 ! 1 122.5 20.0 2 assign ( resid 2 and name C5' ) ( resid 2 and name C4' ) ( resid 2 and name C3' ) ( resid 2 and name O3' ) 1.0 140.0 35.0 2 ! 1 121.8 20.0 2 assign ( resid 3 and name C5' ) ( resid 3 and name C4' ) ( resid 3 and name C3' ) ( resid 3 and name O3' ) 1.0 140.0 35.0 2 ! 1 124.4 20.0 2 assign ( resid 4 and name C5' ) ( resid 4 and name C4' ) ( resid 4 and name C3' ) ( resid 4 and name O3' ) 1.0 140.0 35.0 2 ! 1 128.4 20.0 2 assign ( resid 5 and name C5' ) ( resid 5 and name C4' ) ( resid 5 and name C3' ) ( resid 5 and name O3' ) 1.0 140.0 35.0 2 ! 1 126.7 20.0 2 assign ( resid 6 and name C5' ) ( resid 6 and name C4' ) ( resid 6 and name C3' ) ( resid 6 and name O3' ) 1.0 140.0 35.0 2 ! 1 122.7 20.0 2 assign ( resid 7 and name C5' ) ( resid 7 and name C4' ) ( resid 7 and name C3' ) ( resid 7 and name O3' ) 1.0 140.0 35.0 2 ! 1 110.7 20.0 2 assign ( resid 8 and name C5' ) ( resid 8 and name C4' ) ( resid 8 and name C3' ) ( resid 8 and name O3' ) 1.0 140.0 35.0 2 ! 1 121.1 20.0 2 assign ( resid 9 and name C5' ) ( resid 9 and name C4' ) ( resid 9 and name C3' ) ( resid 9 and name O3' ) 1.0 140.0 35.0 2 ! 1 120.3 20.0 2 assign ( resid 10 and name C5' ) ( resid 10 and name C4' ) ( resid 10 and name C3' ) ( resid 10 and name O3' ) 1.0 140.0 35.0 2 ! 1 127.8 20.0 2 assign ( resid 11 and name C5' ) ( resid 11 and name C4' ) ( resid 11 and name C3' ) ( resid 11 and name O3' )1.0 140.0 35.0 2 ! 1 117.5 20.0 2 assign ( resid 12 and name C5' ) ( resid 12 and name C4' ) ( resid 12 and name C3' ) ( resid 12 and name O3' ) 1.0 140.0 35.0 2 ! 1 123.3 20.0 2 assign ( resid 13 and name C5' ) ( resid 13 and name C4' ) ( resid 13 and name C3' ) ( resid 13 and name O3' ) 1.0 140.0 35.0 2 !1 122.5 20.0 2 assign ( resid 14 and name C5' ) ( resid 14 and name C4' ) ( resid 14 and name C3' ) ( resid 14 and name O3' ) 1.0 140.0 35.0 2 ! 1 121.8 20.0 2 assign ( resid 15 and name C5' ) ( resid 15 and name C4' ) ( resid 15 and name C3' ) ( resid 15 and name O3' ) 1.0 140.0 35.0 2 ! 1 124.4 20.0 2 assign ( resid 16 and name C5' ) ( resid 16 and name C4' ) ( resid 16 and name C3' ) ( resid 16 and name O3' ) 1.0 140.0 35.0 2 ! 1 128.4 20.0 2 assign ( resid 17 and name C5' ) ( resid 17 and name C4' ) ( resid 17 and name C3' ) ( resid 17 and name O3' ) 1.0 140.0 35.0 2 ! 1 126.7 20.0 2 assign ( resid 18 and name C5' ) ( resid 18 and name C4' ) ( resid 18 and name C3' ) ( resid 18 and name O3' ) 1.0 140.0 35.0 2 ! 1 122.7 20.0 2 assign ( resid 19 and name C5' ) ( resid 19 and name C4' ) ( resid 19 and name C3' ) ( resid 19 and name O3' ) 1.0 140.0 35.0 2 ! 1 110.7 20.0 2 assign ( resid 20 and name C5' ) ( resid 20 and name C4' ) ( resid 20 and name C3' ) ( resid 20 and name O3' ) 1.0 140.0 35.0 2 ! 1 121.1 20.0 2 assign ( resid 21 and name C5' ) ( resid 21 and name C4' ) ( resid 21 and name C3' ) ( resid 21 and name O3' ) 1.0 140.0 35.0 2 ! 1 120.3 20.0 2 assign ( resid 22 and name C5' ) ( resid 22 and name C4' ) ( resid 22 and name C3' ) ( resid 22 and name O3' ) 1.0 140.0 35.0 2 ! 1 127.8 20.0 2 assign ( resid 23 and name C5' ) ( resid 23 and name C4' ) ( resid 23 and name C3' ) ( resid 23 and name O3' ) 1.0 140.0 35.0 2 ! 1 117.5 20.0 2 assign ( resid 24 and name C5' ) ( resid 24 and name C4' ) ( resid 24 and name C3' ) ( resid 24 and name O3' ) 1.0 140.0 35.0 2 ! 1 123.3 20.0 2 Epsilon dihedrals Use Sklenar and Bax paper (JACS nov 25, 1987) removed - to allow B2 form - CDS 06/07/12 Zeta dihedral removed - to allow B2 form - CDS 06/07/12 ; 358 1 496 44 parsed_2l7d 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_6 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID parsed_2l7d _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 6 _RDC_constraint_list.Details "Generated by Wattos" loop_ _RDC_constraint.ID _RDC_constraint.Assembly_atom_ID_1 _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Seq_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Resonance_ID_1 _RDC_constraint.Assembly_atom_ID_2 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Seq_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.Resonance_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Source_experiment_ID _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 . . . . . . . . . . . . . . . . -2.132 -3.132 -1.132 . . . 1 . H1' . 1 . H2' parsed_2l7d 1 2 . . . . . . . . . . . . . . . . -2.542 -3.542 -1.542 . . . 3 . H1' . 3 . H2' parsed_2l7d 1 3 . . . . . . . . . . . . . . . . -0.051 -1.051 0.949 . . . 5 . H1' . 5 . H2' parsed_2l7d 1 4 . . . . . . . . . . . . . . . . 1.093 0.093 2.093 . . . 6 . H1' . 6 . H2' parsed_2l7d 1 5 . . . . . . . . . . . . . . . . -0.987 -1.987 0.013 . . . 7 . H1' . 7 . H2' parsed_2l7d 1 6 . . . . . . . . . . . . . . . . -0.756 -1.756 0.244 . . . 11 . H1' . 11 . H2' parsed_2l7d 1 7 . . . . . . . . . . . . . . . . -0.921 -1.921 0.079 . . . 12 . H1' . 12 . H2' parsed_2l7d 1 8 . . . . . . . . . . . . . . . . -8.169 -9.169 -7.169 . . . 1 . H1' . 1 . H2'' parsed_2l7d 1 9 . . . . . . . . . . . . . . . . -7.99 -8.990 -6.990 . . . 3 . H1' . 3 . H2'' parsed_2l7d 1 10 . . . . . . . . . . . . . . . . -2.586 -4.586 -0.586 . . . 5 . H1' . 5 . H2'' parsed_2l7d 1 11 . . . . . . . . . . . . . . . . -3.819 -5.819 -1.819 . . . 6 . H1' . 6 . H2'' parsed_2l7d 1 12 . . . . . . . . . . . . . . . . -4.536 -6.536 -2.536 . . . 9 . H1' . 9 . H2'' parsed_2l7d 1 13 . . . . . . . . . . . . . . . . -10.491 -11.491 -9.491 . . . 11 . H1' . 11 . H2'' parsed_2l7d 1 14 . . . . . . . . . . . . . . . . -10.724 -11.724 -9.724 . . . 12 . H1' . 12 . H2'' parsed_2l7d 1 15 . . . . . . . . . . . . . . . . 7.887 5.887 9.887 . . . 1 . H2' . 1 . H3' parsed_2l7d 1 16 . . . . . . . . . . . . . . . . 7.457 6.457 8.457 . . . 3 . H2' . 3 . H3' parsed_2l7d 1 17 . . . . . . . . . . . . . . . . 6.363 5.363 7.363 . . . 7 . H2' . 7 . H3' parsed_2l7d 1 18 . . . . . . . . . . . . . . . . 9.733 8.733 10.733 . . . 8 . H2' . 8 . H3' parsed_2l7d 1 19 . . . . . . . . . . . . . . . . 10.43 9.430 11.430 . . . 9 . H2' . 9 . H3' parsed_2l7d 1 20 . . . . . . . . . . . . . . . . 8.244 7.244 9.244 . . . 11 . H2' . 11 . H3' parsed_2l7d 1 21 . . . . . . . . . . . . . . . . 8.083 6.083 10.083 . . . 12 . H2' . 12 . H3' parsed_2l7d 1 22 . . . . . . . . . . . . . . . . 2.338 0.338 4.338 . . . 1 . H2'' . 1 . H3' parsed_2l7d 1 23 . . . . . . . . . . . . . . . . 0.655 -3.345 4.655 . . . 5 . H2'' . 5 . H3' parsed_2l7d 1 24 . . . . . . . . . . . . . . . . 4.402 3.402 5.402 . . . 11 . H2'' . 11 . H3' parsed_2l7d 1 25 . . . . . . . . . . . . . . . . 4.215 2.215 6.215 . . . 12 . H2'' . 12 . H3' parsed_2l7d 1 26 . . . . . . . . . . . . . . . . 5.958 4.958 6.958 . . . 1 . H2' . 1 . H2'' parsed_2l7d 1 27 . . . . . . . . . . . . . . . . 7.132 5.132 9.132 . . . 5 . H2' . 5 . H2'' parsed_2l7d 1 28 . . . . . . . . . . . . . . . . 3.055 2.055 4.055 . . . 8 . H2' . 8 . H2'' parsed_2l7d 1 29 . . . . . . . . . . . . . . . . -3.835 -4.835 -2.835 . . . 9 . H2' . 9 . H2'' parsed_2l7d 1 30 . . . . . . . . . . . . . . . . 7.027 6.027 8.027 . . . 11 . H2' . 11 . H2'' parsed_2l7d 1 31 . . . . . . . . . . . . . . . . 5.734 4.734 6.734 . . . 1 . H5 . 1 . H6 parsed_2l7d 1 32 . . . . . . . . . . . . . . . . 5.576 4.576 6.576 . . . 3 . H5 . 3 . H6 parsed_2l7d 1 33 . . . . . . . . . . . . . . . . 5.947 3.947 7.947 . . . 9 . H5 . 9 . H6 parsed_2l7d 1 34 . . . . . . . . . . . . . . . . 5.305 4.305 6.305 . . . 11 . H5 . 11 . H6 parsed_2l7d 1 35 . . . . . . . . . . . . . . . . 1.435 0.435 2.435 . . . 3 . H1' . 4 . H5' parsed_2l7d 1 36 . . . . . . . . . . . . . . . . 3.288 2.288 4.288 . . . 6 . H1' . 7 . H5' parsed_2l7d 1 37 . . . . . . . . . . . . . . . . 1.62 0.620 2.620 . . . 3 . H1' . 3 . H4' parsed_2l7d 1 38 . . . . . . . . . . . . . . . . 3.014 2.014 4.014 . . . 11 . H1' . 11 . H4' parsed_2l7d 1 39 . . . . . . . . . . . . . . . . 2.084 1.084 3.084 . . . 12 . H1' . 12 . H4' parsed_2l7d 1 40 . . . . . . . . . . . . . . . . 1.121 0.121 2.121 . . . 5 . H1' . 5 . H8 parsed_2l7d 1 41 . . . . . . . . . . . . . . . . 2.24 1.240 3.240 . . . 7 . H1' . 7 . H6 parsed_2l7d 1 42 . . . . . . . . . . . . . . . . 1.928 0.928 2.928 . . . 8 . H1' . 8 . H6 parsed_2l7d 1 43 . . . . . . . . . . . . . . . . 1.241 0.241 2.241 . . . 10 . H1' . 10 . H8 parsed_2l7d 1 44 . . . . . . . . . . . . . . . . 1.946 0.946 2.946 . . . 11 . H1' . 11 . H6 parsed_2l7d 1 45 . . . . . . . . . . . . . . . . 1.116 0.116 2.116 . . . 12 . H1' . 12 . H8 parsed_2l7d 1 46 . . . . . . . . . . . . . . . . -3.981 -4.981 -2.981 . . . 8 . H6 . 9 . H5 parsed_2l7d 1 47 . . . . . . . . . . . . . . . . -6.457 -26.457 13.543 . . . 6 . H2' . 7 . H5# parsed_2l7d 1 48 . . . . . . . . . . . . . . . . -6.908 -26.908 13.092 . . . 7 . H2' . 8 . H5# parsed_2l7d 1 49 . . . . . . . . . . . . . . . . 3.981 -16.019 23.981 . . . 7 . H6 . 7 . H5# parsed_2l7d 1 50 . . . . . . . . . . . . . . . . 4.134 -15.866 24.134 . . . 8 . H6 . 8 . H5# parsed_2l7d 1 51 . . . . . . . . . . . . . . . . -5.228 -25.228 14.772 . . . 6 . H8 . 7 . H5# parsed_2l7d 1 52 . . . . . . . . . . . . . . . . -5.019 -25.019 14.981 . . . 7 . H6 . 8 . H5# parsed_2l7d 1 53 . . . . . . . . . . . . . . . . -2.202 -3.202 -1.202 . . . 1 . H1' . 2 . H8 parsed_2l7d 1 54 . . . . . . . . . . . . . . . . -4.073 -5.073 -3.073 . . . 2 . H1' . 3 . H6 parsed_2l7d 1 55 . . . . . . . . . . . . . . . . -3.136 -4.136 -2.136 . . . 7 . H1' . 8 . H6 parsed_2l7d 1 56 . . . . . . . . . . . . . . . . -3.171 -4.171 -2.171 . . . 8 . H1' . 9 . H6 parsed_2l7d 1 57 . . . . . . . . . . . . . . . . -3.908 -4.908 -2.908 . . . 10 . H1' . 11 . H6 parsed_2l7d 1 58 . . . . . . . . . . . . . . . . -2.149 -3.149 -1.149 . . . 11 . H1' . 12 . H8 parsed_2l7d 1 59 . . . . . . . . . . . . . . . . -2.132 -3.132 -1.132 . . . 13 . H1' . 13 . H2' parsed_2l7d 1 60 . . . . . . . . . . . . . . . . -2.542 -3.542 -1.542 . . . 15 . H1' . 15 . H2' parsed_2l7d 1 61 . . . . . . . . . . . . . . . . -0.051 -1.051 0.949 . . . 17 . H1' . 17 . H2' parsed_2l7d 1 62 . . . . . . . . . . . . . . . . 1.093 0.093 2.093 . . . 18 . H1' . 18 . H2' parsed_2l7d 1 63 . . . . . . . . . . . . . . . . -0.987 -1.987 0.013 . . . 19 . H1' . 19 . H2' parsed_2l7d 1 64 . . . . . . . . . . . . . . . . -0.756 -1.756 0.244 . . . 23 . H1' . 23 . H2' parsed_2l7d 1 65 . . . . . . . . . . . . . . . . -0.921 -1.921 0.079 . . . 24 . H1' . 24 . H2' parsed_2l7d 1 66 . . . . . . . . . . . . . . . . -8.169 -9.169 -7.169 . . . 13 . H1' . 13 . H2'' parsed_2l7d 1 67 . . . . . . . . . . . . . . . . -7.990 -8.990 -6.990 . . . 15 . H1' . 15 . H2'' parsed_2l7d 1 68 . . . . . . . . . . . . . . . . -2.586 -4.586 -0.586 . . . 17 . H1' . 17 . H2'' parsed_2l7d 1 69 . . . . . . . . . . . . . . . . -3.819 -5.819 -1.819 . . . 18 . H1' . 18 . H2'' parsed_2l7d 1 70 . . . . . . . . . . . . . . . . -4.536 -6.536 -2.536 . . . 21 . H1' . 21 . H2'' parsed_2l7d 1 71 . . . . . . . . . . . . . . . . -10.491 -11.491 -9.491 . . . 23 . H1' . 23 . H2'' parsed_2l7d 1 72 . . . . . . . . . . . . . . . . -10.724 -11.724 -9.724 . . . 24 . H1' . 24 . H2'' parsed_2l7d 1 73 . . . . . . . . . . . . . . . . 7.887 5.887 9.887 . . . 13 . H2' . 13 . H3' parsed_2l7d 1 74 . . . . . . . . . . . . . . . . 7.457 6.457 8.457 . . . 15 . H2' . 15 . H3' parsed_2l7d 1 75 . . . . . . . . . . . . . . . . 6.363 5.363 7.363 . . . 19 . H2' . 19 . H3' parsed_2l7d 1 76 . . . . . . . . . . . . . . . . 9.733 8.733 10.733 . . . 20 . H2' . 20 . H3' parsed_2l7d 1 77 . . . . . . . . . . . . . . . . 10.430 9.430 11.430 . . . 21 . H2' . 21 . H3' parsed_2l7d 1 78 . . . . . . . . . . . . . . . . 8.244 7.244 9.244 . . . 23 . H2' . 23 . H3' parsed_2l7d 1 79 . . . . . . . . . . . . . . . . 8.083 6.083 10.083 . . . 24 . H2' . 24 . H3' parsed_2l7d 1 80 . . . . . . . . . . . . . . . . 2.338 0.338 4.338 . . . 13 . H2'' . 13 . H3' parsed_2l7d 1 81 . . . . . . . . . . . . . . . . 0.655 -3.345 4.655 . . . 17 . H2'' . 17 . H3' parsed_2l7d 1 82 . . . . . . . . . . . . . . . . 4.402 3.402 5.402 . . . 23 . H2'' . 23 . H3' parsed_2l7d 1 83 . . . . . . . . . . . . . . . . 4.215 2.215 6.215 . . . 24 . H2'' . 24 . H3' parsed_2l7d 1 84 . . . . . . . . . . . . . . . . 5.958 4.958 6.958 . . . 13 . H2' . 13 . H2'' parsed_2l7d 1 85 . . . . . . . . . . . . . . . . 7.132 5.132 9.132 . . . 17 . H2' . 17 . H2'' parsed_2l7d 1 86 . . . . . . . . . . . . . . . . 3.055 2.055 4.055 . . . 20 . H2' . 20 . H2'' parsed_2l7d 1 87 . . . . . . . . . . . . . . . . -3.835 -4.835 -2.835 . . . 21 . H2' . 21 . H2'' parsed_2l7d 1 88 . . . . . . . . . . . . . . . . 7.027 6.027 8.027 . . . 23 . H2' . 23 . H2'' parsed_2l7d 1 89 . . . . . . . . . . . . . . . . 5.734 4.734 6.734 . . . 13 . H5 . 13 . H6 parsed_2l7d 1 90 . . . . . . . . . . . . . . . . 5.576 4.576 6.576 . . . 15 . H5 . 15 . H6 parsed_2l7d 1 91 . . . . . . . . . . . . . . . . 5.947 3.947 7.947 . . . 21 . H5 . 21 . H6 parsed_2l7d 1 92 . . . . . . . . . . . . . . . . 5.305 4.305 6.305 . . . 23 . H5 . 23 . H6 parsed_2l7d 1 93 . . . . . . . . . . . . . . . . 1.435 0.435 2.435 . . . 15 . H1' . 16 . H5' parsed_2l7d 1 94 . . . . . . . . . . . . . . . . 3.288 2.288 4.288 . . . 18 . H1' . 19 . H5' parsed_2l7d 1 95 . . . . . . . . . . . . . . . . 1.620 0.620 2.620 . . . 15 . H1' . 15 . H4' parsed_2l7d 1 96 . . . . . . . . . . . . . . . . 3.014 2.014 4.014 . . . 23 . H1' . 23 . H4' parsed_2l7d 1 97 . . . . . . . . . . . . . . . . 2.084 1.084 3.084 . . . 24 . H1' . 24 . H4' parsed_2l7d 1 98 . . . . . . . . . . . . . . . . 1.121 0.121 2.121 . . . 17 . H1' . 17 . H8 parsed_2l7d 1 99 . . . . . . . . . . . . . . . . 2.240 1.240 3.240 . . . 19 . H1' . 19 . H6 parsed_2l7d 1 100 . . . . . . . . . . . . . . . . 1.928 0.928 2.928 . . . 20 . H1' . 20 . H6 parsed_2l7d 1 101 . . . . . . . . . . . . . . . . 1.241 0.241 2.241 . . . 22 . H1' . 22 . H8 parsed_2l7d 1 102 . . . . . . . . . . . . . . . . 1.946 0.946 2.946 . . . 23 . H1' . 23 . H6 parsed_2l7d 1 103 . . . . . . . . . . . . . . . . 1.116 0.116 2.116 . . . 24 . H1' . 24 . H8 parsed_2l7d 1 104 . . . . . . . . . . . . . . . . -3.981 -4.981 -2.981 . . . 20 . H6 . 21 . H5 parsed_2l7d 1 105 . . . . . . . . . . . . . . . . -6.457 -26.457 13.543 . . . 18 . H2' . 19 . H5# parsed_2l7d 1 106 . . . . . . . . . . . . . . . . -6.908 -26.908 13.092 . . . 19 . H2' . 20 . H5# parsed_2l7d 1 107 . . . . . . . . . . . . . . . . 3.981 -16.019 23.981 . . . 19 . H6 . 19 . H5# parsed_2l7d 1 108 . . . . . . . . . . . . . . . . 4.134 -15.866 24.134 . . . 20 . H6 . 20 . H5# parsed_2l7d 1 109 . . . . . . . . . . . . . . . . -5.228 -25.228 14.772 . . . 18 . H8 . 19 . H5# parsed_2l7d 1 110 . . . . . . . . . . . . . . . . -5.019 -25.019 14.981 . . . 19 . H6 . 20 . H5# parsed_2l7d 1 111 . . . . . . . . . . . . . . . . -2.202 -3.202 -1.202 . . . 13 . H1' . 14 . H8 parsed_2l7d 1 112 . . . . . . . . . . . . . . . . -4.073 -5.073 -3.073 . . . 14 . H1' . 15 . H6 parsed_2l7d 1 113 . . . . . . . . . . . . . . . . -3.136 -4.136 -2.136 . . . 19 . H1' . 20 . H6 parsed_2l7d 1 114 . . . . . . . . . . . . . . . . -3.171 -4.171 -2.171 . . . 20 . H1' . 21 . H6 parsed_2l7d 1 115 . . . . . . . . . . . . . . . . -3.908 -4.908 -2.908 . . . 22 . H1' . 23 . H6 parsed_2l7d 1 116 . . . . . . . . . . . . . . . . -2.149 -3.149 -1.149 . . . 23 . H1' . 24 . H8 parsed_2l7d 1 117 . . . . . . . . . . . . . . . . 3.567 2.567 4.567 . . . 1 . H6 . 1 . H2' parsed_2l7d 1 118 . . . . . . . . . . . . . . . . 5.706 4.706 6.706 . . . 3 . H6 . 3 . H2' parsed_2l7d 1 119 . . . . . . . . . . . . . . . . 5.181 4.181 6.181 . . . 5 . H8 . 5 . H2' parsed_2l7d 1 120 . . . . . . . . . . . . . . . . 5.873 4.873 6.873 . . . 6 . H8 . 6 . H2' parsed_2l7d 1 121 . . . . . . . . . . . . . . . . 2.267 1.267 3.267 . . . 7 . H6 . 7 . H2' parsed_2l7d 1 122 . . . . . . . . . . . . . . . . -2.826 -3.826 -1.826 . . . 11 . H6 . 11 . H2' parsed_2l7d 1 123 . . . . . . . . . . . . . . . . 1.436 0.436 2.436 . . . 1 . H6 . 1 . H2'' parsed_2l7d 1 124 . . . . . . . . . . . . . . . . 1.764 0.764 2.764 . . . 5 . H8 . 5 . H2'' parsed_2l7d 1 125 . . . . . . . . . . . . . . . . 2.148 0.148 4.148 . . . 12 . H8 . 12 . H2'' parsed_2l7d 1 126 . . . . . . . . . . . . . . . . -3.250 -4.250 -2.250 . . . 1 . H2' . 2 . H8 parsed_2l7d 1 127 . . . . . . . . . . . . . . . . -3.159 -4.159 -2.159 . . . 3 . H2' . 4 . H8 parsed_2l7d 1 128 . . . . . . . . . . . . . . . . -2.557 -3.557 -1.557 . . . 4 . H2' . 5 . H8 parsed_2l7d 1 129 . . . . . . . . . . . . . . . . -4.389 -5.389 -3.389 . . . 7 . H2' . 8 . H6 parsed_2l7d 1 130 . . . . . . . . . . . . . . . . -4.591 -5.591 -3.591 . . . 9 . H2' . 10 . H8 parsed_2l7d 1 131 . . . . . . . . . . . . . . . . -3.062 -4.062 -2.062 . . . 11 . H2' . 12 . H8 parsed_2l7d 1 132 . . . . . . . . . . . . . . . . -3.001 -4.001 -2.001 . . . 1 . H2'' . 2 . H8 parsed_2l7d 1 133 . . . . . . . . . . . . . . . . -3.915 -4.915 -2.915 . . . 3 . H2'' . 4 . H8 parsed_2l7d 1 134 . . . . . . . . . . . . . . . . -5.364 -6.364 -4.364 . . . 5 . H2'' . 6 . H8 parsed_2l7d 1 135 . . . . . . . . . . . . . . . . -7.362 -8.362 -6.362 . . . 6 . H2'' . 7 . H6 parsed_2l7d 1 136 . . . . . . . . . . . . . . . . -10.900 -11.900 -9.900 . . . 7 . H2'' . 8 . H6 parsed_2l7d 1 137 . . . . . . . . . . . . . . . . -3.874 -4.874 -2.874 . . . 9 . H2'' . 10 . H8 parsed_2l7d 1 138 . . . . . . . . . . . . . . . . 3.567 2.567 4.567 . . . 13 . H6 . 13 . H2' parsed_2l7d 1 139 . . . . . . . . . . . . . . . . 5.706 4.706 6.706 . . . 15 . H6 . 15 . H2' parsed_2l7d 1 140 . . . . . . . . . . . . . . . . 5.181 4.181 6.181 . . . 17 . H8 . 17 . H2' parsed_2l7d 1 141 . . . . . . . . . . . . . . . . 5.873 4.873 6.873 . . . 18 . H8 . 18 . H2' parsed_2l7d 1 142 . . . . . . . . . . . . . . . . 2.267 1.267 3.267 . . . 19 . H6 . 19 . H2' parsed_2l7d 1 143 . . . . . . . . . . . . . . . . -2.826 -3.826 -1.826 . . . 23 . H6 . 23 . H2' parsed_2l7d 1 144 . . . . . . . . . . . . . . . . 1.436 0.436 2.436 . . . 13 . H6 . 13 . H2'' parsed_2l7d 1 145 . . . . . . . . . . . . . . . . 1.764 0.764 2.764 . . . 17 . H8 . 17 . H2'' parsed_2l7d 1 146 . . . . . . . . . . . . . . . . 2.148 0.148 4.148 . . . 24 . H8 . 24 . H2'' parsed_2l7d 1 147 . . . . . . . . . . . . . . . . -3.250 -4.250 -2.250 . . . 13 . H2' . 14 . H8 parsed_2l7d 1 148 . . . . . . . . . . . . . . . . -3.159 -4.159 -2.159 . . . 15 . H2' . 16 . H8 parsed_2l7d 1 149 . . . . . . . . . . . . . . . . -2.557 -3.557 -1.557 . . . 16 . H2' . 17 . H8 parsed_2l7d 1 150 . . . . . . . . . . . . . . . . -4.389 -5.389 -3.389 . . . 19 . H2' . 20 . H6 parsed_2l7d 1 151 . . . . . . . . . . . . . . . . -4.591 -5.591 -3.591 . . . 21 . H2' . 22 . H8 parsed_2l7d 1 152 . . . . . . . . . . . . . . . . -3.062 -4.062 -2.062 . . . 23 . H2' . 24 . H8 parsed_2l7d 1 153 . . . . . . . . . . . . . . . . -3.001 -4.001 -2.001 . . . 13 . H2'' . 14 . H8 parsed_2l7d 1 154 . . . . . . . . . . . . . . . . -3.915 -4.915 -2.915 . . . 15 . H2'' . 16 . H8 parsed_2l7d 1 155 . . . . . . . . . . . . . . . . -5.364 -6.364 -4.364 . . . 17 . H2'' . 18 . H8 parsed_2l7d 1 156 . . . . . . . . . . . . . . . . -7.362 -8.362 -6.362 . . . 18 . H2'' . 19 . H6 parsed_2l7d 1 157 . . . . . . . . . . . . . . . . -10.900 -11.900 -9.900 . . . 19 . H2'' . 20 . H6 parsed_2l7d 1 158 . . . . . . . . . . . . . . . . -3.874 -4.874 -2.874 . . . 21 . H2'' . 22 . H8 parsed_2l7d 1 stop_ loop_ _RDC_constraint_comment_org.ID _RDC_constraint_comment_org.Comment_text _RDC_constraint_comment_org.Comment_begin_line _RDC_constraint_comment_org.Comment_begin_column _RDC_constraint_comment_org.Comment_end_line _RDC_constraint_comment_org.Comment_end_column _RDC_constraint_comment_org.Entry_ID _RDC_constraint_comment_org.RDC_constraint_list_ID 1 ; #DATA SEQUENCE CGCrGAATTCG CGCGCrGAATT CGCG #VARS RESID_I RESNAME_I ATOMNAME_I RESID_J RESNAME_J ATOMNAME_J D DD W #FORMAT %5d %6s %6s %5d %6s %6s %9.3f %9.3f %.2f #H1'-H2' sign is confirmed ; 1 1 4 29 parsed_2l7d 1 2 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H2' ) -2.200 1.000 1.000 ; 12 1 17 56 parsed_2l7d 1 3 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H2' ) 0.500 1.000 1.000 ; 26 1 31 55 parsed_2l7d 1 4 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H2' ) 0.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 9 and name H2' ) -0.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H2' ) 2.400 1.000 1.000 ; 54 1 73 56 parsed_2l7d 1 5 "#H1'-H2'' sign is confirmed" 89 1 89 30 parsed_2l7d 1 6 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H2'' ) -9.600 1.000 1.000 ; 97 1 102 57 parsed_2l7d 1 7 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H2'' ) -4.700 2.000 2.000 ; 111 1 116 57 parsed_2l7d 1 8 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name H2'' ) -5.700 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H2'' ) -6.400 2.000 2.000 ; 132 1 144 57 parsed_2l7d 1 9 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H2'' ) -5.800 1.000 1.000 ; 153 1 158 58 parsed_2l7d 1 10 "#H2'-H3' close to H20 sign is confirmed" 174 1 174 42 parsed_2l7d 1 11 "# 2 GUA H2' 2 GUA H3' 6.400 2.000 1.00 #ov" 182 1 182 74 parsed_2l7d 1 12 ; # 4 GUA H2' 4 GUA H3' 5.600 2.000 1.00 #ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H2' ) ( resid 5 and name H3' ) 4.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 6 and name H3' ) 4.000 1.000 1.000 ; 190 1 203 55 parsed_2l7d 1 13 "# 10 GUA H2' 10 GUA H3' 9.500 2.000 1.00 #ov" 226 1 226 74 parsed_2l7d 1 14 "#H2''-H3' close to H20, sign is ok" 241 1 241 37 parsed_2l7d 1 15 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2'' ) ( resid 2 and name H3' ) 3.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H2'' ) ( resid 3 and name H3' ) 2.800 1.000 1.000 ; 249 1 261 55 parsed_2l7d 1 16 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2'' ) ( resid 6 and name H3' ) 0.000 4.000 4.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H2'' ) ( resid 7 and name H3' ) -1.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2'' ) ( resid 8 and name H3' ) 0.000 4.000 4.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H2'' ) ( resid 9 and name H3' ) 2.400 1.000 1.000 ; 270 1 296 55 parsed_2l7d 1 17 "#H2'-H2'', sign is comfirmed" 312 1 312 31 parsed_2l7d 1 18 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H2' ) ( resid 3 and name H2'' ) 7.200 1.000 1.000 ; 320 1 325 56 parsed_2l7d 1 19 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 6 and name H2'' ) 14.500 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H2' ) ( resid 7 and name H2'' ) 14.400 2.000 2.000 ; 334 1 346 57 parsed_2l7d 1 20 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 12 and name H2' ) ( resid 12 and name H2'' ) 8.500 1.000 1.000 #H5-H6, sign is affirmative ; 369 1 376 30 parsed_2l7d 1 21 ; #H1'(i)-H5'(i+1), perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 2 and name H5' ) 1.900 1.000 1.000 # 2 GUA H1' 3 CYT H5' 4.800 6.800 1.00 #ov ; 405 1 413 74 parsed_2l7d 1 22 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 5 and name H5' ) 3.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 6 and name H5' ) 3.500 1.000 1.000 ; 421 1 433 55 parsed_2l7d 1 23 ; # 7 THY H1' 8 THY H5' 4.800 6.800 1.00 #ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 9 and name H5' ) 1.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 10 and name H5' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 11 and name H5' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H1' ) ( resid 12 and name H5' ) 0.000 2.000 2.000 #H1'-H4', perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 1 and name H4' ) 1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H4' ) 0.000 2.000 2.000 ; 442 1 484 55 parsed_2l7d 1 24 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 5 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 9 and name H4' ) 2.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H4' ) 1.700 1.000 1.000 ; 493 1 540 56 parsed_2l7d 1 25 ; #H1'(i)-H6/8(i), perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 1 and name H6 ) 2.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H8 ) 1.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H1' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H8 ) 0.000 2.000 2.000 ; 556 1 583 54 parsed_2l7d 1 26 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name H8 ) 2.000 1.000 1.000 ; 592 1 597 54 parsed_2l7d 1 27 ; #H4'-H3', parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name H3' ) -7.900 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name H3' ) -4.400 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H4' ) ( resid 4 and name H3' ) -6.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H4' ) ( resid 5 and name H3' ) -6.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H4' ) ( resid 6 and name H3' ) -3.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H4' ) ( resid 7 and name H3' ) -4.500 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name H3' ) -3.200 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H4' ) ( resid 9 and name H3' ) -3.800 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H4' ) ( resid 10 and name H3' ) -2.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H4' ) ( resid 11 and name H3' ) -4.400 2.000 2.000 #H2 related, parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H2 ) ( resid 6 and name H2 ) -2.900 1.000 1.000 #H5 related, parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 3 and name H5 ) -2.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 3 and name H5 ) -1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 9 and name H5 ) 0.000 2.000 2.000 ; 634 1 733 54 parsed_2l7d 1 28 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 11 and name H5 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 11 and name H5 ) -2.800 1.000 1.000 #methyl related, methyls are splitted by different methyl H D. ; 742 1 756 66 parsed_2l7d 1 29 "#H1'(i)-H6/8(i+1), always very paralla to the axis" 799 1 799 53 parsed_2l7d 1 30 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H1' ) ( resid 4 and name H8 ) -2.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 5 and name H8 ) -5.000 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 6 and name H8 ) -5.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 7 and name H6 ) -4.900 1.000 1.000 ; 814 1 840 55 parsed_2l7d 1 31 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 10 and name H8 ) -3.500 1.000 1.000 ; 856 1 861 56 parsed_2l7d 1 32 ; #H5''-H3', parallal to the axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H5'' ) ( resid 2 and name H3' ) -7.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H5'' ) ( resid 4 and name H3' ) -9.300 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H5'' ) ( resid 5 and name H3' ) -8.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H5'' ) ( resid 6 and name H3' ) -8.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H5'' ) ( resid 8 and name H3' ) -10.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H5'' ) ( resid 10 and name H3' ) -9.500 1.000 1.000 #H5'-H3', parallal to the axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H5' ) ( resid 2 and name H3' ) -3.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H5' ) ( resid 4 and name H3' ) -3.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H5' ) ( resid 5 and name H3' ) -1.900 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H5' ) ( resid 6 and name H3' ) -4.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H5' ) ( resid 8 and name H3' ) -3.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H5' ) ( resid 10 and name H3' ) -2.200 1.000 1.000 #------------------------------------------------------------------ # 2nd strand #------------------------------------------------------------------ #H1'-H2' sign is confirmed ; 877 1 966 29 parsed_2l7d 1 33 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H2' ) -2.200 1.000 1.000 ; 974 1 979 56 parsed_2l7d 1 34 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H2' ) 0.500 1.000 1.000 ; 988 1 993 55 parsed_2l7d 1 35 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H2' ) 0.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 9 and name H2' ) -0.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H2' ) 2.400 1.000 1.000 ; 1016 1 1035 56 parsed_2l7d 1 36 "#H1'-H2'' sign is confirmed" 1051 1 1051 30 parsed_2l7d 1 37 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H2'' ) -9.600 1.000 1.000 ; 1059 1 1064 57 parsed_2l7d 1 38 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H2'' ) -4.700 2.000 2.000 ; 1073 1 1078 57 parsed_2l7d 1 39 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name H2'' ) -5.700 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H2'' ) -6.400 2.000 2.000 ; 1094 1 1106 57 parsed_2l7d 1 40 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H2'' ) -5.800 1.000 1.000 ; 1115 1 1120 58 parsed_2l7d 1 41 "#H2'-H3' close to H20 sign is confirmed" 1136 1 1136 42 parsed_2l7d 1 42 "# 2 GUA H2' 2 GUA H3' 6.400 2.000 1.00 #ov" 1144 1 1144 74 parsed_2l7d 1 43 ; # 4 GUA H2' 4 GUA H3' 5.600 2.000 1.00 #ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H2' ) ( resid 5 and name H3' ) 4.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 6 and name H3' ) 4.000 1.000 1.000 ; 1152 1 1165 55 parsed_2l7d 1 44 "# 10 GUA H2' 10 GUA H3' 9.500 2.000 1.00 #ov" 1188 1 1188 74 parsed_2l7d 1 45 "#H2''-H3' close to H20, sign is ok" 1203 1 1203 37 parsed_2l7d 1 46 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2'' ) ( resid 2 and name H3' ) 3.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H2'' ) ( resid 3 and name H3' ) 2.800 1.000 1.000 ; 1211 1 1223 55 parsed_2l7d 1 47 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2'' ) ( resid 6 and name H3' ) 0.000 4.000 4.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H2'' ) ( resid 7 and name H3' ) -1.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2'' ) ( resid 8 and name H3' ) 0.000 4.000 4.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H2'' ) ( resid 9 and name H3' ) 2.400 1.000 1.000 ; 1232 1 1258 55 parsed_2l7d 1 48 "#H2'-H2'', sign is comfirmed" 1274 1 1274 31 parsed_2l7d 1 49 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H2' ) ( resid 3 and name H2'' ) 7.200 1.000 1.000 ; 1282 1 1287 56 parsed_2l7d 1 50 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 6 and name H2'' ) 14.500 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H2' ) ( resid 7 and name H2'' ) 14.400 2.000 2.000 ; 1296 1 1308 57 parsed_2l7d 1 51 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 12 and name H2' ) ( resid 12 and name H2'' ) 8.500 1.000 1.000 #H5-H6, sign is affirmative ; 1331 1 1338 30 parsed_2l7d 1 52 ; #H1'(i)-H5'(i+1), perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 2 and name H5' ) 1.900 1.000 1.000 # 2 GUA H1' 3 CYT H5' 4.800 6.800 1.00 #ov ; 1367 1 1375 74 parsed_2l7d 1 53 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 5 and name H5' ) 3.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 6 and name H5' ) 3.500 1.000 1.000 ; 1383 1 1395 55 parsed_2l7d 1 54 ; # 7 THY H1' 8 THY H5' 4.800 6.800 1.00 #ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 9 and name H5' ) 1.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 10 and name H5' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 11 and name H5' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H1' ) ( resid 12 and name H5' ) 0.000 2.000 2.000 #H1'-H4', perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 1 and name H4' ) 1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H4' ) 0.000 2.000 2.000 ; 1404 1 1446 55 parsed_2l7d 1 55 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 5 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H4' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 9 and name H4' ) 2.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 10 and name H4' ) 1.700 1.000 1.000 ; 1455 1 1502 56 parsed_2l7d 1 56 ; #H1'(i)-H6/8(i), perpendicular to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 1 and name H1' ) ( resid 1 and name H6 ) 2.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H8 ) 1.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H1' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H8 ) 0.000 2.000 2.000 ; 1518 1 1545 54 parsed_2l7d 1 57 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name H8 ) 2.000 1.000 1.000 ; 1554 1 1559 54 parsed_2l7d 1 58 ; #H4'-H3', parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name H3' ) -7.900 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name H3' ) -4.400 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H4' ) ( resid 4 and name H3' ) -6.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H4' ) ( resid 5 and name H3' ) -6.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H4' ) ( resid 6 and name H3' ) -3.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 7 and name H4' ) ( resid 7 and name H3' ) -4.500 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name H3' ) -3.200 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H4' ) ( resid 9 and name H3' ) -3.800 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H4' ) ( resid 10 and name H3' ) -2.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H4' ) ( resid 11 and name H3' ) -4.400 2.000 2.000 #H2 related, parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H2 ) ( resid 6 and name H2 ) -2.900 1.000 1.000 #H5 related, parallal to the helical axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H1' ) ( resid 3 and name H5 ) -2.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 3 and name H5 ) -1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H1' ) ( resid 9 and name H5 ) 0.000 2.000 2.000 ; 1596 1 1695 54 parsed_2l7d 1 59 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H1' ) ( resid 11 and name H5 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 11 and name H5 ) -2.800 1.000 1.000 #methyl related, methyls are splitted by different methyl H D. ; 1704 1 1718 66 parsed_2l7d 1 60 "#H1'(i)-H6/8(i+1), always very paralla to the axis" 1761 1 1761 53 parsed_2l7d 1 61 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H1' ) ( resid 4 and name H8 ) -2.500 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H1' ) ( resid 5 and name H8 ) -5.000 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H1' ) ( resid 6 and name H8 ) -5.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H1' ) ( resid 7 and name H6 ) -4.900 1.000 1.000 ; 1776 1 1802 55 parsed_2l7d 1 62 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H1' ) ( resid 10 and name H8 ) -3.500 1.000 1.000 ; 1818 1 1823 56 parsed_2l7d 1 63 ; #H5''-H3', parallal to the axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H5'' ) ( resid 2 and name H3' ) -7.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H5'' ) ( resid 4 and name H3' ) -9.300 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H5'' ) ( resid 5 and name H3' ) -8.700 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H5'' ) ( resid 6 and name H3' ) -8.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H5'' ) ( resid 8 and name H3' ) -10.200 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H5'' ) ( resid 10 and name H3' ) -9.500 1.000 1.000 #H5'-H3', parallal to the axis assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H5' ) ( resid 2 and name H3' ) -3.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H5' ) ( resid 4 and name H3' ) -3.100 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 5 and name H5' ) ( resid 5 and name H3' ) -1.900 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H5' ) ( resid 6 and name H3' ) -4.400 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H5' ) ( resid 8 and name H3' ) -3.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H5' ) ( resid 10 and name H3' ) -2.200 1.000 1.000 #DATA SEQUENCE CGCrGAATTCG CGCGCrGAATT CGCG #VARS RESID_I RESNAME_I ATOMNAME_I RESID_J RESNAME_J ATOMNAME_J D DD W #FORMAT %5d %6s %6s %5d %6s %6s %9.3f %9.3f %.2f #------------------------------------------------------------------ # 1st strand #------------------------------------------------------------------ #not sure about the signs #H6/8-H2' ; 1839 1 1931 12 parsed_2l7d 1 64 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 2 and name H2' ) 7.500 1.000 1.000 ; 1939 1 1944 55 parsed_2l7d 1 65 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H8 ) ( resid 4 and name H2' ) 8.900 1.000 1.000 ; 1953 1 1958 55 parsed_2l7d 1 66 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H6 ) ( resid 8 and name H2' ) 2.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H6 ) ( resid 9 and name H2' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 10 and name H2' ) 0.000 2.000 2.000 ; 1981 1 2000 56 parsed_2l7d 1 67 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 12 and name H8 ) ( resid 12 and name H2' ) -3.300 1.000 1.000 #H6/8-H2'' ; 2009 1 2016 13 parsed_2l7d 1 68 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 2 and name H2'' ) 2.300 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H6 ) ( resid 3 and name H2'' ) 1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H8 ) ( resid 4 and name H2'' ) 2.700 1.000 1.000 ; 2024 1 2043 56 parsed_2l7d 1 69 ; # 5 ADE H8 5 ADE H2'' 0.000 8.700 1.00 #ov # 6 ADE H8 6 ADE H2'' 0.000 4.000 1.00 #p.ov # 7 THY H6 7 THY H2'' 0.000 5.600 1.00 #ov # 8 THY H6 8 THY H2'' 0.000 4.000 1.00 #p.ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H6 ) ( resid 9 and name H2'' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 10 and name H2'' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H6 ) ( resid 11 and name H2'' ) 0.000 2.000 2.000 ; 2053 1 2076 57 parsed_2l7d 1 70 "#H2'(i)-H6/8(i+1) SIGN??????????????" 2085 1 2085 39 parsed_2l7d 1 71 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 ; 2093 1 2098 54 parsed_2l7d 1 72 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 7 and name H6 ) -3.600 1.000 1.000 ; 2114 1 2119 55 parsed_2l7d 1 73 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2' ) ( resid 9 and name H6 ) -5.100 1.000 1.000 ; 2128 1 2133 55 parsed_2l7d 1 74 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H2' ) ( resid 11 and name H6 ) 0.000 2.000 2.000 ; 2142 1 2147 55 parsed_2l7d 1 75 "#H2''(i)-H6/8(i+1) SIGN??????????????" 2156 1 2156 40 parsed_2l7d 1 76 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2'' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 ; 2164 1 2169 54 parsed_2l7d 1 77 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H2'' ) ( resid 5 and name H8 ) -1.800 1.000 1.000 ; 2178 1 2183 55 parsed_2l7d 1 78 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2'' ) ( resid 9 and name H6 ) -7.268 1.000 1.000 ; 2206 1 2211 55 parsed_2l7d 1 79 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H2'' ) ( resid 11 and name H6 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H2'' ) ( resid 12 and name H8 ) -2.700 1.000 1.000 #------------------------------------------------------------------ # 2nd strand #------------------------------------------------------------------ #not sure about the signs #H6/8-H2' ; 2220 1 2238 12 parsed_2l7d 1 80 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 2 and name H2' ) 7.500 1.000 1.000 ; 2246 1 2251 55 parsed_2l7d 1 81 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H8 ) ( resid 4 and name H2' ) 8.900 1.000 1.000 ; 2260 1 2265 55 parsed_2l7d 1 82 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H6 ) ( resid 8 and name H2' ) 2.600 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H6 ) ( resid 9 and name H2' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 10 and name H2' ) 0.000 2.000 2.000 ; 2288 1 2307 56 parsed_2l7d 1 83 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 12 and name H8 ) ( resid 12 and name H2' ) -3.300 1.000 1.000 #H6/8-H2'' ; 2316 1 2323 13 parsed_2l7d 1 84 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H8 ) ( resid 2 and name H2'' ) 2.300 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 3 and name H6 ) ( resid 3 and name H2'' ) 1.800 1.000 1.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H8 ) ( resid 4 and name H2'' ) 2.700 1.000 1.000 ; 2331 1 2350 56 parsed_2l7d 1 85 ; # 5 ADE H8 5 ADE H2'' 0.000 8.700 1.00 #ov # 6 ADE H8 6 ADE H2'' 0.000 4.000 1.00 #p.ov # 7 THY H6 7 THY H2'' 0.000 5.600 1.00 #ov # 8 THY H6 8 THY H2'' 0.000 4.000 1.00 #p.ov assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 9 and name H6 ) ( resid 9 and name H2'' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H8 ) ( resid 10 and name H2'' ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H6 ) ( resid 11 and name H2'' ) 0.000 2.000 2.000 ; 2360 1 2383 57 parsed_2l7d 1 86 "#H2'(i)-H6/8(i+1) SIGN??????????????" 2392 1 2392 39 parsed_2l7d 1 87 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 ; 2400 1 2405 54 parsed_2l7d 1 88 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 6 and name H2' ) ( resid 7 and name H6 ) -3.600 1.000 1.000 ; 2421 1 2426 55 parsed_2l7d 1 89 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2' ) ( resid 9 and name H6 ) -5.100 1.000 1.000 ; 2435 1 2440 55 parsed_2l7d 1 90 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H2' ) ( resid 11 and name H6 ) 0.000 2.000 2.000 ; 2449 1 2454 55 parsed_2l7d 1 91 "#H2''(i)-H6/8(i+1) SIGN??????????????" 2463 1 2463 40 parsed_2l7d 1 92 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 2 and name H2'' ) ( resid 3 and name H6 ) 0.000 2.000 2.000 ; 2471 1 2476 54 parsed_2l7d 1 93 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 4 and name H2'' ) ( resid 5 and name H8 ) -1.800 1.000 1.000 ; 2485 1 2490 55 parsed_2l7d 1 94 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 8 and name H2'' ) ( resid 9 and name H6 ) -7.268 1.000 1.000 ; 2513 1 2518 55 parsed_2l7d 1 95 ; assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 10 and name H2'' ) ( resid 11 and name H6 ) 0.000 2.000 2.000 assign ( resid 501 and name OO ) ( resid 501 and name Z ) ( resid 501 and name X ) ( resid 501 and name Y ) ( resid 11 and name H2'' ) ( resid 12 and name H8 ) -2.700 1.000 1.000 ; 2527 1 2539 56 parsed_2l7d 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_7 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID parsed_2l7d _RDC_constraint_list.ID 2 _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 7 _RDC_constraint_list.Details "Generated by Wattos" loop_ _RDC_constraint.ID _RDC_constraint.Assembly_atom_ID_1 _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Seq_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Resonance_ID_1 _RDC_constraint.Assembly_atom_ID_2 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Seq_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.Resonance_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Source_experiment_ID _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 . . . . . . . . . . . . . . . . 1.60 1.5200 1.6800 . . . 1 . H3' . 2 . P parsed_2l7d 2 2 . . . . . . . . . . . . . . . . 1.39 1.3100 1.4700 . . . 2 . H3' . 3 . P parsed_2l7d 2 3 . . . . . . . . . . . . . . . . 2.07 1.9600 2.1800 . . . 3 . H3' . 4 . P parsed_2l7d 2 4 . . . . . . . . . . . . . . . . 1.02 0.9300 1.1100 . . . 4 . H3' . 5 . P parsed_2l7d 2 5 . . . . . . . . . . . . . . . . 1.83 1.7200 1.9400 . . . 5 . H3' . 6 . P parsed_2l7d 2 6 . . . . . . . . . . . . . . . . 1.17 1.0400 1.3000 . . . 6 . H3' . 7 . P parsed_2l7d 2 7 . . . . . . . . . . . . . . . . 0.52 0.3800 0.6600 . . . 7 . H3' . 8 . P parsed_2l7d 2 8 . . . . . . . . . . . . . . . . 0.16 0.0300 0.2900 . . . 8 . H3' . 9 . P parsed_2l7d 2 9 . . . . . . . . . . . . . . . . -0.12 -0.2400 0.0000 . . . 9 . H3' . 10 . P parsed_2l7d 2 10 . . . . . . . . . . . . . . . . 0.11 0.0200 0.2000 . . . 10 . H3' . 11 . P parsed_2l7d 2 11 . . . . . . . . . . . . . . . . 0.50 0.4100 0.5900 . . . 11 . H3' . 12 . P parsed_2l7d 2 12 . . . . . . . . . . . . . . . . 1.60 1.5200 1.6800 . . . 13 . H3' . 14 . P parsed_2l7d 2 13 . . . . . . . . . . . . . . . . 1.39 1.3100 1.4700 . . . 14 . H3' . 15 . P parsed_2l7d 2 14 . . . . . . . . . . . . . . . . 2.07 1.9600 2.1800 . . . 15 . H3' . 16 . P parsed_2l7d 2 15 . . . . . . . . . . . . . . . . 1.02 0.9300 1.1100 . . . 16 . H3' . 17 . P parsed_2l7d 2 16 . . . . . . . . . . . . . . . . 1.83 1.7200 1.9400 . . . 17 . H3' . 18 . P parsed_2l7d 2 17 . . . . . . . . . . . . . . . . 1.17 1.0400 1.3000 . . . 18 . H3' . 19 . P parsed_2l7d 2 18 . . . . . . . . . . . . . . . . 0.52 0.3800 0.6600 . . . 19 . H3' . 20 . P parsed_2l7d 2 19 . . . . . . . . . . . . . . . . 0.16 0.0300 0.2900 . . . 20 . H3' . 21 . P parsed_2l7d 2 20 . . . . . . . . . . . . . . . . -0.12 -0.2400 0.0000 . . . 21 . H3' . 22 . P parsed_2l7d 2 21 . . . . . . . . . . . . . . . . 0.11 0.0200 0.2000 . . . 22 . H3' . 23 . P parsed_2l7d 2 22 . . . . . . . . . . . . . . . . 0.50 0.4100 0.5900 . . . 23 . H3' . 24 . P parsed_2l7d 2 stop_ loop_ _RDC_constraint_comment_org.ID _RDC_constraint_comment_org.Comment_text _RDC_constraint_comment_org.Comment_begin_line _RDC_constraint_comment_org.Comment_begin_column _RDC_constraint_comment_org.Comment_end_line _RDC_constraint_comment_org.Comment_end_column _RDC_constraint_comment_org.Entry_ID _RDC_constraint_comment_org.RDC_constraint_list_ID 1 ; First strand H3'-P dipolar coupling ; 1 1 3 2 parsed_2l7d 2 2 ; Second strand H3'-P dipolar coupling ; 82 1 84 2 parsed_2l7d 2 stop_ save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 11:46:55 PM GMT (wattos1)