NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
545898 |
2lib   |
17887 | cing | 2-parsed | STAR | dihedral angle | 181 |
data_2lib_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lib
_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_2lib 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lib
_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 2lib "Master copy" parsed_2lib
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lib
_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 2lib.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lib 1
1 2lib.mr . . AMBER 2 "dihedral angle" "Not applicable" "Not applicable" 181 parsed_2lib 1
1 2lib.mr . . AMBER 3 distance NOE simple 0 parsed_2lib 1
1 2lib.mr . . AMBER 4 distance "hydrogen bond" simple 0 parsed_2lib 1
1 2lib.mr . . AMBER 5 distance NOE simple 0 parsed_2lib 1
1 2lib.mr . . AMBER 6 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2lib 1
1 2lib.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lib 1
stop_
save_
save_AMBER_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lib
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.8 -19.8 . 2lib_ambr001 1 GUA C4' 2lib_ambr001 1 GUA O4' 2lib_ambr001 1 GUA C1' 2lib_ambr001 1 GUA C2' parsed_2lib 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10.2 40.2 . 2lib_ambr001 1 GUA O4' 2lib_ambr001 1 GUA C1' 2lib_ambr001 1 GUA C2' 2lib_ambr001 1 GUA C3' parsed_2lib 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.1 11.9 . 2lib_ambr001 1 GUA C1' 2lib_ambr001 1 GUA C2' 2lib_ambr001 1 GUA C3' 2lib_ambr001 1 GUA C4' parsed_2lib 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.1 11.9 . 2lib_ambr001 1 GUA C2' 2lib_ambr001 1 GUA C3' 2lib_ambr001 1 GUA C4' 2lib_ambr001 1 GUA O4' parsed_2lib 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10.2 40.2 . 2lib_ambr001 1 GUA C3' 2lib_ambr001 1 GUA C4' 2lib_ambr001 1 GUA O4' 2lib_ambr001 1 GUA C1' parsed_2lib 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.5 -13.5 . 2lib_ambr001 2 THY C4' 2lib_ambr001 2 THY O4' 2lib_ambr001 2 THY C1' 2lib_ambr001 2 THY C2' parsed_2lib 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22.6 52.6 . 2lib_ambr001 2 THY O4' 2lib_ambr001 2 THY C1' 2lib_ambr001 2 THY C2' 2lib_ambr001 2 THY C3' parsed_2lib 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.9 -16.9 . 2lib_ambr001 2 THY C1' 2lib_ambr001 2 THY C2' 2lib_ambr001 2 THY C3' 2lib_ambr001 2 THY C4' parsed_2lib 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -0.7 29.3 . 2lib_ambr001 2 THY C2' 2lib_ambr001 2 THY C3' 2lib_ambr001 2 THY C4' 2lib_ambr001 2 THY O4' parsed_2lib 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -6.2 23.8 . 2lib_ambr001 2 THY C3' 2lib_ambr001 2 THY C4' 2lib_ambr001 2 THY O4' 2lib_ambr001 2 THY C1' parsed_2lib 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.8 -12.8 . 2lib_ambr001 3 CYT C4' 2lib_ambr001 3 CYT O4' 2lib_ambr001 3 CYT C1' 2lib_ambr001 3 CYT C2' parsed_2lib 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22.0 52.0 . 2lib_ambr001 3 CYT O4' 2lib_ambr001 3 CYT C1' 2lib_ambr001 3 CYT C2' 2lib_ambr001 3 CYT C3' parsed_2lib 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.1 -16.1 . 2lib_ambr001 3 CYT C1' 2lib_ambr001 3 CYT C2' 2lib_ambr001 3 CYT C3' 2lib_ambr001 3 CYT C4' parsed_2lib 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -1.0 29.0 . 2lib_ambr001 3 CYT C2' 2lib_ambr001 3 CYT C3' 2lib_ambr001 3 CYT C4' 2lib_ambr001 3 CYT O4' parsed_2lib 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -6.4 23.6 . 2lib_ambr001 3 CYT C3' 2lib_ambr001 3 CYT C4' 2lib_ambr001 3 CYT O4' 2lib_ambr001 3 CYT C1' parsed_2lib 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.6 -14.6 . 2lib_ambr001 4 CYT C4' 2lib_ambr001 4 CYT O4' 2lib_ambr001 4 CYT C1' 2lib_ambr001 4 CYT C2' parsed_2lib 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22.6 52.6 . 2lib_ambr001 4 CYT O4' 2lib_ambr001 4 CYT C1' 2lib_ambr001 4 CYT C2' 2lib_ambr001 4 CYT C3' parsed_2lib 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.6 -14.6 . 2lib_ambr001 4 CYT C1' 2lib_ambr001 4 CYT C2' 2lib_ambr001 4 CYT C3' 2lib_ambr001 4 CYT C4' parsed_2lib 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -3.7 26.3 . 2lib_ambr001 4 CYT C2' 2lib_ambr001 4 CYT C3' 2lib_ambr001 4 CYT C4' 2lib_ambr001 4 CYT O4' parsed_2lib 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -3.7 26.3 . 2lib_ambr001 4 CYT C3' 2lib_ambr001 4 CYT C4' 2lib_ambr001 4 CYT O4' 2lib_ambr001 4 CYT C1' parsed_2lib 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.4 -20.4 . 2lib_ambr001 6 GUA C4' 2lib_ambr001 6 GUA O4' 2lib_ambr001 6 GUA C1' 2lib_ambr001 6 GUA C2' parsed_2lib 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 9.9 39.9 . 2lib_ambr001 6 GUA O4' 2lib_ambr001 6 GUA C1' 2lib_ambr001 6 GUA C2' 2lib_ambr001 6 GUA C3' parsed_2lib 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -21.0 10.0 . 2lib_ambr001 6 GUA C1' 2lib_ambr001 6 GUA C2' 2lib_ambr001 6 GUA C3' 2lib_ambr001 6 GUA C4' parsed_2lib 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.0 -1.0 . 2lib_ambr001 6 GUA C2' 2lib_ambr001 6 GUA C3' 2lib_ambr001 6 GUA C4' 2lib_ambr001 6 GUA O4' parsed_2lib 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 16.3 46.3 . 2lib_ambr001 6 GUA C3' 2lib_ambr001 6 GUA C4' 2lib_ambr001 6 GUA O4' 2lib_ambr001 6 GUA C1' parsed_2lib 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.5 -13.5 . 2lib_ambr001 7 GUA C4' 2lib_ambr001 7 GUA O4' 2lib_ambr001 7 GUA C1' 2lib_ambr001 7 GUA C2' parsed_2lib 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21.8 51.8 . 2lib_ambr001 7 GUA O4' 2lib_ambr001 7 GUA C1' 2lib_ambr001 7 GUA C2' 2lib_ambr001 7 GUA C3' parsed_2lib 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.4 -13.4 . 2lib_ambr001 7 GUA C1' 2lib_ambr001 7 GUA C2' 2lib_ambr001 7 GUA C3' 2lib_ambr001 7 GUA C4' parsed_2lib 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.1 25.9 . 2lib_ambr001 7 GUA C2' 2lib_ambr001 7 GUA C3' 2lib_ambr001 7 GUA C4' 2lib_ambr001 7 GUA O4' parsed_2lib 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.1 25.9 . 2lib_ambr001 7 GUA C3' 2lib_ambr001 7 GUA C4' 2lib_ambr001 7 GUA O4' 2lib_ambr001 7 GUA C1' parsed_2lib 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -37.7 0.0 . 2lib_ambr001 8 ADE C4' 2lib_ambr001 8 ADE O4' 2lib_ambr001 8 ADE C1' 2lib_ambr001 8 ADE C2' parsed_2lib 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.6 45.6 . 2lib_ambr001 8 ADE O4' 2lib_ambr001 8 ADE C1' 2lib_ambr001 8 ADE C2' 2lib_ambr001 8 ADE C3' parsed_2lib 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.9 -13.9 . 2lib_ambr001 8 ADE C1' 2lib_ambr001 8 ADE C2' 2lib_ambr001 8 ADE C3' 2lib_ambr001 8 ADE C4' parsed_2lib 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.0 36.6 . 2lib_ambr001 8 ADE C2' 2lib_ambr001 8 ADE C3' 2lib_ambr001 8 ADE C4' 2lib_ambr001 8 ADE O4' parsed_2lib 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.6 25.8 . 2lib_ambr001 8 ADE C3' 2lib_ambr001 8 ADE C4' 2lib_ambr001 8 ADE O4' 2lib_ambr001 8 ADE C1' parsed_2lib 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.1 -18.1 . 2lib_ambr001 9 CYT C4' 2lib_ambr001 9 CYT O4' 2lib_ambr001 9 CYT C1' 2lib_ambr001 9 CYT C2' parsed_2lib 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19.8 49.8 . 2lib_ambr001 9 CYT O4' 2lib_ambr001 9 CYT C1' 2lib_ambr001 9 CYT C2' 2lib_ambr001 9 CYT C3' parsed_2lib 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -37.9 -7.9 . 2lib_ambr001 9 CYT C1' 2lib_ambr001 9 CYT C2' 2lib_ambr001 9 CYT C3' 2lib_ambr001 9 CYT C4' parsed_2lib 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.5 17.5 . 2lib_ambr001 9 CYT C2' 2lib_ambr001 9 CYT C3' 2lib_ambr001 9 CYT C4' 2lib_ambr001 9 CYT O4' parsed_2lib 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 3.9 33.9 . 2lib_ambr001 9 CYT C3' 2lib_ambr001 9 CYT C4' 2lib_ambr001 9 CYT O4' 2lib_ambr001 9 CYT C1' parsed_2lib 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.2 -15.2 . 2lib_ambr001 10 GUA C4' 2lib_ambr001 10 GUA O4' 2lib_ambr001 10 GUA C1' 2lib_ambr001 10 GUA C2' parsed_2lib 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22.6 52.6 . 2lib_ambr001 10 GUA O4' 2lib_ambr001 10 GUA C1' 2lib_ambr001 10 GUA C2' 2lib_ambr001 10 GUA C3' parsed_2lib 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.4 -14.4 . 2lib_ambr001 10 GUA C1' 2lib_ambr001 10 GUA C2' 2lib_ambr001 10 GUA C3' 2lib_ambr001 10 GUA C4' parsed_2lib 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.2 25.8 . 2lib_ambr001 10 GUA C2' 2lib_ambr001 10 GUA C3' 2lib_ambr001 10 GUA C4' 2lib_ambr001 10 GUA O4' parsed_2lib 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -3.0 27.0 . 2lib_ambr001 10 GUA C3' 2lib_ambr001 10 GUA C4' 2lib_ambr001 10 GUA O4' 2lib_ambr001 10 GUA C1' parsed_2lib 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.1 -11.1 . 2lib_ambr002 1 CYT C4' 2lib_ambr002 1 CYT O4' 2lib_ambr002 1 CYT C1' 2lib_ambr002 1 CYT C2' parsed_2lib 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.8 50.8 . 2lib_ambr002 1 CYT O4' 2lib_ambr002 1 CYT C1' 2lib_ambr002 1 CYT C2' 2lib_ambr002 1 CYT C3' parsed_2lib 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.7 -14.7 . 2lib_ambr002 1 CYT C1' 2lib_ambr002 1 CYT C2' 2lib_ambr002 1 CYT C3' 2lib_ambr002 1 CYT C4' parsed_2lib 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -2.0 29.1 . 2lib_ambr002 1 CYT C2' 2lib_ambr002 1 CYT C3' 2lib_ambr002 1 CYT C4' 2lib_ambr002 1 CYT O4' parsed_2lib 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.6 24.2 . 2lib_ambr002 1 CYT C3' 2lib_ambr002 1 CYT C4' 2lib_ambr002 1 CYT O4' 2lib_ambr002 1 CYT C1' parsed_2lib 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -9.1 . 2lib_ambr002 2 GUA C4' 2lib_ambr002 2 GUA O4' 2lib_ambr002 2 GUA C1' 2lib_ambr002 2 GUA C2' parsed_2lib 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19.8 49.8 . 2lib_ambr002 2 GUA O4' 2lib_ambr002 2 GUA C1' 2lib_ambr002 2 GUA C2' 2lib_ambr002 2 GUA C3' parsed_2lib 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.8 -15.8 . 2lib_ambr002 2 GUA C1' 2lib_ambr002 2 GUA C2' 2lib_ambr002 2 GUA C3' 2lib_ambr002 2 GUA C4' parsed_2lib 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.7 31.1 . 2lib_ambr002 2 GUA C2' 2lib_ambr002 2 GUA C3' 2lib_ambr002 2 GUA C4' 2lib_ambr002 2 GUA O4' parsed_2lib 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -11.8 22.1 . 2lib_ambr002 2 GUA C3' 2lib_ambr002 2 GUA C4' 2lib_ambr002 2 GUA O4' 2lib_ambr002 2 GUA C1' parsed_2lib 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27.2 12.5 . 2lib_ambr002 3 THY C4' 2lib_ambr002 3 THY O4' 2lib_ambr002 3 THY C1' 2lib_ambr002 3 THY C2' parsed_2lib 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 9.7 39.7 . 2lib_ambr002 3 THY O4' 2lib_ambr002 3 THY C1' 2lib_ambr002 3 THY C2' 2lib_ambr002 3 THY C3' parsed_2lib 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.6 -19.6 . 2lib_ambr002 3 THY C1' 2lib_ambr002 3 THY C2' 2lib_ambr002 3 THY C3' 2lib_ambr002 3 THY C4' parsed_2lib 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13.0 43.0 . 2lib_ambr002 3 THY C2' 2lib_ambr002 3 THY C3' 2lib_ambr002 3 THY C4' 2lib_ambr002 3 THY O4' parsed_2lib 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.5 6.0 . 2lib_ambr002 3 THY C3' 2lib_ambr002 3 THY C4' 2lib_ambr002 3 THY O4' 2lib_ambr002 3 THY C1' parsed_2lib 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -36.5 -6.5 . 2lib_ambr002 4 CYT C4' 2lib_ambr002 4 CYT O4' 2lib_ambr002 4 CYT C1' 2lib_ambr002 4 CYT C2' parsed_2lib 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.1 48.1 . 2lib_ambr002 4 CYT O4' 2lib_ambr002 4 CYT C1' 2lib_ambr002 4 CYT C2' 2lib_ambr002 4 CYT C3' parsed_2lib 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.8 -15.8 . 2lib_ambr002 4 CYT C1' 2lib_ambr002 4 CYT C2' 2lib_ambr002 4 CYT C3' 2lib_ambr002 4 CYT C4' parsed_2lib 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.7 34.0 . 2lib_ambr002 4 CYT C2' 2lib_ambr002 4 CYT C3' 2lib_ambr002 4 CYT C4' 2lib_ambr002 4 CYT O4' parsed_2lib 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -16.8 22.1 . 2lib_ambr002 4 CYT C3' 2lib_ambr002 4 CYT C4' 2lib_ambr002 4 CYT O4' 2lib_ambr002 4 CYT C1' parsed_2lib 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.7 -14.7 . 2lib_ambr002 5 CYT C4' 2lib_ambr002 5 CYT O4' 2lib_ambr002 5 CYT C1' 2lib_ambr002 5 CYT C2' parsed_2lib 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.2 50.2 . 2lib_ambr002 5 CYT O4' 2lib_ambr002 5 CYT C1' 2lib_ambr002 5 CYT C2' 2lib_ambr002 5 CYT C3' parsed_2lib 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.2 -10.2 . 2lib_ambr002 5 CYT C1' 2lib_ambr002 5 CYT C2' 2lib_ambr002 5 CYT C3' 2lib_ambr002 5 CYT C4' parsed_2lib 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10.6 24.2 . 2lib_ambr002 5 CYT C2' 2lib_ambr002 5 CYT C3' 2lib_ambr002 5 CYT C4' 2lib_ambr002 5 CYT O4' parsed_2lib 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -1.9 30.3 . 2lib_ambr002 5 CYT C3' 2lib_ambr002 5 CYT C4' 2lib_ambr002 5 CYT O4' 2lib_ambr002 5 CYT C1' parsed_2lib 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.2 -10.2 . 2lib_ambr002 6 THY C4' 2lib_ambr002 6 THY O4' 2lib_ambr002 6 THY C1' 2lib_ambr002 6 THY C2' parsed_2lib 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19.2 49.2 . 2lib_ambr002 6 THY O4' 2lib_ambr002 6 THY C1' 2lib_ambr002 6 THY C2' 2lib_ambr002 6 THY C3' parsed_2lib 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.2 -9.2 . 2lib_ambr002 6 THY C1' 2lib_ambr002 6 THY C2' 2lib_ambr002 6 THY C3' 2lib_ambr002 6 THY C4' parsed_2lib 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -13.8 31.1 . 2lib_ambr002 6 THY C2' 2lib_ambr002 6 THY C3' 2lib_ambr002 6 THY C4' 2lib_ambr002 6 THY O4' parsed_2lib 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -11.8 32.3 . 2lib_ambr002 6 THY C3' 2lib_ambr002 6 THY C4' 2lib_ambr002 6 THY O4' 2lib_ambr002 6 THY C1' parsed_2lib 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.5 -5.5 . 2lib_ambr002 7 GUA C4' 2lib_ambr002 7 GUA O4' 2lib_ambr002 7 GUA C1' 2lib_ambr002 7 GUA C2' parsed_2lib 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19.8 49.8 . 2lib_ambr002 7 GUA O4' 2lib_ambr002 7 GUA C1' 2lib_ambr002 7 GUA C2' 2lib_ambr002 7 GUA C3' parsed_2lib 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.8 -20.8 . 2lib_ambr002 7 GUA C1' 2lib_ambr002 7 GUA C2' 2lib_ambr002 7 GUA C3' 2lib_ambr002 7 GUA C4' parsed_2lib 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 8.1 38.1 . 2lib_ambr002 7 GUA C2' 2lib_ambr002 7 GUA C3' 2lib_ambr002 7 GUA C4' 2lib_ambr002 7 GUA O4' parsed_2lib 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -16.6 13.4 . 2lib_ambr002 7 GUA C3' 2lib_ambr002 7 GUA C4' 2lib_ambr002 7 GUA O4' 2lib_ambr002 7 GUA C1' parsed_2lib 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.0 -12.0 . 2lib_ambr002 8 GUA C4' 2lib_ambr002 8 GUA O4' 2lib_ambr002 8 GUA C1' 2lib_ambr002 8 GUA C2' parsed_2lib 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21.3 51.3 . 2lib_ambr002 8 GUA O4' 2lib_ambr002 8 GUA C1' 2lib_ambr002 8 GUA C2' 2lib_ambr002 8 GUA C3' parsed_2lib 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.5 -14.5 . 2lib_ambr002 8 GUA C1' 2lib_ambr002 8 GUA C2' 2lib_ambr002 8 GUA C3' 2lib_ambr002 8 GUA C4' parsed_2lib 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -2.2 27.8 . 2lib_ambr002 8 GUA C2' 2lib_ambr002 8 GUA C3' 2lib_ambr002 8 GUA C4' 2lib_ambr002 8 GUA O4' parsed_2lib 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -6.6 24.2 . 2lib_ambr002 8 GUA C3' 2lib_ambr002 8 GUA C4' 2lib_ambr002 8 GUA O4' 2lib_ambr002 8 GUA C1' parsed_2lib 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.2 -10.2 . 2lib_ambr002 9 ADE C4' 2lib_ambr002 9 ADE O4' 2lib_ambr002 9 ADE C1' 2lib_ambr002 9 ADE C2' parsed_2lib 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19.8 49.8 . 2lib_ambr002 9 ADE O4' 2lib_ambr002 9 ADE C1' 2lib_ambr002 9 ADE C2' 2lib_ambr002 9 ADE C3' parsed_2lib 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.8 -10.8 . 2lib_ambr002 9 ADE C1' 2lib_ambr002 9 ADE C2' 2lib_ambr002 9 ADE C3' 2lib_ambr002 9 ADE C4' parsed_2lib 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10.6 31.1 . 2lib_ambr002 9 ADE C2' 2lib_ambr002 9 ADE C3' 2lib_ambr002 9 ADE C4' 2lib_ambr002 9 ADE O4' parsed_2lib 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -11.8 30.3 . 2lib_ambr002 9 ADE C3' 2lib_ambr002 9 ADE C4' 2lib_ambr002 9 ADE O4' 2lib_ambr002 9 ADE C1' parsed_2lib 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.9 -17.9 . 2lib_ambr002 10 CYT C4' 2lib_ambr002 10 CYT O4' 2lib_ambr002 10 CYT C1' 2lib_ambr002 10 CYT C2' parsed_2lib 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.8 45.8 . 2lib_ambr002 10 CYT O4' 2lib_ambr002 10 CYT C1' 2lib_ambr002 10 CYT C2' 2lib_ambr002 10 CYT C3' parsed_2lib 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -34.3 -0.7 . 2lib_ambr002 10 CYT C1' 2lib_ambr002 10 CYT C2' 2lib_ambr002 10 CYT C3' 2lib_ambr002 10 CYT C4' parsed_2lib 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.1 17.5 . 2lib_ambr002 10 CYT C2' 2lib_ambr002 10 CYT C3' 2lib_ambr002 10 CYT C4' 2lib_ambr002 10 CYT O4' parsed_2lib 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6.1 36.4 . 2lib_ambr002 10 CYT C3' 2lib_ambr002 10 CYT C4' 2lib_ambr002 10 CYT O4' 2lib_ambr002 10 CYT C1' parsed_2lib 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 174.0 214.0 . 2lib_ambr001 1 GUA C4' 2lib_ambr001 1 GUA C3' 2lib_ambr001 1 GUA O3' 2lib_ambr001 2 THY P parsed_2lib 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 178.0 198.0 . 2lib_ambr001 2 THY C4' 2lib_ambr001 2 THY C3' 2lib_ambr001 2 THY O3' 2lib_ambr001 3 CYT P parsed_2lib 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 172.0 212.0 . 2lib_ambr001 3 CYT C4' 2lib_ambr001 3 CYT C3' 2lib_ambr001 3 CYT O3' 2lib_ambr001 4 CYT P parsed_2lib 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 169.0 194.0 . 2lib_ambr001 4 CYT C4' 2lib_ambr001 4 CYT C3' 2lib_ambr001 4 CYT O3' 2lib_ambr001 5 ADE P parsed_2lib 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 194.0 218.0 . 2lib_ambr001 5 ADE C4' 2lib_ambr001 5 ADE C3' 2lib_ambr001 5 ADE O3' 2lib_ambr001 6 GUA P parsed_2lib 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 177.0 197.0 . 2lib_ambr001 6 GUA C4' 2lib_ambr001 6 GUA C3' 2lib_ambr001 6 GUA O3' 2lib_ambr001 7 GUA P parsed_2lib 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 181.0 201.0 . 2lib_ambr001 7 GUA C4' 2lib_ambr001 7 GUA C3' 2lib_ambr001 7 GUA O3' 2lib_ambr001 8 ADE P parsed_2lib 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 179.0 199.0 . 2lib_ambr001 8 ADE C4' 2lib_ambr001 8 ADE C3' 2lib_ambr001 8 ADE O3' 2lib_ambr001 9 CYT P parsed_2lib 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 182.0 206.0 . 2lib_ambr001 9 CYT C4' 2lib_ambr001 9 CYT C3' 2lib_ambr001 9 CYT O3' 2lib_ambr001 10 GUA P parsed_2lib 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 183.0 213.0 . 2lib_ambr002 1 CYT C4' 2lib_ambr002 1 CYT C3' 2lib_ambr002 1 CYT O3' 2lib_ambr002 2 GUA P parsed_2lib 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 176.0 196.0 . 2lib_ambr002 2 GUA C4' 2lib_ambr002 2 GUA C3' 2lib_ambr002 2 GUA O3' 2lib_ambr002 3 THY P parsed_2lib 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 174.0 194.0 . 2lib_ambr002 3 THY C4' 2lib_ambr002 3 THY C3' 2lib_ambr002 3 THY O3' 2lib_ambr002 4 CYT P parsed_2lib 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 184.0 204.0 . 2lib_ambr002 4 CYT C4' 2lib_ambr002 4 CYT C3' 2lib_ambr002 4 CYT O3' 2lib_ambr002 5 CYT P parsed_2lib 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 157.0 207.0 . 2lib_ambr002 5 CYT C4' 2lib_ambr002 5 CYT C3' 2lib_ambr002 5 CYT O3' 2lib_ambr002 6 THY P parsed_2lib 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 166.0 216.0 . 2lib_ambr002 6 THY C4' 2lib_ambr002 6 THY C3' 2lib_ambr002 6 THY O3' 2lib_ambr002 7 GUA P parsed_2lib 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 200.0 . 2lib_ambr002 7 GUA C4' 2lib_ambr002 7 GUA C3' 2lib_ambr002 7 GUA O3' 2lib_ambr002 8 GUA P parsed_2lib 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 179.0 203.0 . 2lib_ambr002 8 GUA C4' 2lib_ambr002 8 GUA C3' 2lib_ambr002 8 GUA O3' 2lib_ambr002 9 ADE P parsed_2lib 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 181.0 201.0 . 2lib_ambr002 9 ADE C4' 2lib_ambr002 9 ADE C3' 2lib_ambr002 9 ADE O3' 2lib_ambr002 10 CYT P parsed_2lib 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 1 GUA C3' 2lib_ambr001 1 GUA O3' 2lib_ambr001 2 THY P 2lib_ambr001 2 THY O5' parsed_2lib 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 2 THY C3' 2lib_ambr001 2 THY O3' 2lib_ambr001 3 CYT P 2lib_ambr001 3 CYT O5' parsed_2lib 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 3 CYT C3' 2lib_ambr001 3 CYT O3' 2lib_ambr001 4 CYT P 2lib_ambr001 4 CYT O5' parsed_2lib 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 6 GUA C3' 2lib_ambr001 6 GUA O3' 2lib_ambr001 7 GUA P 2lib_ambr001 7 GUA O5' parsed_2lib 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 7 GUA C3' 2lib_ambr001 7 GUA O3' 2lib_ambr001 8 ADE P 2lib_ambr001 8 ADE O5' parsed_2lib 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 8 ADE C3' 2lib_ambr001 8 ADE O3' 2lib_ambr001 9 CYT P 2lib_ambr001 9 CYT O5' parsed_2lib 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr001 9 CYT C3' 2lib_ambr001 9 CYT O3' 2lib_ambr001 10 GUA P 2lib_ambr001 10 GUA O5' parsed_2lib 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 1 CYT C3' 2lib_ambr002 1 CYT O3' 2lib_ambr002 2 GUA P 2lib_ambr002 2 GUA O5' parsed_2lib 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 2 GUA C3' 2lib_ambr002 2 GUA O3' 2lib_ambr002 3 THY P 2lib_ambr002 3 THY O5' parsed_2lib 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 3 THY C3' 2lib_ambr002 3 THY O3' 2lib_ambr002 4 CYT P 2lib_ambr002 4 CYT O5' parsed_2lib 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 4 CYT C3' 2lib_ambr002 4 CYT O3' 2lib_ambr002 5 CYT P 2lib_ambr002 5 CYT O5' parsed_2lib 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 5 CYT C3' 2lib_ambr002 5 CYT O3' 2lib_ambr002 6 THY P 2lib_ambr002 6 THY O5' parsed_2lib 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 6 THY C3' 2lib_ambr002 6 THY O3' 2lib_ambr002 7 GUA P 2lib_ambr002 7 GUA O5' parsed_2lib 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 7 GUA C3' 2lib_ambr002 7 GUA O3' 2lib_ambr002 8 GUA P 2lib_ambr002 8 GUA O5' parsed_2lib 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 8 GUA C3' 2lib_ambr002 8 GUA O3' 2lib_ambr002 9 ADE P 2lib_ambr002 9 ADE O5' parsed_2lib 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 315.0 . 2lib_ambr002 9 ADE C3' 2lib_ambr002 9 ADE O3' 2lib_ambr002 10 CYT P 2lib_ambr002 10 CYT O5' parsed_2lib 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 1 GUA O3' 2lib_ambr001 2 THY P 2lib_ambr001 2 THY O5' 2lib_ambr001 2 THY C5' parsed_2lib 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 2 THY O3' 2lib_ambr001 3 CYT P 2lib_ambr001 3 CYT O5' 2lib_ambr001 3 CYT C5' parsed_2lib 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 5 ADE O3' 2lib_ambr001 6 GUA P 2lib_ambr001 6 GUA O5' 2lib_ambr001 6 GUA C5' parsed_2lib 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 6 GUA O3' 2lib_ambr001 7 GUA P 2lib_ambr001 7 GUA O5' 2lib_ambr001 7 GUA C5' parsed_2lib 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 7 GUA O3' 2lib_ambr001 8 ADE P 2lib_ambr001 8 ADE O5' 2lib_ambr001 8 ADE C5' parsed_2lib 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 8 ADE O3' 2lib_ambr001 9 CYT P 2lib_ambr001 9 CYT O5' 2lib_ambr001 9 CYT C5' parsed_2lib 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr001 9 CYT O3' 2lib_ambr001 10 GUA P 2lib_ambr001 10 GUA O5' 2lib_ambr001 10 GUA C5' parsed_2lib 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 1 CYT O3' 2lib_ambr002 2 GUA P 2lib_ambr002 2 GUA O5' 2lib_ambr002 2 GUA C5' parsed_2lib 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 2 GUA O3' 2lib_ambr002 3 THY P 2lib_ambr002 3 THY O5' 2lib_ambr002 3 THY C5' parsed_2lib 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 3 THY O3' 2lib_ambr002 4 CYT P 2lib_ambr002 4 CYT O5' 2lib_ambr002 4 CYT C5' parsed_2lib 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 4 CYT O3' 2lib_ambr002 5 CYT P 2lib_ambr002 5 CYT O5' 2lib_ambr002 5 CYT C5' parsed_2lib 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 5 CYT O3' 2lib_ambr002 6 THY P 2lib_ambr002 6 THY O5' 2lib_ambr002 6 THY C5' parsed_2lib 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 6 THY O3' 2lib_ambr002 7 GUA P 2lib_ambr002 7 GUA O5' 2lib_ambr002 7 GUA C5' parsed_2lib 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 7 GUA O3' 2lib_ambr002 8 GUA P 2lib_ambr002 8 GUA O5' 2lib_ambr002 8 GUA C5' parsed_2lib 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 8 GUA O3' 2lib_ambr002 9 ADE P 2lib_ambr002 9 ADE O5' 2lib_ambr002 9 ADE C5' parsed_2lib 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . 2lib_ambr002 9 ADE O3' 2lib_ambr002 10 CYT P 2lib_ambr002 10 CYT O5' 2lib_ambr002 10 CYT C5' parsed_2lib 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 2 THY P 2lib_ambr001 2 THY O5' 2lib_ambr001 2 THY C5' 2lib_ambr001 2 THY C4' parsed_2lib 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 3 CYT P 2lib_ambr001 3 CYT O5' 2lib_ambr001 3 CYT C5' 2lib_ambr001 3 CYT C4' parsed_2lib 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 4 CYT P 2lib_ambr001 4 CYT O5' 2lib_ambr001 4 CYT C5' 2lib_ambr001 4 CYT C4' parsed_2lib 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 6 GUA P 2lib_ambr001 6 GUA O5' 2lib_ambr001 6 GUA C5' 2lib_ambr001 6 GUA C4' parsed_2lib 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 7 GUA P 2lib_ambr001 7 GUA O5' 2lib_ambr001 7 GUA C5' 2lib_ambr001 7 GUA C4' parsed_2lib 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 8 ADE P 2lib_ambr001 8 ADE O5' 2lib_ambr001 8 ADE C5' 2lib_ambr001 8 ADE C4' parsed_2lib 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 9 CYT P 2lib_ambr001 9 CYT O5' 2lib_ambr001 9 CYT C5' 2lib_ambr001 9 CYT C4' parsed_2lib 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr001 10 GUA P 2lib_ambr001 10 GUA O5' 2lib_ambr001 10 GUA C5' 2lib_ambr001 10 GUA C4' parsed_2lib 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 2 GUA P 2lib_ambr002 2 GUA O5' 2lib_ambr002 2 GUA C5' 2lib_ambr002 2 GUA C4' parsed_2lib 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 3 THY P 2lib_ambr002 3 THY O5' 2lib_ambr002 3 THY C5' 2lib_ambr002 3 THY C4' parsed_2lib 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 4 CYT P 2lib_ambr002 4 CYT O5' 2lib_ambr002 4 CYT C5' 2lib_ambr002 4 CYT C4' parsed_2lib 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 5 CYT P 2lib_ambr002 5 CYT O5' 2lib_ambr002 5 CYT C5' 2lib_ambr002 5 CYT C4' parsed_2lib 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 6 THY P 2lib_ambr002 6 THY O5' 2lib_ambr002 6 THY C5' 2lib_ambr002 6 THY C4' parsed_2lib 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 7 GUA P 2lib_ambr002 7 GUA O5' 2lib_ambr002 7 GUA C5' 2lib_ambr002 7 GUA C4' parsed_2lib 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 8 GUA P 2lib_ambr002 8 GUA O5' 2lib_ambr002 8 GUA C5' 2lib_ambr002 8 GUA C4' parsed_2lib 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 9 ADE P 2lib_ambr002 9 ADE O5' 2lib_ambr002 9 ADE C5' 2lib_ambr002 9 ADE C4' parsed_2lib 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 215.0 . 2lib_ambr002 10 CYT P 2lib_ambr002 10 CYT O5' 2lib_ambr002 10 CYT C5' 2lib_ambr002 10 CYT C4' parsed_2lib 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 1 GUA O5' 2lib_ambr001 1 GUA C5' 2lib_ambr001 1 GUA C4' 2lib_ambr001 1 GUA C3' parsed_2lib 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 2 THY O5' 2lib_ambr001 2 THY C5' 2lib_ambr001 2 THY C4' 2lib_ambr001 2 THY C3' parsed_2lib 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 3 CYT O5' 2lib_ambr001 3 CYT C5' 2lib_ambr001 3 CYT C4' 2lib_ambr001 3 CYT C3' parsed_2lib 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 4 CYT O5' 2lib_ambr001 4 CYT C5' 2lib_ambr001 4 CYT C4' 2lib_ambr001 4 CYT C3' parsed_2lib 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 6 GUA O5' 2lib_ambr001 6 GUA C5' 2lib_ambr001 6 GUA C4' 2lib_ambr001 6 GUA C3' parsed_2lib 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 7 GUA O5' 2lib_ambr001 7 GUA C5' 2lib_ambr001 7 GUA C4' 2lib_ambr001 7 GUA C3' parsed_2lib 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 8 ADE O5' 2lib_ambr001 8 ADE C5' 2lib_ambr001 8 ADE C4' 2lib_ambr001 8 ADE C3' parsed_2lib 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 9 CYT O5' 2lib_ambr001 9 CYT C5' 2lib_ambr001 9 CYT C4' 2lib_ambr001 9 CYT C3' parsed_2lib 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr001 10 GUA O5' 2lib_ambr001 10 GUA C5' 2lib_ambr001 10 GUA C4' 2lib_ambr001 10 GUA C3' parsed_2lib 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 1 CYT O5' 2lib_ambr002 1 CYT C5' 2lib_ambr002 1 CYT C4' 2lib_ambr002 1 CYT C3' parsed_2lib 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 2 GUA O5' 2lib_ambr002 2 GUA C5' 2lib_ambr002 2 GUA C4' 2lib_ambr002 2 GUA C3' parsed_2lib 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 3 THY O5' 2lib_ambr002 3 THY C5' 2lib_ambr002 3 THY C4' 2lib_ambr002 3 THY C3' parsed_2lib 1
175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 4 CYT O5' 2lib_ambr002 4 CYT C5' 2lib_ambr002 4 CYT C4' 2lib_ambr002 4 CYT C3' parsed_2lib 1
176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 5 CYT O5' 2lib_ambr002 5 CYT C5' 2lib_ambr002 5 CYT C4' 2lib_ambr002 5 CYT C3' parsed_2lib 1
177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 6 THY O5' 2lib_ambr002 6 THY C5' 2lib_ambr002 6 THY C4' 2lib_ambr002 6 THY C3' parsed_2lib 1
178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 7 GUA O5' 2lib_ambr002 7 GUA C5' 2lib_ambr002 7 GUA C4' 2lib_ambr002 7 GUA C3' parsed_2lib 1
179 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 8 GUA O5' 2lib_ambr002 8 GUA C5' 2lib_ambr002 8 GUA C4' 2lib_ambr002 8 GUA C3' parsed_2lib 1
180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 9 ADE O5' 2lib_ambr002 9 ADE C5' 2lib_ambr002 9 ADE C4' 2lib_ambr002 9 ADE C3' parsed_2lib 1
181 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 2lib_ambr002 10 CYT O5' 2lib_ambr002 10 CYT C5' 2lib_ambr002 10 CYT C4' 2lib_ambr002 10 CYT C3' parsed_2lib 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 "G-C Base pair angle restraints" 1 1 1 33 parsed_2lib 1
2 "A-T Base Pair angle restraints" 73 1 73 32 parsed_2lib 1
3 ================================================================= 88 1 88 67 parsed_2lib 1
4 "1 GUA NU0: (1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2') -49.8 -19.8" 91 1 91 74 parsed_2lib 1
5 "1 GUA NU1: (1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3') 10.2 40.2" 96 1 96 74 parsed_2lib 1
6 "1 GUA NU2: (1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4') -31.1 11.9" 101 1 101 74 parsed_2lib 1
7 "1 GUA NU3: (1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4') -31.1 11.9" 106 1 106 74 parsed_2lib 1
8 "1 GUA NU4: (1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1') 10.2 40.2" 111 1 111 74 parsed_2lib 1
9 "2 THY NU0: (2 DT C4')-(2 DT O4')-(2 DT C1')-(2 DT C2') -43.5 -13.5" 116 1 116 70 parsed_2lib 1
10 "2 THY NU1: (2 DT O4')-(2 DT C1')-(2 DT C2')-(2 DT C3') 22.6 52.6" 121 1 121 70 parsed_2lib 1
11 "2 THY NU2: (2 DT C1')-(2 DT C2')-(2 DT C3')-(2 DT C4') -46.9 -16.9" 126 1 126 70 parsed_2lib 1
12 "2 THY NU3: (2 DT C2')-(2 DT C3')-(2 DT C4')-(2 DT O4') -0.7 29.3" 131 1 131 70 parsed_2lib 1
13 "2 THY NU4: (2 DT C3')-(2 DT C4')-(2 DT O4')-(2 DT C1') -6.2 23.8" 136 1 136 70 parsed_2lib 1
14 "3 CYT NU0: (3 DC C4')-(3 DC O4')-(3 DC C1')-(3 DC C2') -42.8 -12.8" 141 1 141 70 parsed_2lib 1
15 "3 CYT NU1: (3 DC O4')-(3 DC C1')-(3 DC C2')-(3 DC C3') 22.0 52.0" 146 1 146 70 parsed_2lib 1
16 "3 CYT NU2: (3 DC C1')-(3 DC C2')-(3 DC C3')-(3 DC C4') -46.1 -16.1" 151 1 151 70 parsed_2lib 1
17 "3 CYT NU3: (3 DC C2')-(3 DC C3')-(3 DC C4')-(3 DC O4') -1.0 29.0" 156 1 156 70 parsed_2lib 1
18 "3 CYT NU4: (3 DC C3')-(3 DC C4')-(3 DC O4')-(3 DC C1') -6.4 23.6" 161 1 161 70 parsed_2lib 1
19 "4 CYT NU0: (4 DC C4')-(4 DC O4')-(4 DC C1')-(4 DC C2') -44.6 -14.6" 166 1 166 70 parsed_2lib 1
20 "4 CYT NU1: (4 DC O4')-(4 DC C1')-(4 DC C2')-(4 DC C3') 22.6 52.6" 171 1 171 70 parsed_2lib 1
21 "4 CYT NU2: (4 DC C1')-(4 DC C2')-(4 DC C3')-(4 DC C4') -44.6 -14.6" 176 1 176 70 parsed_2lib 1
22 "4 CYT NU3: (4 DC C2')-(4 DC C3')-(4 DC C4')-(4 DC O4') -3.7 26.3" 181 1 181 70 parsed_2lib 1
23 "4 CYT NU4: (4 DC C3')-(4 DC C4')-(4 DC O4')-(4 DC C1') -3.7 26.3" 186 1 186 70 parsed_2lib 1
24 "6 GUA NU0: (6 DG C4')-(6 DG O4')-(6 DG C1')-(6 DG C2') -50.4 -20.4" 191 1 191 70 parsed_2lib 1
25 "6 GUA NU1: (6 DG O4')-(6 DG C1')-(6 DG C2')-(6 DG C3') 9.9 39.9" 196 1 196 70 parsed_2lib 1
26 "6 GUA NU2: (6 DG C1')-(6 DG C2')-(6 DG C3')-(6 DG C4') -21.0 10.0" 201 1 201 70 parsed_2lib 1
27 "6 GUA NU3: (6 DG C2')-(6 DG C3')-(6 DG C4')-(6 DG O4') -31.0 -1.0" 206 1 206 70 parsed_2lib 1
28 "6 GUA NU4: (6 DG C3')-(6 DG C4')-(6 DG O4')-(6 DG C1') 16.3 46.3" 211 1 211 70 parsed_2lib 1
29 "7 GUA NU0: (7 DG C4')-(7 DG O4')-(7 DG C1')-(7 DG C2') -43.5 -13.5" 216 1 216 70 parsed_2lib 1
30 "7 GUA NU1: (7 DG O4')-(7 DG C1')-(7 DG C2')-(7 DG C3') 21.8 51.8" 221 1 221 70 parsed_2lib 1
31 "7 GUA NU2: (7 DG C1')-(7 DG C2')-(7 DG C3')-(7 DG C4') -43.4 -13.4" 226 1 226 70 parsed_2lib 1
32 "7 GUA NU3: (7 DG C2')-(7 DG C3')-(7 DG C4')-(7 DG O4') -4.1 25.9" 231 1 231 70 parsed_2lib 1
33 "7 GUA NU4: (7 DG C3')-(7 DG C4')-(7 DG O4')-(7 DG C1') -4.1 25.9" 236 1 236 70 parsed_2lib 1
34 "8 ADE NU0: (8 DA C4')-(8 DA O4')-(8 DA C1')-(8 DA C2') -37.7 0.0" 241 1 241 70 parsed_2lib 1
35 "8 ADE NU1: (8 DA O4')-(8 DA C1')-(8 DA C2')-(8 DA C3') 15.6 45.6" 246 1 246 70 parsed_2lib 1
36 "8 ADE NU2: (8 DA C1')-(8 DA C2')-(8 DA C3')-(8 DA C4') -43.9 -13.9" 251 1 251 70 parsed_2lib 1
37 "8 ADE NU3: (8 DA C2')-(8 DA C3')-(8 DA C4')-(8 DA O4') -4.0 36.6" 256 1 256 70 parsed_2lib 1
38 "8 ADE NU4: (8 DA C3')-(8 DA C4')-(8 DA O4')-(8 DA C1') -22.6 25.8" 261 1 261 70 parsed_2lib 1
39 "9 CYT NU0: (9 DC C4')-(9 DC O4')-(9 DC C1')-(9 DC C2') -48.1 -18.1" 266 1 266 70 parsed_2lib 1
40 "9 CYT NU1: (9 DC O4')-(9 DC C1')-(9 DC C2')-(9 DC C3') 19.8 49.8" 271 1 271 70 parsed_2lib 1
41 "9 CYT NU2: (9 DC C1')-(9 DC C2')-(9 DC C3')-(9 DC C4') -37.9 -7.9" 276 1 276 70 parsed_2lib 1
42 "9 CYT NU3: (9 DC C2')-(9 DC C3')-(9 DC C4')-(9 DC O4') -12.5 17.5" 281 1 281 70 parsed_2lib 1
43 "9 CYT NU4: (9 DC C3')-(9 DC C4')-(9 DC O4')-(9 DC C1') 3.9 33.9" 286 1 286 70 parsed_2lib 1
44 "10 GUA NU0: (10 DG3 C4')-(10 DG3 O4')-(10 DG3 C1')-(10 DG3 C2') -45.2 -15.2" 291 1 291 79 parsed_2lib 1
45 "10 GUA NU1: (10 DG3 O4')-(10 DG3 C1')-(10 DG3 C2')-(10 DG3 C3') 22.6 52.6" 296 1 296 79 parsed_2lib 1
46 "10 GUA NU2: (10 DG3 C1')-(10 DG3 C2')-(10 DG3 C3')-(10 DG3 C4') -44.4 -14.4" 301 1 301 79 parsed_2lib 1
47 "10 GUA NU3: (10 DG3 C2')-(10 DG3 C3')-(10 DG3 C4')-(10 DG3 O4') -4.2 25.8" 306 1 306 79 parsed_2lib 1
48 "10 GUA NU4: (10 DG3 C3')-(10 DG3 C4')-(10 DG3 O4')-(10 DG3 C1') -3.0 27.0" 311 1 311 79 parsed_2lib 1
49 "11 CYT NU0: (11 DC5 C4')-(11 DC5 O4')-(11 DC5 C1')-(11 DC5 C2') -41.1 -11.1" 316 1 316 79 parsed_2lib 1
50 "11 CYT NU1: (11 DC5 O4')-(11 DC5 C1')-(11 DC5 C2')-(11 DC5 C3') 20.8 50.8" 321 1 321 79 parsed_2lib 1
51 "11 CYT NU2: (11 DC5 C1')-(11 DC5 C2')-(11 DC5 C3')-(11 DC5 C4') -44.7 -14.7" 326 1 326 79 parsed_2lib 1
52 "11 CYT NU3: (11 DC5 C2')-(11 DC5 C3')-(11 DC5 C4')-(11 DC5 O4') -2.0 29.1" 331 1 331 79 parsed_2lib 1
53 "11 CYT NU4: (11 DC5 C3')-(11 DC5 C4')-(11 DC5 O4')-(11 DC5 C1') -8.6 24.2" 336 1 336 79 parsed_2lib 1
54 "12 GUA NU0: (12 DG C4')-(12 DG O4')-(12 DG C1')-(12 DG C2') -39.1 -9.1" 341 1 341 75 parsed_2lib 1
55 "12 GUA NU1: (12 DG O4')-(12 DG C1')-(12 DG C2')-(12 DG C3') 19.8 49.8" 346 1 346 75 parsed_2lib 1
56 "12 GUA NU2: (12 DG C1')-(12 DG C2')-(12 DG C3')-(12 DG C4') -45.8 -15.8" 351 1 351 75 parsed_2lib 1
57 "12 GUA NU3: (12 DG C2')-(12 DG C3')-(12 DG C4')-(12 DG O4') 0.7 31.1" 356 1 356 75 parsed_2lib 1
58 "12 GUA NU4: (12 DG C3')-(12 DG C4')-(12 DG O4')-(12 DG C1') -11.8 22.1" 361 1 361 75 parsed_2lib 1
59 "13 THY NU0: (13 DT C4')-(13 DT O4')-(13 DT C1')-(13 DT C2') -27.2 12.5" 366 1 366 75 parsed_2lib 1
60 "13 THY NU1: (13 DT O4')-(13 DT C1')-(13 DT C2')-(13 DT C3') 9.7 39.7" 371 1 371 75 parsed_2lib 1
61 "13 THY NU2: (13 DT C1')-(13 DT C2')-(13 DT C3')-(13 DT C4') -49.6 -19.6" 376 1 376 75 parsed_2lib 1
62 "13 THY NU3: (13 DT C2')-(13 DT C3')-(13 DT C4')-(13 DT O4') 13.0 43.0" 381 1 381 75 parsed_2lib 1
63 "13 THY NU4: (13 DT C3')-(13 DT C4')-(13 DT O4')-(13 DT C1') -31.5 6.0" 386 1 386 75 parsed_2lib 1
64 "14 CYT NU0: (14 DC C4')-(14 DC O4')-(14 DC C1')-(14 DC C2') -36.5 -6.5" 391 1 391 75 parsed_2lib 1
65 "14 CYT NU1: (14 DC O4')-(14 DC C1')-(14 DC C2')-(14 DC C3') 18.1 48.1" 396 1 396 75 parsed_2lib 1
66 "14 CYT NU2: (14 DC C1')-(14 DC C2')-(14 DC C3')-(14 DC C4') -45.8 -15.8" 401 1 401 75 parsed_2lib 1
67 "14 CYT NU3: (14 DC C2')-(14 DC C3')-(14 DC C4')-(14 DC O4') 0.7 34.0" 406 1 406 75 parsed_2lib 1
68 "14 CYT NU4: (14 DC C3')-(14 DC C4')-(14 DC O4')-(14 DC C1') -16.8 22.1" 411 1 411 75 parsed_2lib 1
69 "15 CYT NU0: (15 DC C4')-(15 DC O4')-(15 DC C1')-(15 DC C2') -44.7 -14.7" 416 1 416 75 parsed_2lib 1
70 "15 CYT NU1: (15 DC O4')-(15 DC C1')-(15 DC C2')-(15 DC C3') 20.2 50.2" 421 1 421 75 parsed_2lib 1
71 "15 CYT NU2: (15 DC C1')-(15 DC C2')-(15 DC C3')-(15 DC C4') -40.2 -10.2" 426 1 426 75 parsed_2lib 1
72 "15 CYT NU3: (15 DC C2')-(15 DC C3')-(15 DC C4')-(15 DC O4') -10.6 24.2" 431 1 431 75 parsed_2lib 1
73 "15 CYT NU4: (15 DC C3')-(15 DC C4')-(15 DC O4')-(15 DC C1') -1.9 30.3" 436 1 436 75 parsed_2lib 1
74 "16 THY NU0: (16 DT C4')-(16 DT O4')-(16 DT C1')-(16 DT C2') -40.2 -10.2" 441 1 441 75 parsed_2lib 1
75 "16 THY NU1: (16 DT O4')-(16 DT C1')-(16 DT C2')-(16 DT C3') 19.2 49.2" 446 1 446 75 parsed_2lib 1
76 "16 THY NU2: (16 DT C1')-(16 DT C2')-(16 DT C3')-(16 DT C4') -39.2 -9.2" 451 1 451 75 parsed_2lib 1
77 "16 THY NU3: (16 DT C2')-(16 DT C3')-(16 DT C4')-(16 DT O4') -13.8 31.1" 456 1 456 75 parsed_2lib 1
78 "16 THY NU4: (16 DT C3')-(16 DT C4')-(16 DT O4')-(16 DT C1') -11.8 32.3" 461 1 461 75 parsed_2lib 1
79 "17 GUA NU0: (17 DG C4')-(17 DG O4')-(17 DG C1')-(17 DG C2') -35.5 -5.5" 466 1 466 75 parsed_2lib 1
80 "17 GUA NU1: (17 DG O4')-(17 DG C1')-(17 DG C2')-(17 DG C3') 19.8 49.8" 471 1 471 75 parsed_2lib 1
81 "17 GUA NU2: (17 DG C1')-(17 DG C2')-(17 DG C3')-(17 DG C4') -50.8 -20.8" 476 1 476 75 parsed_2lib 1
82 "17 GUA NU3: (17 DG C2')-(17 DG C3')-(17 DG C4')-(17 DG O4') 8.1 38.1" 481 1 481 75 parsed_2lib 1
83 "17 GUA NU4: (17 DG C3')-(17 DG C4')-(17 DG O4')-(17 DG C1') -16.6 13.4" 486 1 486 75 parsed_2lib 1
84 "18 GUA NU0: (18 DG C4')-(18 DG O4')-(18 DG C1')-(18 DG C2') -42.0 -12.0" 491 1 491 75 parsed_2lib 1
85 "18 GUA NU1: (18 DG O4')-(18 DG C1')-(18 DG C2')-(18 DG C3') 21.3 51.3" 496 1 496 75 parsed_2lib 1
86 "18 GUA NU2: (18 DG C1')-(18 DG C2')-(18 DG C3')-(18 DG C4') -44.5 -14.5" 501 1 501 75 parsed_2lib 1
87 "18 GUA NU3: (18 DG C2')-(18 DG C3')-(18 DG C4')-(18 DG O4') -2.2 27.8" 506 1 506 75 parsed_2lib 1
88 "18 GUA NU4: (18 DG C3')-(18 DG C4')-(18 DG O4')-(18 DG C1') -6.6 24.2" 511 1 511 75 parsed_2lib 1
89 "19 ADE NU0: (19 DA C4')-(19 DA O4')-(19 DA C1')-(19 DA C2') -40.2 -10.2" 516 1 516 75 parsed_2lib 1
90 "19 ADE NU1: (19 DA O4')-(19 DA C1')-(19 DA C2')-(19 DA C3') 19.8 49.8" 521 1 521 75 parsed_2lib 1
91 "19 ADE NU2: (19 DA C1')-(19 DA C2')-(19 DA C3')-(19 DA C4') -40.8 -10.8" 526 1 526 75 parsed_2lib 1
92 "19 ADE NU3: (19 DA C2')-(19 DA C3')-(19 DA C4')-(19 DA O4') -10.6 31.1" 531 1 531 75 parsed_2lib 1
93 "19 ADE NU4: (19 DA C3')-(19 DA C4')-(19 DA O4')-(19 DA C1') -11.8 30.3" 536 1 536 75 parsed_2lib 1
94 "20 CYT NU0: (20 DC3 C4')-(20 DC3 O4')-(20 DC3 C1')-(20 DC3 C2') -47.9 -17.9" 541 1 541 79 parsed_2lib 1
95 "20 CYT NU1: (20 DC3 O4')-(20 DC3 C1')-(20 DC3 C2')-(20 DC3 C3') 15.8 45.8" 546 1 546 79 parsed_2lib 1
96 "20 CYT NU2: (20 DC3 C1')-(20 DC3 C2')-(20 DC3 C3')-(20 DC3 C4') -34.3 -0.7" 551 1 551 79 parsed_2lib 1
97 "20 CYT NU3: (20 DC3 C2')-(20 DC3 C3')-(20 DC3 C4')-(20 DC3 O4') -22.1 17.5" 556 1 556 79 parsed_2lib 1
98 "20 CYT NU4: (20 DC3 C3')-(20 DC3 C4')-(20 DC3 O4')-(20 DC3 C1') 6.1 36.4" 561 1 561 79 parsed_2lib 1
99
;
==================================================================================
631 atoms read from pdb file CaAG.pdb.
no rsts: az C4, abgz A5, a G6
1 GUA EPSILN: (1 DG5 C4')-(1 DG5 C3')-(1 DG5 O3')-(2 DT P) 174.0 214.0
;
565 1 569 74 parsed_2lib 1
100 "2 THY EPSILN: (2 DT C4')-(2 DT C3')-(2 DT O3')-(3 DC P) 178.0 198.0" 574 1 574 71 parsed_2lib 1
101 "3 CYT EPSILN: (3 DC C4')-(3 DC C3')-(3 DC O3')-(4 DC P) 172.0 212.0" 579 1 579 71 parsed_2lib 1
102 "4 CYT EPSILN: (4 DC C4')-(4 DC C3')-(4 DC O3')-(5 DA P) 169.0 194.0" 584 1 584 71 parsed_2lib 1
103 "5 ADE EPSILN: (5 DA C4')-(5 DA C3')-(5 DA O3')-(6 DG P) 194.0 218.0" 589 1 589 71 parsed_2lib 1
104 "6 GUA EPSILN: (6 DG C4')-(6 DG C3')-(6 DG O3')-(7 DG P) 177.0 197.0" 594 1 594 71 parsed_2lib 1
105 "7 GUA EPSILN: (7 DG C4')-(7 DG C3')-(7 DG O3')-(8 DA P) 181.0 201.0" 599 1 599 71 parsed_2lib 1
106 "8 ADE EPSILN: (8 DA C4')-(8 DA C3')-(8 DA O3')-(9 DC P) 179.0 199.0" 604 1 604 71 parsed_2lib 1
107 "9 CYT EPSILN: (9 DC C4')-(9 DC C3')-(9 DC O3')-(10 DG3 P) 182.0 206.0" 609 1 609 73 parsed_2lib 1
108 "11 CYT EPSILN: (11 DC5 C4')-(11 DC5 C3')-(11 DC5 O3')-(12 DG P) 183.0 213.0" 614 1 614 79 parsed_2lib 1
109 "12 GUA EPSILN: (12 DG C4')-(12 DG C3')-(12 DG O3')-(13 DT P) 176.0 196.0" 619 1 619 76 parsed_2lib 1
110 "13 THY EPSILN: (13 DT C4')-(13 DT C3')-(13 DT O3')-(14 DC P) 174.0 194.0" 624 1 624 76 parsed_2lib 1
111 "14 CYT EPSILN: (14 DC C4')-(14 DC C3')-(14 DC O3')-(15 DC P) 184.0 204.0" 629 1 629 76 parsed_2lib 1
112 "15 CYT EPSILN: (15 DC C4')-(15 DC C3')-(15 DC O3')-(16 DT P) 157.0 207.0" 634 1 634 76 parsed_2lib 1
113 "16 THY EPSILN: (16 DT C4')-(16 DT C3')-(16 DT O3')-(17 DG P) 166.0 216.0" 639 1 639 76 parsed_2lib 1
114 "17 GUA EPSILN: (17 DG C4')-(17 DG C3')-(17 DG O3')-(18 DG P) 180.0 200.0" 644 1 644 76 parsed_2lib 1
115 "18 GUA EPSILN: (18 DG C4')-(18 DG C3')-(18 DG O3')-(19 DA P) 179.0 203.0" 649 1 649 76 parsed_2lib 1
116 "19 ADE EPSILN: (19 DA C4')-(19 DA C3')-(19 DA O3')-(20 DC3 P) 181.0 201.0" 654 1 654 77 parsed_2lib 1
117 "1 GUA ZETA: (1 DG5 C3')-(1 DG5 O3')-(2 DT P)-(2 DT O5') 150.0 315.0" 659 1 659 71 parsed_2lib 1
118 "2 THY ZETA: (2 DT C3')-(2 DT O3')-(3 DC P)-(3 DC O5') 150.0 315.0" 664 1 664 69 parsed_2lib 1
119 "3 CYT ZETA: (3 DC C3')-(3 DC O3')-(4 DC P)-(4 DC O5') 150.0 315.0" 669 1 669 69 parsed_2lib 1
120
;
======================================================================
4 CYT ZETA: (4 DC C3')-(4 DC O3')-(5 DA P)-(5 DA O5') 150.0 315.0
&rst iat = 118, 123, 124, 127,
r1 = 130.0, r2 = 150.0, r3 = 315.0, r4 = 335.0,
rk2 = 50.0, rk3 = 50.0, &end
=======================================================================
6 GUA ZETA: (6 DG C3')-(6 DG O3')-(7 DG P)-(7 DG O5') 150.0 315.0
;
673 1 680 69 parsed_2lib 1
121 "7 GUA ZETA: (7 DG C3')-(7 DG O3')-(8 DA P)-(8 DA O5') 150.0 315.0" 685 1 685 69 parsed_2lib 1
122 "8 ADE ZETA: (8 DA C3')-(8 DA O3')-(9 DC P)-(9 DC O5') 150.0 315.0" 690 1 690 69 parsed_2lib 1
123 "9 CYT ZETA: (9 DC C3')-(9 DC O3')-(10 DG3 P)-(10 DG3 O5') 150.0 315.0" 695 1 695 73 parsed_2lib 1
124 "11 CYT ZETA: (11 DC5 C3')-(11 DC5 O3')-(12 DG P)-(12 DG O5') 150.0 315.0" 700 1 700 76 parsed_2lib 1
125 "12 GUA ZETA: (12 DG C3')-(12 DG O3')-(13 DT P)-(13 DT O5') 150.0 315.0" 705 1 705 74 parsed_2lib 1
126 "13 THY ZETA: (13 DT C3')-(13 DT O3')-(14 DC P)-(14 DC O5') 150.0 315.0" 710 1 710 74 parsed_2lib 1
127 "14 CYT ZETA: (14 DC C3')-(14 DC O3')-(15 DC P)-(15 DC O5') 150.0 315.0" 715 1 715 74 parsed_2lib 1
128 "15 CYT ZETA: (15 DC C3')-(15 DC O3')-(16 DT P)-(16 DT O5') 150.0 315.0" 720 1 720 74 parsed_2lib 1
129 "16 THY ZETA: (16 DT C3')-(16 DT O3')-(17 DG P)-(17 DG O5') 150.0 315.0" 725 1 725 74 parsed_2lib 1
130 "17 GUA ZETA: (17 DG C3')-(17 DG O3')-(18 DG P)-(18 DG O5') 150.0 315.0" 730 1 730 74 parsed_2lib 1
131 "18 GUA ZETA: (18 DG C3')-(18 DG O3')-(19 DA P)-(19 DA O5') 150.0 315.0" 735 1 735 74 parsed_2lib 1
132 "19 ADE ZETA: (19 DA C3')-(19 DA O3')-(20 DC3 P)-(20 DC3 O5') 150.0 315.0" 740 1 740 76 parsed_2lib 1
133 "2 THY ALPHA: (1 DG5 O3')-(2 DT P)-(2 DT O5')-(2 DT C5') 270.0 330.0" 745 1 745 71 parsed_2lib 1
134 "3 CYT ALPHA: (2 DT O3')-(3 DC P)-(3 DC O5')-(3 DC C5') 270.0 330.0" 750 1 750 70 parsed_2lib 1
135
;
====================================================================
4 CYT ALPHA: (3 DC O3')-(4 DC P)-(4 DC O5')-(4 DC C5') 270.0 330.0
&rst iat = 93, 94, 97, 98,
r1 = 250.1, r2 = 270.0, r3 = 330.0, r4 = 350.1,
rk2 = 50.0, rk3 = 50.0, &end
=====================================================================
6 GUA ALPHA: (5 DA O3')-(6 DG P)-(6 DG O5')-(6 DG C5') 270.0 330.0
;
754 1 761 70 parsed_2lib 1
136 "7 GUA ALPHA: (6 DG O3')-(7 DG P)-(7 DG O5')-(7 DG C5') 270.0 330.0" 766 1 766 70 parsed_2lib 1
137 "8 ADE ALPHA: (7 DG O3')-(8 DA P)-(8 DA O5')-(8 DA C5') 270.0 330.0" 771 1 771 70 parsed_2lib 1
138 "9 CYT ALPHA: (8 DA O3')-(9 DC P)-(9 DC O5')-(9 DC C5') 270.0 330.0" 776 1 776 70 parsed_2lib 1
139 "10 GUA ALPHA: (9 DC O3')-(10 DG3 P)-(10 DG3 O5')-(10 DG3 C5') 270.0 330.0" 781 1 781 77 parsed_2lib 1
140 "12 GUA ALPHA: (11 DC5 O3')-(12 DG P)-(12 DG O5')-(12 DG C5') 270.0 330.0" 786 1 786 76 parsed_2lib 1
141 "13 THY ALPHA: (12 DG O3')-(13 DT P)-(13 DT O5')-(13 DT C5') 270.0 330.0" 791 1 791 75 parsed_2lib 1
142 "14 CYT ALPHA: (13 DT O3')-(14 DC P)-(14 DC O5')-(14 DC C5') 270.0 330.0" 796 1 796 75 parsed_2lib 1
143 "15 CYT ALPHA: (14 DC O3')-(15 DC P)-(15 DC O5')-(15 DC C5') 270.0 330.0" 801 1 801 75 parsed_2lib 1
144 "16 THY ALPHA: (15 DC O3')-(16 DT P)-(16 DT O5')-(16 DT C5') 270.0 330.0" 806 1 806 75 parsed_2lib 1
145 "17 GUA ALPHA: (16 DT O3')-(17 DG P)-(17 DG O5')-(17 DG C5') 270.0 330.0" 811 1 811 75 parsed_2lib 1
146 "18 GUA ALPHA: (17 DG O3')-(18 DG P)-(18 DG O5')-(18 DG C5') 270.0 330.0" 816 1 816 75 parsed_2lib 1
147 "19 ADE ALPHA: (18 DG O3')-(19 DA P)-(19 DA O5')-(19 DA C5') 270.0 330.0" 821 1 821 75 parsed_2lib 1
148 "20 CYT ALPHA: (19 DA O3')-(20 DC3 P)-(20 DC3 O5')-(20 DC3 C5') 270.0 330.0" 826 1 826 78 parsed_2lib 1
149 "2 THY BETA: (2 DT P)-(2 DT O5')-(2 DT C5')-(2 DT C4') 135.0 215.0" 832 1 832 69 parsed_2lib 1
150 "3 CYT BETA: (3 DC P)-(3 DC O5')-(3 DC C5')-(3 DC C4') 135.0 215.0" 837 1 837 69 parsed_2lib 1
151 "4 CYT BETA: (4 DC P)-(4 DC O5')-(4 DC C5')-(4 DC C4') 135.0 215.0" 842 1 842 69 parsed_2lib 1
152 "6 GUA BETA: (6 DG P)-(6 DG O5')-(6 DG C5')-(6 DG C4') 135.0 215.0" 847 1 847 69 parsed_2lib 1
153 "7 GUA BETA: (7 DG P)-(7 DG O5')-(7 DG C5')-(7 DG C4') 135.0 215.0" 852 1 852 69 parsed_2lib 1
154 "8 ADE BETA: (8 DA P)-(8 DA O5')-(8 DA C5')-(8 DA C4') 135.0 215.0" 857 1 857 69 parsed_2lib 1
155 "9 CYT BETA: (9 DC P)-(9 DC O5')-(9 DC C5')-(9 DC C4') 135.0 215.0" 862 1 862 69 parsed_2lib 1
156 "10 GUA BETA: (10 DG3 P)-(10 DG3 O5')-(10 DG3 C5')-(10 DG3 C4') 135.0 215.0" 867 1 867 78 parsed_2lib 1
157 "12 GUA BETA: (12 DG P)-(12 DG O5')-(12 DG C5')-(12 DG C4') 135.0 215.0" 872 1 872 74 parsed_2lib 1
158 "13 THY BETA: (13 DT P)-(13 DT O5')-(13 DT C5')-(13 DT C4') 135.0 215.0" 877 1 877 74 parsed_2lib 1
159 "14 CYT BETA: (14 DC P)-(14 DC O5')-(14 DC C5')-(14 DC C4') 135.0 215.0" 882 1 882 74 parsed_2lib 1
160 "15 CYT BETA: (15 DC P)-(15 DC O5')-(15 DC C5')-(15 DC C4') 135.0 215.0" 887 1 887 74 parsed_2lib 1
161 "16 THY BETA: (16 DT P)-(16 DT O5')-(16 DT C5')-(16 DT C4') 135.0 215.0" 892 1 892 74 parsed_2lib 1
162 "17 GUA BETA: (17 DG P)-(17 DG O5')-(17 DG C5')-(17 DG C4') 135.0 215.0" 897 1 897 74 parsed_2lib 1
163 "18 GUA BETA: (18 DG P)-(18 DG O5')-(18 DG C5')-(18 DG C4') 135.0 215.0" 902 1 902 74 parsed_2lib 1
164 "19 ADE BETA: (19 DA P)-(19 DA O5')-(19 DA C5')-(19 DA C4') 135.0 215.0" 907 1 907 74 parsed_2lib 1
165 "20 CYT BETA: (20 DC3 P)-(20 DC3 O5')-(20 DC3 C5')-(20 DC3 C4') 135.0 215.0" 912 1 912 78 parsed_2lib 1
166 "1 GUA GAMMA: (1 DG5 O5')-(1 DG5 C5')-(1 DG5 C4')-(1 DG5 C3') 30.0 90.0" 917 1 917 76 parsed_2lib 1
167 "2 THY GAMMA: (2 DT O5')-(2 DT C5')-(2 DT C4')-(2 DT C3') 30.0 90.0" 922 1 922 72 parsed_2lib 1
168 "3 CYT GAMMA: (3 DC O5')-(3 DC C5')-(3 DC C4')-(3 DC C3') 30.0 90.0" 927 1 927 72 parsed_2lib 1
169 "4 CYT GAMMA: (4 DC O5')-(4 DC C5')-(4 DC C4')-(4 DC C3') 30.0 90.0" 932 1 932 72 parsed_2lib 1
170
;
======================================================================
5 ADE GAMMA: (5 DA O5')-(5 DA C5')-(5 DA C4')-(5 DA C3') 30.0 90.0
&rst iat = 127, 128, 131, 150,
r1 = 10.3, r2 = 30.0, r3 = 90.0, r4 = 110.3,
rk2 = 50.0, rk3 = 50.0, &end
======================================================================
6 GUA GAMMA: (6 DG O5')-(6 DG C5')-(6 DG C4')-(6 DG C3') 30.0 90.0
;
936 1 942 72 parsed_2lib 1
171 "7 GUA GAMMA: (7 DG O5')-(7 DG C5')-(7 DG C4')-(7 DG C3') 30.0 90.0" 947 1 947 72 parsed_2lib 1
172 "8 ADE GAMMA: (8 DA O5')-(8 DA C5')-(8 DA C4')-(8 DA C3') 30.0 90.0" 952 1 952 72 parsed_2lib 1
173 "9 CYT GAMMA: (9 DC O5')-(9 DC C5')-(9 DC C4')-(9 DC C3') 30.0 90.0" 957 1 957 72 parsed_2lib 1
174 "10 GUA GAMMA: (10 DG3 O5')-(10 DG3 C5')-(10 DG3 C4')-(10 DG3 C3') 30.0 90.0" 962 1 962 81 parsed_2lib 1
175 "11 CYT GAMMA: (11 DC5 O5')-(11 DC5 C5')-(11 DC5 C4')-(11 DC5 C3') 30.0 90.0" 967 1 967 81 parsed_2lib 1
176 "12 GUA GAMMA: (12 DG O5')-(12 DG C5')-(12 DG C4')-(12 DG C3') 30.0 90.0" 972 1 972 77 parsed_2lib 1
177 "13 THY GAMMA: (13 DT O5')-(13 DT C5')-(13 DT C4')-(13 DT C3') 30.0 90.0" 977 1 977 77 parsed_2lib 1
178 "14 CYT GAMMA: (14 DC O5')-(14 DC C5')-(14 DC C4')-(14 DC C3') 30.0 90.0" 982 1 982 77 parsed_2lib 1
179 "15 CYT GAMMA: (15 DC O5')-(15 DC C5')-(15 DC C4')-(15 DC C3') 30.0 90.0" 987 1 987 77 parsed_2lib 1
180 "16 THY GAMMA: (16 DT O5')-(16 DT C5')-(16 DT C4')-(16 DT C3') 30.0 90.0" 992 1 992 77 parsed_2lib 1
181 "17 GUA GAMMA: (17 DG O5')-(17 DG C5')-(17 DG C4')-(17 DG C3') 30.0 90.0" 997 1 997 77 parsed_2lib 1
182 "18 GUA GAMMA: (18 DG O5')-(18 DG C5')-(18 DG C4')-(18 DG C3') 30.0 90.0" 1002 1 1002 77 parsed_2lib 1
183 "19 ADE GAMMA: (19 DA O5')-(19 DA C5')-(19 DA C4')-(19 DA C3') 30.0 90.0" 1007 1 1007 77 parsed_2lib 1
184 "20 CYT GAMMA: (20 DC3 O5')-(20 DC3 C5')-(20 DC3 C4')-(20 DC3 C3') 30.0 90.0" 1012 1 1012 81 parsed_2lib 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "95 constraints (0 torsion + 19 pseudorotation) converted to RST format." 89 1 89 71 parsed_2lib 1
stop_
save_
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