NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
617629 | 5uzz | 30258 | cing | 2-parsed | STAR | dihedral angle | 100 |
data_5uzz_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5uzz _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_5uzz 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5uzz _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 5uzz "Master copy" parsed_5uzz stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5uzz _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 5uzz.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 2 distance NOE simple 35 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 12 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 4 distance NOE simple 236 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 33 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 100 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 7 distance NOE simple 0 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 8 planarity "Not applicable" "Not applicable" 0 parsed_5uzz 1 1 5uzz.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5uzz 1 stop_ save_ save_CNS/XPLOR_dihedral_6 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_5uzz _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 6 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 45.0 . . 22 . O4' . 22 . C1' . 22 . C2' . 22 . C3' parsed_5uzz 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -25.0 . . 22 . C1' . 22 . C2' . 22 . C3' . 22 . C4' parsed_5uzz 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 165.0 . . 22 . c5' . 22 . c4' . 22 . c3' . 22 . o3' parsed_5uzz 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 22 . O4' . 22 . C1' . 22 . N9 . 22 . C4 parsed_5uzz 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 23 . O4' . 23 . C1' . 23 . C2' . 23 . C3' parsed_5uzz 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 23 . C1' . 23 . C2' . 23 . C3' . 23 . C4' parsed_5uzz 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 23 . c5' . 23 . c4' . 23 . c3' . 23 . o3' parsed_5uzz 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -120.0 . . 23 . O4' . 23 . C1' . 23 . N9 . 23 . C4 parsed_5uzz 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' parsed_5uzz 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' parsed_5uzz 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' parsed_5uzz 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 23 . C4' . 23 . C3' . 23 . O3' . 24 . P parsed_5uzz 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 23 . C3' . 23 . O3' . 24 . P . 24 . O5' parsed_5uzz 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 24 . O4' . 24 . C1' . 24 . C2' . 24 . C3' parsed_5uzz 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 24 . C1' . 24 . C2' . 24 . C3' . 24 . C4' parsed_5uzz 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 24 . c5' . 24 . c4' . 24 . c3' . 24 . o3' parsed_5uzz 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 24 . O4' . 24 . C1' . 24 . N1 . 24 . C2 parsed_5uzz 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' parsed_5uzz 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' parsed_5uzz 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' parsed_5uzz 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 24 . C4' . 24 . C3' . 24 . O3' . 25 . P parsed_5uzz 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 24 . C3' . 24 . O3' . 25 . P . 25 . O5' parsed_5uzz 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 25 . O4' . 25 . C1' . 25 . C2' . 25 . C3' parsed_5uzz 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 25 . C1' . 25 . C2' . 25 . C3' . 25 . C4' parsed_5uzz 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 25 . c5' . 25 . c4' . 25 . c3' . 25 . o3' parsed_5uzz 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -120.0 . . 25 . O4' . 25 . C1' . 25 . N9 . 25 . C4 parsed_5uzz 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 24 . O3' . 25 . P . 25 . O5' . 25 . C5' parsed_5uzz 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 25 . P . 25 . O5' . 25 . C5' . 25 . C4' parsed_5uzz 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 25 . O5' . 25 . C5' . 25 . C4' . 25 . C3' parsed_5uzz 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 25 . C4' . 25 . C3' . 25 . O3' . 26 . P parsed_5uzz 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 25 . C3' . 25 . O3' . 26 . P . 26 . O5' parsed_5uzz 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 26 . O4' . 26 . C1' . 26 . C2' . 26 . C3' parsed_5uzz 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 26 . C1' . 26 . C2' . 26 . C3' . 26 . C4' parsed_5uzz 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 26 . c5' . 26 . c4' . 26 . c3' . 26 . o3' parsed_5uzz 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 26 . O4' . 26 . C1' . 26 . N1 . 26 . C2 parsed_5uzz 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 25 . O3' . 26 . P . 26 . O5' . 26 . C5' parsed_5uzz 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 26 . P . 26 . O5' . 26 . C5' . 26 . C4' parsed_5uzz 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 26 . O5' . 26 . C5' . 26 . C4' . 26 . C3' parsed_5uzz 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 26 . C4' . 26 . C3' . 26 . O3' . 27 . P parsed_5uzz 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 26 . C3' . 26 . O3' . 27 . P . 27 . O5' parsed_5uzz 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 27 . O4' . 27 . C1' . 27 . C2' . 27 . C3' parsed_5uzz 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 27 . C1' . 27 . C2' . 27 . C3' . 27 . C4' parsed_5uzz 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 27 . c5' . 27 . c4' . 27 . c3' . 27 . o3' parsed_5uzz 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 27 . O4' . 27 . C1' . 27 . N1 . 27 . C2 parsed_5uzz 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 26 . O3' . 27 . P . 27 . O5' . 27 . C5' parsed_5uzz 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 27 . P . 27 . O5' . 27 . C5' . 27 . C4' parsed_5uzz 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 27 . O5' . 27 . C5' . 27 . C4' . 27 . C3' parsed_5uzz 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 27 . C4' . 27 . C3' . 27 . O3' . 28 . P parsed_5uzz 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 27 . C3' . 27 . O3' . 28 . P . 28 . O5' parsed_5uzz 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 47 . O4' . 47 . C1' . 47 . C2' . 47 . C3' parsed_5uzz 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 47 . C1' . 47 . C2' . 47 . C3' . 47 . C4' parsed_5uzz 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 47 . c5' . 47 . c4' . 47 . c3' . 47 . o3' parsed_5uzz 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -120.0 . . 47 . O4' . 47 . C1' . 47 . N9 . 47 . C4 parsed_5uzz 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 46 . O3' . 47 . P . 47 . O5' . 47 . C5' parsed_5uzz 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 47 . P . 47 . O5' . 47 . C5' . 47 . C4' parsed_5uzz 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 47 . O5' . 47 . C5' . 47 . C4' . 47 . C3' parsed_5uzz 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 47 . C4' . 47 . C3' . 47 . O3' . 48 . P parsed_5uzz 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 47 . C3' . 47 . O3' . 48 . P . 48 . O5' parsed_5uzz 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 48 . O4' . 48 . C1' . 48 . C2' . 48 . C3' parsed_5uzz 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 48 . C1' . 48 . C2' . 48 . C3' . 48 . C4' parsed_5uzz 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 48 . c5' . 48 . c4' . 48 . c3' . 48 . o3' parsed_5uzz 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -120.0 . . 48 . O4' . 48 . C1' . 48 . N9 . 48 . C4 parsed_5uzz 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 47 . O3' . 48 . P . 48 . O5' . 48 . C5' parsed_5uzz 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 48 . P . 48 . O5' . 48 . C5' . 48 . C4' parsed_5uzz 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 48 . O5' . 48 . C5' . 48 . C4' . 48 . C3' parsed_5uzz 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 48 . C4' . 48 . C3' . 48 . O3' . 49 . P parsed_5uzz 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 48 . C3' . 48 . O3' . 49 . P . 49 . O5' parsed_5uzz 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 49 . O4' . 49 . C1' . 49 . C2' . 49 . C3' parsed_5uzz 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 49 . C1' . 49 . C2' . 49 . C3' . 49 . C4' parsed_5uzz 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 49 . c5' . 49 . c4' . 49 . c3' . 49 . o3' parsed_5uzz 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 49 . O4' . 49 . C1' . 49 . N1 . 49 . C2 parsed_5uzz 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 48 . O3' . 49 . P . 49 . O5' . 49 . C5' parsed_5uzz 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 49 . P . 49 . O5' . 49 . C5' . 49 . C4' parsed_5uzz 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 49 . O5' . 49 . C5' . 49 . C4' . 49 . C3' parsed_5uzz 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 49 . C4' . 49 . C3' . 49 . O3' . 50 . P parsed_5uzz 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 49 . C3' . 49 . O3' . 50 . P . 50 . O5' parsed_5uzz 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 50 . O4' . 50 . C1' . 50 . C2' . 50 . C3' parsed_5uzz 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 50 . C1' . 50 . C2' . 50 . C3' . 50 . C4' parsed_5uzz 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 50 . c5' . 50 . c4' . 50 . c3' . 50 . o3' parsed_5uzz 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -120.0 . . 50 . O4' . 50 . C1' . 50 . N9 . 50 . C4 parsed_5uzz 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 49 . O3' . 50 . P . 50 . O5' . 50 . C5' parsed_5uzz 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 50 . P . 50 . O5' . 50 . C5' . 50 . C4' parsed_5uzz 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 50 . O5' . 50 . C5' . 50 . C4' . 50 . C3' parsed_5uzz 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 50 . C4' . 50 . C3' . 50 . O3' . 51 . P parsed_5uzz 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 50 . C3' . 50 . O3' . 51 . P . 51 . O5' parsed_5uzz 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 51 . O4' . 51 . C1' . 51 . C2' . 51 . C3' parsed_5uzz 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 51 . C1' . 51 . C2' . 51 . C3' . 51 . C4' parsed_5uzz 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 51 . c5' . 51 . c4' . 51 . c3' . 51 . o3' parsed_5uzz 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 50 . O3' . 51 . P . 51 . O5' . 51 . C5' parsed_5uzz 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 51 . P . 51 . O5' . 51 . C5' . 51 . C4' parsed_5uzz 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 51 . O5' . 51 . C5' . 51 . C4' . 51 . C3' parsed_5uzz 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 51 . C4' . 51 . C3' . 51 . O3' . 52 . P parsed_5uzz 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 51 . C3' . 51 . O3' . 52 . P . 52 . O5' parsed_5uzz 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 -5.0 . . 52 . O4' . 52 . C1' . 52 . C2' . 52 . C3' parsed_5uzz 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 50.0 . . 52 . C1' . 52 . C2' . 52 . C3' . 52 . C4' parsed_5uzz 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55.0 105.0 . . 52 . c5' . 52 . c4' . 52 . c3' . 52 . o3' parsed_5uzz 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -240.0 -60.0 . . 52 . O4' . 52 . C1' . 52 . N1 . 52 . C2 parsed_5uzz 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 51 . O3' . 52 . P . 52 . O5' . 52 . C5' parsed_5uzz 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 52 . P . 52 . O5' . 52 . C5' . 52 . C4' parsed_5uzz 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 52 . O5' . 52 . C5' . 52 . C4' . 52 . C3' parsed_5uzz 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 ; Pucker is defined with ribose torsion angles nu1 and nu2. nu1 = O4'-C1'-C2'-C3' nu2 = C1'-C2'-C3'-C4' "N" C3' endo: nu1 = -20 +/- 10 nu2 = +35 +/- 5 "S" C2' endo: nu1 = +35 +/- 5 nu2 = -35 +/- 5 See Saenger page 20. C2' endo nucleotides (Judging from TOCSY): only if both H1'-H2'' and H1'-H3' couplings both are strong (intensity of H1'-H3' even larger). G1 ; 2 1 15 11 parsed_5uzz 1 2 G2 28 1 29 11 parsed_5uzz 1 3 "backbone alpha" 42 1 42 16 parsed_5uzz 1 4 "backbone beta" 45 1 45 15 parsed_5uzz 1 5 "backbone gama" 48 1 48 15 parsed_5uzz 1 6 "backbone epsilon" 51 1 51 18 parsed_5uzz 1 7 "backbone zeta" 54 1 54 15 parsed_5uzz 1 8 U3 57 1 58 11 parsed_5uzz 1 9 "backbone alpha" 71 1 71 16 parsed_5uzz 1 10 "backbone beta" 74 1 74 15 parsed_5uzz 1 11 "backbone gama" 77 1 77 15 parsed_5uzz 1 12 "backbone epsilon" 80 1 80 18 parsed_5uzz 1 13 "backbone zeta" 83 1 83 15 parsed_5uzz 1 14 G4 86 1 87 11 parsed_5uzz 1 15 "backbone alpha" 100 1 100 16 parsed_5uzz 1 16 "backbone beta" 103 1 103 15 parsed_5uzz 1 17 "backbone gama" 106 1 106 15 parsed_5uzz 1 18 "backbone epsilon" 109 1 109 18 parsed_5uzz 1 19 "backbone zeta" 112 1 112 15 parsed_5uzz 1 20 U5 115 1 116 11 parsed_5uzz 1 21 "backbone alpha" 129 1 129 16 parsed_5uzz 1 22 "backbone beta" 132 1 132 15 parsed_5uzz 1 23 "backbone gama" 135 1 135 15 parsed_5uzz 1 24 "backbone epsilon" 138 1 138 18 parsed_5uzz 1 25 "backbone zeta" 141 1 141 15 parsed_5uzz 1 26 U6 145 1 145 11 parsed_5uzz 1 27 "backbone alpha" 158 1 158 16 parsed_5uzz 1 28 "backbone beta" 161 1 161 15 parsed_5uzz 1 29 "backbone gama" 164 1 164 15 parsed_5uzz 1 30 "backbone epsilon" 167 1 167 18 parsed_5uzz 1 31 "backbone zeta" 170 1 170 15 parsed_5uzz 1 32 ; G7 assign (resid 28 and name O4') (resid 28 and name C1') (resid 28 and name C2') (resid 28 and name C3') 1.0 -20.0 15.0 2 assign (resid 28 and name C1') (resid 28 and name C2') (resid 28 and name C3') (resid 28 and name C4') 1.0 35.0 15.0 2 assign (resid 28 and name c5') (resid 28 and name c4') (resid 28 and name c3') (resid 28 and name o3') 1.0 80.0 25.0 2 assign (resid 28 and name O4') (resid 28 and name C1') (resid 28 and name N9 ) (resid 28 and name C4 ) 1.0 -160.0 40.0 2 backbone alpha assign (resid 27 and name O3') (resid 28 and name P ) (resid 28 and name O5') (resid 28 and name C5') 1.0 -60.0 40.0 2 backbone beta assign (resid 28 and name P ) (resid 28 and name O5') (resid 28 and name C5') (resid 28 and name C4') 1.0 180.0 50.0 2 backbone gama assign (resid 28 and name O5') (resid 28 and name C5') (resid 28 and name C4') (resid 28 and name C3') 1.0 60.0 40.0 2 backbone epsilon assign (resid 28 and name C4') (resid 28 and name C3') (resid 28 and name O3') (resid 29 and name P ) 1.0 -160.0 50.0 2 backbone zeta assign (resid 28 and name C3') (resid 28 and name O3') (resid 29 and name P ) (resid 29 and name O5') 1.0 -70.0 50.0 2 C25 assign (resid 46 and name O4') (resid 46 and name C1') (resid 46 and name C2') (resid 46 and name C3') 1.0 -20.0 15.0 2 assign (resid 46 and name C1') (resid 46 and name C2') (resid 46 and name C3') (resid 46 and name C4') 1.0 35.0 15.0 2 assign (resid 46 and name c5') (resid 46 and name c4') (resid 46 and name c3') (resid 46 and name o3') 1.0 80.0 25.0 2 assign (resid 46 and name O4') (resid 46 and name C1') (resid 46 and name N1 ) (resid 46 and name C2 ) 1.0 -150.0 90.0 2 backbone alpha assign (resid 45 and name O3') (resid 46 and name P ) (resid 46 and name O5') (resid 46 and name C5') 1.0 -60.0 40.0 2 backbone beta assign (resid 25 and name P ) (resid 25 and name O5') (resid 25 and name C5') (resid 25 and name C4') 1.0 180.0 50.0 2 backbone gama assign (resid 25 and name O5') (resid 25 and name C5') (resid 25 and name C4') (resid 25 and name C3') 1.0 60.0 40.0 2 backbone epsilon assign (resid 25 and name C4') (resid 25 and name C3') (resid 25 and name O3') (resid 26 and name P ) 1.0 -160.0 50.0 2 backbone zeta assign (resid 25 and name C3') (resid 25 and name O3') (resid 26 and name P ) (resid 26 and name O5') 1.0 -70.0 50.0 2 A26 ; 175 1 240 12 parsed_5uzz 1 33 "backbone alpha" 253 1 253 16 parsed_5uzz 1 34 "backbone beta" 256 1 256 15 parsed_5uzz 1 35 "backbone gama" 259 1 259 15 parsed_5uzz 1 36 "backbone epsilon" 262 1 262 18 parsed_5uzz 1 37 "backbone zeta" 265 1 265 15 parsed_5uzz 1 38 A27 269 1 270 12 parsed_5uzz 1 39 "backbone alpha" 283 1 283 16 parsed_5uzz 1 40 "backbone beta" 286 1 286 15 parsed_5uzz 1 41 "backbone gama" 289 1 289 15 parsed_5uzz 1 42 "backbone epsilon" 292 1 292 18 parsed_5uzz 1 43 "backbone zeta" 295 1 295 15 parsed_5uzz 1 44 C28 300 1 301 12 parsed_5uzz 1 45 "backbone alpha" 314 1 314 16 parsed_5uzz 1 46 "backbone beta" 317 1 317 15 parsed_5uzz 1 47 "backbone gama" 320 1 320 15 parsed_5uzz 1 48 "backbone epsilon" 323 1 323 18 parsed_5uzz 1 49 "backbone zeta" 326 1 326 15 parsed_5uzz 1 50 A29 329 1 330 12 parsed_5uzz 1 51 "backbone alpha" 343 1 343 16 parsed_5uzz 1 52 "backbone beta" 346 1 346 15 parsed_5uzz 1 53 "backbone gama" 349 1 349 15 parsed_5uzz 1 54 "backbone epsilon" 352 1 352 18 parsed_5uzz 1 55 "backbone zeta" 355 1 355 15 parsed_5uzz 1 56 C30 359 1 360 12 parsed_5uzz 1 57 "backbone alpha" 371 1 371 16 parsed_5uzz 1 58 "backbone beta" 374 1 374 15 parsed_5uzz 1 59 "backbone gama" 377 1 377 15 parsed_5uzz 1 60 "backbone epsilon" 380 1 380 18 parsed_5uzz 1 61 "backbone zeta" 383 1 383 15 parsed_5uzz 1 62 C31 386 1 387 12 parsed_5uzz 1 63 "backbone alpha" 400 1 400 16 parsed_5uzz 1 64 "backbone beta" 403 1 403 15 parsed_5uzz 1 65 "backbone gama" 406 1 406 15 parsed_5uzz 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 "# Restraints file 3: miR21_dihedral.tbl" 1 1 1 39 parsed_5uzz 1 stop_ save_
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