NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
573066 | 2m4w | 19024 | cing | 2-parsed | STAR | dihedral angle | 123 |
data_2m4w_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2m4w _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_2m4w 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2m4w _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 2m4w "Master copy" parsed_2m4w stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2m4w _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 2m4w.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m4w 1 1 2m4w.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 123 parsed_2m4w 1 1 2m4w.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_2m4w 1 1 2m4w.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_2m4w 1 1 2m4w.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m4w 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2m4w _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_2m4w 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_2m4w 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2m4w 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 4 . O3' . 5 . P . 5 . O5' . 5 . C5' parsed_2m4w 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 11 . O3' . 12 . P . 12 . O5' . 12 . C5' parsed_2m4w 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 12 . O3' . 13 . P . 13 . O5' . 13 . C5' parsed_2m4w 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_2m4w 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2m4w 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_2m4w 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_2m4w 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_2m4w 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' parsed_2m4w 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' parsed_2m4w 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' parsed_2m4w 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2m4w 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_2m4w 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2m4w 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2m4w 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 1 . O5' . 1 . C5' . 1 . C4' . 1 . C3' parsed_2m4w 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' parsed_2m4w 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_2m4w 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' parsed_2m4w 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 5 . O5' . 5 . C5' . 5 . C4' . 5 . C3' parsed_2m4w 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' parsed_2m4w 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' parsed_2m4w 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2m4w 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' parsed_2m4w 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2m4w 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2m4w 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 1 . H1' . 1 . C1' . 1 . C2' . 1 . H2' parsed_2m4w 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 1 . H2' . 1 . C2' . 1 . C3' . 1 . H3' parsed_2m4w 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 1 . H3' . 1 . C3' . 1 . C4' . 1 . H4' parsed_2m4w 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 2 . H1' . 2 . C1' . 2 . C2' . 2 . H2' parsed_2m4w 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 2 . H2' . 2 . C2' . 2 . C3' . 2 . H3' parsed_2m4w 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 2 . H3' . 2 . C3' . 2 . C4' . 2 . H4' parsed_2m4w 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 3 . H1' . 3 . C1' . 3 . C2' . 3 . H2' parsed_2m4w 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 3 . H2' . 3 . C2' . 3 . C3' . 3 . H3' parsed_2m4w 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 3 . H3' . 3 . C3' . 3 . C4' . 3 . H4' parsed_2m4w 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 4 . H1' . 4 . C1' . 4 . C2' . 4 . H2' parsed_2m4w 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 4 . H2' . 4 . C2' . 4 . C3' . 4 . H3' parsed_2m4w 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 4 . H3' . 4 . C3' . 4 . C4' . 4 . H4' parsed_2m4w 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 5 . H1' . 5 . C1' . 5 . C2' . 5 . H2' parsed_2m4w 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 5 . H2' . 5 . C2' . 5 . C3' . 5 . H3' parsed_2m4w 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 5 . H3' . 5 . C3' . 5 . C4' . 5 . H4' parsed_2m4w 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 12 . H1' . 12 . C1' . 12 . C2' . 12 . H2' parsed_2m4w 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 12 . H2' . 12 . C2' . 12 . C3' . 12 . H3' parsed_2m4w 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 12 . H3' . 12 . C3' . 12 . C4' . 12 . H4' parsed_2m4w 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 13 . H1' . 13 . C1' . 13 . C2' . 13 . H2' parsed_2m4w 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 13 . H2' . 13 . C2' . 13 . C3' . 13 . H3' parsed_2m4w 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 13 . H3' . 13 . C3' . 13 . C4' . 13 . H4' parsed_2m4w 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 14 . H1' . 14 . C1' . 14 . C2' . 14 . H2' parsed_2m4w 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 14 . H2' . 14 . C2' . 14 . C3' . 14 . H3' parsed_2m4w 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 14 . H3' . 14 . C3' . 14 . C4' . 14 . H4' parsed_2m4w 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 15 . H1' . 15 . C1' . 15 . C2' . 15 . H2' parsed_2m4w 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 15 . H2' . 15 . C2' . 15 . C3' . 15 . H3' parsed_2m4w 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 15 . H3' . 15 . C3' . 15 . C4' . 15 . H4' parsed_2m4w 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 16 . H1' . 16 . C1' . 16 . C2' . 16 . H2' parsed_2m4w 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 16 . H2' . 16 . C2' . 16 . C3' . 16 . H3' parsed_2m4w 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 16 . H3' . 16 . C3' . 16 . C4' . 16 . H4' parsed_2m4w 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 17 . H1' . 17 . C1' . 17 . C2' . 17 . H2' parsed_2m4w 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 17 . H2' . 17 . C2' . 17 . C3' . 17 . H3' parsed_2m4w 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 17 . H3' . 17 . C3' . 17 . C4' . 17 . H4' parsed_2m4w 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P parsed_2m4w 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_2m4w 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_2m4w 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 4 . C4' . 4 . C3' . 4 . O3' . 5 . P parsed_2m4w 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 5 . C4' . 5 . C3' . 5 . O3' . 6 . P parsed_2m4w 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 12 . C4' . 12 . C3' . 12 . O3' . 13 . P parsed_2m4w 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P parsed_2m4w 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_2m4w 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P parsed_2m4w 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 285.0 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2m4w 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 2 . O4' . 2 . C1' . 2 . N9 . 2 . C4 parsed_2m4w 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 3 . O4' . 3 . C1' . 3 . N9 . 3 . C4 parsed_2m4w 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 4 . O4' . 4 . C1' . 4 . N9 . 4 . C4 parsed_2m4w 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 5 . O4' . 5 . C1' . 5 . N1 . 5 . C2 parsed_2m4w 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 12 . O4' . 12 . C1' . 12 . N9 . 12 . C4 parsed_2m4w 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 13 . O4' . 13 . C1' . 13 . N1 . 13 . C2 parsed_2m4w 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 15 . O4' . 15 . C1' . 15 . N1 . 15 . C2 parsed_2m4w 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 16 . O4' . 16 . C1' . 16 . N1 . 16 . C2 parsed_2m4w 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 17 . O4' . 17 . C1' . 17 . N1 . 17 . C2 parsed_2m4w 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 1 . C3' . 1 . O3' . 2 . P . 2 . O5' parsed_2m4w 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' parsed_2m4w 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_2m4w 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 4 . C3' . 4 . O3' . 5 . P . 5 . O5' parsed_2m4w 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 5 . C3' . 5 . O3' . 6 . P . 6 . O5' parsed_2m4w 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 12 . C3' . 12 . O3' . 13 . P . 13 . O5' parsed_2m4w 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 15 . C3' . 15 . O3' . 16 . P . 16 . O5' parsed_2m4w 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2m4w 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 272.000 312.000 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_2m4w 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.000 120.000 . . 6 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_2m4w 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.000 120.000 . . 9 . O3' . 9 . P . 10 . O5' . 10 . C5' parsed_2m4w 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.000 198.000 . . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' parsed_2m4w 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.000 120.000 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_2m4w 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 6 . O5' . 6 . C5' . 6 . C4' . 6 . C3' parsed_2m4w 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.000 74.000 . . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' parsed_2m4w 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 6 . H1' . 6 . C1' . 6 . C2' . 6 . H2' parsed_2m4w 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 6 . H2' . 6 . C2' . 6 . C3' . 6 . H3' parsed_2m4w 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 6 . H3' . 6 . C3' . 6 . C4' . 6 . H4' parsed_2m4w 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 7 . H1' . 7 . C1' . 7 . C2' . 7 . H2' parsed_2m4w 1 101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 7 . H2' . 7 . C2' . 7 . C3' . 7 . H3' parsed_2m4w 1 102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 7 . H3' . 7 . C3' . 7 . C4' . 7 . H4' parsed_2m4w 1 103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 10 . H1' . 10 . C1' . 10 . C2' . 10 . H2' parsed_2m4w 1 104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 10 . H2' . 10 . C2' . 10 . C3' . 10 . H3' parsed_2m4w 1 105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 10 . H3' . 10 . C3' . 10 . C4' . 10 . H4' parsed_2m4w 1 106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.2 109.2 . . 11 . H1' . 11 . C1' . 11 . C2' . 11 . H2' parsed_2m4w 1 107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29.4 49.4 . . 11 . H2' . 11 . C2' . 11 . C3' . 11 . H3' parsed_2m4w 1 108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -152.0 . . 11 . H3' . 11 . C3' . 11 . C4' . 11 . H4' parsed_2m4w 1 109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 187.000 227.000 . . 6 . C4' . 6 . C3' . 6 . O3' . 7 . P parsed_2m4w 1 110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.000 285.000 . . 7 . C4' . 7 . C3' . 7 . O3' . 8 . P parsed_2m4w 1 111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.000 285.000 . . 8 . C4' . 8 . C3' . 8 . O3' . 9 . P parsed_2m4w 1 112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.000 285.000 . . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P parsed_2m4w 1 113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.000 285.000 . . 10 . C4' . 10 . C3' . 10 . O3' . 11 . P parsed_2m4w 1 114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 187.000 227.000 . . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P parsed_2m4w 1 115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.000 120.000 . . 6 . C3' . 6 . O3' . 7 . P . 7 . O5' parsed_2m4w 1 116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.000 120.000 . . 9 . C3' . 9 . O3' . 10 . P . 10 . O5' parsed_2m4w 1 117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 269.000 309.000 . . 11 . C3' . 11 . O3' . 12 . P . 12 . O5' parsed_2m4w 1 118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 172.000 232.000 . . 6 . O4' . 6 . C1' . 6 . N1 . 6 . C2 parsed_2m4w 1 119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 7 . O4' . 7 . C1' . 7 . N9 . 7 . C4 parsed_2m4w 1 120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 8 . O4' . 8 . C1' . 8 . N9 . 8 . C4 parsed_2m4w 1 121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 9 . O4' . 9 . C1' . 9 . N9 . 9 . C4 parsed_2m4w 1 122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.000 262.000 . . 10 . O4' . 10 . C1' . 10 . N9 . 10 . C4 parsed_2m4w 1 123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 172.000 232.000 . . 11 . O4' . 11 . C1' . 11 . N9 . 11 . C4 parsed_2m4w 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 ; restraints on alpha ------------------- ; 1 1 2 21 parsed_2m4w 1 2 ; restraints on beta in A-helix ----------------------------- ; 52 1 53 31 parsed_2m4w 1 3 ; restraints on gamma in A-helix ----------------------------- ; 116 1 117 31 parsed_2m4w 1 4 ; restraints on residues with N-puckering -------------------------------------- ; 187 1 188 40 parsed_2m4w 1 5 ; restraints on residues with S-puckering -------------------------------------- assign (resid 9 and name H1') (resid 9 and name C1') (resid 9 and name C2') (resid 9 and name H2') 1.000 157.4 10.0 2 assign (resid 9 and name H2') (resid 9 and name C2') (resid 9 and name C3') (resid 9 and name H3') 1.000 -34.6 10.0 2 assign (resid 9 and name H3') (resid 9 and name C3') (resid 9 and name C4') (resid 9 and name H4') 1.000 -100.5 10.0 2 restraints on epsilon --------------------- ; 390 1 414 23 parsed_2m4w 1 6 ; restraints on chi in A-helix ----------------------------- ; 477 1 478 31 parsed_2m4w 1 7 ; restraints on zeta in regular duplex ------------------------------------ ; 537 1 538 38 parsed_2m4w 1 8 "Dihedral alpha constraints from vsm1 hairpin in GAAAloop" 592 1 592 59 parsed_2m4w 1 9 "residu C6" 597 1 597 12 parsed_2m4w 1 10 "residu G7" 602 1 602 12 parsed_2m4w 1 11 "residu A10" 607 1 607 13 parsed_2m4w 1 12 ; message=on messsage=off ; 614 2 617 20 parsed_2m4w 1 13 "Dihedral beta constraints from vsm1 hairpin in GAAAloop" 618 1 619 58 parsed_2m4w 1 14 "residu C6" 624 1 624 12 parsed_2m4w 1 15 "residu G11" 630 1 630 13 parsed_2m4w 1 16 ; message=on messsage=off ; 637 2 639 20 parsed_2m4w 1 17 "Dihedral gamma constraints from vsm1 hairpin in GAAAloop" 640 1 641 59 parsed_2m4w 1 18 "residu C6" 646 1 646 12 parsed_2m4w 1 19 "residu G11" 651 1 651 13 parsed_2m4w 1 20 ; message=on message=off ; 658 2 660 19 parsed_2m4w 1 21 "Residue C6: phase angle= 10.000 , amplitude= 35.000, range in P= 20.000" 665 1 665 76 parsed_2m4w 1 22 "Residue G7: phase angle= 10.000 , amplitude= 35.000, range in P= 20.000" 684 1 684 76 parsed_2m4w 1 23 "Residue A10: phase angle= 10.000 , amplitude= 35.000, range in P= 20.000" 704 1 704 77 parsed_2m4w 1 24 "Residue 11: phase angle= 10.000 , amplitude= 35.000, range in P= 20.000" 723 1 723 76 parsed_2m4w 1 25 ; message=on messsage=off ; 744 1 745 20 parsed_2m4w 1 26 "Dihedral epsilon constraints from vsm1 hairpin in GAAAloop" 747 1 747 61 parsed_2m4w 1 27 "residu C6" 752 1 752 12 parsed_2m4w 1 28 "residu G7" 757 1 757 12 parsed_2m4w 1 29 "residu A8" 762 1 762 12 parsed_2m4w 1 30 "residu A9" 767 1 767 12 parsed_2m4w 1 31 "residu A10" 772 1 772 13 parsed_2m4w 1 32 "residu G11" 777 1 777 13 parsed_2m4w 1 33 ; message=on messsage=off ; 784 2 785 20 parsed_2m4w 1 34 "Dihedral zeta constraints from vsm1 hairpin in GAAAloop" 787 1 787 58 parsed_2m4w 1 35 "residu C6" 791 1 791 12 parsed_2m4w 1 36 "residu A9" 796 1 796 12 parsed_2m4w 1 37 "residu G11" 801 1 801 13 parsed_2m4w 1 38 ; message=on messsage=off ; 808 2 809 20 parsed_2m4w 1 39 "Dihedral chi constraints from vsm1 hairpin in GAAAloop" 811 1 811 57 parsed_2m4w 1 40 "residu C6" 816 1 816 12 parsed_2m4w 1 41 "residu G7" 822 1 822 12 parsed_2m4w 1 42 "residu A8" 829 1 829 12 parsed_2m4w 1 43 "residu A9" 835 1 835 12 parsed_2m4w 1 44 "residu A10" 841 1 841 13 parsed_2m4w 1 45 "residu G11" 847 1 847 13 parsed_2m4w 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 dihedral" 594 1 594 19 parsed_2m4w 1 2 ; end set message=on end set messsage=off end ! ! Dihedral beta constraints from vsm1 hairpin in GAAAloop restraints dihedral ; 613 1 621 19 parsed_2m4w 1 3 ; end set message=on end set messsage=off end ! ! Dihedral gamma constraints from vsm1 hairpin in GAAAloop restraints dihedral ; 636 1 643 19 parsed_2m4w 1 4 ; end set message=on end set message=off end restraints dihedral ; 657 1 662 19 parsed_2m4w 1 5 ; end set message=on end set messsage=off end ! Dihedral epsilon constraints from vsm1 hairpin in GAAAloop restraints dihedral ; 743 1 749 19 parsed_2m4w 1 6 ; end set message=on end set messsage=off end ! Dihedral zeta constraints from vsm1 hairpin in GAAAloop restraints dihedral ; 783 1 789 19 parsed_2m4w 1 7 ; end set message=on end set messsage=off end ! Dihedral chi constraints from vsm1 hairpin in GAAAloop restraints dihedral ; 807 1 813 19 parsed_2m4w 1 stop_ save_
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