NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
572715 | 2mk3 | 19750 | cing | 2-parsed | STAR | dihedral angle | 102 |
data_2mk3_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2mk3 _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_2mk3 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2mk3 _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 2mk3 "Master copy" parsed_2mk3 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2mk3 _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 2mk3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mk3 1 1 2mk3.mr . . XPLOR/CNS 2 distance NOE simple 466 parsed_2mk3 1 1 2mk3.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2mk3 1 1 2mk3.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 102 parsed_2mk3 1 1 2mk3.mr . . unknown 5 unknown "Not applicable" "Not applicable" 0 parsed_2mk3 1 1 2mk3.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mk3 1 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2mk3 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.584 -49.584 . A 5 . C A 6 . N A 6 . CA A 6 . C parsed_2mk3 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.958 -14.958 . A 6 . N A 6 . CA A 6 . C A 7 . N parsed_2mk3 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.332 -48.332 . A 6 . C A 7 . N A 7 . CA A 7 . C parsed_2mk3 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.788 -16.788 . A 7 . N A 7 . CA A 7 . C A 8 . N parsed_2mk3 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.855 -46.855 . A 7 . C A 8 . N A 8 . CA A 8 . C parsed_2mk3 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.047 -18.047 . A 8 . N A 8 . CA A 8 . C A 9 . N parsed_2mk3 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.816 -46.816 . A 8 . C A 9 . N A 9 . CA A 9 . C parsed_2mk3 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.924 -16.924 . A 9 . N A 9 . CA A 9 . C A 10 . N parsed_2mk3 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.040 -46.040 . A 9 . C A 10 . N A 10 . CA A 10 . C parsed_2mk3 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.149 -23.149 . A 10 . N A 10 . CA A 10 . C A 11 . N parsed_2mk3 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.507 -43.507 . A 10 . C A 11 . N A 11 . CA A 11 . C parsed_2mk3 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.088 -20.088 . A 11 . N A 11 . CA A 11 . C A 12 . N parsed_2mk3 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.879 -45.879 . A 11 . C A 12 . N A 12 . CA A 12 . C parsed_2mk3 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.932 -18.932 . A 12 . N A 12 . CA A 12 . C A 13 . N parsed_2mk3 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.544 -46.544 . A 12 . C A 13 . N A 13 . CA A 13 . C parsed_2mk3 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.495 -20.495 . A 13 . N A 13 . CA A 13 . C A 14 . N parsed_2mk3 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.378 -44.378 . A 13 . C A 14 . N A 14 . CA A 14 . C parsed_2mk3 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.833 -23.833 . A 14 . N A 14 . CA A 14 . C A 15 . N parsed_2mk3 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.216 -46.216 . A 14 . C A 15 . N A 15 . CA A 15 . C parsed_2mk3 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.221 -4.221 . A 15 . N A 15 . CA A 15 . C A 16 . N parsed_2mk3 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.860 -80.860 . A 15 . C A 16 . N A 16 . CA A 16 . C parsed_2mk3 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.108 40.108 . A 16 . N A 16 . CA A 16 . C A 17 . N parsed_2mk3 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.000 -90.000 . A 16 . C A 17 . N A 17 . CA A 17 . C parsed_2mk3 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.500 40.500 . A 17 . N A 17 . CA A 17 . C A 18 . N parsed_2mk3 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.000 -35.000 . A 17 . C A 18 . N A 18 . CA A 18 . C parsed_2mk3 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.500 -15.500 . A 18 . N A 18 . CA A 18 . C A 19 . N parsed_2mk3 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.000 -45.000 . A 18 . C A 19 . N A 19 . CA A 19 . C parsed_2mk3 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.029 -18.029 . A 19 . N A 19 . CA A 19 . C A 20 . N parsed_2mk3 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.984 -46.984 . A 19 . C A 20 . N A 20 . CA A 20 . C parsed_2mk3 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.651 -30.651 . A 20 . N A 20 . CA A 20 . C A 21 . N parsed_2mk3 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.005 -44.005 . A 20 . C A 21 . N A 21 . CA A 21 . C parsed_2mk3 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.659 -22.659 . A 21 . N A 21 . CA A 21 . C A 22 . N parsed_2mk3 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.401 -44.401 . A 21 . C A 22 . N A 22 . CA A 22 . C parsed_2mk3 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.427 -18.427 . A 22 . N A 22 . CA A 22 . C A 23 . N parsed_2mk3 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.690 -46.690 . A 22 . C A 23 . N A 23 . CA A 23 . C parsed_2mk3 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.261 -21.261 . A 23 . N A 23 . CA A 23 . C A 24 . N parsed_2mk3 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.728 -46.728 . A 23 . C A 24 . N A 24 . CA A 24 . C parsed_2mk3 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.544 -17.544 . A 24 . N A 24 . CA A 24 . C A 25 . N parsed_2mk3 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.274 -43.274 . A 24 . C A 25 . N A 25 . CA A 25 . C parsed_2mk3 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.177 -23.177 . A 25 . N A 25 . CA A 25 . C A 26 . N parsed_2mk3 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.882 -42.882 . A 25 . C A 26 . N A 26 . CA A 26 . C parsed_2mk3 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.854 -24.854 . A 26 . N A 26 . CA A 26 . C A 27 . N parsed_2mk3 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.310 -43.310 . A 26 . C A 27 . N A 27 . CA A 27 . C parsed_2mk3 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.914 -23.914 . A 27 . N A 27 . CA A 27 . C A 28 . N parsed_2mk3 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.331 -44.331 . A 27 . C A 28 . N A 28 . CA A 28 . C parsed_2mk3 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.911 -22.911 . A 28 . N A 28 . CA A 28 . C A 29 . N parsed_2mk3 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.928 -43.928 . A 28 . C A 29 . N A 29 . CA A 29 . C parsed_2mk3 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.494 -21.494 . A 29 . N A 29 . CA A 29 . C A 30 . N parsed_2mk3 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.152 -47.152 . A 29 . C A 30 . N A 30 . CA A 30 . C parsed_2mk3 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.580 -20.580 . A 30 . N A 30 . CA A 30 . C A 31 . N parsed_2mk3 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.248 -45.248 . A 30 . C A 31 . N A 31 . CA A 31 . C parsed_2mk3 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.848 -31.848 . A 31 . N A 31 . CA A 31 . C A 32 . N parsed_2mk3 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.836 -45.836 . A 31 . C A 32 . N A 32 . CA A 32 . C parsed_2mk3 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.387 -17.387 . A 32 . N A 32 . CA A 32 . C A 33 . N parsed_2mk3 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.891 -45.891 . A 32 . C A 33 . N A 33 . CA A 33 . C parsed_2mk3 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.000 -30.000 . A 33 . N A 33 . CA A 33 . C A 34 . N parsed_2mk3 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.836 -43.836 . A 33 . C A 34 . N A 34 . CA A 34 . C parsed_2mk3 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.969 -15.969 . A 34 . N A 34 . CA A 34 . C A 35 . N parsed_2mk3 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.900 -65.900 . A 40 . C A 41 . N A 41 . CA A 41 . C parsed_2mk3 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.326 -34.326 . A 41 . N A 41 . CA A 41 . C A 42 . N parsed_2mk3 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.151 -47.151 . A 41 . C A 42 . N A 42 . CA A 42 . C parsed_2mk3 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.228 -19.228 . A 42 . N A 42 . CA A 42 . C A 43 . N parsed_2mk3 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.476 -47.476 . A 42 . C A 43 . N A 43 . CA A 43 . C parsed_2mk3 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.000 -20.000 . A 43 . N A 43 . CA A 43 . C A 44 . N parsed_2mk3 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.314 -45.314 . A 43 . C A 44 . N A 44 . CA A 44 . C parsed_2mk3 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.500 -20.500 . A 44 . N A 44 . CA A 44 . C A 45 . N parsed_2mk3 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.064 -45.064 . A 44 . C A 45 . N A 45 . CA A 45 . C parsed_2mk3 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.560 -30.560 . A 45 . N A 45 . CA A 45 . C A 46 . N parsed_2mk3 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.000 -35.000 . A 45 . C A 46 . N A 46 . CA A 46 . C parsed_2mk3 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.914 -21.914 . A 46 . N A 46 . CA A 46 . C A 47 . N parsed_2mk3 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.324 -45.324 . A 46 . C A 47 . N A 47 . CA A 47 . C parsed_2mk3 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.773 -20.773 . A 47 . N A 47 . CA A 47 . C A 48 . N parsed_2mk3 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.304 -44.304 . A 47 . C A 48 . N A 48 . CA A 48 . C parsed_2mk3 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.450 -22.450 . A 48 . N A 48 . CA A 48 . C A 49 . N parsed_2mk3 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.316 -46.316 . A 48 . C A 49 . N A 49 . CA A 49 . C parsed_2mk3 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.997 -17.997 . A 49 . N A 49 . CA A 49 . C A 50 . N parsed_2mk3 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.190 -47.190 . A 49 . C A 50 . N A 50 . CA A 50 . C parsed_2mk3 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.913 -27.913 . A 50 . N A 50 . CA A 50 . C A 51 . N parsed_2mk3 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.017 -45.017 . A 50 . C A 51 . N A 51 . CA A 51 . C parsed_2mk3 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.739 -30.739 . A 51 . N A 51 . CA A 51 . C A 52 . N parsed_2mk3 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.031 -44.031 . A 51 . C A 52 . N A 52 . CA A 52 . C parsed_2mk3 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.693 -20.693 . A 52 . N A 52 . CA A 52 . C A 53 . N parsed_2mk3 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.872 -45.872 . A 52 . C A 53 . N A 53 . CA A 53 . C parsed_2mk3 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.679 -19.679 . A 53 . N A 53 . CA A 53 . C A 54 . N parsed_2mk3 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.349 -45.349 . A 53 . C A 54 . N A 54 . CA A 54 . C parsed_2mk3 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.079 -23.079 . A 54 . N A 54 . CA A 54 . C A 55 . N parsed_2mk3 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.898 -32.898 . A 54 . C A 55 . N A 55 . CA A 55 . C parsed_2mk3 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.581 -23.581 . A 55 . N A 55 . CA A 55 . C A 56 . N parsed_2mk3 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.574 -45.574 . A 55 . C A 56 . N A 56 . CA A 56 . C parsed_2mk3 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.832 -17.832 . A 56 . N A 56 . CA A 56 . C A 57 . N parsed_2mk3 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.086 -46.086 . A 56 . C A 57 . N A 57 . CA A 57 . C parsed_2mk3 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.845 -19.845 . A 57 . N A 57 . CA A 57 . C A 58 . N parsed_2mk3 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.495 -45.495 . A 57 . C A 58 . N A 58 . CA A 58 . C parsed_2mk3 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.321 -23.321 . A 58 . N A 58 . CA A 58 . C A 59 . N parsed_2mk3 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.934 -47.934 . A 58 . C A 59 . N A 59 . CA A 59 . C parsed_2mk3 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.403 -21.403 . A 59 . N A 59 . CA A 59 . C A 60 . N parsed_2mk3 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.048 -46.048 . A 59 . C A 60 . N A 60 . CA A 60 . C parsed_2mk3 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.989 -17.989 . A 60 . N A 60 . CA A 60 . C A 61 . N parsed_2mk3 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.875 -48.875 . A 60 . C A 61 . N A 61 . CA A 61 . C parsed_2mk3 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.259 -14.259 . A 61 . N A 61 . CA A 61 . C A 62 . N parsed_2mk3 1 101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.434 -50.434 . A 61 . C A 62 . N A 62 . CA A 62 . C parsed_2mk3 1 102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.516 -8.516 . A 62 . N A 62 . CA A 62 . C A 63 . N parsed_2mk3 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 ; !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! Dihedral !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ; 1 1 5 67 parsed_2mk3 1 stop_ save_
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