NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype
545837 1ud7 4493 cing 4-filtered-FRED Wattos check violation dihedral angle


data_1ud7


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              48
    _TA_constraint_stats_list.Viol_count                    198
    _TA_constraint_stats_list.Viol_total                    1649.57
    _TA_constraint_stats_list.Viol_max                      1.56
    _TA_constraint_stats_list.Viol_rms                      0.23
    _TA_constraint_stats_list.Viol_average_all_restraints   0.09
    _TA_constraint_stats_list.Viol_average_violations_only  0.42
    _TA_constraint_stats_list.Cutoff_violation_report       5.00
    _TA_constraint_stats_list.Details                       
;
Description of the tags in this list:
*  1 * Administrative tag
*  2 * ID of the restraint list.                                                                 
*  3 * Number of restraints in list.                                                             
*  4 * Number of violated restraints (each model violation is used).                             
*  5 * Sum of violations in degrees.                                                             
*  6 * Maximum violation of a restraint without averaging in any way.                            
*  7 * Rms of violations over all restraints.                                                    
*  8 *  Average violation over all restraints.                                                   
*  9 *  Average violation over violated restraints.                                              
            This violation is averaged over only those models in which the restraint is violated.
            Threshold for reporting violations (degrees) in the last columns of the next table.     
*  10 * This tag.                                                                                

Description of the tags in the per restraint table below:
*  1 * Restraint ID within restraint list.                             
*  2 * Torsion angle name where available.                             
*  3 *     First atom's:                                               
*  4 * Chain identifier (can be absent if none defined)                
*  5 * Residue number                                                  
*  6 * Residue name                                                    
*  7 * Name of (pseudo-)atom                                           
*  8 *  Second thru fourth atom's identifiers occupy columns 7 thru 18.
*  19 * Lower bound (degrees)                                               
*  20 * Upper bound (degrees)                                               
*  21 * Average angle in ensemble of models                                 
*  22 * Minimum angle in ensemble of models (counter clockwise from range)  
*  23 * Maximum angle in ensemble of models         (clockwise from range)  
*  24 * Maximum violation (without any averaging)                           
*  25 * Model number with the maximum violation                             
*  26 * Number of models with a violation above cutoff                      
*  27 * List of models with a violation above cutoff. See description above.
*  28 * Administrative tag                                                  
*  29 * Administrative tag                                                  

;


    loop_
       _TA_constraint_stats.Restraint_ID
       _TA_constraint_stats.Torsion_angle_name
       _TA_constraint_stats.Entity_assembly_ID_1
       _TA_constraint_stats.Comp_index_ID_1
       _TA_constraint_stats.Comp_ID_1
       _TA_constraint_stats.Atom_ID_1
       _TA_constraint_stats.Entity_assembly_ID_2
       _TA_constraint_stats.Comp_index_ID_2
       _TA_constraint_stats.Comp_ID_2
       _TA_constraint_stats.Atom_ID_2
       _TA_constraint_stats.Entity_assembly_ID_3
       _TA_constraint_stats.Comp_index_ID_3
       _TA_constraint_stats.Comp_ID_3
       _TA_constraint_stats.Atom_ID_3
       _TA_constraint_stats.Entity_assembly_ID_4
       _TA_constraint_stats.Comp_index_ID_4
       _TA_constraint_stats.Comp_ID_4
       _TA_constraint_stats.Atom_ID_4
       _TA_constraint_stats.Angle_lower_bound_val
       _TA_constraint_stats.Angle_upper_bound_val
       _TA_constraint_stats.Angle_average
       _TA_constraint_stats.Angle_minimum
       _TA_constraint_stats.Angle_maximum
       _TA_constraint_stats.Max_violation
       _TA_constraint_stats.Max_violation_model_number
       _TA_constraint_stats.Over_cutoff_violation_count
       _TA_constraint_stats.Over_cutoff_violation_per_model

        1 . 1  1 MET C 1  2 GLN N 1  2 GLN CA 1  2 GLN C -140.00 -100.00  -99.00  -99.67  -98.58 1.42 11 0 "[    .    1    .    2]" 
        2 . 1  2 GLN C 1  3 VAL N 1  3 VAL CA 1  3 VAL C -140.00 -100.00 -112.86 -102.68 -110.38 0.39 13 0 "[    .    1    .    2]" 
        3 . 1  3 VAL C 1  4 PHE N 1  4 PHE CA 1  4 PHE C -140.00 -100.00 -118.99 -127.89 -111.61    .  . 0 "[    .    1    .    2]" 
        4 . 1  4 PHE C 1  5 LEU N 1  5 LEU CA 1  5 LEU C -140.00 -100.00 -118.98 -139.00 -105.88    .  . 0 "[    .    1    .    2]" 
        5 . 1  5 LEU C 1  6 LYS N 1  6 LYS CA 1  6 LYS C -140.00 -100.00 -104.68 -111.78  -99.84 0.16 19 0 "[    .    1    .    2]" 
        6 . 1  6 LYS C 1  7 THR N 1  7 THR CA 1  7 THR C -140.00 -100.00 -103.96  -99.91 -101.37 0.25 16 0 "[    .    1    .    2]" 
        7 . 1  7 THR C 1  8 LEU N 1  8 LEU CA 1  8 LEU C  -80.00  -40.00  -75.38  -80.27  -64.85 0.27 13 0 "[    .    1    .    2]" 
        8 . 1  8 LEU C 1  9 THR N 1  9 THR CA 1  9 THR C -140.00 -100.00 -102.85 -128.59  -98.86 1.14  3 0 "[    .    1    .    2]" 
        9 . 1 11 LYS C 1 12 THR N 1 12 THR CA 1 12 THR C -140.00 -100.00 -107.86 -100.40 -101.22 0.35  9 0 "[    .    1    .    2]" 
       10 . 1 12 THR C 1 13 VAL N 1 13 VAL CA 1 13 VAL C -140.00 -100.00 -112.29 -119.28  -99.80 0.20  7 0 "[    .    1    .    2]" 
       11 . 1 13 VAL C 1 14 THR N 1 14 THR CA 1 14 THR C -140.00 -100.00 -107.99 -105.43 -107.81 0.05 14 0 "[    .    1    .    2]" 
       12 . 1 14 THR C 1 15 ILE N 1 15 ILE CA 1 15 ILE C -140.00 -100.00 -123.06 -139.78  -99.90 0.10  9 0 "[    .    1    .    2]" 
       13 . 1 15 ILE C 1 16 GLU N 1 16 GLU CA 1 16 GLU C -140.00 -100.00 -100.12  -99.63  -99.70 0.68  3 0 "[    .    1    .    2]" 
       14 . 1 16 GLU C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -140.00 -100.00 -140.67 -140.38 -140.41 1.56 17 0 "[    .    1    .    2]" 
       15 . 1 17 VAL C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -140.00 -100.00 -121.02 -123.79 -126.38    .  . 0 "[    .    1    .    2]" 
       16 . 1 22 THR C 1 23 VAL N 1 23 VAL CA 1 23 VAL C  -80.00  -40.00  -47.85  -55.28  -41.51    .  . 0 "[    .    1    .    2]" 
       17 . 1 23 VAL C 1 24 GLU N 1 24 GLU CA 1 24 GLU C  -80.00  -40.00  -53.74  -60.23  -47.34    .  . 0 "[    .    1    .    2]" 
       18 . 1 25 ASN C 1 26 PHE N 1 26 PHE CA 1 26 PHE C  -80.00  -40.00  -57.97  -70.20  -52.04    .  . 0 "[    .    1    .    2]" 
       19 . 1 26 PHE C 1 27 LYS N 1 27 LYS CA 1 27 LYS C  -80.00  -40.00  -62.71  -70.97  -55.77    .  . 0 "[    .    1    .    2]" 
       20 . 1 30 ILE C 1 31 GLN N 1 31 GLN CA 1 31 GLN C  -80.00  -40.00  -58.36  -57.61  -59.37    .  . 0 "[    .    1    .    2]" 
       21 . 1 31 GLN C 1 32 ASP N 1 32 ASP CA 1 32 ASP C  -80.00  -40.00  -66.70  -68.02  -68.71    .  . 0 "[    .    1    .    2]" 
       22 . 1 33 LYS C 1 34 GLU N 1 34 GLU CA 1 34 GLU C -140.00 -100.00 -101.93 -100.49 -101.77 0.40  8 0 "[    .    1    .    2]" 
       23 . 1 35 GLY C 1 36 ILE N 1 36 ILE CA 1 36 ILE C -140.00 -100.00 -122.22 -140.29  -99.86 0.29 20 0 "[    .    1    .    2]" 
       24 . 1 39 ASP C 1 40 GLN N 1 40 GLN CA 1 40 GLN C -140.00 -100.00 -119.78 -126.82 -110.86    .  . 0 "[    .    1    .    2]" 
       25 . 1 40 GLN C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -140.00 -100.00 -101.55  -99.68  -99.79 0.64 11 0 "[    .    1    .    2]" 
       26 . 1 41 GLN C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -140.00 -100.00 -118.74 -119.00 -135.40 0.47 19 0 "[    .    1    .    2]" 
       27 . 1 42 ARG C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -140.00 -100.00 -101.28  -99.98 -100.15 0.49 17 0 "[    .    1    .    2]" 
       28 . 1 43 LEU C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -140.00 -100.00 -115.42 -115.24 -117.96 0.33  7 0 "[    .    1    .    2]" 
       29 . 1 44 ILE C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -140.00 -100.00 -125.86 -140.25 -107.81 0.25  4 0 "[    .    1    .    2]" 
       30 . 1 50 LEU C 1 51 GLU N 1 51 GLU CA 1 51 GLU C -140.00 -100.00 -103.85 -115.72  -99.63 0.37 17 0 "[    .    1    .    2]" 
       31 . 1 51 GLU C 1 52 ASP N 1 52 ASP CA 1 52 ASP C  -80.00  -40.00  -69.10  -73.56  -64.91    .  . 0 "[    .    1    .    2]" 
       32 . 1 53 GLY C 1 54 ARG N 1 54 ARG CA 1 54 ARG C -140.00 -100.00 -103.75 -111.61  -99.16 0.84 10 0 "[    .    1    .    2]" 
       33 . 1 54 ARG C 1 55 THR N 1 55 THR CA 1 55 THR C -140.00 -100.00 -121.49 -136.39 -114.31    .  . 0 "[    .    1    .    2]" 
       34 . 1 55 THR C 1 56 LEU N 1 56 LEU CA 1 56 LEU C  -80.00  -40.00  -57.98  -56.00  -60.93    .  . 0 "[    .    1    .    2]" 
       35 . 1 56 LEU C 1 57 SER N 1 57 SER CA 1 57 SER C  -80.00  -40.00  -60.81  -58.69  -60.53    .  . 0 "[    .    1    .    2]" 
       36 . 1 57 SER C 1 58 ASP N 1 58 ASP CA 1 58 ASP C  -80.00  -40.00  -64.45  -57.94  -60.67    .  . 0 "[    .    1    .    2]" 
       37 . 1 58 ASP C 1 59 TYR N 1 59 TYR CA 1 59 TYR C -140.00 -100.00  -99.89 -100.69 -101.33 1.41 12 0 "[    .    1    .    2]" 
       38 . 1 61 ILE C 1 62 GLN N 1 62 GLN CA 1 62 GLN C -140.00 -100.00 -106.55 -103.84 -107.71 0.97  2 0 "[    .    1    .    2]" 
       39 . 1 62 GLN C 1 63 LYS N 1 63 LYS CA 1 63 LYS C  -80.00  -40.00  -71.36  -78.97  -59.45    .  . 0 "[    .    1    .    2]" 
       40 . 1 65 SER C 1 66 THR N 1 66 THR CA 1 66 THR C -140.00 -100.00 -118.72 -127.08 -115.28    .  . 0 "[    .    1    .    2]" 
       41 . 1 66 THR C 1 67 ILE N 1 67 ILE CA 1 67 ILE C -140.00 -100.00 -125.51 -124.43 -128.97    .  . 0 "[    .    1    .    2]" 
       42 . 1 67 ILE C 1 68 HIS N 1 68 HIS CA 1 68 HIS C -140.00 -100.00 -102.29 -102.69 -103.42 0.36 11 0 "[    .    1    .    2]" 
       43 . 1 68 HIS C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -140.00 -100.00 -104.52 -101.86 -103.19 0.11 18 0 "[    .    1    .    2]" 
       44 . 1 69 LEU C 1 70 VAL N 1 70 VAL CA 1 70 VAL C -140.00 -100.00 -131.44 -140.15 -117.34 0.15 10 0 "[    .    1    .    2]" 
       45 . 1 48 LYS C 1 49 GLN N 1 49 GLN CA 1 49 GLN C -180.00    0.00  -76.72  -88.60  -98.21    .  . 0 "[    .    1    .    2]" 
       46 . 1 49 GLN C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -180.00    0.00  -70.42  -90.65  -42.20    .  . 0 "[    .    1    .    2]" 
       47 . 1 52 ASP C 1 53 GLY N 1 53 GLY CA 1 53 GLY C -180.00    0.00 -127.95 -102.90 -106.01    .  . 0 "[    .    1    .    2]" 
       48 . 1 70 VAL C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -180.00    0.00  -75.19  -65.63  -77.95    .  . 0 "[    .    1    .    2]" 
    stop_

save_


save_dihedral_constraint_statistics_2
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              45
    _TA_constraint_stats_list.Viol_count                    28
    _TA_constraint_stats_list.Viol_total                    103.00
    _TA_constraint_stats_list.Viol_max                      0.48
    _TA_constraint_stats_list.Viol_rms                      0.04
    _TA_constraint_stats_list.Viol_average_all_restraints   0.01
    _TA_constraint_stats_list.Viol_average_violations_only  0.18
    _TA_constraint_stats_list.Cutoff_violation_report       5.00
    _TA_constraint_stats_list.Details                       .

    loop_
       _TA_constraint_stats.Restraint_ID
       _TA_constraint_stats.Torsion_angle_name
       _TA_constraint_stats.Entity_assembly_ID_1
       _TA_constraint_stats.Comp_index_ID_1
       _TA_constraint_stats.Comp_ID_1
       _TA_constraint_stats.Atom_ID_1
       _TA_constraint_stats.Entity_assembly_ID_2
       _TA_constraint_stats.Comp_index_ID_2
       _TA_constraint_stats.Comp_ID_2
       _TA_constraint_stats.Atom_ID_2
       _TA_constraint_stats.Entity_assembly_ID_3
       _TA_constraint_stats.Comp_index_ID_3
       _TA_constraint_stats.Comp_ID_3
       _TA_constraint_stats.Atom_ID_3
       _TA_constraint_stats.Entity_assembly_ID_4
       _TA_constraint_stats.Comp_index_ID_4
       _TA_constraint_stats.Comp_ID_4
       _TA_constraint_stats.Atom_ID_4
       _TA_constraint_stats.Angle_lower_bound_val
       _TA_constraint_stats.Angle_upper_bound_val
       _TA_constraint_stats.Angle_average
       _TA_constraint_stats.Angle_minimum
       _TA_constraint_stats.Angle_maximum
       _TA_constraint_stats.Max_violation
       _TA_constraint_stats.Max_violation_model_number
       _TA_constraint_stats.Over_cutoff_violation_count
       _TA_constraint_stats.Over_cutoff_violation_per_model

        1 . 1  3 VAL HA 1  3 VAL CA 1  3 VAL CB  1  3 VAL HB   -90.00  -30.00  -62.79  -85.42  -50.76    .  . 0 "[    .    1    .    2]" 
        2 . 1 13 VAL HA 1 13 VAL CA 1 13 VAL CB  1 13 VAL HB   160.00  -40.00  -77.46 -159.97  -48.94    .  . 0 "[    .    1    .    2]" 
        3 . 1 17 VAL HA 1 17 VAL CA 1 17 VAL CB  1 17 VAL HB   -90.00  -30.00  -52.10  -80.82  -38.78    .  . 0 "[    .    1    .    2]" 
        4 . 1 23 VAL HA 1 23 VAL CA 1 23 VAL CB  1 23 VAL HB   150.00 -150.00  176.19  166.00 -170.47    .  . 0 "[    .    1    .    2]" 
        5 . 1  9 THR N  1  9 THR CA 1  9 THR CB  1  9 THR OG1   30.00   90.00   63.54   35.13   87.99    .  . 0 "[    .    1    .    2]" 
        6 . 1 12 THR N  1 12 THR CA 1 12 THR CB  1 12 THR OG1  160.00  -40.00  -47.95  -45.01  -47.07    .  . 0 "[    .    1    .    2]" 
        7 . 1 22 THR N  1 22 THR CA 1 22 THR CB  1 22 THR OG1   30.00   90.00   62.20   76.77   73.99    .  . 0 "[    .    1    .    2]" 
        8 . 1 55 THR N  1 55 THR CA 1 55 THR CB  1 55 THR OG1   30.00   90.00   65.06   45.69   86.76    .  . 0 "[    .    1    .    2]" 
        9 . 1 15 ILE N  1 15 ILE CA 1 15 ILE CB  1 15 ILE CG1  160.00  -40.00  -49.60  -60.87  -39.87 0.13  1 0 "[    .    1    .    2]" 
       10 . 1 30 ILE N  1 30 ILE CA 1 30 ILE CB  1 30 ILE CG1  -90.00  -30.00  -57.60  -68.14  -48.57    .  . 0 "[    .    1    .    2]" 
       11 . 1 36 ILE N  1 36 ILE CA 1 36 ILE CB  1 36 ILE CG1  -90.00  -30.00  -51.19  -47.83  -53.41    .  . 0 "[    .    1    .    2]" 
       12 . 1 44 ILE N  1 44 ILE CA 1 44 ILE CB  1 44 ILE CG1  160.00  -40.00  -51.36  -53.58  -57.09    .  . 0 "[    .    1    .    2]" 
       13 . 1 61 ILE N  1 61 ILE CA 1 61 ILE CB  1 61 ILE CG1  -90.00  -30.00  -61.51  -55.98  -58.09    .  . 0 "[    .    1    .    2]" 
       14 . 1 67 ILE N  1 67 ILE CA 1 67 ILE CB  1 67 ILE CG1  -90.00  -30.00  -57.11  -58.48  -59.24    .  . 0 "[    .    1    .    2]" 
       15 . 1  4 PHE N  1  4 PHE CA 1  4 PHE CB  1  4 PHE CG   -90.00  -30.00  -44.18  -55.32  -34.17    .  . 0 "[    .    1    .    2]" 
       16 . 1  5 LEU N  1  5 LEU CA 1  5 LEU CB  1  5 LEU CG   150.00 -150.00 -156.92  171.03 -149.52 0.48 20 0 "[    .    1    .    2]" 
       17 . 1  8 LEU N  1  8 LEU CA 1  8 LEU CB  1  8 LEU CG   -90.00  -30.00  -45.22  -63.57  -34.34    .  . 0 "[    .    1    .    2]" 
       18 . 1 18 GLU N  1 18 GLU CA 1 18 GLU CB  1 18 GLU CG   -90.00  -30.00  -71.36  -89.77  -37.74    .  . 0 "[    .    1    .    2]" 
       19 . 1 20 SER N  1 20 SER CA 1 20 SER CB  1 20 SER OG    30.00   90.00   45.55   58.69   47.49    .  . 0 "[    .    1    .    2]" 
       20 . 1 21 ASP N  1 21 ASP CA 1 21 ASP CB  1 21 ASP CG   -90.00  -30.00  -80.27  -90.39  -68.81 0.39 10 0 "[    .    1    .    2]" 
       21 . 1 26 PHE N  1 26 PHE CA 1 26 PHE CB  1 26 PHE CG   150.00 -150.00 -166.76 -175.52 -155.08    .  . 0 "[    .    1    .    2]" 
       22 . 1 27 LYS N  1 27 LYS CA 1 27 LYS CB  1 27 LYS CG   -90.00  -30.00  -62.73  -89.40  -40.45    .  . 0 "[    .    1    .    2]" 
       23 . 1 29 LYS N  1 29 LYS CA 1 29 LYS CB  1 29 LYS CG   -90.00  -30.00  -69.51  -32.85  -46.06    .  . 0 "[    .    1    .    2]" 
       24 . 1 31 GLN N  1 31 GLN CA 1 31 GLN CB  1 31 GLN CG   150.00 -150.00  179.26 -161.60 -165.27    .  . 0 "[    .    1    .    2]" 
       25 . 1 33 LYS N  1 33 LYS CA 1 33 LYS CB  1 33 LYS CG   -90.00  -30.00  -84.75  -85.77  -87.16 0.37 17 0 "[    .    1    .    2]" 
       26 . 1 34 GLU N  1 34 GLU CA 1 34 GLU CB  1 34 GLU CG   -90.00  -30.00  -64.99  -89.50  -33.29    .  . 0 "[    .    1    .    2]" 
       27 . 1 41 GLN N  1 41 GLN CA 1 41 GLN CB  1 41 GLN CG   -90.00  -30.00  -82.22  -89.21  -69.09    .  . 0 "[    .    1    .    2]" 
       28 . 1 43 LEU N  1 43 LEU CA 1 43 LEU CB  1 43 LEU CG   -90.00  -30.00  -43.90  -59.28  -33.93    .  . 0 "[    .    1    .    2]" 
       29 . 1 50 LEU N  1 50 LEU CA 1 50 LEU CB  1 50 LEU CG   -90.00  -30.00  -66.66  -89.13  -90.00 0.16 12 0 "[    .    1    .    2]" 
       30 . 1 51 GLU N  1 51 GLU CA 1 51 GLU CB  1 51 GLU CG   -90.00  -30.00  -65.02  -46.18  -50.33    .  . 0 "[    .    1    .    2]" 
       31 . 1 52 ASP N  1 52 ASP CA 1 52 ASP CB  1 52 ASP CG   -90.00  -30.00  -62.21  -89.62  -34.31    .  . 0 "[    .    1    .    2]" 
       32 . 1 56 LEU N  1 56 LEU CA 1 56 LEU CB  1 56 LEU CG   -90.00  -30.00  -47.37  -58.32  -32.73    .  . 0 "[    .    1    .    2]" 
       33 . 1 57 SER N  1 57 SER CA 1 57 SER CB  1 57 SER OG    30.00   90.00   75.17   47.19   90.16 0.16  9 0 "[    .    1    .    2]" 
       34 . 1 58 ASP N  1 58 ASP CA 1 58 ASP CB  1 58 ASP CG   -90.00  -30.00  -72.09  -78.90  -85.95    .  . 0 "[    .    1    .    2]" 
       35 . 1 59 TYR N  1 59 TYR CA 1 59 TYR CB  1 59 TYR CG   -90.00  -30.00  -61.73  -72.44  -50.82    .  . 0 "[    .    1    .    2]" 
       36 . 1 62 GLN N  1 62 GLN CA 1 62 GLN CB  1 62 GLN CG   -90.00  -30.00  -61.70  -47.09  -51.53    .  . 0 "[    .    1    .    2]" 
       37 . 1 64 GLU N  1 64 GLU CA 1 64 GLU CB  1 64 GLU CG   -90.00  -30.00  -56.89  -87.62  -30.14    .  . 0 "[    .    1    .    2]" 
       38 . 1 65 SER N  1 65 SER CA 1 65 SER CB  1 65 SER OG   -90.00  -30.00  -68.18  -44.34  -54.32    .  . 0 "[    .    1    .    2]" 
       39 . 1 69 LEU N  1 69 LEU CA 1 69 LEU CB  1 69 LEU CG   150.00 -150.00  170.37 -179.52  176.25    .  . 0 "[    .    1    .    2]" 
       40 . 1  5 LEU CA 1  5 LEU CB 1  5 LEU CG  1  5 LEU HG  -100.00  -20.00  -23.17  -47.07  -19.58 0.42 10 0 "[    .    1    .    2]" 
       41 . 1  8 LEU CA 1  8 LEU CB 1  8 LEU CG  1  8 LEU HG    20.00  100.00   55.27   50.54   42.41    .  . 0 "[    .    1    .    2]" 
       42 . 1 43 LEU CA 1 43 LEU CB 1 43 LEU CG  1 43 LEU HG    20.00  100.00   66.43   68.04   65.58    .  . 0 "[    .    1    .    2]" 
       43 . 1 69 LEU CA 1 69 LEU CB 1 69 LEU CG  1 69 LEU HG  -100.00  -20.00  -41.04  -28.46  -28.78    .  . 0 "[    .    1    .    2]" 
       44 . 1 30 ILE CA 1 30 ILE CB 1 30 ILE CG1 1 30 ILE CD1  140.00 -140.00  165.36  171.98  169.01    .  . 0 "[    .    1    .    2]" 
       45 . 1 61 ILE CA 1 61 ILE CB 1 61 ILE CG1 1 61 ILE CD1  140.00 -140.00 -178.81 -171.46 -172.08    .  . 0 "[    .    1    .    2]" 
    stop_

save_



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