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
436724 2k1g 15603 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2k1g


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              138
    _TA_constraint_stats_list.Viol_count                    86
    _TA_constraint_stats_list.Viol_total                    2024.27
    _TA_constraint_stats_list.Viol_max                      4.87
    _TA_constraint_stats_list.Viol_rms                      0.27
    _TA_constraint_stats_list.Viol_average_all_restraints   0.04
    _TA_constraint_stats_list.Viol_average_violations_only  1.18
    _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   4 ASP C 1   5 VAL N  1   5 VAL CA 1   5 VAL C  -98.67  -18.67  -53.38  -57.20  -58.71    .  . 0 "[    .    1    .    2]" 
         2 . 1   5 VAL N 1   5 VAL CA 1   5 VAL C  1   6 LYS N  -90.44    9.56  -50.23  -54.23  -57.08    .  . 0 "[    .    1    .    2]" 
         3 . 1   5 VAL C 1   6 LYS N  1   6 LYS CA 1   6 LYS C -100.29  -20.29  -57.34  -57.30  -57.67    .  . 0 "[    .    1    .    2]" 
         4 . 1   6 LYS N 1   6 LYS CA 1   6 LYS C  1   7 SER N  -94.03    5.97  -46.14  -56.95  -37.76    .  . 0 "[    .    1    .    2]" 
         5 . 1   6 LYS C 1   7 SER N  1   7 SER CA 1   7 SER C -101.25  -21.25  -59.86  -69.05  -53.19    .  . 0 "[    .    1    .    2]" 
         6 . 1   7 SER N 1   7 SER CA 1   7 SER C  1   8 ARG N  -93.26    6.74  -41.81  -45.44  -46.89    .  . 0 "[    .    1    .    2]" 
         7 . 1   7 SER C 1   8 ARG N  1   8 ARG CA 1   8 ARG C -106.23  -26.23  -66.93  -66.26  -67.39    .  . 0 "[    .    1    .    2]" 
         8 . 1   8 ARG N 1   8 ARG CA 1   8 ARG C  1   9 ILE N  -94.91    5.09  -41.74  -53.93  -30.03    .  . 0 "[    .    1    .    2]" 
         9 . 1   8 ARG C 1   9 ILE N  1   9 ILE CA 1   9 ILE C -104.69  -24.69  -62.59  -58.35  -60.06    .  . 0 "[    .    1    .    2]" 
        10 . 1   9 ILE N 1   9 ILE CA 1   9 ILE C  1  10 MET N  -91.78    8.22  -44.11  -46.74  -47.79    .  . 0 "[    .    1    .    2]" 
        11 . 1   9 ILE C 1  10 MET N  1  10 MET CA 1  10 MET C -105.77  -25.77  -65.43  -67.08  -67.22    .  . 0 "[    .    1    .    2]" 
        12 . 1  10 MET N 1  10 MET CA 1  10 MET C  1  11 ASP N  -86.02   13.98  -33.73  -32.04  -34.01    .  . 0 "[    .    1    .    2]" 
        13 . 1  10 MET C 1  11 ASP N  1  11 ASP CA 1  11 ASP C -108.43  -28.43  -59.86  -68.43  -54.06    .  . 0 "[    .    1    .    2]" 
        14 . 1  11 ASP N 1  11 ASP CA 1  11 ASP C  1  12 GLN N  -86.98   13.02  -44.34  -43.65  -44.81    .  . 0 "[    .    1    .    2]" 
        15 . 1  11 ASP C 1  12 GLN N  1  12 GLN CA 1  12 GLN C -103.77  -23.77  -68.42  -78.87  -62.01    .  . 0 "[    .    1    .    2]" 
        16 . 1  12 GLN N 1  12 GLN CA 1  12 GLN C  1  13 TYR N  -94.42    5.58  -44.61  -55.19  -31.82    .  . 0 "[    .    1    .    2]" 
        17 . 1  12 GLN C 1  13 TYR N  1  13 TYR CA 1  13 TYR C -103.19  -23.19  -53.70  -49.01  -50.44    .  . 0 "[    .    1    .    2]" 
        18 . 1  13 TYR N 1  13 TYR CA 1  13 TYR C  1  14 ALA N  -93.37    6.63  -38.41  -47.06  -32.66    .  . 0 "[    .    1    .    2]" 
        19 . 1  13 TYR C 1  14 ALA N  1  14 ALA CA 1  14 ALA C -102.10  -22.10  -56.65  -62.92  -52.73    .  . 0 "[    .    1    .    2]" 
        20 . 1  14 ALA N 1  14 ALA CA 1  14 ALA C  1  15 ASP N  -90.04    9.96  -28.88  -40.24  -18.40    .  . 0 "[    .    1    .    2]" 
        21 . 1  14 ALA C 1  15 ASP N  1  15 ASP CA 1  15 ASP C -111.05  -31.05  -81.65  -86.65  -88.89    .  . 0 "[    .    1    .    2]" 
        22 . 1  15 ASP N 1  15 ASP CA 1  15 ASP C  1  16 TRP N  -83.24   16.76  -30.42  -47.12  -19.80    .  . 0 "[    .    1    .    2]" 
        23 . 1  20 ARG C 1  21 TYR N  1  21 TYR CA 1  21 TYR C -136.20  -56.20  -84.06  -81.25  -83.64    .  . 0 "[    .    1    .    2]" 
        24 . 1  21 TYR N 1  21 TYR CA 1  21 TYR C  1  22 ARG N   82.27 -177.73  128.14  123.01  121.46    .  . 0 "[    .    1    .    2]" 
        25 . 1  21 TYR C 1  22 ARG N  1  22 ARG CA 1  22 ARG C -136.46  -56.46 -135.10 -137.08 -137.57 1.93 12 0 "[    .    1    .    2]" 
        26 . 1  22 ARG N 1  22 ARG CA 1  22 ARG C  1  23 LEU N   76.71  176.71  122.67   97.48  176.87 0.16 13 0 "[    .    1    .    2]" 
        27 . 1  25 GLY C 1  26 SER N  1  26 SER CA 1  26 SER C -124.86  -44.86  -94.83 -128.00  -67.26 3.14  7 0 "[    .    1    .    2]" 
        28 . 1  26 SER N 1  26 SER CA 1  26 SER C  1  27 THR N  101.32 -158.68  105.37   98.28  119.41 3.04 19 0 "[    .    1    .    2]" 
        29 . 1  30 GLY C 1  31 ILE N  1  31 ILE CA 1  31 ILE C -165.29  -85.29 -149.57 -151.63 -154.53 0.20  3 0 "[    .    1    .    2]" 
        30 . 1  31 ILE N 1  31 ILE CA 1  31 ILE C  1  32 ASP N  104.65 -155.35  148.66  147.50  146.40    .  . 0 "[    .    1    .    2]" 
        31 . 1  31 ILE C 1  32 ASP N  1  32 ASP CA 1  32 ASP C -141.34  -61.34  -94.12  -95.11  -95.93    .  . 0 "[    .    1    .    2]" 
        32 . 1  32 ASP N 1  32 ASP CA 1  32 ASP C  1  33 CYS N  102.81 -157.19  175.86  160.04 -171.37    .  . 0 "[    .    1    .    2]" 
        33 . 1  32 ASP C 1  33 CYS N  1  33 CYS CA 1  33 CYS C  -96.35  -16.35  -59.77  -60.27  -61.31    .  . 0 "[    .    1    .    2]" 
        34 . 1  33 CYS N 1  33 CYS CA 1  33 CYS C  1  34 SER N  -90.39    9.61  -52.18  -61.25  -39.72    .  . 0 "[    .    1    .    2]" 
        35 . 1  33 CYS C 1  34 SER N  1  34 SER CA 1  34 SER C -106.13  -26.13  -65.41  -63.97  -65.53    .  . 0 "[    .    1    .    2]" 
        36 . 1  34 SER N 1  34 SER CA 1  34 SER C  1  35 GLY N  -88.09   11.91  -38.44  -47.01  -27.58    .  . 0 "[    .    1    .    2]" 
        37 . 1  35 GLY C 1  36 PHE N  1  36 PHE CA 1  36 PHE C -104.07  -24.07  -63.02  -64.34  -65.32    .  . 0 "[    .    1    .    2]" 
        38 . 1  36 PHE N 1  36 PHE CA 1  36 PHE C  1  37 VAL N  -87.13   12.87  -52.48  -57.78  -47.25    .  . 0 "[    .    1    .    2]" 
        39 . 1  36 PHE C 1  37 VAL N  1  37 VAL CA 1  37 VAL C -104.87  -24.87  -61.17  -67.90  -57.00    .  . 0 "[    .    1    .    2]" 
        40 . 1  37 VAL N 1  37 VAL CA 1  37 VAL C  1  38 GLN N  -92.58    7.42  -43.10  -52.82  -36.49    .  . 0 "[    .    1    .    2]" 
        41 . 1  37 VAL C 1  38 GLN N  1  38 GLN CA 1  38 GLN C -101.08  -21.08  -58.05  -65.99  -50.85    .  . 0 "[    .    1    .    2]" 
        42 . 1  38 GLN N 1  38 GLN CA 1  38 GLN C  1  39 ARG N  -90.38    9.62  -47.85  -44.85  -48.64    .  . 0 "[    .    1    .    2]" 
        43 . 1  38 GLN C 1  39 ARG N  1  39 ARG CA 1  39 ARG C -106.42  -26.42  -62.85  -72.00  -52.24    .  . 0 "[    .    1    .    2]" 
        44 . 1  39 ARG N 1  39 ARG CA 1  39 ARG C  1  40 THR N  -91.56    8.44  -50.16  -45.04  -46.53    .  . 0 "[    .    1    .    2]" 
        45 . 1  39 ARG C 1  40 THR N  1  40 THR CA 1  40 THR C -103.91  -23.91  -50.52  -57.81  -40.75    .  . 0 "[    .    1    .    2]" 
        46 . 1  40 THR N 1  40 THR CA 1  40 THR C  1  41 PHE N  -93.34    6.66  -49.69  -50.18  -51.10    .  . 0 "[    .    1    .    2]" 
        47 . 1  40 THR C 1  41 PHE N  1  41 PHE CA 1  41 PHE C  -99.73  -19.73  -71.15  -73.78  -74.94    .  . 0 "[    .    1    .    2]" 
        48 . 1  41 PHE N 1  41 PHE CA 1  41 PHE C  1  42 ARG N  -91.41    8.59  -38.87  -44.46  -31.22    .  . 0 "[    .    1    .    2]" 
        49 . 1  41 PHE C 1  42 ARG N  1  42 ARG CA 1  42 ARG C -102.73  -22.73  -72.96  -80.31  -62.00    .  . 0 "[    .    1    .    2]" 
        50 . 1  42 ARG N 1  42 ARG CA 1  42 ARG C  1  43 GLU N  -92.67    7.33  -32.31  -36.72  -39.67    .  . 0 "[    .    1    .    2]" 
        51 . 1  42 ARG C 1  43 GLU N  1  43 GLU CA 1  43 GLU C -103.90  -23.90  -77.73  -88.00  -97.10    .  . 0 "[    .    1    .    2]" 
        52 . 1  43 GLU N 1  43 GLU CA 1  43 GLU C  1  44 GLN N  -87.75   12.25  -42.43  -72.99  -18.49    .  . 0 "[    .    1    .    2]" 
        53 . 1  43 GLU C 1  44 GLN N  1  44 GLN CA 1  44 GLN C -110.67  -30.67  -89.08  -87.11  -87.28    .  . 0 "[    .    1    .    2]" 
        54 . 1  44 GLN N 1  44 GLN CA 1  44 GLN C  1  45 PHE N  -69.22   30.78  -54.38  -70.31   -5.96 1.09 19 0 "[    .    1    .    2]" 
        55 . 1  46 GLY C 1  47 LEU N  1  47 LEU CA 1  47 LEU C -137.95  -57.95  -92.85  -95.47 -100.34    .  . 0 "[    .    1    .    2]" 
        56 . 1  47 LEU N 1  47 LEU CA 1  47 LEU C  1  48 GLU N   86.55 -173.45  124.97  110.75  160.09    .  . 0 "[    .    1    .    2]" 
        57 . 1  47 LEU C 1  48 GLU N  1  48 GLU CA 1  48 GLU C -130.63  -50.63  -85.16  -98.63  -69.60    .  . 0 "[    .    1    .    2]" 
        58 . 1  48 GLU N 1  48 GLU CA 1  48 GLU C  1  49 LEU N   70.78  170.78  103.49   92.36   88.78    .  . 0 "[    .    1    .    2]" 
        59 . 1  48 GLU C 1  49 LEU N  1  49 LEU CA 1  49 LEU C -139.72  -59.72 -107.24  -88.93  -92.67 0.05 10 0 "[    .    1    .    2]" 
        60 . 1  49 LEU N 1  49 LEU CA 1  49 LEU C  1  50 PRO N   67.92  167.92  144.81  142.37  139.83    .  . 0 "[    .    1    .    2]" 
        61 . 1  52 SER C 1  53 THR N  1  53 THR CA 1  53 THR C  -99.63  -19.63  -52.80  -56.87  -46.04    .  . 0 "[    .    1    .    2]" 
        62 . 1  53 THR N 1  53 THR CA 1  53 THR C  1  54 TYR N  -88.32   11.68  -44.15  -40.13  -41.62    .  . 0 "[    .    1    .    2]" 
        63 . 1  53 THR C 1  54 TYR N  1  54 TYR CA 1  54 TYR C  -98.97  -18.97  -55.78  -55.45  -57.17    .  . 0 "[    .    1    .    2]" 
        64 . 1  54 TYR N 1  54 TYR CA 1  54 TYR C  1  55 GLU N  -91.65    8.35  -37.87  -47.08  -17.04    .  . 0 "[    .    1    .    2]" 
        65 . 1  54 TYR C 1  55 GLU N  1  55 GLU CA 1  55 GLU C -106.31  -26.31  -73.78  -75.93  -78.62    .  . 0 "[    .    1    .    2]" 
        66 . 1  55 GLU N 1  55 GLU CA 1  55 GLU C  1  56 GLN N  -89.25   10.75  -40.15  -40.96  -42.59    .  . 0 "[    .    1    .    2]" 
        67 . 1  55 GLU C 1  56 GLN N  1  56 GLN CA 1  56 GLN C -101.95  -21.95  -63.10  -67.92  -54.25    .  . 0 "[    .    1    .    2]" 
        68 . 1  56 GLN N 1  56 GLN CA 1  56 GLN C  1  57 GLN N  -91.49    8.51  -31.70  -36.12  -43.87    .  . 0 "[    .    1    .    2]" 
        69 . 1  56 GLN C 1  57 GLN N  1  57 GLN CA 1  57 GLN C -103.10  -23.10  -61.65  -78.28  -52.01    .  . 0 "[    .    1    .    2]" 
        70 . 1  57 GLN N 1  57 GLN CA 1  57 GLN C  1  58 GLU N  -74.33   25.67  -29.33  -55.15   -6.58    .  . 0 "[    .    1    .    2]" 
        71 . 1  60 GLY C 1  61 LYS N  1  61 LYS CA 1  61 LYS C -150.12  -70.12  -93.83 -127.75  -70.88    .  . 0 "[    .    1    .    2]" 
        72 . 1  61 LYS N 1  61 LYS CA 1  61 LYS C  1  62 SER N   97.71 -162.29  150.45  159.69  153.94    .  . 0 "[    .    1    .    2]" 
        73 . 1  62 SER C 1  63 VAL N  1  63 VAL CA 1  63 VAL C -160.90  -80.90 -137.04 -140.42 -142.50    .  . 0 "[    .    1    .    2]" 
        74 . 1  63 VAL N 1  63 VAL CA 1  63 VAL C  1  64 SER N  100.74 -159.26  157.23  137.95  174.06    .  . 0 "[    .    1    .    2]" 
        75 . 1  63 VAL C 1  64 SER N  1  64 SER CA 1  64 SER C -116.37  -36.37 -101.91 -117.16  -80.13 0.79  2 0 "[    .    1    .    2]" 
        76 . 1  64 SER N 1  64 SER CA 1  64 SER C  1  65 ARG N  101.55 -158.45  178.25 -179.98  179.67    .  . 0 "[    .    1    .    2]" 
        77 . 1  64 SER C 1  65 ARG N  1  65 ARG CA 1  65 ARG C  -98.09  -18.09  -50.28  -47.53  -49.08    .  . 0 "[    .    1    .    2]" 
        78 . 1  65 ARG N 1  65 ARG CA 1  65 ARG C  1  66 SER N  -80.92   19.08  -44.58  -61.49  -29.19    .  . 0 "[    .    1    .    2]" 
        79 . 1  65 ARG C 1  66 SER N  1  66 SER CA 1  66 SER C -111.23  -31.23  -75.52  -74.57  -75.69    .  . 0 "[    .    1    .    2]" 
        80 . 1  66 SER N 1  66 SER CA 1  66 SER C  1  67 ASN N  -76.59   23.41  -15.73  -16.93  -21.14    .  . 0 "[    .    1    .    2]" 
        81 . 1  69 ARG C 1  70 THR N  1  70 THR CA 1  70 THR C -101.62  -21.62  -77.23 -106.12  -38.67 4.50  3 0 "[    .    1    .    2]" 
        82 . 1  70 THR N 1  70 THR CA 1  70 THR C  1  71 GLY N   82.48 -177.52  110.78  114.84  111.35    .  . 0 "[    .    1    .    2]" 
        83 . 1  72 ASP C 1  73 LEU N  1  73 LEU CA 1  73 LEU C -146.29  -66.29  -90.88  -96.37  -99.86    .  . 0 "[    .    1    .    2]" 
        84 . 1  73 LEU N 1  73 LEU CA 1  73 LEU C  1  74 VAL N  104.09 -155.91  113.21  112.32  110.98 0.58 13 0 "[    .    1    .    2]" 
        85 . 1  73 LEU C 1  74 VAL N  1  74 VAL CA 1  74 VAL C -177.05  -97.05  -95.61  -95.67  -96.16 2.90 20 0 "[    .    1    .    2]" 
        86 . 1  74 VAL N 1  74 VAL CA 1  74 VAL C  1  75 LEU N  109.44 -150.56  124.22  124.80  123.98    .  . 0 "[    .    1    .    2]" 
        87 . 1  74 VAL C 1  75 LEU N  1  75 LEU CA 1  75 LEU C -158.61  -78.61  -96.87 -106.56  -87.37    .  . 0 "[    .    1    .    2]" 
        88 . 1  75 LEU N 1  75 LEU CA 1  75 LEU C  1  76 PHE N   89.67 -170.33  128.58  115.10  143.44    .  . 0 "[    .    1    .    2]" 
        89 . 1  75 LEU C 1  76 PHE N  1  76 PHE CA 1  76 PHE C -164.33  -84.33 -117.94 -117.41 -120.22    .  . 0 "[    .    1    .    2]" 
        90 . 1  76 PHE N 1  76 PHE CA 1  76 PHE C  1  77 ARG N   94.63 -165.37  143.32  151.61  141.89    .  . 0 "[    .    1    .    2]" 
        91 . 1  77 ARG C 1  78 ALA N  1  78 ALA CA 1  78 ALA C -174.01  -94.01  -98.16 -118.87 -126.90 4.87  3 0 "[    .    1    .    2]" 
        92 . 1  78 ALA N 1  78 ALA CA 1  78 ALA C  1  79 GLY N  100.65 -159.35  136.41  152.97  147.99 0.54  7 0 "[    .    1    .    2]" 
        93 . 1  82 GLY C 1  83 ARG N  1  83 ARG CA 1  83 ARG C -167.27  -87.27 -105.86 -119.46 -126.65 1.11  7 0 "[    .    1    .    2]" 
        94 . 1  83 ARG N 1  83 ARG CA 1  83 ARG C  1  84 HIS N   87.62 -172.38  110.27  134.97  128.37    .  . 0 "[    .    1    .    2]" 
        95 . 1  83 ARG C 1  84 HIS N  1  84 HIS CA 1  84 HIS C -164.66  -84.66 -105.44 -165.67  -84.04 1.01  3 0 "[    .    1    .    2]" 
        96 . 1  84 HIS N 1  84 HIS CA 1  84 HIS C  1  85 VAL N   80.80 -179.20  144.62  118.90  160.46    .  . 0 "[    .    1    .    2]" 
        97 . 1  84 HIS C 1  85 VAL N  1  85 VAL CA 1  85 VAL C -175.17  -95.17 -130.57 -135.93 -136.71    .  . 0 "[    .    1    .    2]" 
        98 . 1  85 VAL N 1  85 VAL CA 1  85 VAL C  1  86 GLY N   92.31 -167.69  137.61  138.58  137.94    .  . 0 "[    .    1    .    2]" 
        99 . 1  92 ASN C 1  93 GLN N  1  93 GLN CA 1  93 GLN C -160.96  -80.96  -94.25 -114.99  -81.03    .  . 0 "[    .    1    .    2]" 
       100 . 1  93 GLN N 1  93 GLN CA 1  93 GLN C  1  94 PHE N   96.09 -163.91  143.76  145.24  144.62    .  . 0 "[    .    1    .    2]" 
       101 . 1  93 GLN C 1  94 PHE N  1  94 PHE CA 1  94 PHE C  177.66 -102.34 -152.05 -151.41 -152.03    .  . 0 "[    .    1    .    2]" 
       102 . 1  94 PHE N 1  94 PHE CA 1  94 PHE C  1  95 VAL N   97.97 -162.03  145.97  148.68  146.59    .  . 0 "[    .    1    .    2]" 
       103 . 1  94 PHE C 1  95 VAL N  1  95 VAL CA 1  95 VAL C -166.70  -86.70  -99.92 -106.67  -93.08    .  . 0 "[    .    1    .    2]" 
       104 . 1  95 VAL N 1  95 VAL CA 1  95 VAL C  1  96 HIS N   91.87 -168.13  136.21  135.91  133.86    .  . 0 "[    .    1    .    2]" 
       105 . 1  95 VAL C 1  96 HIS N  1  96 HIS CA 1  96 HIS C -174.54  -94.54 -159.27 -166.45 -150.65    .  . 0 "[    .    1    .    2]" 
       106 . 1  96 HIS N 1  96 HIS CA 1  96 HIS C  1  97 ALA N   94.24 -165.76  171.33  150.14 -166.28    .  . 0 "[    .    1    .    2]" 
       107 . 1  96 HIS C 1  97 ALA N  1  97 ALA CA 1  97 ALA C -158.74  -78.74 -102.40  -94.54  -97.93    .  . 0 "[    .    1    .    2]" 
       108 . 1  97 ALA N 1  97 ALA CA 1  97 ALA C  1  98 SER N   80.35 -179.65   99.42   86.99  122.92    .  . 0 "[    .    1    .    2]" 
       109 . 1  97 ALA C 1  98 SER N  1  98 SER CA 1  98 SER C -137.43  -57.43  -78.90  -81.89  -86.08    .  . 0 "[    .    1    .    2]" 
       110 . 1  98 SER N 1  98 SER CA 1  98 SER C  1  99 THR N   95.92 -164.08  145.45  149.38  146.04    .  . 0 "[    .    1    .    2]" 
       111 . 1  98 SER C 1  99 THR N  1  99 THR CA 1  99 THR C -101.90  -21.90  -60.13  -81.19  -47.43    .  . 0 "[    .    1    .    2]" 
       112 . 1  99 THR N 1  99 THR CA 1  99 THR C  1 100 SER N  -80.96   19.04  -32.49  -11.85  -17.76    .  . 0 "[    .    1    .    2]" 
       113 . 1  99 THR C 1 100 SER N  1 100 SER CA 1 100 SER C -112.39  -32.39  -93.83 -109.70  -65.95    .  . 0 "[    .    1    .    2]" 
       114 . 1 100 SER N 1 100 SER CA 1 100 SER C  1 101 SER N  -71.04   28.96  -44.31  -60.93  -67.47 0.21  1 0 "[    .    1    .    2]" 
       115 . 1 100 SER C 1 101 SER N  1 101 SER CA 1 101 SER C -138.13  -58.13  -98.56 -139.65  -58.71 1.52 17 0 "[    .    1    .    2]" 
       116 . 1 101 SER N 1 101 SER CA 1 101 SER C  1 102 GLY N  -52.36   47.64  -27.73  -52.82   13.79 0.46 11 0 "[    .    1    .    2]" 
       117 . 1 103 VAL C 1 104 ILE N  1 104 ILE CA 1 104 ILE C -171.83  -91.83 -138.15 -136.96 -138.23    .  . 0 "[    .    1    .    2]" 
       118 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C  1 105 ILE N  105.41 -154.59  178.33  168.47 -175.54    .  . 0 "[    .    1    .    2]" 
       119 . 1 104 ILE C 1 105 ILE N  1 105 ILE CA 1 105 ILE C -151.37  -71.37 -113.15 -122.28 -101.15    .  . 0 "[    .    1    .    2]" 
       120 . 1 105 ILE N 1 105 ILE CA 1 105 ILE C  1 106 SER N   83.60 -176.40  127.95  114.55  110.47    .  . 0 "[    .    1    .    2]" 
       121 . 1 106 SER C 1 107 SER N  1 107 SER CA 1 107 SER C -154.08  -74.08 -132.53 -127.99 -128.78    .  . 0 "[    .    1    .    2]" 
       122 . 1 107 SER N 1 107 SER CA 1 107 SER C  1 108 MET N   82.30 -177.70  141.97  153.67  148.40    .  . 0 "[    .    1    .    2]" 
       123 . 1 107 SER C 1 108 MET N  1 108 MET CA 1 108 MET C -107.62  -27.62  -68.30  -60.07  -63.39    .  . 0 "[    .    1    .    2]" 
       124 . 1 108 MET N 1 108 MET CA 1 108 MET C  1 109 ASN N  -71.29   28.71  -10.37  -30.42    8.74    .  . 0 "[    .    1    .    2]" 
       125 . 1 111 PRO C 1 112 TYR N  1 112 TYR CA 1 112 TYR C -106.61  -26.61  -60.60  -61.72  -63.18    .  . 0 "[    .    1    .    2]" 
       126 . 1 112 TYR N 1 112 TYR CA 1 112 TYR C  1 113 TRP N  -88.22   11.78  -47.23  -44.16  -45.00    .  . 0 "[    .    1    .    2]" 
       127 . 1 112 TYR C 1 113 TRP N  1 113 TRP CA 1 113 TRP C -115.18  -35.18  -77.11  -77.53  -78.89    .  . 0 "[    .    1    .    2]" 
       128 . 1 113 TRP N 1 113 TRP CA 1 113 TRP C  1 114 LYS N  -91.43    8.57  -36.07  -42.39  -27.97    .  . 0 "[    .    1    .    2]" 
       129 . 1 113 TRP C 1 114 LYS N  1 114 LYS CA 1 114 LYS C -101.59  -21.59  -57.02  -56.81  -58.13    .  . 0 "[    .    1    .    2]" 
       130 . 1 114 LYS N 1 114 LYS CA 1 114 LYS C  1 115 LYS N  -84.54   15.46  -45.67  -55.95  -32.63    .  . 0 "[    .    1    .    2]" 
       131 . 1 114 LYS C 1 115 LYS N  1 115 LYS CA 1 115 LYS C -109.73  -29.73  -85.54 -102.60  -73.24    .  . 0 "[    .    1    .    2]" 
       132 . 1 115 LYS N 1 115 LYS CA 1 115 LYS C  1 116 ARG N  -70.32   29.68  -13.52    0.47   -7.86    .  . 0 "[    .    1    .    2]" 
       133 . 1 116 ARG C 1 117 TYR N  1 117 TYR CA 1 117 TYR C -111.23  -31.23  -57.94  -61.26  -54.11    .  . 0 "[    .    1    .    2]" 
       134 . 1 117 TYR N 1 117 TYR CA 1 117 TYR C  1 118 ASN N   79.85  179.85  115.61   92.76  135.62    .  . 0 "[    .    1    .    2]" 
       135 . 1 119 GLU C 1 120 ALA N  1 120 ALA CA 1 120 ALA C -166.08  -86.08 -124.57 -146.69  -99.82    .  . 0 "[    .    1    .    2]" 
       136 . 1 120 ALA N 1 120 ALA CA 1 120 ALA C  1 121 ARG N   92.65 -167.35  151.90  137.63  169.41    .  . 0 "[    .    1    .    2]" 
       137 . 1 120 ALA C 1 121 ARG N  1 121 ARG CA 1 121 ARG C -174.49  -94.49 -140.45 -144.33 -146.84    .  . 0 "[    .    1    .    2]" 
       138 . 1 121 ARG N 1 121 ARG CA 1 121 ARG C  1 122 ARG N   98.50 -161.50  121.89  121.14  119.18    .  . 0 "[    .    1    .    2]" 
    stop_

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