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
630091 6alk 25590 cing 4-filtered-FRED Wattos check violation dihedral angle


data_6alk


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              177
    _TA_constraint_stats_list.Viol_count                    370
    _TA_constraint_stats_list.Viol_total                    8163.13
    _TA_constraint_stats_list.Viol_max                      7.09
    _TA_constraint_stats_list.Viol_rms                      0.46
    _TA_constraint_stats_list.Viol_average_all_restraints   0.12
    _TA_constraint_stats_list.Viol_average_violations_only  1.10
    _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   3 PHE C 1   4 THR N  1   4 THR CA 1   4 THR C -150.00  -78.54 -117.35 -113.10 -120.01    .  . 0 "[    .    1    .    2]" 
         2 . 1   4 THR N 1   4 THR CA 1   4 THR C  1   5 TYR N  100.00  153.26  106.78   98.25  127.16 1.75 10 0 "[    .    1    .    2]" 
         3 . 1   4 THR C 1   5 TYR N  1   5 TYR CA 1   5 TYR C -160.00  -95.22 -117.51 -111.55 -120.26 0.97 18 0 "[    .    1    .    2]" 
         4 . 1   5 TYR N 1   5 TYR CA 1   5 TYR C  1   6 GLU N  100.00 -177.70  134.13  105.28  158.67    .  . 0 "[    .    1    .    2]" 
         5 . 1   5 TYR C 1   6 GLU N  1   6 GLU CA 1   6 GLU C -170.00  -68.46 -131.45 -130.38 -137.91    .  . 0 "[    .    1    .    2]" 
         6 . 1   7 SER C 1   8 GLU N  1   8 GLU CA 1   8 GLU C -160.00 -107.60 -114.15 -120.81 -134.52 2.29  5 0 "[    .    1    .    2]" 
         7 . 1   9 THR C 1  10 THR N  1  10 THR CA 1  10 THR C -170.00  -79.92  -85.79  -81.27  -83.32 0.64 15 0 "[    .    1    .    2]" 
         8 . 1  10 THR N 1  10 THR CA 1  10 THR C  1  11 THR N  100.00  175.42  100.03   96.74  113.53 3.26  4 0 "[    .    1    .    2]" 
         9 . 1  10 THR C 1  11 THR N  1  11 THR CA 1  11 THR C -170.00  -62.04  -98.93  -96.84 -100.77    .  . 0 "[    .    1    .    2]" 
        10 . 1  11 THR N 1  11 THR CA 1  11 THR C  1  12 VAL N  100.00  169.08  137.46  112.97  158.35    .  . 0 "[    .    1    .    2]" 
        11 . 1  12 VAL C 1  13 ILE N  1  13 ILE CA 1  13 ILE C -100.00  -30.70  -84.02 -100.08  -71.90 0.08  3 0 "[    .    1    .    2]" 
        12 . 1  13 ILE N 1  13 ILE CA 1  13 ILE C  1  14 THR N  100.00 -170.76  155.99  160.97  158.94    .  . 0 "[    .    1    .    2]" 
        13 . 1  13 ILE C 1  14 THR N  1  14 THR CA 1  14 THR C -100.00  -49.18  -67.51  -66.69  -67.89    .  . 0 "[    .    1    .    2]" 
        14 . 1  14 THR N 1  14 THR CA 1  14 THR C  1  15 PRO N  120.00 -179.08  151.29  135.46  160.51    .  . 0 "[    .    1    .    2]" 
        15 . 1  14 THR C 1  15 PRO N  1  15 PRO CA 1  15 PRO C  -70.00  -39.92  -48.63  -59.09  -39.16 0.76  9 0 "[    .    1    .    2]" 
        16 . 1  15 PRO N 1  15 PRO CA 1  15 PRO C  1  16 ALA N  -60.00  -10.04  -34.15  -26.71  -28.89    .  . 0 "[    .    1    .    2]" 
        17 . 1  15 PRO C 1  16 ALA N  1  16 ALA CA 1  16 ALA C  -90.00  -32.66  -56.68  -60.71  -52.88    .  . 0 "[    .    1    .    2]" 
        18 . 1  16 ALA N 1  16 ALA CA 1  16 ALA C  1  17 ARG N  -70.00  -15.36  -44.00  -41.70  -42.07    .  . 0 "[    .    1    .    2]" 
        19 . 1  16 ALA C 1  17 ARG N  1  17 ARG CA 1  17 ARG C  -90.00  -39.34  -57.75  -58.87  -60.44    .  . 0 "[    .    1    .    2]" 
        20 . 1  17 ARG N 1  17 ARG CA 1  17 ARG C  1  18 LEU N  -70.00  -13.76  -32.96  -43.61  -17.85    .  . 0 "[    .    1    .    2]" 
        21 . 1  17 ARG C 1  18 LEU N  1  18 LEU CA 1  18 LEU C  -90.00  -32.86  -83.04  -91.11  -71.91 1.11 10 0 "[    .    1    .    2]" 
        22 . 1  18 LEU N 1  18 LEU CA 1  18 LEU C  1  19 PHE N  -70.00  -14.92  -51.84  -59.01  -29.50    .  . 0 "[    .    1    .    2]" 
        23 . 1  18 LEU C 1  19 PHE N  1  19 PHE CA 1  19 PHE C  -90.00  -39.94  -63.88  -65.08  -66.83 0.25  9 0 "[    .    1    .    2]" 
        24 . 1  19 PHE N 1  19 PHE CA 1  19 PHE C  1  20 LYS N  -60.00  -29.14  -29.65  -33.47  -27.36 1.78  7 0 "[    .    1    .    2]" 
        25 . 1  20 LYS C 1  21 ALA N  1  21 ALA CA 1  21 ALA C -100.00  -45.06  -78.93 -102.01  -63.45 2.01 15 0 "[    .    1    .    2]" 
        26 . 1  21 ALA N 1  21 ALA CA 1  21 ALA C  1  22 PHE N  -70.00    0.10  -49.28  -10.02  -38.40    .  . 0 "[    .    1    .    2]" 
        27 . 1  25 ASP C 1  26 ALA N  1  26 ALA CA 1  26 ALA C  -90.00  -36.40  -59.70  -75.88  -52.78    .  . 0 "[    .    1    .    2]" 
        28 . 1  26 ALA N 1  26 ALA CA 1  26 ALA C  1  27 ASP N  -70.00   -2.90  -33.46  -29.41  -30.45    .  . 0 "[    .    1    .    2]" 
        29 . 1  26 ALA C 1  27 ASP N  1  27 ASP CA 1  27 ASP C  -90.00  -24.64  -72.80  -69.91  -71.30    .  . 0 "[    .    1    .    2]" 
        30 . 1  27 ASP N 1  27 ASP CA 1  27 ASP C  1  28 ASN N  -60.00   -3.60  -18.69  -32.89   -2.07 1.53  7 0 "[    .    1    .    2]" 
        31 . 1  27 ASP C 1  28 ASN N  1  28 ASN CA 1  28 ASN C -100.00  -32.90  -91.44  -92.44  -93.33 0.52 17 0 "[    .    1    .    2]" 
        32 . 1  28 ASN N 1  28 ASN CA 1  28 ASN C  1  29 LEU N  -70.00   13.68  -22.98  -23.37  -25.41    .  . 0 "[    .    1    .    2]" 
        33 . 1  28 ASN C 1  29 LEU N  1  29 LEU CA 1  29 LEU C -110.00  -41.38  -95.93 -110.74  -81.26 0.74 19 0 "[    .    1    .    2]" 
        34 . 1  29 LEU C 1  30 ILE N  1  30 ILE CA 1  30 ILE C  -80.00  -31.14  -53.25  -60.67  -49.16    .  . 0 "[    .    1    .    2]" 
        35 . 1  30 ILE N 1  30 ILE CA 1  30 ILE C  1  31 PRO N  -70.00  -37.20  -53.90  -52.71  -52.73    .  . 0 "[    .    1    .    2]" 
        36 . 1  30 ILE C 1  31 PRO N  1  31 PRO CA 1  31 PRO C  -80.00  -30.00  -57.20  -61.75  -49.44    .  . 0 "[    .    1    .    2]" 
        37 . 1  31 PRO N 1  31 PRO CA 1  31 PRO C  1  32 LYS N  -50.00  -19.98  -21.97  -20.08  -21.45 1.35 10 0 "[    .    1    .    2]" 
        38 . 1  31 PRO C 1  32 LYS N  1  32 LYS CA 1  32 LYS C -110.00  -36.38 -103.30 -103.91 -106.46 0.47  8 0 "[    .    1    .    2]" 
        39 . 1  32 LYS N 1  32 LYS CA 1  32 LYS C  1  33 VAL N  -70.00   -0.50  -51.70  -58.78  -39.68    .  . 0 "[    .    1    .    2]" 
        40 . 1  32 LYS C 1  33 VAL N  1  33 VAL CA 1  33 VAL C -120.00  -45.96  -96.58  -94.79  -97.86    .  . 0 "[    .    1    .    2]" 
        41 . 1  33 VAL N 1  33 VAL CA 1  33 VAL C  1  34 ALA N  -60.00   36.10  -18.14  -23.03  -12.24    .  . 0 "[    .    1    .    2]" 
        42 . 1  35 PRO C 1  36 GLN N  1  36 GLN CA 1  36 GLN C -100.00  -40.72  -76.74  -80.18  -81.15    .  . 0 "[    .    1    .    2]" 
        43 . 1  36 GLN N 1  36 GLN CA 1  36 GLN C  1  37 ALA N  -50.00    2.88  -12.20  -24.06   -4.71    .  . 0 "[    .    1    .    2]" 
        44 . 1  37 ALA C 1  38 ILE N  1  38 ILE CA 1  38 ILE C -180.00  -91.18 -129.06 -139.29 -106.08    .  . 0 "[    .    1    .    2]" 
        45 . 1  38 ILE N 1  38 ILE CA 1  38 ILE C  1  39 LYS N  110.00  174.22  125.10  130.23  128.85    .  . 0 "[    .    1    .    2]" 
        46 . 1  38 ILE C 1  39 LYS N  1  39 LYS CA 1  39 LYS C -120.00  -55.06  -78.83  -92.00  -67.32    .  . 0 "[    .    1    .    2]" 
        47 . 1  42 GLU C 1  43 ILE N  1  43 ILE CA 1  43 ILE C -110.00  -59.92  -73.89 -117.09  -61.86 7.09 15 1 "[    .    1    +    2]" 
        48 . 1  44 ILE C 1  45 GLU N  1  45 GLU CA 1  45 GLU C -180.00 -120.26 -164.32 -163.69 -164.14    .  . 0 "[    .    1    .    2]" 
        49 . 1  45 GLU N 1  45 GLU CA 1  45 GLU C  1  46 GLY N  110.00  178.86  160.30  142.98  179.26 0.40 17 0 "[    .    1    .    2]" 
        50 . 1  51 GLY C 1  52 THR N  1  52 THR CA 1  52 THR C -120.00  -43.32  -75.69  -87.63  -59.89    .  . 0 "[    .    1    .    2]" 
        51 . 1  52 THR N 1  52 THR CA 1  52 THR C  1  53 ILE N  100.00  169.28  112.44  106.54  104.94 0.86 11 0 "[    .    1    .    2]" 
        52 . 1  52 THR C 1  53 ILE N  1  53 ILE CA 1  53 ILE C -150.00  -77.98  -91.21  -92.75  -96.89    .  . 0 "[    .    1    .    2]" 
        53 . 1  54 LYS C 1  55 LYS N  1  55 LYS CA 1  55 LYS C -150.00  -81.88  -87.79  -82.50  -85.02 1.62 14 0 "[    .    1    .    2]" 
        54 . 1  71 ILE C 1  72 ASP N  1  72 ASP CA 1  72 ASP C -130.00  -44.26  -74.71  -91.10  -59.11    .  . 0 "[    .    1    .    2]" 
        55 . 1  72 ASP N 1  72 ASP CA 1  72 ASP C  1  73 GLU N  -60.00   10.34  -37.95  -29.79  -31.71    .  . 0 "[    .    1    .    2]" 
        56 . 1  72 ASP C 1  73 GLU N  1  73 GLU CA 1  73 GLU C -180.00 -127.02 -152.96 -167.24 -139.78    .  . 0 "[    .    1    .    2]" 
        57 . 1  73 GLU N 1  73 GLU CA 1  73 GLU C  1  74 ILE N  120.00  170.04  135.21  119.48  150.42 0.52  5 0 "[    .    1    .    2]" 
        58 . 1  73 GLU C 1  74 ILE N  1  74 ILE CA 1  74 ILE C -160.00  -75.12 -139.80 -147.78 -149.25    .  . 0 "[    .    1    .    2]" 
        59 . 1  74 ILE N 1  74 ILE CA 1  74 ILE C  1  75 ASP N   90.00  166.26  129.90   93.12  142.98    .  . 0 "[    .    1    .    2]" 
        60 . 1  78 ASN N 1  78 ASN CA 1  78 ASN C  1  79 PHE N  -30.00   28.94   -1.65  -10.81   12.62    .  . 0 "[    .    1    .    2]" 
        61 . 1  79 PHE C 1  80 THR N  1  80 THR CA 1  80 THR C -170.00  -57.24 -130.22 -126.69 -133.63    .  . 0 "[    .    1    .    2]" 
        62 . 1  80 THR N 1  80 THR CA 1  80 THR C  1  81 TYR N  100.00  171.44  133.77  117.72  143.71    .  . 0 "[    .    1    .    2]" 
        63 . 1  80 THR C 1  81 TYR N  1  81 TYR CA 1  81 TYR C -160.00  -98.76 -130.16 -142.88 -146.70    .  . 0 "[    .    1    .    2]" 
        64 . 1  81 TYR N 1  81 TYR CA 1  81 TYR C  1  82 ALA N  100.00  174.24  111.09   98.67  144.72 1.33 17 0 "[    .    1    .    2]" 
        65 . 1  81 TYR C 1  82 ALA N  1  82 ALA CA 1  82 ALA C -160.00  -95.90 -109.00 -118.55 -125.27    .  . 0 "[    .    1    .    2]" 
        66 . 1  82 ALA N 1  82 ALA CA 1  82 ALA C  1  83 CYS N  100.00 -175.30  132.92  117.83  158.38    .  . 0 "[    .    1    .    2]" 
        67 . 1  82 ALA C 1  83 CYS N  1  83 CYS CA 1  83 CYS C -170.00  -69.36 -122.53 -126.83 -127.90    .  . 0 "[    .    1    .    2]" 
        68 . 1  83 CYS N 1  83 CYS CA 1  83 CYS C  1  84 THR N  100.00  170.30  136.90   99.66  160.99 0.34 11 0 "[    .    1    .    2]" 
        69 . 1  83 CYS C 1  84 THR N  1  84 THR CA 1  84 THR C -150.00  -82.14 -128.97 -123.52 -129.64 1.07  5 0 "[    .    1    .    2]" 
        70 . 1  84 THR N 1  84 THR CA 1  84 THR C  1  85 LEU N  100.00  152.42  155.38  156.37  156.19 4.18 12 0 "[    .    1    .    2]" 
        71 . 1  84 THR C 1  85 LEU N  1  85 LEU CA 1  85 LEU C -160.00  -38.48  -86.20  -86.23  -86.56    .  . 0 "[    .    1    .    2]" 
        72 . 1  85 LEU N 1  85 LEU CA 1  85 LEU C  1  86 ILE N  100.00  136.02  122.59  134.93  127.94 3.83  5 0 "[    .    1    .    2]" 
        73 . 1  93 GLU C 1  94 THR N  1  94 THR CA 1  94 THR C -130.00  -63.24  -95.19 -104.29 -130.23 1.70 12 0 "[    .    1    .    2]" 
        74 . 1  94 THR N 1  94 THR CA 1  94 THR C  1  95 LEU N  -40.00   31.52   12.81   30.64   22.53 2.11  2 0 "[    .    1    .    2]" 
        75 . 1  94 THR C 1  95 LEU N  1  95 LEU CA 1  95 LEU C -180.00  -42.88 -111.43 -128.72  -83.68    .  . 0 "[    .    1    .    2]" 
        76 . 1  95 LEU N 1  95 LEU CA 1  95 LEU C  1  96 GLU N  110.00 -178.42  167.04  140.08 -177.58 0.84 13 0 "[    .    1    .    2]" 
        77 . 1  97 LYS C 1  98 ILE N  1  98 ILE CA 1  98 ILE C -170.00  -82.42 -106.35 -130.58  -94.24    .  . 0 "[    .    1    .    2]" 
        78 . 1  99 ALA C 1 100 TYR N  1 100 TYR CA 1 100 TYR C -160.00  -90.96 -124.89 -141.53  -90.79 0.17 19 0 "[    .    1    .    2]" 
        79 . 1 101 GLU C 1 102 ILE N  1 102 ILE CA 1 102 ILE C -150.00  -99.02 -100.33 -103.21 -105.73 2.07 17 0 "[    .    1    .    2]" 
        80 . 1 103 LYS C 1 104 LEU N  1 104 LEU CA 1 104 LEU C -140.00  -89.78  -90.41  -99.84  -87.82 1.96 18 0 "[    .    1    .    2]" 
        81 . 1 105 VAL C 1 106 ALA N  1 106 ALA CA 1 106 ALA C -130.00  -40.06  -82.69  -73.11  -79.50    .  . 0 "[    .    1    .    2]" 
        82 . 1 106 ALA N 1 106 ALA CA 1 106 ALA C  1 107 SER N   90.00  160.14  127.97  113.72  140.30    .  . 0 "[    .    1    .    2]" 
        83 . 1 107 SER C 1 108 PRO N  1 108 PRO CA 1 108 PRO C  -90.00  -39.94  -52.29  -41.96  -55.94 0.80  2 0 "[    .    1    .    2]" 
        84 . 1 108 PRO N 1 108 PRO CA 1 108 PRO C  1 109 ASP N  -60.00   29.14  -30.76  -60.91    1.30 0.91 15 0 "[    .    1    .    2]" 
        85 . 1 108 PRO C 1 109 ASP N  1 109 ASP CA 1 109 ASP C -120.00  -50.82  -99.49 -121.70  -67.89 1.70 11 0 "[    .    1    .    2]" 
        86 . 1 109 ASP N 1 109 ASP CA 1 109 ASP C  1 110 GLY N  -30.00   34.66    5.78   32.04   19.90    .  . 0 "[    .    1    .    2]" 
        87 . 1 116 SER C 1 117 THR N  1 117 THR CA 1 117 THR C -150.00  -72.36  -96.72  -92.86  -96.21    .  . 0 "[    .    1    .    2]" 
        88 . 1 117 THR N 1 117 THR CA 1 117 THR C  1 118 SER N  100.00  151.62  110.17   98.81  133.69 1.19  2 0 "[    .    1    .    2]" 
        89 . 1 117 THR C 1 118 SER N  1 118 SER CA 1 118 SER C -150.00  -88.62  -99.59  -96.79  -99.64 0.93 13 0 "[    .    1    .    2]" 
        90 . 1 129 LYS C 1 130 GLU N  1 130 GLU CA 1 130 GLU C  -90.00  -39.46  -61.49  -57.26  -59.74 1.50 18 0 "[    .    1    .    2]" 
        91 . 1 130 GLU C 1 131 ASP N  1 131 ASP CA 1 131 ASP C  -90.00  -39.12  -62.00  -81.54  -50.97    .  . 0 "[    .    1    .    2]" 
        92 . 1 131 ASP N 1 131 ASP CA 1 131 ASP C  1 132 GLN N  -70.00  -17.80  -44.82  -46.06  -47.87    .  . 0 "[    .    1    .    2]" 
        93 . 1 131 ASP C 1 132 GLN N  1 132 GLN CA 1 132 GLN C  -80.00  -49.72  -74.41  -74.37  -75.22 0.61 13 0 "[    .    1    .    2]" 
        94 . 1 132 GLN N 1 132 GLN CA 1 132 GLN C  1 133 ILE N  -70.00  -18.32  -41.04  -51.98  -31.38    .  . 0 "[    .    1    .    2]" 
        95 . 1 132 GLN C 1 133 ILE N  1 133 ILE CA 1 133 ILE C  -90.00  -39.60  -59.54  -59.91  -60.38    .  . 0 "[    .    1    .    2]" 
        96 . 1 146 ALA C 1 147 VAL N  1 147 VAL CA 1 147 VAL C  -90.00  -38.20  -76.06  -74.95  -76.51    .  . 0 "[    .    1    .    2]" 
        97 . 1 147 VAL N 1 147 VAL CA 1 147 VAL C  1 148 GLU N  -70.00  -17.08  -37.89  -48.25  -24.13    .  . 0 "[    .    1    .    2]" 
        98 . 1 147 VAL C 1 148 GLU N  1 148 GLU CA 1 148 GLU C  -80.00  -46.30  -56.76  -63.11  -48.35    .  . 0 "[    .    1    .    2]" 
        99 . 1 148 GLU N 1 148 GLU CA 1 148 GLU C  1 149 ALA N  -70.00  -19.48  -44.63  -42.91  -45.64    .  . 0 "[    .    1    .    2]" 
       100 . 1 148 GLU C 1 149 ALA N  1 149 ALA CA 1 149 ALA C  -90.00  -39.16  -76.40  -90.45  -68.82 0.45 16 0 "[    .    1    .    2]" 
       101 . 1 149 ALA N 1 149 ALA CA 1 149 ALA C  1 150 TYR N  -70.00   -9.12  -38.12  -44.60  -29.75    .  . 0 "[    .    1    .    2]" 
       102 . 1 149 ALA C 1 150 TYR N  1 150 TYR CA 1 150 TYR C  -90.00  -39.92  -57.68  -64.03  -52.82    .  . 0 "[    .    1    .    2]" 
       103 . 1 152 LEU N 1 152 LEU CA 1 152 LEU C  1 153 ALA N  -60.00    7.16  -27.12    9.02  -23.80 5.97 19 1 "[    .    1    .   +2]" 
       104 . 1 154 ASN N 1 154 ASN CA 1 154 ASN C  1 155 PRO N  -70.00   -0.42  -52.95  -62.81  -36.12    .  . 0 "[    .    1    .    2]" 
       105 . 1 154 ASN C 1 155 PRO N  1 155 PRO CA 1 155 PRO C  -90.00  -32.32  -59.90  -51.43  -52.40    .  . 0 "[    .    1    .    2]" 
       106 . 1 155 PRO N 1 155 PRO CA 1 155 PRO C  1 156 ALA N  -60.00   11.72  -32.91  -43.93  -19.20    .  . 0 "[    .    1    .    2]" 
       107 . 1 155 PRO C 1 156 ALA N  1 156 ALA CA 1 156 ALA C -120.00  -67.22 -106.02  -96.56  -98.22 1.13  4 0 "[    .    1    .    2]" 
       108 . 1   6 GLU N 1   6 GLU CA 1   6 GLU C  1   7 SER N  100.00  172.02  128.89   98.81  164.07 1.19 17 0 "[    .    1    .    2]" 
       109 . 1   6 GLU C 1   7 SER N  1   7 SER CA 1   7 SER C -180.00  -98.98 -119.95 -111.64 -119.08 0.63 19 0 "[    .    1    .    2]" 
       110 . 1   7 SER N 1   7 SER CA 1   7 SER C  1   8 GLU N  110.00 -162.22  142.27  120.00 -178.81    .  . 0 "[    .    1    .    2]" 
       111 . 1   8 GLU N 1   8 GLU CA 1   8 GLU C  1   9 THR N  110.00  177.62  121.91  130.28  122.87 1.66 14 0 "[    .    1    .    2]" 
       112 . 1   8 GLU C 1   9 THR N  1   9 THR CA 1   9 THR C -150.00  -97.50  -97.43  -96.32  -96.57 2.07 18 0 "[    .    1    .    2]" 
       113 . 1   9 THR N 1   9 THR CA 1   9 THR C  1  10 THR N  100.00  153.00   97.98   96.83   99.14 3.17 12 0 "[    .    1    .    2]" 
       114 . 1  39 LYS N 1  39 LYS CA 1  39 LYS C  1  40 SER N  -60.00   31.54  -33.74  -40.73  -25.69    .  . 0 "[    .    1    .    2]" 
       115 . 1  39 LYS C 1  40 SER N  1  40 SER CA 1  40 SER C -180.00 -120.64 -141.21 -139.47 -142.12 0.82 10 0 "[    .    1    .    2]" 
       116 . 1  40 SER N 1  40 SER CA 1  40 SER C  1  41 SER N  120.00 -169.10  123.46  124.31  120.73 2.59  1 0 "[    .    1    .    2]" 
       117 . 1  43 ILE N 1  43 ILE CA 1  43 ILE C  1  44 ILE N  100.00  131.16  118.02  101.86  131.64 0.48 20 0 "[    .    1    .    2]" 
       118 . 1  43 ILE C 1  44 ILE N  1  44 ILE CA 1  44 ILE C -120.00  -50.84  -79.41  -72.41  -75.86    .  . 0 "[    .    1    .    2]" 
       119 . 1  44 ILE N 1  44 ILE CA 1  44 ILE C  1  45 GLU N  -60.00    8.72  -53.74  -62.13  -44.29 2.13 15 0 "[    .    1    .    2]" 
       120 . 1  53 ILE N 1  53 ILE CA 1  53 ILE C  1  54 LYS N  100.00  153.64  145.92  136.61  154.01 0.37  5 0 "[    .    1    .    2]" 
       121 . 1  53 ILE C 1  54 LYS N  1  54 LYS CA 1  54 LYS C -160.00 -108.14 -142.26 -133.07 -139.09    .  . 0 "[    .    1    .    2]" 
       122 . 1  54 LYS N 1  54 LYS CA 1  54 LYS C  1  55 LYS N  110.00 -162.22  125.12  109.02  154.57 0.98  9 0 "[    .    1    .    2]" 
       123 . 1  55 LYS N 1  55 LYS CA 1  55 LYS C  1  56 ILE N  100.00  154.46  114.77   99.71  141.03 0.29 18 0 "[    .    1    .    2]" 
       124 . 1  55 LYS C 1  56 ILE N  1  56 ILE CA 1  56 ILE C -140.00  -82.34 -105.68 -129.45  -92.79    .  . 0 "[    .    1    .    2]" 
       125 . 1  56 ILE C 1  57 THR N  1  57 THR CA 1  57 THR C -140.00  -57.38 -105.15 -110.21 -111.85    .  . 0 "[    .    1    .    2]" 
       126 . 1  56 ILE N 1  56 ILE CA 1  56 ILE C  1  57 THR N  100.00  149.88  111.84   98.37  125.41 1.63  8 0 "[    .    1    .    2]" 
       127 . 1  57 THR N 1  57 THR CA 1  57 THR C  1  58 PHE N  100.00  146.32  115.86  116.01  114.65    .  . 0 "[    .    1    .    2]" 
       128 . 1  98 ILE N 1  98 ILE CA 1  98 ILE C  1  99 ALA N  100.00  176.34  124.93   98.73  145.00 1.27 12 0 "[    .    1    .    2]" 
       129 . 1  98 ILE C 1  99 ALA N  1  99 ALA CA 1  99 ALA C -180.00  -85.90 -106.82  -97.49 -103.75 2.66 12 0 "[    .    1    .    2]" 
       130 . 1  99 ALA N 1  99 ALA CA 1  99 ALA C  1 100 TYR N  110.00  178.48  146.41  109.21  159.78 0.79  6 0 "[    .    1    .    2]" 
       131 . 1 100 TYR N 1 100 TYR CA 1 100 TYR C  1 101 GLU N  110.00  163.30  125.70  109.68  147.23 0.32 13 0 "[    .    1    .    2]" 
       132 . 1 100 TYR C 1 101 GLU N  1 101 GLU CA 1 101 GLU C -160.00  -84.06 -125.55 -139.00 -148.12    .  . 0 "[    .    1    .    2]" 
       133 . 1 101 GLU N 1 101 GLU CA 1 101 GLU C  1 102 ILE N  100.00  177.96  106.82   97.82  136.42 2.18 13 0 "[    .    1    .    2]" 
       134 . 1 102 ILE N 1 102 ILE CA 1 102 ILE C  1 103 LYS N  100.00  150.24  110.55   98.80  119.49 1.20  6 0 "[    .    1    .    2]" 
       135 . 1 102 ILE C 1 103 LYS N  1 103 LYS CA 1 103 LYS C -150.00  -99.60 -101.10 -110.72  -98.43 1.17  9 0 "[    .    1    .    2]" 
       136 . 1 103 LYS N 1 103 LYS CA 1 103 LYS C  1 104 LEU N  100.00  151.00  125.40  107.04  144.35    .  . 0 "[    .    1    .    2]" 
       137 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C  1 105 VAL N  100.00  151.42  113.13  118.41  113.67 0.85 19 0 "[    .    1    .    2]" 
       138 . 1 104 LEU C 1 105 VAL N  1 105 VAL CA 1 105 VAL C -150.00  -99.40 -111.21 -131.01  -99.12 0.28  5 0 "[    .    1    .    2]" 
       139 . 1 105 VAL N 1 105 VAL CA 1 105 VAL C  1 106 ALA N  110.00  165.16  145.24  126.80  158.04    .  . 0 "[    .    1    .    2]" 
       140 . 1 112 SER C 1 113 ILE N  1 113 ILE CA 1 113 ILE C -150.00  -85.16 -141.91 -150.30 -136.12 0.30 15 0 "[    .    1    .    2]" 
       141 . 1 113 ILE C 1 114 LEU N  1 114 LEU CA 1 114 LEU C -140.00  -71.68  -87.90  -90.06  -91.54    .  . 0 "[    .    1    .    2]" 
       142 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C  1 114 LEU N  100.00  149.84  100.92   98.21  110.05 1.79 12 0 "[    .    1    .    2]" 
       143 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C  1 115 LYS N   90.00  144.90   94.65   88.23  107.00 1.77 15 0 "[    .    1    .    2]" 
       144 . 1 115 LYS C 1 116 SER N  1 116 SER CA 1 116 SER C -150.00  -86.64  -87.93  -87.62  -88.99 1.16  7 0 "[    .    1    .    2]" 
       145 . 1 116 SER N 1 116 SER CA 1 116 SER C  1 117 THR N  100.00  153.12   98.35   97.14   99.57 2.86 15 0 "[    .    1    .    2]" 
       146 . 1 118 SER N 1 118 SER CA 1 118 SER C  1 119 LYS N  100.00  159.20  142.27  146.68  144.24 0.22  8 0 "[    .    1    .    2]" 
       147 . 1 118 SER C 1 119 LYS N  1 119 LYS CA 1 119 LYS C -150.00  -80.00 -122.78 -142.84  -99.55    .  . 0 "[    .    1    .    2]" 
       148 . 1 119 LYS C 1 120 TYR N  1 120 TYR CA 1 120 TYR C -150.00  -83.98  -88.06  -85.30  -89.74 1.18  4 0 "[    .    1    .    2]" 
       149 . 1 119 LYS N 1 119 LYS CA 1 119 LYS C  1 120 TYR N  100.00  149.98  108.37   98.54  132.79 1.46 10 0 "[    .    1    .    2]" 
       150 . 1 120 TYR C 1 121 HIS N  1 121 HIS CA 1 121 HIS C -150.00  -12.82  -90.93 -101.85  -81.62    .  . 0 "[    .    1    .    2]" 
       151 . 1 120 TYR N 1 120 TYR CA 1 120 TYR C  1 121 HIS N  100.00  151.56  101.77   98.91  111.91 1.09 10 0 "[    .    1    .    2]" 
       152 . 1 121 HIS N 1 121 HIS CA 1 121 HIS C  1 122 THR N   90.00 -178.00  129.21  130.20  128.03    .  . 0 "[    .    1    .    2]" 
       153 . 1 133 ILE C 1 134 LYS N  1 134 LYS CA 1 134 LYS C  -90.00  -33.32  -64.30  -72.78  -57.34    .  . 0 "[    .    1    .    2]" 
       154 . 1 134 LYS C 1 135 ALA N  1 135 ALA CA 1 135 ALA C  -90.00  -39.88  -60.44  -60.91  -61.34    .  . 0 "[    .    1    .    2]" 
       155 . 1 134 LYS N 1 134 LYS CA 1 134 LYS C  1 135 ALA N  -70.00  -11.84  -43.38  -54.05  -31.73    .  . 0 "[    .    1    .    2]" 
       156 . 1 135 ALA C 1 136 GLY N  1 136 GLY CA 1 136 GLY C  -90.00  -39.44  -68.06  -71.18  -63.63    .  . 0 "[    .    1    .    2]" 
       157 . 1 135 ALA N 1 135 ALA CA 1 135 ALA C  1 136 GLY N  -70.00   -1.78  -35.42  -40.61  -26.85    .  . 0 "[    .    1    .    2]" 
       158 . 1 136 GLY C 1 137 LYS N  1 137 LYS CA 1 137 LYS C  -90.00  -37.38  -67.35  -85.65  -59.47    .  . 0 "[    .    1    .    2]" 
       159 . 1 136 GLY N 1 136 GLY CA 1 136 GLY C  1 137 LYS N  -70.00  -13.58  -47.15  -47.67  -48.51    .  . 0 "[    .    1    .    2]" 
       160 . 1 137 LYS N 1 137 LYS CA 1 137 LYS C  1 138 GLU N  -70.00  -11.18  -44.77  -44.34  -46.53    .  . 0 "[    .    1    .    2]" 
       161 . 1 139 GLU C 1 140 ALA N  1 140 ALA CA 1 140 ALA C  -90.00  -39.62  -60.55  -65.11  -66.35    .  . 0 "[    .    1    .    2]" 
       162 . 1 140 ALA C 1 141 SER N  1 141 SER CA 1 141 SER C  -80.00  -49.62  -63.13  -65.65  -67.14    .  . 0 "[    .    1    .    2]" 
       163 . 1 140 ALA N 1 140 ALA CA 1 140 ALA C  1 141 SER N  -70.00  -17.48  -35.43  -44.43  -28.44    .  . 0 "[    .    1    .    2]" 
       164 . 1 141 SER C 1 142 GLY N  1 142 GLY CA 1 142 GLY C  -90.00  -37.46  -64.54  -68.88  -57.13    .  . 0 "[    .    1    .    2]" 
       165 . 1 141 SER N 1 141 SER CA 1 141 SER C  1 142 GLY N  -70.00   -3.82  -49.79  -50.75  -53.52    .  . 0 "[    .    1    .    2]" 
       166 . 1 142 GLY C 1 143 ILE N  1 143 ILE CA 1 143 ILE C  -90.00  -40.40  -54.97  -55.33  -56.58    .  . 0 "[    .    1    .    2]" 
       167 . 1 142 GLY N 1 142 GLY CA 1 142 GLY C  1 143 ILE N  -70.00  -12.24  -44.78  -56.31  -31.86    .  . 0 "[    .    1    .    2]" 
       168 . 1 143 ILE C 1 144 PHE N  1 144 PHE CA 1 144 PHE C  -80.00  -47.12  -56.74  -58.36  -60.65    .  . 0 "[    .    1    .    2]" 
       169 . 1 143 ILE N 1 143 ILE CA 1 143 ILE C  1 144 PHE N  -70.00  -19.28  -64.55  -70.24  -59.90 0.24 18 0 "[    .    1    .    2]" 
       170 . 1 144 PHE C 1 145 LYS N  1 145 LYS CA 1 145 LYS C  -90.00  -31.68  -66.64  -67.32  -68.81    .  . 0 "[    .    1    .    2]" 
       171 . 1 144 PHE N 1 144 PHE CA 1 144 PHE C  1 145 LYS N  -70.00  -19.66  -56.36  -64.91  -44.26    .  . 0 "[    .    1    .    2]" 
       172 . 1 145 LYS C 1 146 ALA N  1 146 ALA CA 1 146 ALA C  -90.00  -39.96  -85.95  -90.65  -78.23 0.65 14 0 "[    .    1    .    2]" 
       173 . 1 146 ALA N 1 146 ALA CA 1 146 ALA C  1 147 VAL N  -70.00  -19.22  -38.82  -45.32  -30.60    .  . 0 "[    .    1    .    2]" 
       174 . 1 145 LYS N 1 145 LYS CA 1 145 LYS C  1 146 ALA N  -70.00  -10.48  -29.90  -35.66  -16.33    .  . 0 "[    .    1    .    2]" 
       175 . 1 150 TYR N 1 150 TYR CA 1 150 TYR C  1 151 LEU N  -70.00  -17.30  -36.60  -31.15  -34.52    .  . 0 "[    .    1    .    2]" 
       176 . 1 150 TYR C 1 151 LEU N  1 151 LEU CA 1 151 LEU C  -90.00  -41.80  -76.94  -87.83  -66.58    .  . 0 "[    .    1    .    2]" 
       177 . 1 151 LEU N 1 151 LEU CA 1 151 LEU C  1 152 LEU N  -70.00  -19.60  -32.79  -18.46  -24.34 3.43  2 0 "[    .    1    .    2]" 
    stop_

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