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
619204 5lgf 25770 cing 4-filtered-FRED Wattos check violation dihedral angle


data_5lgf


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              198
    _TA_constraint_stats_list.Viol_count                    329
    _TA_constraint_stats_list.Viol_total                    106666.33
    _TA_constraint_stats_list.Viol_max                      157.38
    _TA_constraint_stats_list.Viol_rms                      11.37
    _TA_constraint_stats_list.Viol_average_all_restraints   1.35
    _TA_constraint_stats_list.Viol_average_violations_only  16.21
    _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   2 ARG C 1   3 PHE N  1   3 PHE CA 1   3 PHE C  -80.80  -38.00  -60.04  -61.34  -59.83      .  .  0 "[    .    1    .    2]" 
         2 . 1   3 PHE N 1   3 PHE CA 1   3 PHE C  1   4 ASP N  -62.40   -9.80  -44.08  -47.27  -48.67      .  .  0 "[    .    1    .    2]" 
         3 . 1   3 PHE C 1   4 ASP N  1   4 ASP CA 1   4 ASP C  -79.20  -39.20  -60.97  -59.99  -60.01      .  .  0 "[    .    1    .    2]" 
         4 . 1   4 ASP N 1   4 ASP CA 1   4 ASP C  1   5 GLN N  -59.70  -19.70  -46.94  -53.77  -40.10      .  .  0 "[    .    1    .    2]" 
         5 . 1   4 ASP C 1   5 GLN N  1   5 GLN CA 1   5 GLN C  -86.80  -46.80  -68.44  -72.83  -61.13      .  .  0 "[    .    1    .    2]" 
         6 . 1   5 GLN N 1   5 GLN CA 1   5 GLN C  1   6 TYR N  -59.20  -19.20  -30.30  -28.14  -28.75      .  .  0 "[    .    1    .    2]" 
         7 . 1   5 GLN C 1   6 TYR N  1   6 TYR CA 1   6 TYR C  -82.70  -42.70  -58.43  -60.08  -52.04      .  .  0 "[    .    1    .    2]" 
         8 . 1   6 TYR N 1   6 TYR CA 1   6 TYR C  1   7 VAL N  -63.50  -23.50  -40.99  -47.87  -36.27      .  .  0 "[    .    1    .    2]" 
         9 . 1   6 TYR C 1   7 VAL N  1   7 VAL CA 1   7 VAL C  -84.20  -44.20  -60.35  -60.00  -60.03      .  .  0 "[    .    1    .    2]" 
        10 . 1   7 VAL N 1   7 VAL CA 1   7 VAL C  1   8 ASP N  -64.70  -24.70  -47.70  -52.83  -39.87      .  .  0 "[    .    1    .    2]" 
        11 . 1   7 VAL C 1   8 ASP N  1   8 ASP CA 1   8 ASP C  -77.60  -37.60  -69.96  -67.95  -69.32      .  .  0 "[    .    1    .    2]" 
        12 . 1   8 ASP N 1   8 ASP CA 1   8 ASP C  1   9 GLU N  -63.30  -23.30  -22.81  -23.19  -22.29   1.01 10  0 "[    .    1    .    2]" 
        13 . 1   8 ASP C 1   9 GLU N  1   9 GLU CA 1   9 GLU C  -91.20  -50.60  -78.30  -89.96  -72.19      .  .  0 "[    .    1    .    2]" 
        14 . 1   9 GLU N 1   9 GLU CA 1   9 GLU C  1  10 ASN N  -53.90  -13.90  -46.47  -48.49  -51.54      .  .  0 "[    .    1    .    2]" 
        15 . 1   9 GLU C 1  10 ASN N  1  10 ASN CA 1  10 ASN C -124.40  -79.00  -88.77  -87.85  -90.15   0.34 15  0 "[    .    1    .    2]" 
        16 . 1  10 ASN N 1  10 ASN CA 1  10 ASN C  1  11 LYS N  -54.20   39.40    4.40  -11.16   19.10      .  .  0 "[    .    1    .    2]" 
        17 . 1  10 ASN C 1  11 LYS N  1  11 LYS CA 1  11 LYS C -160.10  -42.30  -58.67  -59.39  -59.97      .  .  0 "[    .    1    .    2]" 
        18 . 1  11 LYS N 1  11 LYS CA 1  11 LYS C  1  12 SER N  110.50 -175.90  121.47  120.19  118.89      .  .  0 "[    .    1    .    2]" 
        19 . 1  11 LYS C 1  12 SER N  1  12 SER CA 1  12 SER C -106.00  -37.80  -76.23  -88.96  -69.27      .  .  0 "[    .    1    .    2]" 
        20 . 1  12 SER N 1  12 SER CA 1  12 SER C  1  13 SER N  -55.30   -4.10  -35.19  -31.26  -34.42      .  .  0 "[    .    1    .    2]" 
        21 . 1  13 SER C 1  14 ASP N  1  14 ASP CA 1  14 ASP C  -79.10  -39.10  -73.95  -76.47  -77.01      .  .  0 "[    .    1    .    2]" 
        22 . 1  14 ASP N 1  14 ASP CA 1  14 ASP C  1  15 ASP N  -54.90  -14.90  -14.27  -14.72  -13.84   1.06  1  0 "[    .    1    .    2]" 
        23 . 1  14 ASP C 1  15 ASP N  1  15 ASP CA 1  15 ASP C  -97.40  -57.40  -63.63  -62.10  -63.06      .  .  0 "[    .    1    .    2]" 
        24 . 1  15 ASP N 1  15 ASP CA 1  15 ASP C  1  16 PHE N  -66.40    2.80   -9.49  -15.42   -0.42      .  .  0 "[    .    1    .    2]" 
        25 . 1  15 ASP C 1  16 PHE N  1  16 PHE CA 1  16 PHE C -141.50  -65.10  -87.34  -84.71  -85.78      .  .  0 "[    .    1    .    2]" 
        26 . 1  16 PHE N 1  16 PHE CA 1  16 PHE C  1  17 GLU N  -33.80   22.40   21.89   17.16   23.22   0.82 19  0 "[    .    1    .    2]" 
        27 . 1  16 PHE C 1  17 GLU N  1  17 GLU CA 1  17 GLU C  -72.10  -32.10  -48.99  -50.04  -45.34      .  .  0 "[    .    1    .    2]" 
        28 . 1  17 GLU N 1  17 GLU CA 1  17 GLU C  1  18 PRO N  -68.10  -28.10  -52.91  -54.72  -50.04      .  .  0 "[    .    1    .    2]" 
        29 . 1  17 GLU C 1  18 PRO N  1  18 PRO CA 1  18 PRO C  -77.40  -37.40  -58.82  -57.26  -58.36      .  .  0 "[    .    1    .    2]" 
        30 . 1  18 PRO N 1  18 PRO CA 1  18 PRO C  1  19 LEU N  -62.90   -2.50  -37.38  -40.37  -33.92      .  .  0 "[    .    1    .    2]" 
        31 . 1  18 PRO C 1  19 LEU N  1  19 LEU CA 1  19 LEU C  -84.10  -44.10  -70.13  -70.03  -70.05      .  .  0 "[    .    1    .    2]" 
        32 . 1  19 LEU N 1  19 LEU CA 1  19 LEU C  1  20 ILE N  -58.70  -17.10  -41.08  -40.03  -40.07      .  .  0 "[    .    1    .    2]" 
        33 . 1  19 LEU C 1  20 ILE N  1  20 ILE CA 1  20 ILE C  -80.00  -40.00  -69.12  -70.13  -60.20      .  .  0 "[    .    1    .    2]" 
        34 . 1  20 ILE N 1  20 ILE CA 1  20 ILE C  1  21 HIS N  -64.90  -24.90  -40.28  -44.56  -39.95      .  .  0 "[    .    1    .    2]" 
        35 . 1  20 ILE C 1  21 HIS N  1  21 HIS CA 1  21 HIS C  -80.90  -40.90  -64.34  -67.12  -60.27      .  .  0 "[    .    1    .    2]" 
        36 . 1  21 HIS N 1  21 HIS CA 1  21 HIS C  1  22 ASP N  -62.70  -22.70  -42.45  -49.98  -39.90      .  .  0 "[    .    1    .    2]" 
        37 . 1  21 HIS C 1  22 ASP N  1  22 ASP CA 1  22 ASP C  -83.40  -43.40  -74.52  -71.05  -71.90      .  .  0 "[    .    1    .    2]" 
        38 . 1  22 ASP N 1  22 ASP CA 1  22 ASP C  1  23 LEU N  -64.90  -24.90  -41.43  -40.68  -42.44      .  .  0 "[    .    1    .    2]" 
        39 . 1  22 ASP C 1  23 LEU N  1  23 LEU CA 1  23 LEU C  -84.50  -44.50  -64.83  -70.04  -60.46      .  .  0 "[    .    1    .    2]" 
        40 . 1  23 LEU N 1  23 LEU CA 1  23 LEU C  1  24 PHE N  -69.50  -29.50  -39.97  -39.71  -39.86      .  .  0 "[    .    1    .    2]" 
        41 . 1  23 LEU C 1  24 PHE N  1  24 PHE CA 1  24 PHE C  -81.20  -41.20  -65.23  -66.89  -67.54      .  .  0 "[    .    1    .    2]" 
        42 . 1  24 PHE N 1  24 PHE CA 1  24 PHE C  1  25 GLU N  -60.30  -20.30  -25.48  -41.11  -19.75   0.55  3  0 "[    .    1    .    2]" 
        43 . 1  24 PHE C 1  25 GLU N  1  25 GLU CA 1  25 GLU C -111.20  -34.20  -58.39  -53.09  -53.89      .  .  0 "[    .    1    .    2]" 
        44 . 1  25 GLU N 1  25 GLU CA 1  25 GLU C  1  26 THR N  -63.60    0.40  -30.40  -20.02  -22.68      .  .  0 "[    .    1    .    2]" 
        45 . 1  25 GLU C 1  26 THR N  1  26 THR CA 1  26 THR C  -82.00  -42.00  -63.08  -54.17  -56.65      .  .  0 "[    .    1    .    2]" 
        46 . 1  26 THR N 1  26 THR CA 1  26 THR C  1  27 ARG N  -59.80  -19.80  -19.73  -24.31  -18.63   1.17 17  0 "[    .    1    .    2]" 
        47 . 1  26 THR C 1  27 ARG N  1  27 ARG CA 1  27 ARG C -112.90  -46.90  -58.23  -51.71  -54.12   0.79  7  0 "[    .    1    .    2]" 
        48 . 1  27 ARG N 1  27 ARG CA 1  27 ARG C  1  28 TRP N  -67.30   -5.30  -32.61  -59.62   -4.43   0.87 19  0 "[    .    1    .    2]" 
        49 . 1  28 TRP C 1  29 HIS N  1  29 HIS CA 1  29 HIS C -126.70  -33.50 -108.79 -127.80  -57.18   1.10 11  0 "[    .    1    .    2]" 
        50 . 1  29 HIS N 1  29 HIS CA 1  29 HIS C  1  30 GLY N  107.30  177.10  137.06  113.20  110.30   0.23  8  0 "[    .    1    .    2]" 
        51 . 1  29 HIS C 1  30 GLY N  1  30 GLY CA 1  30 GLY C  -84.10  -44.10  152.46   83.89  -68.13 157.38 14 15 "[**-***** ****+. * *2]" 
        52 . 1  30 GLY N 1  30 GLY CA 1  30 GLY C  1  31 THR N  -57.20   -0.40  142.88  147.64   59.52 148.70 16 20  [**************-+****]  
        53 . 1  30 GLY C 1  31 THR N  1  31 THR CA 1  31 THR C  -86.80  -46.80 -125.49 -144.53   63.97 110.77 18 20  [*****************+-*]  
        54 . 1  31 THR N 1  31 THR CA 1  31 THR C  1  32 GLY N  -58.80  -18.80   16.77  -54.87   49.99  68.79 13 15 "[** ** ** ***+*.-***2]" 
        55 . 1  31 THR C 1  32 GLY N  1  32 GLY CA 1  32 GLY C  -86.70  -46.70  -73.48  -66.68  -70.09   0.83 18  0 "[    .    1    .    2]" 
        56 . 1  32 GLY N 1  32 GLY CA 1  32 GLY C  1  33 ARG N  -54.80  -14.80  -52.35  -55.50  -55.78   2.27 18  0 "[    .    1    .    2]" 
        57 . 1  32 GLY C 1  33 ARG N  1  33 ARG CA 1  33 ARG C -108.90  -42.30  -97.63 -110.68  -80.76   1.78 18  0 "[    .    1    .    2]" 
        58 . 1  33 ARG N 1  33 ARG CA 1  33 ARG C  1  34 GLU N  -49.00   -1.20   -3.90  -11.45   -0.03   1.17 16  0 "[    .    1    .    2]" 
        59 . 1  33 ARG C 1  34 GLU N  1  34 GLU CA 1  34 GLU C -121.40  -81.40  -84.57  -81.28  -82.43   1.22 16  0 "[    .    1    .    2]" 
        60 . 1  34 GLU N 1  34 GLU CA 1  34 GLU C  1  35 ILE N  -40.70   39.90  -16.33  -31.41   19.78      .  .  0 "[    .    1    .    2]" 
        61 . 1  34 GLU C 1  35 ILE N  1  35 ILE CA 1  35 ILE C -116.00  -47.40  -85.03 -100.47 -105.32   0.03 10  0 "[    .    1    .    2]" 
        62 . 1  35 ILE N 1  35 ILE CA 1  35 ILE C  1  36 TRP N  107.20  149.80  127.98  108.59  134.47      .  .  0 "[    .    1    .    2]" 
        63 . 1  35 ILE C 1  36 TRP N  1  36 TRP CA 1  36 TRP C -125.00  -78.80 -110.07 -108.96 -110.15      .  .  0 "[    .    1    .    2]" 
        64 . 1  36 TRP N 1  36 TRP CA 1  36 TRP C  1  37 ILE N  112.30  154.70  128.29  128.47  127.12      .  .  0 "[    .    1    .    2]" 
        65 . 1  36 TRP C 1  37 ILE N  1  37 ILE CA 1  37 ILE C -144.00 -104.00 -109.61 -111.01 -111.71   0.19 15  0 "[    .    1    .    2]" 
        66 . 1  37 ILE N 1  37 ILE CA 1  37 ILE C  1  38 GLU N  111.10  179.30  136.16  129.79  143.30      .  .  0 "[    .    1    .    2]" 
        67 . 1  37 ILE C 1  38 GLU N  1  38 GLU CA 1  38 GLU C -164.40 -116.80 -141.48 -141.40 -143.94      .  .  0 "[    .    1    .    2]" 
        68 . 1  38 GLU N 1  38 GLU CA 1  38 GLU C  1  39 ARG N  102.50  173.10  156.22  135.96  168.00      .  .  0 "[    .    1    .    2]" 
        69 . 1  38 GLU C 1  39 ARG N  1  39 ARG CA 1  39 ARG C -100.00  -52.00  -82.51  -80.70  -82.23      .  .  0 "[    .    1    .    2]" 
        70 . 1  39 ARG N 1  39 ARG CA 1  39 ARG C  1  40 VAL N  108.80  148.80  110.18  111.62  110.07   0.88  4  0 "[    .    1    .    2]" 
        71 . 1  39 ARG C 1  40 VAL N  1  40 VAL CA 1  40 VAL C -129.80  -84.80  -94.27 -108.85  -84.16   0.64 13  0 "[    .    1    .    2]" 
        72 . 1  40 VAL N 1  40 VAL CA 1  40 VAL C  1  41 LYS N  -66.20    5.80  -26.02  -13.80  -21.35      .  .  0 "[    .    1    .    2]" 
        73 . 1  40 VAL C 1  41 LYS N  1  41 LYS CA 1  41 LYS C -169.50 -129.30 -133.25 -134.67 -135.99   0.46 11  0 "[    .    1    .    2]" 
        74 . 1  41 LYS N 1  41 LYS CA 1  41 LYS C  1  42 ASP N  130.90 -175.70  154.54  174.42  165.26      .  .  0 "[    .    1    .    2]" 
        75 . 1  41 LYS C 1  42 ASP N  1  42 ASP CA 1  42 ASP C -156.00  -42.80 -109.52  -70.80  -90.48      .  .  0 "[    .    1    .    2]" 
        76 . 1  44 LYS C 1  45 ILE N  1  45 ILE CA 1  45 ILE C -159.70  -42.90  -77.40 -118.51  -51.32      .  .  0 "[    .    1    .    2]" 
        77 . 1  45 ILE N 1  45 ILE CA 1  45 ILE C  1  46 PRO N   86.30 -171.30  135.22  129.11  125.77      .  .  0 "[    .    1    .    2]" 
        78 . 1  45 ILE C 1  46 PRO N  1  46 PRO CA 1  46 PRO C  -84.60  -41.00  -65.92  -60.37  -69.89      .  .  0 "[    .    1    .    2]" 
        79 . 1  48 THR C 1  49 LEU N  1  49 LEU CA 1  49 LEU C -139.40  -57.00 -100.09 -111.74  -85.38      .  .  0 "[    .    1    .    2]" 
        80 . 1  49 LEU N 1  49 LEU CA 1  49 LEU C  1  50 VAL N  -73.50   24.30   -9.54  -22.47    0.81      .  .  0 "[    .    1    .    2]" 
        81 . 1  49 LEU C 1  50 VAL N  1  50 VAL CA 1  50 VAL C -120.80  -69.20 -112.60 -110.95 -112.57   0.15 18  0 "[    .    1    .    2]" 
        82 . 1  50 VAL N 1  50 VAL CA 1  50 VAL C  1  51 LYS N  -54.10   22.70  -35.13  -34.46  -35.20      .  .  0 "[    .    1    .    2]" 
        83 . 1  51 LYS C 1  52 PRO N  1  52 PRO CA 1  52 PRO C  -83.70  -43.30  -67.77  -76.43  -60.04      .  .  0 "[    .    1    .    2]" 
        84 . 1  54 TYR C 1  55 SER N  1  55 SER CA 1  55 SER C -123.60  -36.40  -99.05 -106.57  -90.59      .  .  0 "[    .    1    .    2]" 
        85 . 1  55 SER N 1  55 SER CA 1  55 SER C  1  56 HIS N   96.10 -151.10  168.06  154.05  179.86      .  .  0 "[    .    1    .    2]" 
        86 . 1  55 SER C 1  56 HIS N  1  56 HIS CA 1  56 HIS C  -74.30  -34.30  -55.54  -51.65  -52.66      .  .  0 "[    .    1    .    2]" 
        87 . 1  56 HIS N 1  56 HIS CA 1  56 HIS C  1  57 GLU N  -67.10  -27.10  -65.68  -67.43  -67.51   0.94  1  0 "[    .    1    .    2]" 
        88 . 1  56 HIS C 1  57 GLU N  1  57 GLU CA 1  57 GLU C  -78.70  -38.70  -62.52  -68.80  -59.98      .  .  0 "[    .    1    .    2]" 
        89 . 1  57 GLU N 1  57 GLU CA 1  57 GLU C  1  58 GLU N  -62.20  -22.20  -39.57  -39.89  -39.99      .  .  0 "[    .    1    .    2]" 
        90 . 1  57 GLU C 1  58 GLU N  1  58 GLU CA 1  58 GLU C  -81.60  -41.60  -60.84  -59.95  -59.98      .  .  0 "[    .    1    .    2]" 
        91 . 1  58 GLU N 1  58 GLU CA 1  58 GLU C  1  59 LEU N  -64.20  -24.20  -48.09  -48.07  -49.03      .  .  0 "[    .    1    .    2]" 
        92 . 1  58 GLU C 1  59 LEU N  1  59 LEU CA 1  59 LEU C  -81.80  -41.80  -59.27  -60.07  -54.50      .  .  0 "[    .    1    .    2]" 
        93 . 1  59 LEU N 1  59 LEU CA 1  59 LEU C  1  60 ILE N  -64.10  -24.10  -37.95  -34.49  -35.30      .  .  0 "[    .    1    .    2]" 
        94 . 1  59 LEU C 1  60 ILE N  1  60 ILE CA 1  60 ILE C  -85.50  -45.50  -60.29  -59.11  -59.52      .  .  0 "[    .    1    .    2]" 
        95 . 1  60 ILE N 1  60 ILE CA 1  60 ILE C  1  61 ASP N  -60.40  -20.40  -55.22  -61.27  -40.09   0.87 10  0 "[    .    1    .    2]" 
        96 . 1  60 ILE C 1  61 ASP N  1  61 ASP CA 1  61 ASP C  -84.90  -44.90  -65.73  -66.46  -68.09      .  .  0 "[    .    1    .    2]" 
        97 . 1  61 ASP N 1  61 ASP CA 1  61 ASP C  1  62 MET N  -58.50  -18.50  -42.21  -39.95  -40.00      .  .  0 "[    .    1    .    2]" 
        98 . 1  61 ASP C 1  62 MET N  1  62 MET CA 1  62 MET C  -84.20  -44.20  -63.74  -60.88  -63.46      .  .  0 "[    .    1    .    2]" 
        99 . 1  62 MET N 1  62 MET CA 1  62 MET C  1  63 LEU N  -57.60  -17.60  -39.78  -45.09  -29.22      .  .  0 "[    .    1    .    2]" 
       100 . 1  62 MET C 1  63 LEU N  1  63 LEU CA 1  63 LEU C -103.70  -34.90  -63.57  -69.94  -59.91      .  .  0 "[    .    1    .    2]" 
       101 . 1  63 LEU N 1  63 LEU CA 1  63 LEU C  1  64 ILE N  -62.80  -17.00  -41.30  -44.59  -36.98      .  .  0 "[    .    1    .    2]" 
       102 . 1  63 LEU C 1  64 ILE N  1  64 ILE CA 1  64 ILE C  -83.90  -43.90  -60.83  -64.17  -59.09      .  .  0 "[    .    1    .    2]" 
       103 . 1  64 ILE N 1  64 ILE CA 1  64 ILE C  1  65 GLY N  -65.00  -25.00  -42.12  -49.57  -39.93      .  .  0 "[    .    1    .    2]" 
       104 . 1  64 ILE C 1  65 GLY N  1  65 GLY CA 1  65 GLY C  -83.00  -43.00  -67.18  -73.24  -58.64      .  .  0 "[    .    1    .    2]" 
       105 . 1  65 GLY N 1  65 GLY CA 1  65 GLY C  1  66 TYR N  -61.40  -21.40  -28.17  -25.64  -26.70      .  .  0 "[    .    1    .    2]" 
       106 . 1  65 GLY C 1  66 TYR N  1  66 TYR CA 1  66 TYR C  -82.00  -42.00  -60.35  -59.93  -59.94      .  .  0 "[    .    1    .    2]" 
       107 . 1  66 TYR N 1  66 TYR CA 1  66 TYR C  1  67 LEU N  -65.10  -25.10  -43.09  -41.23  -41.85      .  .  0 "[    .    1    .    2]" 
       108 . 1  66 TYR C 1  67 LEU N  1  67 LEU CA 1  67 LEU C -101.60  -47.80  -92.46  -98.90 -100.61   0.54 11  0 "[    .    1    .    2]" 
       109 . 1  67 LEU N 1  67 LEU CA 1  67 LEU C  1  68 ALA N  -64.10   26.30   -2.64  -35.71   26.48   0.18 10  0 "[    .    1    .    2]" 
       110 . 1  77 ILE C 1  78 ASN N  1  78 ASN CA 1  78 ASN C  -77.20  -33.20  -63.20  -64.24  -66.77      .  .  0 "[    .    1    .    2]" 
       111 . 1  78 ASN N 1  78 ASN CA 1  78 ASN C  1  79 GLY N  -56.60    0.20  -40.59  -40.03  -40.05      .  .  0 "[    .    1    .    2]" 
       112 . 1  83 GLY C 1  84 ASP N  1  84 ASP CA 1  84 ASP C  -92.90  -46.10  -64.76  -70.13  -60.02      .  .  0 "[    .    1    .    2]" 
       113 . 1  84 ASP N 1  84 ASP CA 1  84 ASP C  1  85 ASP N  -57.00  -17.00  -36.36  -51.37  -17.00   0.00  3  0 "[    .    1    .    2]" 
       114 . 1  84 ASP C 1  85 ASP N  1  85 ASP CA 1  85 ASP C  -99.20  -40.40  -63.84  -92.56  -53.71      .  .  0 "[    .    1    .    2]" 
       115 . 1  85 ASP N 1  85 ASP CA 1  85 ASP C  1  86 LEU N  -67.60    0.20  -38.21  -40.58  -42.22      .  .  0 "[    .    1    .    2]" 
       116 . 1  85 ASP C 1  86 LEU N  1  86 LEU CA 1  86 LEU C  -85.80  -45.80  -62.77  -79.52  -55.72      .  .  0 "[    .    1    .    2]" 
       117 . 1  86 LEU N 1  86 LEU CA 1  86 LEU C  1  87 GLU N  -55.80  -15.80  -39.57  -42.83  -32.12      .  .  0 "[    .    1    .    2]" 
       118 . 1  86 LEU C 1  87 GLU N  1  87 GLU CA 1  87 GLU C  -82.90  -42.90  -59.69  -60.08  -54.96      .  .  0 "[    .    1    .    2]" 
       119 . 1  87 GLU N 1  87 GLU CA 1  87 GLU C  1  88 ILE N  -60.00  -20.00  -40.07  -45.96  -35.35      .  .  0 "[    .    1    .    2]" 
       120 . 1  87 GLU C 1  88 ILE N  1  88 ILE CA 1  88 ILE C  -83.60  -43.60  -69.85  -82.35  -60.00      .  .  0 "[    .    1    .    2]" 
       121 . 1  88 ILE N 1  88 ILE CA 1  88 ILE C  1  89 ALA N  -63.50  -23.50  -38.69  -41.62  -46.19      .  .  0 "[    .    1    .    2]" 
       122 . 1  88 ILE C 1  89 ALA N  1  89 ALA CA 1  89 ALA C  -83.40  -43.40  -67.12  -79.16  -59.31      .  .  0 "[    .    1    .    2]" 
       123 . 1  89 ALA N 1  89 ALA CA 1  89 ALA C  1  90 ASN N  -59.70  -10.90  -40.40  -35.98  -39.11      .  .  0 "[    .    1    .    2]" 
       124 . 1  89 ALA C 1  90 ASN N  1  90 ASN CA 1  90 ASN C  -83.10  -43.10  -72.61  -83.17  -59.99   0.07  8  0 "[    .    1    .    2]" 
       125 . 1  90 ASN N 1  90 ASN CA 1  90 ASN C  1  91 SER N  -62.30  -15.70  -40.32  -60.92  -20.88      .  .  0 "[    .    1    .    2]" 
       126 . 1  90 ASN C 1  91 SER N  1  91 SER CA 1  91 SER C  -94.70  -42.90  -78.75  -72.23  -75.23   0.57 13  0 "[    .    1    .    2]" 
       127 . 1  91 SER N 1  91 SER CA 1  91 SER C  1  92 TYR N  -60.30   -9.90  -54.71  -57.01  -58.16   0.70  8  0 "[    .    1    .    2]" 
       128 . 1  91 SER C 1  92 TYR N  1  92 TYR CA 1  92 TYR C -108.50  -68.50  -78.81 -100.60  -68.42   0.08 18  0 "[    .    1    .    2]" 
       129 . 1  92 TYR N 1  92 TYR CA 1  92 TYR C  1  93 GLY N  -21.10   18.90  -14.09  -13.62  -15.89   0.80 16  0 "[    .    1    .    2]" 
       130 . 1  98 ASN C 1  99 ALA N  1  99 ALA CA 1  99 ALA C  -82.50  -42.50  -68.44  -60.15  -62.51   1.11 11  0 "[    .    1    .    2]" 
       131 . 1  99 ALA N 1  99 ALA CA 1  99 ALA C  1 100 VAL N  -61.20  -21.20  -38.79  -37.27  -39.97      .  .  0 "[    .    1    .    2]" 
       132 . 1  99 ALA C 1 100 VAL N  1 100 VAL CA 1 100 VAL C  -83.50  -43.50  -63.55  -59.04  -59.90      .  .  0 "[    .    1    .    2]" 
       133 . 1 100 VAL N 1 100 VAL CA 1 100 VAL C  1 101 THR N  -63.80  -23.80  -33.62  -42.66  -26.36      .  .  0 "[    .    1    .    2]" 
       134 . 1 100 VAL C 1 101 THR N  1 101 THR CA 1 101 THR C  -83.50  -43.50  -65.79  -73.00  -59.55      .  .  0 "[    .    1    .    2]" 
       135 . 1 101 THR N 1 101 THR CA 1 101 THR C  1 102 ASN N  -63.50  -23.50  -39.54  -35.56  -39.88      .  .  0 "[    .    1    .    2]" 
       136 . 1 101 THR C 1 102 ASN N  1 102 ASN CA 1 102 ASN C  -81.60  -41.60  -62.56  -71.17  -59.41      .  .  0 "[    .    1    .    2]" 
       137 . 1 102 ASN N 1 102 ASN CA 1 102 ASN C  1 103 LEU N  -60.20  -20.20  -48.18  -42.37  -44.95      .  .  0 "[    .    1    .    2]" 
       138 . 1 102 ASN C 1 103 LEU N  1 103 LEU CA 1 103 LEU C  -85.00  -45.00  -67.16  -70.06  -60.04      .  .  0 "[    .    1    .    2]" 
       139 . 1 103 LEU N 1 103 LEU CA 1 103 LEU C  1 104 LEU N  -60.80  -20.80  -38.77  -36.83  -38.28      .  .  0 "[    .    1    .    2]" 
       140 . 1 103 LEU C 1 104 LEU N  1 104 LEU CA 1 104 LEU C  -83.60  -43.60  -68.84  -72.70  -63.56      .  .  0 "[    .    1    .    2]" 
       141 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C  1 105 LYS N  -54.30  -14.30  -31.05  -33.18  -34.02      .  .  0 "[    .    1    .    2]" 
       142 . 1 104 LEU C 1 105 LYS N  1 105 LYS CA 1 105 LYS C -121.00  -63.40  -76.67  -89.54  -64.66      .  .  0 "[    .    1    .    2]" 
       143 . 1 105 LYS N 1 105 LYS CA 1 105 LYS C  1 106 SER N  -35.00   32.80   -7.79    0.61   -2.73      .  .  0 "[    .    1    .    2]" 
       144 . 1 105 LYS C 1 106 SER N  1 106 SER CA 1 106 SER C -131.30  -34.90  -57.80  -70.10  -47.45      .  .  0 "[    .    1    .    2]" 
       145 . 1 106 SER N 1 106 SER CA 1 106 SER C  1 107 PRO N   72.90 -175.10  144.99  149.61  148.90      .  .  0 "[    .    1    .    2]" 
       146 . 1 106 SER C 1 107 PRO N  1 107 PRO CA 1 107 PRO C  -74.30  -34.30  -55.29  -53.07  -54.63      .  .  0 "[    .    1    .    2]" 
       147 . 1 107 PRO N 1 107 PRO CA 1 107 PRO C  1 108 GLU N  -55.50  -15.50  -36.60  -41.35  -27.23      .  .  0 "[    .    1    .    2]" 
       148 . 1 107 PRO C 1 108 GLU N  1 108 GLU CA 1 108 GLU C  -84.60  -44.60  -61.67  -71.39  -59.95      .  .  0 "[    .    1    .    2]" 
       149 . 1 108 GLU N 1 108 GLU CA 1 108 GLU C  1 109 PHE N  -59.80  -19.80  -39.21  -35.82  -39.85      .  .  0 "[    .    1    .    2]" 
       150 . 1 108 GLU C 1 109 PHE N  1 109 PHE CA 1 109 PHE C  -82.30  -42.30  -67.87  -75.04  -61.20      .  .  0 "[    .    1    .    2]" 
       151 . 1 109 PHE N 1 109 PHE CA 1 109 PHE C  1 110 ARG N  -63.30  -23.30  -26.52  -32.13  -23.36      .  .  0 "[    .    1    .    2]" 
       152 . 1 109 PHE C 1 110 ARG N  1 110 ARG CA 1 110 ARG C  -83.70  -43.70  -59.90  -59.95  -59.96      .  .  0 "[    .    1    .    2]" 
       153 . 1 110 ARG N 1 110 ARG CA 1 110 ARG C  1 111 LEU N  -63.00  -23.00  -41.47  -47.78  -39.29      .  .  0 "[    .    1    .    2]" 
       154 . 1 110 ARG C 1 111 LEU N  1 111 LEU CA 1 111 LEU C  -86.00  -46.00  -64.99  -65.41  -67.69      .  .  0 "[    .    1    .    2]" 
       155 . 1 111 LEU N 1 111 LEU CA 1 111 LEU C  1 112 VAL N  -62.10  -22.10  -39.04  -40.00  -40.01      .  .  0 "[    .    1    .    2]" 
       156 . 1 111 LEU C 1 112 VAL N  1 112 VAL CA 1 112 VAL C  -82.80  -42.80  -53.92  -54.36  -54.77      .  .  0 "[    .    1    .    2]" 
       157 . 1 112 VAL N 1 112 VAL CA 1 112 VAL C  1 113 HIS N  -64.70  -24.70  -55.00  -62.57  -46.75      .  .  0 "[    .    1    .    2]" 
       158 . 1 112 VAL C 1 113 HIS N  1 113 HIS CA 1 113 HIS C  -83.50  -43.50  -54.52  -48.29  -49.56      .  .  0 "[    .    1    .    2]" 
       159 . 1 113 HIS N 1 113 HIS CA 1 113 HIS C  1 114 THR N  -55.70  -15.70  -40.83  -41.05  -41.95      .  .  0 "[    .    1    .    2]" 
       160 . 1 113 HIS C 1 114 THR N  1 114 THR CA 1 114 THR C  -83.60  -43.60  -66.04  -69.71  -60.16      .  .  0 "[    .    1    .    2]" 
       161 . 1 114 THR N 1 114 THR CA 1 114 THR C  1 115 ILE N  -64.70  -24.70  -40.68  -40.90  -42.37      .  .  0 "[    .    1    .    2]" 
       162 . 1 114 THR C 1 115 ILE N  1 115 ILE CA 1 115 ILE C  -92.20  -50.00  -74.58  -77.55  -71.07      .  .  0 "[    .    1    .    2]" 
       163 . 1 115 ILE N 1 115 ILE CA 1 115 ILE C  1 116 ILE N  -63.20   -9.20  -51.30  -53.56  -49.21      .  .  0 "[    .    1    .    2]" 
       164 . 1 115 ILE C 1 116 ILE N  1 116 ILE CA 1 116 ILE C -121.90  -81.30  -80.97  -81.62  -80.59   0.71 19  0 "[    .    1    .    2]" 
       165 . 1 116 ILE N 1 116 ILE CA 1 116 ILE C  1 117 GLY N  -22.80   19.80  -22.61  -23.36  -18.90   0.56  9  0 "[    .    1    .    2]" 
       166 . 1 117 GLY C 1 118 THR N  1 118 THR CA 1 118 THR C  -74.90  -34.90  -64.94  -69.45  -69.98      .  .  0 "[    .    1    .    2]" 
       167 . 1 118 THR N 1 118 THR CA 1 118 THR C  1 119 GLU N  -67.20  -21.60  -49.74  -53.25  -53.76      .  .  0 "[    .    1    .    2]" 
       168 . 1 118 THR C 1 119 GLU N  1 119 GLU CA 1 119 GLU C  -84.60  -44.60  -53.61  -60.02  -46.69      .  .  0 "[    .    1    .    2]" 
       169 . 1 119 GLU N 1 119 GLU CA 1 119 GLU C  1 120 THR N  -58.30  -18.30  -45.02  -58.78  -39.50   0.48 12  0 "[    .    1    .    2]" 
       170 . 1 119 GLU C 1 120 THR N  1 120 THR CA 1 120 THR C  -90.20  -49.00  -75.09  -73.10  -74.47      .  .  0 "[    .    1    .    2]" 
       171 . 1 120 THR N 1 120 THR CA 1 120 THR C  1 121 PHE N  -57.60  -17.60  -36.78  -41.55  -32.60      .  .  0 "[    .    1    .    2]" 
       172 . 1 120 THR C 1 121 PHE N  1 121 PHE CA 1 121 PHE C  -83.70  -43.70  -59.95  -59.96  -59.98      .  .  0 "[    .    1    .    2]" 
       173 . 1 121 PHE N 1 121 PHE CA 1 121 PHE C  1 122 LEU N  -63.40  -23.40  -46.70  -46.48  -47.67      .  .  0 "[    .    1    .    2]" 
       174 . 1 121 PHE C 1 122 LEU N  1 122 LEU CA 1 122 LEU C  -82.50  -40.70  -67.25  -70.15  -63.10      .  .  0 "[    .    1    .    2]" 
       175 . 1 122 LEU N 1 122 LEU CA 1 122 LEU C  1 123 ASP N  -63.40  -23.40  -42.43  -42.12  -43.36      .  .  0 "[    .    1    .    2]" 
       176 . 1 122 LEU C 1 123 ASP N  1 123 ASP CA 1 123 ASP C  -82.70  -42.70  -62.40  -68.11  -59.99      .  .  0 "[    .    1    .    2]" 
       177 . 1 123 ASP N 1 123 ASP CA 1 123 ASP C  1 124 LEU N  -64.10  -24.10  -41.94  -41.44  -41.99      .  .  0 "[    .    1    .    2]" 
       178 . 1 123 ASP C 1 124 LEU N  1 124 LEU CA 1 124 LEU C  -85.20  -45.20  -60.34  -59.97  -59.99      .  .  0 "[    .    1    .    2]" 
       179 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C  1 125 LEU N  -61.90  -15.90  -43.39  -31.64  -38.70      .  .  0 "[    .    1    .    2]" 
       180 . 1 124 LEU C 1 125 LEU N  1 125 LEU CA 1 125 LEU C  -92.00  -47.40  -77.57  -90.50  -69.88      .  .  0 "[    .    1    .    2]" 
       181 . 1 125 LEU N 1 125 LEU CA 1 125 LEU C  1 126 ILE N  -64.30  -24.30  -35.97  -44.57  -24.13   0.17 19  0 "[    .    1    .    2]" 
       182 . 1 125 LEU C 1 126 ILE N  1 126 ILE CA 1 126 ILE C  -92.60  -48.00  -88.68  -86.52  -87.93   0.85  5  0 "[    .    1    .    2]" 
       183 . 1 126 ILE N 1 126 ILE CA 1 126 ILE C  1 127 ASN N  -60.20  -20.20  -59.07  -60.79  -60.82   1.19 10  0 "[    .    1    .    2]" 
       184 . 1 126 ILE C 1 127 ASN N  1 127 ASN CA 1 127 ASN C -109.70  -54.10  -73.90  -66.85  -68.95      .  .  0 "[    .    1    .    2]" 
       185 . 1 127 ASN N 1 127 ASN CA 1 127 ASN C  1 128 TYR N  -57.30   12.50  -46.21  -58.00  -31.21   0.70 17  0 "[    .    1    .    2]" 
       186 . 1 127 ASN C 1 128 TYR N  1 128 TYR CA 1 128 TYR C -170.50  -38.30  -98.32 -121.54  -73.74      .  .  0 "[    .    1    .    2]" 
       187 . 1 128 TYR N 1 128 TYR CA 1 128 TYR C  1 129 SER N  121.90  175.10  163.92  154.56  175.20   0.10  1  0 "[    .    1    .    2]" 
       188 . 1 128 TYR C 1 129 SER N  1 129 SER CA 1 129 SER C -152.80 -112.80 -126.90 -129.41 -133.54      .  .  0 "[    .    1    .    2]" 
       189 . 1 129 SER N 1 129 SER CA 1 129 SER C  1 130 ALA N  135.00 -177.20  153.71  154.16  152.92      .  .  0 "[    .    1    .    2]" 
       190 . 1 129 SER C 1 130 ALA N  1 130 ALA CA 1 130 ALA C -151.00  -85.80 -120.25 -130.81 -112.05      .  .  0 "[    .    1    .    2]" 
       191 . 1 130 ALA N 1 130 ALA CA 1 130 ALA C  1 131 ARG N  101.20  165.40  140.75  128.11  149.80      .  .  0 "[    .    1    .    2]" 
       192 . 1 130 ALA C 1 131 ARG N  1 131 ARG CA 1 131 ARG C -152.50  -86.50 -122.50 -108.15 -115.20      .  .  0 "[    .    1    .    2]" 
       193 . 1 131 ARG N 1 131 ARG CA 1 131 ARG C  1 132 MET N  108.80  151.60  127.32  126.21  123.02      .  .  0 "[    .    1    .    2]" 
       194 . 1 131 ARG C 1 132 MET N  1 132 MET CA 1 132 MET C -167.00  -67.80 -115.26 -124.55  -99.56      .  .  0 "[    .    1    .    2]" 
       195 . 1 132 MET N 1 132 MET CA 1 132 MET C  1 133 GLY N   77.80  175.80  104.42  104.69  102.26      .  .  0 "[    .    1    .    2]" 
       196 . 1 132 MET C 1 133 GLY N  1 133 GLY CA 1 133 GLY C   51.70   91.70   60.75   60.85   58.52   0.80 18  0 "[    .    1    .    2]" 
       197 . 1 133 GLY N 1 133 GLY CA 1 133 GLY C  1 134 ASN N -142.80 -102.80 -108.41 -112.43 -102.75   0.05  3  0 "[    .    1    .    2]" 
       198 . 1 133 GLY C 1 134 ASN N  1 134 ASN CA 1 134 ASN C -114.90  -74.90 -109.66 -115.48  -99.21   0.58 15  0 "[    .    1    .    2]" 
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