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
621379 5lue 34039 cing 4-filtered-FRED Wattos check violation dihedral angle


data_5lue


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              175
    _TA_constraint_stats_list.Viol_count                    144
    _TA_constraint_stats_list.Viol_total                    16479.16
    _TA_constraint_stats_list.Viol_max                      71.30
    _TA_constraint_stats_list.Viol_rms                      2.03
    _TA_constraint_stats_list.Viol_average_all_restraints   0.24
    _TA_constraint_stats_list.Viol_average_violations_only  5.72
    _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 PSI   1  1 MET N  1  1 MET CA 1  1 MET C   1  2 LEU N     62.80 -167.10 -175.16  149.85   93.08 71.30  4  8 "[ * +. -  1 ***. ** 2]" 
         2 CHI1  1  1 MET N  1  1 MET CA 1  1 MET CB  1  1 MET CG   145.00  105.00  -64.29  -65.07  -66.47     .  .  0 "[    .    1    .    2]" 
         3 CHI2  1  1 MET CA 1  1 MET CB 1  1 MET CG  1  1 MET SD    35.00  -35.00 -121.15  -77.07  177.36     .  .  0 "[    .    1    .    2]" 
         4 PHI   1  1 MET C  1  2 LEU N  1  2 LEU CA  1  2 LEU C   -110.00  -50.00  -70.68  -82.35  -63.80     .  .  0 "[    .    1    .    2]" 
         5 PSI   1  2 LEU N  1  2 LEU CA 1  2 LEU C   1  3 LYS N    180.00 -165.00  179.91 -178.18 -178.73  3.07  6  0 "[    .    1    .    2]" 
         6 PHI   1  2 LEU C  1  3 LYS N  1  3 LYS CA  1  3 LYS C   -140.00 -100.00 -125.90 -120.89 -121.82  1.38  6  0 "[    .    1    .    2]" 
         7 PSI   1  3 LYS N  1  3 LYS CA 1  3 LYS C   1  4 CYS N    100.00  150.00  138.76  135.87  142.10     .  .  0 "[    .    1    .    2]" 
         8 PHI   1  3 LYS C  1  4 CYS N  1  4 CYS CA  1  4 CYS C   -146.90  -72.90 -122.28 -127.82 -113.45     .  .  0 "[    .    1    .    2]" 
         9 PSI   1  4 CYS N  1  4 CYS CA 1  4 CYS C   1  5 ASN N     93.70  157.60  152.97  154.34  153.12  3.28  6  0 "[    .    1    .    2]" 
        10 CHI1  1  4 CYS N  1  4 CYS CA 1  4 CYS CB  1  4 CYS SG   -80.00  -40.00  -58.97  -62.97  -54.10     .  .  0 "[    .    1    .    2]" 
        11 PHI   1  4 CYS C  1  5 ASN N  1  5 ASN CA  1  5 ASN C   -120.00  -80.00  -81.69  -89.32  -91.92  2.49 19  0 "[    .    1    .    2]" 
        12 PSI   1  5 ASN N  1  5 ASN CA 1  5 ASN C   1  6 LYS N    100.00  180.00  152.61  141.25  133.17     .  .  0 "[    .    1    .    2]" 
        13 PHI   1  5 ASN C  1  6 LYS N  1  6 LYS CA  1  6 LYS C   -152.50  -77.20 -137.19 -140.52 -130.93     .  .  0 "[    .    1    .    2]" 
        14 PSI   1  6 LYS N  1  6 LYS CA 1  6 LYS C   1  7 LEU N   -100.00  -60.00  -84.33  -85.00  -82.70     .  .  0 "[    .    1    .    2]" 
        15 PHI   1  6 LYS C  1  7 LEU N  1  7 LEU CA  1  7 LEU C    179.40  -78.30  -88.35 -113.49  -61.70 16.60 16  2 "[    .    1    .+ - 2]" 
        16 PSI   1  7 LEU N  1  7 LEU CA 1  7 LEU C   1  8 VAL N     63.20  135.70  136.42  134.87  133.90 14.79  9  2 "[    .   +1-   .    2]" 
        17 PHI   1  7 LEU C  1  8 VAL N  1  8 VAL CA  1  8 VAL C   -129.10  -57.30  -64.96  -66.24  -67.81     .  .  0 "[    .    1    .    2]" 
        18 PSI   1  8 VAL N  1  8 VAL CA 1  8 VAL C   1  9 PRO N    124.20  162.70  153.23  153.07  152.98     .  .  0 "[    .    1    .    2]" 
        19 PSI   1  9 PRO N  1  9 PRO CA 1  9 PRO C   1 10 ILE N    -50.00  -15.00  -42.17  -44.20  -40.79     .  .  0 "[    .    1    .    2]" 
        20 PHI   1  9 PRO C  1 10 ILE N  1 10 ILE CA  1 10 ILE C   -129.90  -78.50 -115.88 -117.18 -114.47     .  .  0 "[    .    1    .    2]" 
        21 PSI   1 10 ILE N  1 10 ILE CA 1 10 ILE C   1 11 ALA N    -20.00   20.00  -19.26  -17.81  -22.25  3.84 19  0 "[    .    1    .    2]" 
        22 PHI   1 10 ILE C  1 11 ALA N  1 11 ALA CA  1 11 ALA C    -50.00  -20.00  -42.41  -44.40  -40.41     .  .  0 "[    .    1    .    2]" 
        23 PSI   1 11 ALA N  1 11 ALA CA 1 11 ALA C   1 12 TYR N    111.80  151.80  133.79  131.72  135.25     .  .  0 "[    .    1    .    2]" 
        24 PHI   1 11 ALA C  1 12 TYR N  1 12 TYR CA  1 12 TYR C   -169.20 -126.10 -137.50 -135.26 -136.65     .  .  0 "[    .    1    .    2]" 
        25 PSI   1 12 TYR N  1 12 TYR CA 1 12 TYR C   1 13 LYS N    141.20 -178.80  161.93  164.92  164.38     .  .  0 "[    .    1    .    2]" 
        26 PHI   1 12 TYR C  1 13 LYS N  1 13 LYS CA  1 13 LYS C   -151.40  -96.70 -122.25 -128.39 -109.93     .  .  0 "[    .    1    .    2]" 
        27 PSI   1 13 LYS N  1 13 LYS CA 1 13 LYS C   1 14 THR N    111.80  161.80  153.94  149.63  149.53     .  .  0 "[    .    1    .    2]" 
        28 PHI   1 13 LYS C  1 14 THR N  1 14 THR CA  1 14 THR C   -122.30  -77.80  -84.65  -86.62  -87.02     .  .  0 "[    .    1    .    2]" 
        29 PSI   1 14 THR N  1 14 THR CA 1 14 THR C   1 15 CYS N     98.40  138.40  127.08  121.68  130.26     .  .  0 "[    .    1    .    2]" 
        30 PHI   1 14 THR C  1 15 CYS N  1 15 CYS CA  1 15 CYS C   -146.50  -63.30  -69.29  -69.91  -68.65     .  .  0 "[    .    1    .    2]" 
        31 PHI   1 14 THR C  1 15 CYS N  1 15 CYS CA  1 15 CYS C    -75.00  -65.00  -69.29  -69.91  -68.65     .  .  0 "[    .    1    .    2]" 
        32 PSI   1 15 CYS N  1 15 CYS CA 1 15 CYS C   1 16 PRO N     70.00  166.80  144.97  139.40  150.79     .  .  0 "[    .    1    .    2]" 
        33 PSI   1 15 CYS N  1 15 CYS CA 1 15 CYS C   1 16 PRO N    120.00  180.00  144.97  139.40  150.79     .  .  0 "[    .    1    .    2]" 
        34 PSI   1 16 PRO N  1 16 PRO CA 1 16 PRO C   1 17 GLU N    131.20  171.20  155.05  155.01  154.78     .  .  0 "[    .    1    .    2]" 
        35 PSI   1 16 PRO N  1 16 PRO CA 1 16 PRO C   1 17 GLU N    100.00  160.00  155.05  155.01  154.78     .  .  0 "[    .    1    .    2]" 
        36 CHI1  1 15 CYS N  1 15 CYS CA 1 15 CYS CB  1 15 CYS SG   -75.00  -45.00  -66.91  -67.32  -67.44     .  .  0 "[    .    1    .    2]" 
        37 PHI   1 16 PRO C  1 17 GLU N  1 17 GLU CA  1 17 GLU C    -75.00  -45.00  -56.97  -56.58  -56.94     .  .  0 "[    .    1    .    2]" 
        38 CHI1  1 17 GLU N  1 17 GLU CA 1 17 GLU CB  1 17 GLU CG   160.00 -160.00 -178.47 -179.26 -178.13     .  .  0 "[    .    1    .    2]" 
        39 PSI   1 17 GLU N  1 17 GLU CA 1 17 GLU C   1 18 GLY N    120.00  160.00  135.12  134.26  133.18     .  .  0 "[    .    1    .    2]" 
        40 PHI   1 17 GLU C  1 18 GLY N  1 18 GLY CA  1 18 GLY C     30.00   90.00   98.94  101.29  100.08 12.35  9 20  [********+**********-]  
        41 PSI   1 18 GLY N  1 18 GLY CA 1 18 GLY C   1 19 LYS N   -105.00  105.00  -20.88  -28.01  -11.62     .  .  0 "[    .    1    .    2]" 
        42 PHI   1 18 GLY C  1 19 LYS N  1 19 LYS CA  1 19 LYS C   -125.00  -80.00  -98.89 -104.69  -90.00     .  .  0 "[    .    1    .    2]" 
        43 CHI1  1 19 LYS N  1 19 LYS CA 1 19 LYS CB  1 19 LYS CG   -80.00  -40.00  -63.30  -69.14  -72.16     .  .  0 "[    .    1    .    2]" 
        44 PSI   1 19 LYS N  1 19 LYS CA 1 19 LYS C   1 20 ASN N    145.00 -175.00  151.82  154.23  153.42     .  .  0 "[    .    1    .    2]" 
        45 PHI   1 19 LYS C  1 20 ASN N  1 20 ASN CA  1 20 ASN C   -150.00 -105.00 -141.16 -154.98 -135.00  4.98  9  0 "[    .    1    .    2]" 
        46 CHI1  1 20 ASN N  1 20 ASN CA 1 20 ASN CB  1 20 ASN CG   160.00 -160.00 -178.32  178.87 -175.54     .  .  0 "[    .    1    .    2]" 
        47 PSI   1 20 ASN N  1 20 ASN CA 1 20 ASN C   1 21 LEU N    -65.00    0.00  -43.71  -35.62  -47.28     .  .  0 "[    .    1    .    2]" 
        48 PHI   1 20 ASN C  1 21 LEU N  1 21 LEU CA  1 21 LEU C   -100.00  -80.00  -88.59  -93.60  -84.82     .  .  0 "[    .    1    .    2]" 
        49 CHI1  1 21 LEU N  1 21 LEU CA 1 21 LEU CB  1 21 LEU CG   -90.00  -30.00  -50.49  -50.73  -51.24     .  .  0 "[    .    1    .    2]" 
        50 CHI2  1 21 LEU CA 1 21 LEU CB 1 21 LEU CG  1 21 LEU CD1   75.00 -115.00  179.10 -178.11 -179.40     .  .  0 "[    .    1    .    2]" 
        51 PSI   1 21 LEU N  1 21 LEU CA 1 21 LEU C   1 22 CYS N    145.00  175.00  155.06  157.47  156.37     .  .  0 "[    .    1    .    2]" 
        52 PHI   1 21 LEU C  1 22 CYS N  1 22 CYS CA  1 22 CYS C   -135.00 -105.00 -112.71 -112.75 -113.24     .  .  0 "[    .    1    .    2]" 
        53 CHI1  1 22 CYS N  1 22 CYS CA 1 22 CYS CB  1 22 CYS SG   -85.00  -35.00  -67.51  -65.28  -66.45     .  .  0 "[    .    1    .    2]" 
        54 PSI   1 22 CYS N  1 22 CYS CA 1 22 CYS C   1 23 TYR N    135.00  -65.00  130.27  138.77  136.78 11.77 18 11 "[    **** ***- *  + *]" 
        55 PHI   1 22 CYS C  1 23 TYR N  1 23 TYR CA  1 23 TYR C   -135.00 -105.00 -121.09 -124.11 -115.49     .  .  0 "[    .    1    .    2]" 
        56 PSI   1 23 TYR N  1 23 TYR CA 1 23 TYR C   1 24 LYS N     55.00 -175.00  158.16  155.65  160.11     .  .  0 "[    .    1    .    2]" 
        57 CHI1  1 23 TYR N  1 23 TYR CA 1 23 TYR CB  1 23 TYR CG    40.00   80.00   73.50   75.82   74.48     .  .  0 "[    .    1    .    2]" 
        58 PHI   1 23 TYR C  1 24 LYS N  1 24 LYS CA  1 24 LYS C   -145.00  -95.00 -132.55 -135.63 -129.89     .  .  0 "[    .    1    .    2]" 
        59 CHI1  1 24 LYS N  1 24 LYS CA 1 24 LYS CB  1 24 LYS CG    40.00   80.00   59.06   55.49   61.06     .  .  0 "[    .    1    .    2]" 
        60 CHI2  1 24 LYS CA 1 24 LYS CB 1 24 LYS CG  1 24 LYS CD    15.00  -45.00  176.27  173.59  172.46     .  .  0 "[    .    1    .    2]" 
        61 PSI   1 24 LYS N  1 24 LYS CA 1 24 LYS C   1 25 MET N    110.00  180.00  148.06  142.24  149.99     .  .  0 "[    .    1    .    2]" 
        62 PHI   1 24 LYS C  1 25 MET N  1 25 MET CA  1 25 MET C   -145.00  -95.00 -112.90 -110.89 -111.22     .  .  0 "[    .    1    .    2]" 
        63 CHI1  1 25 MET N  1 25 MET CA 1 25 MET CB  1 25 MET CG   -85.00  -35.00  -64.88  -64.48  -65.08     .  .  0 "[    .    1    .    2]" 
        64 CHI2  1 25 MET CA 1 25 MET CB 1 25 MET CG  1 25 MET SD    45.00  -35.00 -177.28 -176.99  176.40     .  .  0 "[    .    1    .    2]" 
        65 PSI   1 25 MET N  1 25 MET CA 1 25 MET C   1 26 PHE N    125.00 -175.00  136.86  139.60  138.77     .  .  0 "[    .    1    .    2]" 
        66 PHI   1 25 MET C  1 26 PHE N  1 26 PHE CA  1 26 PHE C   -145.00  -95.00 -113.31 -113.90 -114.31     .  .  0 "[    .    1    .    2]" 
        67 CHI1  1 26 PHE N  1 26 PHE CA 1 26 PHE CB  1 26 PHE CG   -75.00  -45.00  -61.63  -63.36  -59.25     .  .  0 "[    .    1    .    2]" 
        68 PSI   1 26 PHE N  1 26 PHE CA 1 26 PHE C   1 27 MET N    125.00 -165.00  168.38  167.55  166.60     .  .  0 "[    .    1    .    2]" 
        69 PHI   1 26 PHE C  1 27 MET N  1 27 MET CA  1 27 MET C   -141.00 -100.00 -116.84 -117.82 -120.87     .  .  0 "[    .    1    .    2]" 
        70 CHI1  1 27 MET N  1 27 MET CA 1 27 MET CB  1 27 MET CG   -85.00  -45.00  -63.54  -63.83  -64.37     .  .  0 "[    .    1    .    2]" 
        71 PSI   1 27 MET N  1 27 MET CA 1 27 MET C   1 28 MET N    120.00  160.00  142.98  140.85  146.54     .  .  0 "[    .    1    .    2]" 
        72 PHI   1 27 MET C  1 28 MET N  1 28 MET CA  1 28 MET C    -75.00  -25.00  -48.95  -49.44  -52.53     .  .  0 "[    .    1    .    2]" 
        73 CHI1  1 28 MET N  1 28 MET CA 1 28 MET CB  1 28 MET CG   -85.00  -35.00  -74.84  -76.93  -72.09     .  .  0 "[    .    1    .    2]" 
        74 PSI   1 28 MET N  1 28 MET CA 1 28 MET C   1 29 SER N    -80.00  -20.00  -28.66  -32.40  -22.34     .  .  0 "[    .    1    .    2]" 
        75 PHI   1 28 MET C  1 29 SER N  1 29 SER CA  1 29 SER C    -95.00  -35.00  -63.87  -65.19  -68.59     .  .  0 "[    .    1    .    2]" 
        76 CHI1  1 29 SER N  1 29 SER CA 1 29 SER CB  1 29 SER OG   160.00 -160.00  179.89  179.51 -179.55     .  .  0 "[    .    1    .    2]" 
        77 PSI   1 29 SER N  1 29 SER CA 1 29 SER C   1 30 ASP N    -95.00  -55.00  -72.06  -77.59  -63.60     .  .  0 "[    .    1    .    2]" 
        78 PHI   1 29 SER C  1 30 ASP N  1 30 ASP CA  1 30 ASP C    -95.00  -35.00  -94.08  -97.23 -100.80  9.69  6  4 "[*   .+   1 -  .*   2]" 
        79 CHI1  1 30 ASP N  1 30 ASP CA 1 30 ASP CB  1 30 ASP CG   160.00 -160.00 -174.11 -174.52 -175.38     .  .  0 "[    .    1    .    2]" 
        80 PSI   1 30 ASP N  1 30 ASP CA 1 30 ASP C   1 31 LEU N     55.00  125.00   85.61   81.50   95.17     .  .  0 "[    .    1    .    2]" 
        81 PHI   1 30 ASP C  1 31 LEU N  1 31 LEU CA  1 31 LEU C    -85.00  -65.00  -78.48  -78.84  -79.76     .  .  0 "[    .    1    .    2]" 
        82 CHI1  1 31 LEU N  1 31 LEU CA 1 31 LEU CB  1 31 LEU CG   -85.00  -35.00  -87.41  -91.46  -77.51  6.46  8  8 "[  * . *+ *  **. -* 2]" 
        83 PSI   1 31 LEU N  1 31 LEU CA 1 31 LEU C   1 32 THR N    -85.00    5.00  -21.97  -21.51  -28.05     .  .  0 "[    .    1    .    2]" 
        84 PHI   1 31 LEU C  1 32 THR N  1 32 THR CA  1 32 THR C   -120.00  -55.00  -70.87  -72.99  -66.89     .  .  0 "[    .    1    .    2]" 
        85 CHI1  1 32 THR N  1 32 THR CA 1 32 THR CB  1 32 THR OG1  -85.00  -35.00  -60.17  -60.48  -60.72     .  .  0 "[    .    1    .    2]" 
        86 PSI   1 32 THR N  1 32 THR CA 1 32 THR C   1 33 ILE N    -85.00   65.00  -44.22  -45.23  -41.78     .  .  0 "[    .    1    .    2]" 
        87 PHI   1 32 THR C  1 33 ILE N  1 33 ILE CA  1 33 ILE C   -160.00 -110.00 -125.31 -125.12 -125.12     .  .  0 "[    .    1    .    2]" 
        88 CHI1  1 33 ILE N  1 33 ILE CA 1 33 ILE CB  1 33 ILE CG1  -85.00  -45.00  -64.55  -64.57  -64.63     .  .  0 "[    .    1    .    2]" 
        89 CHI21 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 1 33 ILE CD1   25.00  -45.00  -63.63  -63.28  -63.35     .  .  0 "[    .    1    .    2]" 
        90 PSI   1 33 ILE N  1 33 ILE CA 1 33 ILE C   1 34 PRO N     80.00  130.00  125.80  126.43  126.10     .  .  0 "[    .    1    .    2]" 
        91 PSI   1 34 PRO N  1 34 PRO CA 1 34 PRO C   1 35 VAL N    125.00  180.00  158.52  156.44  155.28     .  .  0 "[    .    1    .    2]" 
        92 PHI   1 34 PRO C  1 35 VAL N  1 35 VAL CA  1 35 VAL C   -135.00 -105.00 -113.45 -112.40 -113.02     .  .  0 "[    .    1    .    2]" 
        93 CHI1  1 35 VAL N  1 35 VAL CA 1 35 VAL CB  1 35 VAL CG1  -80.00  -40.00  -58.36  -58.59  -59.22     .  .  0 "[    .    1    .    2]" 
        94 PSI   1 35 VAL N  1 35 VAL CA 1 35 VAL C   1 36 LYS N    -85.00   45.00  -28.43  -33.40  -21.96     .  .  0 "[    .    1    .    2]" 
        95 PHI   1 35 VAL C  1 36 LYS N  1 36 LYS CA  1 36 LYS C   -160.00 -120.00 -146.44 -144.23 -144.78     .  .  0 "[    .    1    .    2]" 
        96 CHI1  1 36 LYS N  1 36 LYS CA 1 36 LYS CB  1 36 LYS CG   -85.00  -35.00  -76.41  -74.21  -75.67     .  .  0 "[    .    1    .    2]" 
        97 CHI2  1 36 LYS CA 1 36 LYS CB 1 36 LYS CG  1 36 LYS CD    65.00  -25.00 -164.99 -178.17 -158.58     .  .  0 "[    .    1    .    2]" 
        98 PSI   1 36 LYS N  1 36 LYS CA 1 36 LYS C   1 37 ARG N    105.00 -175.00  145.29  135.95  149.90     .  .  0 "[    .    1    .    2]" 
        99 PHI   1 36 LYS C  1 37 ARG N  1 37 ARG CA  1 37 ARG C   -180.00 -120.00 -137.22 -140.02 -132.20     .  .  0 "[    .    1    .    2]" 
       100 CHI1  1 37 ARG N  1 37 ARG CA 1 37 ARG CB  1 37 ARG CG   -85.00  -35.00  -55.58  -60.61  -53.17     .  .  0 "[    .    1    .    2]" 
       101 PSI   1 37 ARG N  1 37 ARG CA 1 37 ARG C   1 38 GLY N     85.00 -165.00  160.18  154.01  151.75     .  .  0 "[    .    1    .    2]" 
       102 PHI   1 37 ARG C  1 38 GLY N  1 38 GLY CA  1 38 GLY C    165.00 -115.00 -178.61  174.04 -171.67     .  .  0 "[    .    1    .    2]" 
       103 PSI   1 38 GLY N  1 38 GLY CA 1 38 GLY C   1 39 CYS N     85.00  -85.00 -168.37 -160.40 -164.89     .  .  0 "[    .    1    .    2]" 
       104 PHI   1 38 GLY C  1 39 CYS N  1 39 CYS CA  1 39 CYS C   -145.00  -95.00 -106.13 -103.06 -104.48     .  .  0 "[    .    1    .    2]" 
       105 CHI1  1 39 CYS N  1 39 CYS CA 1 39 CYS CB  1 39 CYS SG   -85.00  -45.00  -59.05  -54.37  -57.20     .  .  0 "[    .    1    .    2]" 
       106 PSI   1 39 CYS N  1 39 CYS CA 1 39 CYS C   1 40 ILE N    120.00  175.00  152.67  154.79  153.72     .  .  0 "[    .    1    .    2]" 
       107 PHI   1 39 CYS C  1 40 ILE N  1 40 ILE CA  1 40 ILE C   -165.00 -125.00 -159.39 -157.44 -158.12     .  .  0 "[    .    1    .    2]" 
       108 CHI1  1 40 ILE N  1 40 ILE CA 1 40 ILE CB  1 40 ILE CG1  165.00 -165.00 -165.34 -167.70 -164.61  0.39  7  0 "[    .    1    .    2]" 
       109 PSI   1 40 ILE N  1 40 ILE CA 1 40 ILE C   1 41 ASP N    120.00  180.00  161.81  156.61  163.50     .  .  0 "[    .    1    .    2]" 
       110 PHI   1 40 ILE C  1 41 ASP N  1 41 ASP CA  1 41 ASP C   -100.00  -80.00  -89.31  -90.99  -88.28     .  .  0 "[    .    1    .    2]" 
       111 PSI   1 41 ASP N  1 41 ASP CA 1 41 ASP C   1 42 VAL N    -85.00    0.00  -48.29  -54.67  -46.61     .  .  0 "[    .    1    .    2]" 
       112 CHI1  1 41 ASP N  1 41 ASP CA 1 41 ASP CB  1 41 ASP CG    40.00   80.00   52.01   49.81   53.06     .  .  0 "[    .    1    .    2]" 
       113 PHI   1 41 ASP C  1 42 VAL N  1 42 VAL CA  1 42 VAL C   -125.00 -105.00 -114.27 -117.03 -112.92     .  .  0 "[    .    1    .    2]" 
       114 CHI1  1 42 VAL N  1 42 VAL CA 1 42 VAL CB  1 42 VAL CG1  165.00 -145.00  179.74  179.93  179.85     .  .  0 "[    .    1    .    2]" 
       115 PSI   1 42 VAL N  1 42 VAL CA 1 42 VAL C   1 43 CYS N    101.00  152.00  128.00  119.12  129.79     .  .  0 "[    .    1    .    2]" 
       116 PHI   1 42 VAL C  1 43 CYS N  1 43 CYS CA  1 43 CYS C    -75.00  -65.00  -69.86  -70.93  -69.38     .  .  0 "[    .    1    .    2]" 
       117 CHI1  1 43 CYS N  1 43 CYS CA 1 43 CYS CB  1 43 CYS SG   155.00 -155.00 -175.09 -173.28 -174.10     .  .  0 "[    .    1    .    2]" 
       118 PSI   1 43 CYS N  1 43 CYS CA 1 43 CYS C   1 44 PRO N     90.00  140.00  122.46  118.07  124.91     .  .  0 "[    .    1    .    2]" 
       119 PSI   1 44 PRO N  1 44 PRO CA 1 44 PRO C   1 45 LYS N    100.00  140.00  139.87  146.03  143.30  6.03  2  1 "[ +  .    1    .    2]" 
       120 PHI   1 44 PRO C  1 45 LYS N  1 45 LYS CA  1 45 LYS C    -85.00  -55.00  -69.90  -67.38  -68.97     .  .  0 "[    .    1    .    2]" 
       121 CHI1  1 45 LYS N  1 45 LYS CA 1 45 LYS CB  1 45 LYS CG   -85.00  -45.00  -66.18  -66.37  -66.11     .  .  0 "[    .    1    .    2]" 
       122 CHI2  1 45 LYS CA 1 45 LYS CB 1 45 LYS CG  1 45 LYS CD    15.00  -25.00  179.48  179.20  179.94     .  .  0 "[    .    1    .    2]" 
       123 PSI   1 45 LYS N  1 45 LYS CA 1 45 LYS C   1 46 ASN N    105.00 -165.00  158.91  162.73  160.02     .  .  0 "[    .    1    .    2]" 
       124 PHI   1 45 LYS C  1 46 ASN N  1 46 ASN CA  1 46 ASN C   -105.00  -60.00  -73.39  -72.86  -73.31     .  .  0 "[    .    1    .    2]" 
       125 CHI1  1 46 ASN N  1 46 ASN CA 1 46 ASN CB  1 46 ASN CG   -85.00  -35.00  -67.09  -68.58  -65.63     .  .  0 "[    .    1    .    2]" 
       126 CHI2  1 46 ASN CA 1 46 ASN CB 1 46 ASN CG  1 46 ASN OD1 -155.00   75.00  -25.07  -25.58  -24.29     .  .  0 "[    .    1    .    2]" 
       127 PSI   1 46 ASN N  1 46 ASN CA 1 46 ASN C   1 47 SER N     75.00  165.00  143.46  144.50  143.85     .  .  0 "[    .    1    .    2]" 
       128 PHI   1 46 ASN C  1 47 SER N  1 47 SER CA  1 47 SER C   -162.00  -95.00 -109.41 -111.56 -108.21     .  .  0 "[    .    1    .    2]" 
       129 CHI1  1 47 SER N  1 47 SER CA 1 47 SER CB  1 47 SER OG    40.00   80.00   67.03   67.72   67.47     .  .  0 "[    .    1    .    2]" 
       130 PSI   1 47 SER N  1 47 SER CA 1 47 SER C   1 48 LEU N    130.00  180.00  176.18  176.03  175.58     .  .  0 "[    .    1    .    2]" 
       131 PHI   1 47 SER C  1 48 LEU N  1 48 LEU CA  1 48 LEU C    -95.00  -55.00  -75.78  -76.46  -74.71     .  .  0 "[    .    1    .    2]" 
       132 CHI1  1 48 LEU N  1 48 LEU CA 1 48 LEU CB  1 48 LEU CG   -80.00  -40.00  -63.81  -63.81  -63.82     .  .  0 "[    .    1    .    2]" 
       133 CHI2  1 48 LEU CA 1 48 LEU CB 1 48 LEU CG  1 48 LEU CD1   85.00 -125.00  174.73  174.82  174.71     .  .  0 "[    .    1    .    2]" 
       134 PSI   1 48 LEU N  1 48 LEU CA 1 48 LEU C   1 49 LEU N    -60.00   -5.00  -26.60  -27.06  -27.22     .  .  0 "[    .    1    .    2]" 
       135 PHI   1 48 LEU C  1 49 LEU N  1 49 LEU CA  1 49 LEU C    -95.00  -35.00  -95.35  -97.73  -90.94  2.73 17  0 "[    .    1    .    2]" 
       136 CHI1  1 49 LEU N  1 49 LEU CA 1 49 LEU CB  1 49 LEU CG   -80.00  -40.00  -61.91  -62.03  -61.56     .  .  0 "[    .    1    .    2]" 
       137 PSI   1 49 LEU N  1 49 LEU CA 1 49 LEU C   1 50 VAL N    -60.00  -20.00  -49.24  -49.57  -50.73     .  .  0 "[    .    1    .    2]" 
       138 PHI   1 49 LEU C  1 50 VAL N  1 50 VAL CA  1 50 VAL C   -130.00 -105.00 -124.83 -124.81 -124.92     .  .  0 "[    .    1    .    2]" 
       139 CHI1  1 50 VAL N  1 50 VAL CA 1 50 VAL CB  1 50 VAL CG1  -80.00  -40.00  -65.13  -64.87  -64.99     .  .  0 "[    .    1    .    2]" 
       140 PSI   1 50 VAL N  1 50 VAL CA 1 50 VAL C   1 51 LYS N    120.00  160.00  146.82  147.16  146.87     .  .  0 "[    .    1    .    2]" 
       141 PHI   1 50 VAL C  1 51 LYS N  1 51 LYS CA  1 51 LYS C   -155.00  -25.00 -104.87 -104.57 -105.36     .  .  0 "[    .    1    .    2]" 
       142 CHI1  1 51 LYS N  1 51 LYS CA 1 51 LYS CB  1 51 LYS CG   165.00 -165.00  178.90  178.17  179.96     .  .  0 "[    .    1    .    2]" 
       143 CHI2  1 51 LYS CA 1 51 LYS CB 1 51 LYS CG  1 51 LYS CD    15.00  -15.00 -178.57 -177.57 -177.81     .  .  0 "[    .    1    .    2]" 
       144 PSI   1 51 LYS N  1 51 LYS CA 1 51 LYS C   1 52 TYR N    120.00  175.00  145.22  144.24  145.84     .  .  0 "[    .    1    .    2]" 
       145 PHI   1 51 LYS C  1 52 TYR N  1 52 TYR CA  1 52 TYR C   -140.00 -100.00 -116.66 -115.82 -116.09     .  .  0 "[    .    1    .    2]" 
       146 CHI1  1 52 TYR N  1 52 TYR CA 1 52 TYR CB  1 52 TYR CG   -85.00  -35.00  -64.47  -67.31  -63.27     .  .  0 "[    .    1    .    2]" 
       147 PSI   1 52 TYR N  1 52 TYR CA 1 52 TYR C   1 53 VAL N    100.00  140.00  126.05  127.54  127.43     .  .  0 "[    .    1    .    2]" 
       148 PHI   1 52 TYR C  1 53 VAL N  1 53 VAL CA  1 53 VAL C   -140.00 -100.00 -124.95 -124.74 -124.90     .  .  0 "[    .    1    .    2]" 
       149 CHI1  1 53 VAL N  1 53 VAL CA 1 53 VAL CB  1 53 VAL CG1  160.00 -160.00 -178.56 -179.43 -178.08     .  .  0 "[    .    1    .    2]" 
       150 PSI   1 53 VAL N  1 53 VAL CA 1 53 VAL C   1 54 CYS N    120.00  160.00  129.90  129.37  128.95     .  .  0 "[    .    1    .    2]" 
       151 PHI   1 53 VAL C  1 54 CYS N  1 54 CYS CA  1 54 CYS C   -145.00  -95.00 -119.50 -125.27 -116.71     .  .  0 "[    .    1    .    2]" 
       152 CHI1  1 54 CYS N  1 54 CYS CA 1 54 CYS CB  1 54 CYS SG   -85.00  -35.00  -44.17  -48.02  -41.32     .  .  0 "[    .    1    .    2]" 
       153 PSI   1 54 CYS N  1 54 CYS CA 1 54 CYS C   1 55 CYS N    125.00 -175.00  161.94  156.43  165.33     .  .  0 "[    .    1    .    2]" 
       154 PHI   1 54 CYS C  1 55 CYS N  1 55 CYS CA  1 55 CYS C    175.00 -125.00 -158.38 -162.85 -150.14     .  .  0 "[    .    1    .    2]" 
       155 CHI1  1 55 CYS N  1 55 CYS CA 1 55 CYS CB  1 55 CYS SG    40.00   80.00   44.38   41.73   67.47     .  .  0 "[    .    1    .    2]" 
       156 PSI   1 55 CYS N  1 55 CYS CA 1 55 CYS C   1 56 ASN N    105.00 -175.00  149.28  144.21  152.87     .  .  0 "[    .    1    .    2]" 
       157 PHI   1 55 CYS C  1 56 ASN N  1 56 ASN CA  1 56 ASN C   -160.00  -80.00 -104.63 -105.87  -99.24     .  .  0 "[    .    1    .    2]" 
       158 PSI   1 56 ASN N  1 56 ASN CA 1 56 ASN C   1 57 THR N    -70.00   60.00   33.62   30.89   36.84     .  .  0 "[    .    1    .    2]" 
       159 CHI1  1 56 ASN N  1 56 ASN CA 1 56 ASN CB  1 56 ASN CG    40.00   80.00   61.36   60.53   62.09     .  .  0 "[    .    1    .    2]" 
       160 PHI   1 56 ASN C  1 57 THR N  1 57 THR CA  1 57 THR C   -165.00 -110.00 -135.05 -138.29 -133.14     .  .  0 "[    .    1    .    2]" 
       161 CHI1  1 57 THR N  1 57 THR CA 1 57 THR CB  1 57 THR OG1   15.00   95.00   57.64   52.52   62.47     .  .  0 "[    .    1    .    2]" 
       162 PSI   1 57 THR N  1 57 THR CA 1 57 THR C   1 58 ASP N    155.00 -175.00  171.26  170.55  170.11     .  .  0 "[    .    1    .    2]" 
       163 PHI   1 57 THR C  1 58 ASP N  1 58 ASP CA  1 58 ASP C   -115.00  -70.00  -77.63  -80.70  -88.01     .  .  0 "[    .    1    .    2]" 
       164 CHI1  1 58 ASP N  1 58 ASP CA 1 58 ASP CB  1 58 ASP CG   -85.00  -45.00  -72.54  -71.08  -71.20     .  .  0 "[    .    1    .    2]" 
       165 PSI   1 58 ASP N  1 58 ASP CA 1 58 ASP C   1 59 ARG N    125.00  165.00  136.79  134.13  140.33     .  .  0 "[    .    1    .    2]" 
       166 PHI   1 58 ASP C  1 59 ARG N  1 59 ARG CA  1 59 ARG C     30.00   70.00   52.19   49.89   49.09     .  .  0 "[    .    1    .    2]" 
       167 CHI1  1 59 ARG N  1 59 ARG CA 1 59 ARG CB  1 59 ARG CG   -75.00  -45.00  -60.42  -62.62  -57.88     .  .  0 "[    .    1    .    2]" 
       168 CHI2  1 59 ARG CA 1 59 ARG CB 1 59 ARG CG  1 59 ARG CD    25.00  -15.00  158.23  159.88  157.94     .  .  0 "[    .    1    .    2]" 
       169 PSI   1 59 ARG N  1 59 ARG CA 1 59 ARG C   1 60 CYS N     20.00   80.00   32.84   29.31   51.63     .  .  0 "[    .    1    .    2]" 
       170 PHI   1 59 ARG C  1 60 CYS N  1 60 CYS CA  1 60 CYS C    -85.00  -30.00  -83.77  -85.04  -85.72  2.95  1  0 "[    .    1    .    2]" 
       171 CHI1  1 60 CYS N  1 60 CYS CA 1 60 CYS CB  1 60 CYS SG    40.00   80.00   65.76   54.51   77.10     .  .  0 "[    .    1    .    2]" 
       172 PSI   1 60 CYS N  1 60 CYS CA 1 60 CYS C   1 61 ASN N    -60.00  -20.00  -25.30  -27.64  -33.06     .  .  0 "[    .    1    .    2]" 
       173 PHI   1 60 CYS C  1 61 ASN N  1 61 ASN CA  1 61 ASN C   -160.00  -80.00  -93.57  -93.27  -96.52     .  .  0 "[    .    1    .    2]" 
       174 CHI1  1 61 ASN N  1 61 ASN CA 1 61 ASN CB  1 61 ASN CG    40.00   80.00   60.90   55.33   53.59     .  .  0 "[    .    1    .    2]" 
       175 CHI2  1 61 ASN CA 1 61 ASN CB 1 61 ASN CG  1 61 ASN OD1 -105.00  125.00    4.48  -13.29   19.05     .  .  0 "[    .    1    .    2]" 
    stop_

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