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
602382 2n2s 25610 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2n2s


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              107
    _TA_constraint_stats_list.Viol_count                    71
    _TA_constraint_stats_list.Viol_total                    40006.68
    _TA_constraint_stats_list.Viol_max                      82.12
    _TA_constraint_stats_list.Viol_rms                      6.38
    _TA_constraint_stats_list.Viol_average_all_restraints   0.93
    _TA_constraint_stats_list.Viol_average_violations_only  28.17
    _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 SER N 1  1 SER CA 1  1 SER C  1  2 CYS N    -85.00 -155.00  155.11  136.66   91.13     .  .  0 "[    .    1    .    2]" 
         2 PHI  1  1 SER C 1  2 CYS N  1  2 CYS CA 1  2 CYS C     45.00  -45.00  -99.09 -102.89 -126.49     .  .  0 "[    .    1    .    2]" 
         3 PHI  1  1 SER C 1  2 CYS N  1  2 CYS CA 1  2 CYS C    175.00   75.00  -99.09 -102.89 -126.49     .  .  0 "[    .    1    .    2]" 
         4 CHI1 1  2 CYS N 1  2 CYS CA 1  2 CYS CB 1  2 CYS SG    25.00  -25.00  -93.99 -171.55  -24.37  0.63  4  0 "[    .    1    .    2]" 
         5 CHI1 1  2 CYS N 1  2 CYS CA 1  2 CYS CB 1  2 CYS SG   155.00   85.00  -93.99 -171.55  -24.37     .  .  0 "[    .    1    .    2]" 
         6 PSI  1  2 CYS N 1  2 CYS CA 1  2 CYS C  1  3 GLY N     15.00 -165.00  177.62  176.73  170.51 12.50  6  3 "[    .+- *1    .    2]" 
         7 PHI  1  2 CYS C 1  3 GLY N  1  3 GLY CA 1  3 GLY C     45.00  -45.00  -85.32  -71.04  -73.74     .  .  0 "[    .    1    .    2]" 
         8 PSI  1  3 GLY N 1  3 GLY CA 1  3 GLY C  1  4 SER N   -115.00  115.00  -11.90  -63.28   19.78     .  .  0 "[    .    1    .    2]" 
         9 PHI  1  3 GLY C 1  4 SER N  1  4 SER CA 1  4 SER C     45.00  -45.00   74.59   51.67  160.44     .  .  0 "[    .    1    .    2]" 
        10 PHI  1  3 GLY C 1  4 SER N  1  4 SER CA 1  4 SER C    175.00   75.00   74.59   51.67  160.44 43.75  4  3 "[  *+.    1    .    -]" 
        11 PSI  1  4 SER N 1  4 SER CA 1  4 SER C  1  5 GLU N    -85.00  105.00    9.57  -12.98   29.68     .  .  0 "[    .    1    .    2]" 
        12 PHI  1  4 SER C 1  5 GLU N  1  5 GLU CA 1  5 GLU C     45.00  -45.00  -88.69 -117.55  -70.33     .  .  0 "[    .    1    .    2]" 
        13 PHI  1  4 SER C 1  5 GLU N  1  5 GLU CA 1  5 GLU C    175.00   75.00  -88.69 -117.55  -70.33     .  .  0 "[    .    1    .    2]" 
        14 CHI1 1  5 GLU N 1  5 GLU CA 1  5 GLU CB 1  5 GLU CG    25.00  -25.00 -168.08 -172.34 -177.18     .  .  0 "[    .    1    .    2]" 
        15 CHI1 1  5 GLU N 1  5 GLU CA 1  5 GLU CB 1  5 GLU CG   155.00   95.00 -168.08 -172.34 -177.18     .  .  0 "[    .    1    .    2]" 
        16 PSI  1  5 GLU N 1  5 GLU CA 1  5 GLU C  1  6 CYS N    -85.00   95.00  -25.12  -15.84  -18.38     .  .  0 "[    .    1    .    2]" 
        17 PHI  1  5 GLU C 1  6 CYS N  1  6 CYS CA 1  6 CYS C     45.00  -45.00  -98.77  -94.50  -96.39     .  .  0 "[    .    1    .    2]" 
        18 PHI  1  5 GLU C 1  6 CYS N  1  6 CYS CA 1  6 CYS C    175.00   75.00  -98.77  -94.50  -96.39     .  .  0 "[    .    1    .    2]" 
        19 CHI1 1  6 CYS N 1  6 CYS CA 1  6 CYS CB 1  6 CYS SG    35.00  -25.00  -71.88  -75.22  -76.07     .  .  0 "[    .    1    .    2]" 
        20 CHI1 1  6 CYS N 1  6 CYS CA 1  6 CYS CB 1  6 CYS SG   155.00   85.00  -71.88  -75.22  -76.07     .  .  0 "[    .    1    .    2]" 
        21 PSI  1  6 CYS N 1  6 CYS CA 1  6 CYS C  1  7 ALA N    -85.00   85.00   45.04   42.95   41.41     .  .  0 "[    .    1    .    2]" 
        22 PHI  1  6 CYS C 1  7 ALA N  1  7 ALA CA 1  7 ALA C     45.00 -125.00 -112.72 -142.92  -89.62 35.38 14 13 "[*-  * * **** +.****2]" 
        23 PHI  1  6 CYS C 1  7 ALA N  1  7 ALA CA 1  7 ALA C    175.00   75.00 -112.72 -142.92  -89.62     .  .  0 "[    .    1    .    2]" 
        24 PSI  1  7 ALA N 1  7 ALA CA 1  7 ALA C  1  8 PRO N     55.00   85.00    0.42    5.26   -5.99 82.12 14 20  [*****-*******+******]  
        25 PSI  1  8 PRO N 1  8 PRO CA 1  8 PRO C  1  9 GLU N    -55.00    5.00  -51.83  -61.05  -38.88  6.05  6  1 "[    .+   1    .    2]" 
        26 PHI  1  8 PRO C 1  9 GLU N  1  9 GLU CA 1  9 GLU C   -175.00  -45.00  -78.24  -85.27  -67.59     .  .  0 "[    .    1    .    2]" 
        27 CHI1 1  9 GLU N 1  9 GLU CA 1  9 GLU CB 1  9 GLU CG  -155.00  -85.00  -59.95  -60.49  -63.08 32.09  9 20  [********+********-**]  
        28 CHI1 1  9 GLU N 1  9 GLU CA 1  9 GLU CB 1  9 GLU CG  -115.00 -125.00  -59.95  -60.49  -63.08     .  .  0 "[    .    1    .    2]" 
        29 PSI  1  9 GLU N 1  9 GLU CA 1  9 GLU C  1 10 PRO N     65.00  165.00  157.74  153.91  151.54  0.14 15  0 "[    .    1    .    2]" 
        30 PSI  1  9 GLU N 1  9 GLU CA 1  9 GLU C  1 10 PRO N    145.00   75.00  157.74  153.91  151.54     .  .  0 "[    .    1    .    2]" 
        31 PSI  1 10 PRO N 1 10 PRO CA 1 10 PRO C  1 11 ASP N    175.00   -5.00  -29.20  -17.09  -23.92     .  .  0 "[    .    1    .    2]" 
        32 PSI  1 10 PRO N 1 10 PRO CA 1 10 PRO C  1 11 ASP N    -55.00 -165.00  -29.20  -17.09  -23.92     .  .  0 "[    .    1    .    2]" 
        33 PHI  1 10 PRO C 1 11 ASP N  1 11 ASP CA 1 11 ASP C     45.00  -65.00 -101.55 -109.22 -114.30     .  .  0 "[    .    1    .    2]" 
        34 PHI  1 10 PRO C 1 11 ASP N  1 11 ASP CA 1 11 ASP C    175.00   75.00 -101.55 -109.22 -114.30     .  .  0 "[    .    1    .    2]" 
        35 CHI1 1 11 ASP N 1 11 ASP CA 1 11 ASP CB 1 11 ASP CG   135.00   95.00  159.86   54.44  -48.99     .  .  0 "[    .    1    .    2]" 
        36 PSI  1 11 ASP N 1 11 ASP CA 1 11 ASP C  1 12 CYS N      5.00  145.00   51.74   23.54   82.42     .  .  0 "[    .    1    .    2]" 
        37 PHI  1 11 ASP C 1 12 CYS N  1 12 CYS CA 1 12 CYS C     55.00  -45.00  -63.95  -77.80  -49.91     .  .  0 "[    .    1    .    2]" 
        38 PHI  1 11 ASP C 1 12 CYS N  1 12 CYS CA 1 12 CYS C    175.00   65.00  -63.95  -77.80  -49.91     .  .  0 "[    .    1    .    2]" 
        39 CHI1 1 12 CYS N 1 12 CYS CA 1 12 CYS CB 1 12 CYS SG    35.00  -35.00   61.19   32.80   76.90  2.20 14  0 "[    .    1    .    2]" 
        40 CHI1 1 12 CYS N 1 12 CYS CA 1 12 CYS CB 1 12 CYS SG   155.00   85.00   61.19   32.80   76.90     .  .  0 "[    .    1    .    2]" 
        41 PSI  1 12 CYS N 1 12 CYS CA 1 12 CYS C  1 13 TRP N    -85.00   35.00  -19.23  -23.70  -27.67     .  .  0 "[    .    1    .    2]" 
        42 PHI  1 12 CYS C 1 13 TRP N  1 13 TRP CA 1 13 TRP C    175.00  -45.00  -50.03  -57.97  -42.74  2.26 10  0 "[    .    1    .    2]" 
        43 CHI1 1 13 TRP N 1 13 TRP CA 1 13 TRP CB 1 13 TRP CG   155.00  -25.00  -57.59  -55.31  -55.59     .  .  0 "[    .    1    .    2]" 
        44 PSI  1 13 TRP N 1 13 TRP CA 1 13 TRP C  1 14 GLY N    -85.00    5.00  -37.91  -37.18  -37.86     .  .  0 "[    .    1    .    2]" 
        45 PHI  1 13 TRP C 1 14 GLY N  1 14 GLY CA 1 14 GLY C     45.00  -45.00  -76.86  -93.60  -64.85     .  .  0 "[    .    1    .    2]" 
        46 PSI  1 14 GLY N 1 14 GLY CA 1 14 GLY C  1 15 CYS N   -105.00  105.00   -0.27  -36.52   49.06     .  .  0 "[    .    1    .    2]" 
        47 PHI  1 14 GLY C 1 15 CYS N  1 15 CYS CA 1 15 CYS C   -175.00  -45.00 -115.07 -154.94 -159.99     .  .  0 "[    .    1    .    2]" 
        48 CHI1 1 15 CYS N 1 15 CYS CA 1 15 CYS CB 1 15 CYS SG   155.00  -65.00 -167.37 -162.23 -164.83     .  .  0 "[    .    1    .    2]" 
        49 PSI  1 15 CYS N 1 15 CYS CA 1 15 CYS C  1 16 CYS N    -85.00    5.00  -46.49  -51.82  -41.26     .  .  0 "[    .    1    .    2]" 
        50 PHI  1 15 CYS C 1 16 CYS N  1 16 CYS CA 1 16 CYS C    175.00  -45.00  -77.31  -82.73  -70.32     .  .  0 "[    .    1    .    2]" 
        51 CHI1 1 16 CYS N 1 16 CYS CA 1 16 CYS CB 1 16 CYS SG   155.00  -45.00  168.88  166.79  165.38     .  .  0 "[    .    1    .    2]" 
        52 PSI  1 16 CYS N 1 16 CYS CA 1 16 CYS C  1 17 LEU N    -85.00   25.00  -48.56  -60.23  -42.01     .  .  0 "[    .    1    .    2]" 
        53 PHI  1 16 CYS C 1 17 LEU N  1 17 LEU CA 1 17 LEU C     45.00  -45.00  -63.65  -62.59  -63.13     .  .  0 "[    .    1    .    2]" 
        54 PHI  1 16 CYS C 1 17 LEU N  1 17 LEU CA 1 17 LEU C    175.00   75.00  -63.65  -62.59  -63.13     .  .  0 "[    .    1    .    2]" 
        55 CHI1 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG   135.00  105.00  -72.39  -78.91  -68.33     .  .  0 "[    .    1    .    2]" 
        56 PSI  1 17 LEU N 1 17 LEU CA 1 17 LEU C  1 18 VAL N    -85.00   95.00   -9.68  -27.22   15.44     .  .  0 "[    .    1    .    2]" 
        57 PHI  1 17 LEU C 1 18 VAL N  1 18 VAL CA 1 18 VAL C     45.00  -45.00  -80.88  -67.65  -74.43     .  .  0 "[    .    1    .    2]" 
        58 PHI  1 17 LEU C 1 18 VAL N  1 18 VAL CA 1 18 VAL C    175.00   75.00  -80.88  -67.65  -74.43     .  .  0 "[    .    1    .    2]" 
        59 CHI1 1 18 VAL N 1 18 VAL CA 1 18 VAL CB 1 18 VAL CG1   45.00  -45.00   61.08   56.32   65.18     .  .  0 "[    .    1    .    2]" 
        60 CHI1 1 18 VAL N 1 18 VAL CA 1 18 VAL CB 1 18 VAL CG1  165.00   85.00   61.08   56.32   65.18     .  .  0 "[    .    1    .    2]" 
        61 CHI1 1 18 VAL N 1 18 VAL CA 1 18 VAL CB 1 18 VAL CG1  -95.00 -155.00   61.08   56.32   65.18     .  .  0 "[    .    1    .    2]" 
        62 PSI  1 18 VAL N 1 18 VAL CA 1 18 VAL C  1 19 GLN N    -85.00   95.00  -19.84  -19.41  -19.75     .  .  0 "[    .    1    .    2]" 
        63 PHI  1 18 VAL C 1 19 GLN N  1 19 GLN CA 1 19 GLN C     45.00  -45.00 -139.68 -152.86 -132.18     .  .  0 "[    .    1    .    2]" 
        64 PHI  1 18 VAL C 1 19 GLN N  1 19 GLN CA 1 19 GLN C    175.00   75.00 -139.68 -152.86 -132.18     .  .  0 "[    .    1    .    2]" 
        65 CHI1 1 19 GLN N 1 19 GLN CA 1 19 GLN CB 1 19 GLN CG    25.00  -25.00   53.89   40.18   64.93     .  .  0 "[    .    1    .    2]" 
        66 CHI1 1 19 GLN N 1 19 GLN CA 1 19 GLN CB 1 19 GLN CG   155.00   95.00   53.89   40.18   64.93     .  .  0 "[    .    1    .    2]" 
        67 PSI  1 19 GLN N 1 19 GLN CA 1 19 GLN C  1 20 CYS N    -85.00   85.00   -4.14  -34.01    8.73     .  .  0 "[    .    1    .    2]" 
        68 PHI  1 19 GLN C 1 20 CYS N  1 20 CYS CA 1 20 CYS C     45.00  -45.00 -140.26 -128.55 -136.47     .  .  0 "[    .    1    .    2]" 
        69 PHI  1 19 GLN C 1 20 CYS N  1 20 CYS CA 1 20 CYS C    175.00   75.00 -140.26 -128.55 -136.47     .  .  0 "[    .    1    .    2]" 
        70 CHI1 1 20 CYS N 1 20 CYS CA 1 20 CYS CB 1 20 CYS SG    25.00  -25.00  -49.77  -44.02  -50.49     .  .  0 "[    .    1    .    2]" 
        71 CHI1 1 20 CYS N 1 20 CYS CA 1 20 CYS CB 1 20 CYS SG  -165.00   85.00  -49.77  -44.02  -50.49     .  .  0 "[    .    1    .    2]" 
        72 PSI  1 20 CYS N 1 20 CYS CA 1 20 CYS C  1 21 ALA N    115.00 -165.00  167.85  156.66  175.88     .  .  0 "[    .    1    .    2]" 
        73 PHI  1 20 CYS C 1 21 ALA N  1 21 ALA CA 1 21 ALA C     55.00  -45.00  -87.09  -86.18  -87.24     .  .  0 "[    .    1    .    2]" 
        74 PHI  1 20 CYS C 1 21 ALA N  1 21 ALA CA 1 21 ALA C    175.00   75.00  -87.09  -86.18  -87.24     .  .  0 "[    .    1    .    2]" 
        75 PSI  1 21 ALA N 1 21 ALA CA 1 21 ALA C  1 22 PRO N    145.00  165.00  156.23  158.44  157.84     .  .  0 "[    .    1    .    2]" 
        76 PSI  1 22 PRO N 1 22 PRO CA 1 22 PRO C  1 23 SER N     65.00   -5.00  -23.85  -33.48  -12.43     .  .  0 "[    .    1    .    2]" 
        77 PSI  1 22 PRO N 1 22 PRO CA 1 22 PRO C  1 23 SER N    -55.00 -165.00  -23.85  -33.48  -12.43     .  .  0 "[    .    1    .    2]" 
        78 PHI  1 22 PRO C 1 23 SER N  1 23 SER CA 1 23 SER C     45.00  -45.00  -61.13  -57.37  -58.40     .  .  0 "[    .    1    .    2]" 
        79 PHI  1 22 PRO C 1 23 SER N  1 23 SER CA 1 23 SER C    175.00   75.00  -61.13  -57.37  -58.40     .  .  0 "[    .    1    .    2]" 
        80 PSI  1 23 SER N 1 23 SER CA 1 23 SER C  1 24 ILE N    -85.00 -155.00  -38.16  -22.73  -32.63     .  .  0 "[    .    1    .    2]" 
        81 PHI  1 23 SER C 1 24 ILE N  1 24 ILE CA 1 24 ILE C   -155.00  -45.00  -78.56 -101.47  -68.04     .  .  0 "[    .    1    .    2]" 
        82 CHI1 1 24 ILE N 1 24 ILE CA 1 24 ILE CB 1 24 ILE CG1  -75.00  -25.00  -54.55  -53.44  -56.61     .  .  0 "[    .    1    .    2]" 
        83 PSI  1 24 ILE N 1 24 ILE CA 1 24 ILE C  1 25 CYS N    -85.00   -5.00  -49.89  -56.03  -43.06     .  .  0 "[    .    1    .    2]" 
        84 PHI  1 24 ILE C 1 25 CYS N  1 25 CYS CA 1 25 CYS C     55.00  -45.00  -64.08  -65.17  -65.37     .  .  0 "[    .    1    .    2]" 
        85 PHI  1 24 ILE C 1 25 CYS N  1 25 CYS CA 1 25 CYS C    175.00   65.00  -64.08  -65.17  -65.37     .  .  0 "[    .    1    .    2]" 
        86 CHI1 1 25 CYS N 1 25 CYS CA 1 25 CYS CB 1 25 CYS SG    35.00  -25.00  -46.44  -54.80  -40.18     .  .  0 "[    .    1    .    2]" 
        87 CHI1 1 25 CYS N 1 25 CYS CA 1 25 CYS CB 1 25 CYS SG   155.00   85.00  -46.44  -54.80  -40.18     .  .  0 "[    .    1    .    2]" 
        88 PSI  1 25 CYS N 1 25 CYS CA 1 25 CYS C  1 26 ALA N    -85.00   35.00  -30.09  -24.36  -26.28     .  .  0 "[    .    1    .    2]" 
        89 PHI  1 25 CYS C 1 26 ALA N  1 26 ALA CA 1 26 ALA C     45.00  -45.00  -62.96  -60.31  -60.38     .  .  0 "[    .    1    .    2]" 
        90 PHI  1 25 CYS C 1 26 ALA N  1 26 ALA CA 1 26 ALA C    175.00   75.00  -62.96  -60.31  -60.38     .  .  0 "[    .    1    .    2]" 
        91 PSI  1 26 ALA N 1 26 ALA CA 1 26 ALA C  1 27 GLY N    -85.00  105.00  -31.77  -45.29  -20.65     .  .  0 "[    .    1    .    2]" 
        92 PHI  1 26 ALA C 1 27 GLY N  1 27 GLY CA 1 27 GLY C     45.00  -45.00  -79.04  -83.58  -86.08     .  .  0 "[    .    1    .    2]" 
        93 PSI  1 27 GLY N 1 27 GLY CA 1 27 GLY C  1 28 TRP N   -115.00  115.00  -31.00  -20.59  -22.62     .  .  0 "[    .    1    .    2]" 
        94 PHI  1 27 GLY C 1 28 TRP N  1 28 TRP CA 1 28 TRP C     45.00  -45.00  -87.55  -89.28  -91.12     .  .  0 "[    .    1    .    2]" 
        95 PHI  1 27 GLY C 1 28 TRP N  1 28 TRP CA 1 28 TRP C    175.00   75.00  -87.55  -89.28  -91.12     .  .  0 "[    .    1    .    2]" 
        96 CHI1 1 28 TRP N 1 28 TRP CA 1 28 TRP CB 1 28 TRP CG    25.00  -25.00  -60.75  -62.56  -63.25     .  .  0 "[    .    1    .    2]" 
        97 CHI1 1 28 TRP N 1 28 TRP CA 1 28 TRP CB 1 28 TRP CG   155.00   95.00  -60.75  -62.56  -63.25     .  .  0 "[    .    1    .    2]" 
        98 PSI  1 28 TRP N 1 28 TRP CA 1 28 TRP C  1 29 CYS N    -85.00   95.00  -42.95  -69.34  -25.43     .  .  0 "[    .    1    .    2]" 
        99 PHI  1 28 TRP C 1 29 CYS N  1 29 CYS CA 1 29 CYS C     45.00  -45.00  -75.00  -94.14  -64.68     .  .  0 "[    .    1    .    2]" 
       100 PHI  1 28 TRP C 1 29 CYS N  1 29 CYS CA 1 29 CYS C    175.00   75.00  -75.00  -94.14  -64.68     .  .  0 "[    .    1    .    2]" 
       101 CHI1 1 29 CYS N 1 29 CYS CA 1 29 CYS CB 1 29 CYS SG    25.00  -25.00  -74.55  -92.01  -59.30     .  .  0 "[    .    1    .    2]" 
       102 CHI1 1 29 CYS N 1 29 CYS CA 1 29 CYS CB 1 29 CYS SG   155.00   85.00  -74.55  -92.01  -59.30     .  .  0 "[    .    1    .    2]" 
       103 PSI  1 29 CYS N 1 29 CYS CA 1 29 CYS C  1 30 GLY N    -85.00  105.00  -66.12  -63.67  -69.89     .  .  0 "[    .    1    .    2]" 
       104 PHI  1 29 CYS C 1 30 GLY N  1 30 GLY CA 1 30 GLY C     45.00  -45.00 -148.20   86.08  -75.67     .  .  0 "[    .    1    .    2]" 
       105 PHI  1 30 GLY C 1 31 GLY N  1 31 GLY CA 1 31 GLY C     45.00  -45.00 -178.24  140.79  115.68     .  .  0 "[    .    1    .    2]" 
       106 PHI  1 31 GLY C 1 32 SER N  1 32 SER CA 1 32 SER C     45.00  -45.00 -135.36 -171.81   68.57     .  .  0 "[    .    1    .    2]" 
       107 PHI  1 31 GLY C 1 32 SER N  1 32 SER CA 1 32 SER C    175.00   75.00 -135.36 -171.81   68.57     .  .  0 "[    .    1    .    2]" 
    stop_

save_



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