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
626040 5n9v 34106 cing 4-filtered-FRED Wattos check violation dihedral angle


data_5n9v


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              125
    _TA_constraint_stats_list.Viol_count                    179
    _TA_constraint_stats_list.Viol_total                    85777.88
    _TA_constraint_stats_list.Viol_max                      130.88
    _TA_constraint_stats_list.Viol_rms                      11.19
    _TA_constraint_stats_list.Viol_average_all_restraints   1.72
    _TA_constraint_stats_list.Viol_average_violations_only  23.96
    _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 PHI 1  2 HIS C 1  3 MET N  1  3 MET CA 1  3 MET C  178.40  -55.80  -97.75  -84.28  -95.92 103.86  5  1 "[    +    1    .    2]" 
         2 PSI 1  3 MET N 1  3 MET CA 1  3 MET C  1  4 GLN N  108.30  168.20  133.85   65.51  172.08  42.79  5  3 "[    + *  1   -.    2]" 
         3 PHI 1  3 MET C 1  4 GLN N  1  4 GLN CA 1  4 GLN C -148.60  -75.80 -136.31 -151.74 -109.84   3.14 13  0 "[    .    1    .    2]" 
         4 PSI 1  4 GLN N 1  4 GLN CA 1  4 GLN C  1  5 VAL N  117.00  174.40  156.00  131.66  169.40      .  .  0 "[    .    1    .    2]" 
         5 PHI 1  4 GLN C 1  5 VAL N  1  5 VAL CA 1  5 VAL C -163.20 -109.50 -132.58 -144.34  -96.05  13.45 10  1 "[    .    +    .    2]" 
         6 PSI 1  5 VAL N 1  5 VAL CA 1  5 VAL C  1  6 SER N  133.70  174.30  155.97  155.76  151.35      .  .  0 "[    .    1    .    2]" 
         7 PHI 1  5 VAL C 1  6 SER N  1  6 SER CA 1  6 SER C -135.60  -78.10 -118.49 -143.66  -93.14   8.06 19  2 "[    -    1    .   +2]" 
         8 PSI 1  6 SER N 1  6 SER CA 1  6 SER C  1  7 ILE N  109.00  157.00  138.08  116.38  149.23      .  .  0 "[    .    1    .    2]" 
         9 PHI 1  6 SER C 1  7 ILE N  1  7 ILE CA 1  7 ILE C -151.90  -67.80 -112.41 -115.92 -117.04      .  .  0 "[    .    1    .    2]" 
        10 PSI 1  7 ILE N 1  7 ILE CA 1  7 ILE C  1  8 GLU N  103.70  158.30  120.26  125.82  123.51      .  .  0 "[    .    1    .    2]" 
        11 PHI 1  7 ILE C 1  8 GLU N  1  8 GLU CA 1  8 GLU C -127.70  -62.00  -99.36 -112.43  -85.51      .  .  0 "[    .    1    .    2]" 
        12 PSI 1  8 GLU N 1  8 GLU CA 1  8 GLU C  1  9 PHE N  110.70  153.20  123.86  115.33  134.52      .  .  0 "[    .    1    .    2]" 
        13 PHI 1  8 GLU C 1  9 PHE N  1  9 PHE CA 1  9 PHE C -113.60  -58.20  -85.08  -84.54  -86.20      .  .  0 "[    .    1    .    2]" 
        14 PSI 1  9 PHE N 1  9 PHE CA 1  9 PHE C  1 10 GLN N   89.40 -152.30  165.72  167.58  167.10      .  .  0 "[    .    1    .    2]" 
        15 PHI 1  9 PHE C 1 10 GLN N  1 10 GLN CA 1 10 GLN C  -80.80  -40.80  -61.56  -65.89  -67.63      .  .  0 "[    .    1    .    2]" 
        16 PSI 1 10 GLN N 1 10 GLN CA 1 10 GLN C  1 11 ASN N  -48.40   -8.40  -31.48  -41.76  -12.40      .  .  0 "[    .    1    .    2]" 
        17 PHI 1 10 GLN C 1 11 ASN N  1 11 ASN CA 1 11 ASN C -106.90  -66.90  -77.63 -105.84  -68.71      .  .  0 "[    .    1    .    2]" 
        18 PSI 1 11 ASN N 1 11 ASN CA 1 11 ASN C  1 12 GLY N  -16.50   23.50    0.03   -1.05   -2.79      .  .  0 "[    .    1    .    2]" 
        19 PHI 1 11 ASN C 1 12 GLY N  1 12 GLY CA 1 12 GLY C   70.70  110.70   84.29   82.33   78.28      .  .  0 "[    .    1    .    2]" 
        20 PSI 1 12 GLY N 1 12 GLY CA 1 12 GLY C  1 13 GLU N  -26.20   13.80   -2.89  -13.86   18.50   4.70 15  0 "[    .    1    .    2]" 
        21 PHI 1 12 GLY C 1 13 GLU N  1 13 GLU CA 1 13 GLU C  -99.30  -55.80  -75.03  -83.47  -90.87  16.95 15  1 "[    .    1    +    2]" 
        22 PSI 1 13 GLU N 1 13 GLU CA 1 13 GLU C  1 14 LYS N   73.00 -155.10  155.82  139.12  168.21      .  .  0 "[    .    1    .    2]" 
        23 PHI 1 13 GLU C 1 14 LYS N  1 14 LYS CA 1 14 LYS C -173.40  -98.50 -125.75 -137.84 -111.40      .  .  0 "[    .    1    .    2]" 
        24 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C  1 15 LEU N  127.60  176.40  143.31  151.54  149.48  38.93  3  2 "[  + .    1-   .    2]" 
        25 PHI 1 14 LYS C 1 15 LEU N  1 15 LEU CA 1 15 LEU C -156.90 -116.90 -107.99 -135.78  -73.63  43.27 11 11 "[* * - *  1+ *** ***2]" 
        26 PSI 1 15 LEU N 1 15 LEU CA 1 15 LEU C  1 16 LYS N  123.90  169.30  139.19  118.26  163.83   5.64  3  1 "[  + .    1    .    2]" 
        27 PHI 1 15 LEU C 1 16 LYS N  1 16 LYS CA 1 16 LYS C -164.50  -96.80 -104.21 -101.12 -107.39  13.08  8  7 "[  ***- + 1    .   **]" 
        28 PSI 1 16 LYS N 1 16 LYS CA 1 16 LYS C  1 17 PHE N   94.70  174.70  138.41  111.43  149.72      .  .  0 "[    .    1    .    2]" 
        29 PHI 1 16 LYS C 1 17 PHE N  1 17 PHE CA 1 17 PHE C -157.30 -101.70 -132.29  -96.84 -123.58   4.86  2  0 "[    .    1    .    2]" 
        30 PSI 1 17 PHE N 1 17 PHE CA 1 17 PHE C  1 18 ASN N  120.60  177.00  136.38  139.03  138.03      .  .  0 "[    .    1    .    2]" 
        31 PHI 1 17 PHE C 1 18 ASN N  1 18 ASN CA 1 18 ASN C -130.90  -56.00  -82.34 -113.83  -70.40      .  .  0 "[    .    1    .    2]" 
        32 PSI 1 18 ASN N 1 18 ASN CA 1 18 ASN C  1 19 VAL N  103.60  160.50  138.30  122.85  147.07      .  .  0 "[    .    1    .    2]" 
        33 PHI 1 18 ASN C 1 19 VAL N  1 19 VAL CA 1 19 VAL C -156.60 -116.60 -134.27 -132.72 -133.97      .  .  0 "[    .    1    .    2]" 
        34 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C  1 20 GLN N  146.90 -173.10  162.49  145.64  177.17   1.26 17  0 "[    .    1    .    2]" 
        35 PHI 1 19 VAL C 1 20 GLN N  1 20 GLN CA 1 20 GLN C -154.30  -57.40 -127.97 -139.66 -141.78      .  .  0 "[    .    1    .    2]" 
        36 PSI 1 20 GLN N 1 20 GLN CA 1 20 GLN C  1 21 PRO N   92.70 -146.40  151.30  136.24  160.13      .  .  0 "[    .    1    .    2]" 
        37 PSI 1 21 PRO N 1 21 PRO CA 1 21 PRO C  1 22 SER N  -41.60   -1.60  -17.63  -42.48    3.69   5.29 19  1 "[    .    1    .   +2]" 
        38 PHI 1 21 PRO C 1 22 SER N  1 22 SER CA 1 22 SER C -128.40  -55.60  -81.68  -76.38  -79.93      .  .  0 "[    .    1    .    2]" 
        39 PSI 1 22 SER N 1 22 SER CA 1 22 SER C  1 23 HIS N  -54.30   35.20   -8.89  -28.33    9.68      .  .  0 "[    .    1    .    2]" 
        40 PHI 1 22 SER C 1 23 HIS N  1 23 HIS CA 1 23 HIS C -120.30  -24.60  -68.76  -97.60  -50.30      .  .  0 "[    .    1    .    2]" 
        41 PSI 1 23 HIS N 1 23 HIS CA 1 23 HIS C  1 24 LYS N  -76.50   21.60  139.06  118.99  158.78 130.88  3 20  [**+********-********]  
        42 PHI 1 24 LYS C 1 25 ILE N  1 25 ILE CA 1 25 ILE C  -79.00  -39.00  -62.81  -63.62  -63.76      .  .  0 "[    .    1    .    2]" 
        43 PSI 1 25 ILE N 1 25 ILE CA 1 25 ILE C  1 26 LEU N  -60.00  -11.70  -29.82  -37.64  -23.60      .  .  0 "[    .    1    .    2]" 
        44 PHI 1 25 ILE C 1 26 LEU N  1 26 LEU CA 1 26 LEU C  -82.90  -42.90  -60.86  -65.70  -53.59      .  .  0 "[    .    1    .    2]" 
        45 PSI 1 26 LEU N 1 26 LEU CA 1 26 LEU C  1 27 ASP N  -59.90  -19.90  -33.34  -24.52  -25.98      .  .  0 "[    .    1    .    2]" 
        46 PHI 1 26 LEU C 1 27 ASP N  1 27 ASP CA 1 27 ASP C  -82.60  -42.60  -68.88  -75.49  -59.87      .  .  0 "[    .    1    .    2]" 
        47 PSI 1 27 ASP N 1 27 ASP CA 1 27 ASP C  1 28 ILE N  -64.20  -24.20  -29.39  -34.05  -21.89   2.31 14  0 "[    .    1    .    2]" 
        48 PHI 1 27 ASP C 1 28 ILE N  1 28 ILE CA 1 28 ILE C  -85.00  -45.00  -66.62  -62.00  -63.40      .  .  0 "[    .    1    .    2]" 
        49 PSI 1 28 ILE N 1 28 ILE CA 1 28 ILE C  1 29 LYS N  -64.70  -24.70  -44.17  -43.67  -44.76      .  .  0 "[    .    1    .    2]" 
        50 PHI 1 28 ILE C 1 29 LYS N  1 29 LYS CA 1 29 LYS C  -83.50  -43.50  -58.56  -61.11  -55.80      .  .  0 "[    .    1    .    2]" 
        51 PSI 1 29 LYS N 1 29 LYS CA 1 29 LYS C  1 30 GLU N  -58.90  -18.90  -37.08  -39.26  -40.91      .  .  0 "[    .    1    .    2]" 
        52 PHI 1 29 LYS C 1 30 GLU N  1 30 GLU CA 1 30 GLU C  -84.70  -44.70  -65.45  -71.53  -59.71      .  .  0 "[    .    1    .    2]" 
        53 PSI 1 30 GLU N 1 30 GLU CA 1 30 GLU C  1 31 MET N  -62.20  -22.20  -44.01  -44.38  -44.74      .  .  0 "[    .    1    .    2]" 
        54 PHI 1 30 GLU C 1 31 MET N  1 31 MET CA 1 31 MET C  -84.40  -44.40  -63.09  -61.60  -62.68      .  .  0 "[    .    1    .    2]" 
        55 PSI 1 31 MET N 1 31 MET CA 1 31 MET C  1 32 ILE N  -63.50  -23.50  -38.67  -37.48  -39.06      .  .  0 "[    .    1    .    2]" 
        56 PHI 1 31 MET C 1 32 ILE N  1 32 ILE CA 1 32 ILE C  -86.40  -46.40  -63.96  -72.25  -56.75      .  .  0 "[    .    1    .    2]" 
        57 PSI 1 32 ILE N 1 32 ILE CA 1 32 ILE C  1 33 PHE N  -56.30  -15.00  -45.24  -48.34  -49.75      .  .  0 "[    .    1    .    2]" 
        58 PHI 1 32 ILE C 1 33 PHE N  1 33 PHE CA 1 33 PHE C  -88.80  -48.80  -55.40  -59.99  -51.62      .  .  0 "[    .    1    .    2]" 
        59 PSI 1 33 PHE N 1 33 PHE CA 1 33 PHE C  1 34 LYS N  -60.10  -20.10  -37.92  -39.01  -40.81      .  .  0 "[    .    1    .    2]" 
        60 PHI 1 33 PHE C 1 34 LYS N  1 34 LYS CA 1 34 LYS C  -88.20  -48.20  -67.87  -77.97  -59.93      .  .  0 "[    .    1    .    2]" 
        61 PSI 1 34 LYS N 1 34 LYS CA 1 34 LYS C  1 35 LYS N  -63.60   -6.70  -22.77   -6.56  -14.55  27.80  3  3 "[ -+ .*   1    .    2]" 
        62 PHI 1 34 LYS C 1 35 LYS N  1 35 LYS CA 1 35 LYS C -107.20  -67.20  -98.96 -141.64  -78.50  34.44  3  4 "[ *+ .*   1    -    2]" 
        63 PSI 1 35 LYS N 1 35 LYS CA 1 35 LYS C  1 36 THR N  -58.50   -0.70  -28.53  -25.01  -33.21   4.45  1  0 "[    .    1    .    2]" 
        64 PHI 1 37 ASN C 1 38 ILE N  1 38 ILE CA 1 38 ILE C -117.40  -62.70  -77.43  -73.96  -74.73      .  .  0 "[    .    1    .    2]" 
        65 PSI 1 38 ILE N 1 38 ILE CA 1 38 ILE C  1 39 ASN N  104.00  145.40  118.82  117.04  116.04      .  .  0 "[    .    1    .    2]" 
        66 PHI 1 38 ILE C 1 39 ASN N  1 39 ASN CA 1 39 ASN C -132.50  -12.60  -58.97  -63.51  -50.91      .  .  0 "[    .    1    .    2]" 
        67 PSI 1 39 ASN N 1 39 ASN CA 1 39 ASN C  1 40 VAL N  108.30 -172.10  137.90  138.67  137.87      .  .  0 "[    .    1    .    2]" 
        68 PHI 1 39 ASN C 1 40 VAL N  1 40 VAL CA 1 40 VAL C  -79.60  -39.60  -58.76  -57.65  -59.00      .  .  0 "[    .    1    .    2]" 
        69 PSI 1 40 VAL N 1 40 VAL CA 1 40 VAL C  1 41 LYS N  -56.00  -16.00  -28.16  -26.85  -28.29   4.18  3  0 "[    .    1    .    2]" 
        70 PHI 1 40 VAL C 1 41 LYS N  1 41 LYS CA 1 41 LYS C  -92.30  -52.30  -66.90  -85.67  -52.30   0.00 19  0 "[    .    1    .    2]" 
        71 PSI 1 41 LYS N 1 41 LYS CA 1 41 LYS C  1 42 ASP N  -46.20   15.20  -30.06  -43.55  -14.92      .  .  0 "[    .    1    .    2]" 
        72 PHI 1 41 LYS C 1 42 ASP N  1 42 ASP CA 1 42 ASP C -118.00  -78.00  -85.41  -77.82  -81.02   7.46  7  2 "[    . +  1   -.    2]" 
        73 PSI 1 42 ASP N 1 42 ASP CA 1 42 ASP C  1 43 GLN N  -30.20    9.80  -31.50  -46.20   -7.42  16.00  7  9 "[ ** . +* 1* ***  - 2]" 
        74 PHI 1 43 GLN C 1 44 SER N  1 44 SER CA 1 44 SER C -141.20  -66.70 -146.27 -151.36 -151.70  15.45 17 11 "[** **- **1    * +* *]" 
        75 PSI 1 44 SER N 1 44 SER CA 1 44 SER C  1 45 LEU N   68.60  165.40  148.25  133.58  160.53      .  .  0 "[    .    1    .    2]" 
        76 PHI 1 44 SER C 1 45 LEU N  1 45 LEU CA 1 45 LEU C -156.20  -79.50 -124.75 -120.85 -122.35      .  .  0 "[    .    1    .    2]" 
        77 PSI 1 45 LEU N 1 45 LEU CA 1 45 LEU C  1 46 LYS N  107.30  157.80  144.63  147.86  147.48      .  .  0 "[    .    1    .    2]" 
        78 PHI 1 45 LEU C 1 46 LYS N  1 46 LYS CA 1 46 LYS C -170.90  -96.60 -119.40 -132.70  -95.06   1.54  8  0 "[    .    1    .    2]" 
        79 PSI 1 46 LYS N 1 46 LYS CA 1 46 LYS C  1 47 PHE N  110.90  176.40  150.76  140.26  156.11      .  .  0 "[    .    1    .    2]" 
        80 PHI 1 46 LYS C 1 47 PHE N  1 47 PHE CA 1 47 PHE C -173.90  -97.30 -143.03 -153.64 -131.69      .  .  0 "[    .    1    .    2]" 
        81 PSI 1 47 PHE N 1 47 PHE CA 1 47 PHE C  1 48 ALA N  105.00  147.00  136.20  153.03  145.43   6.03  2  1 "[ +  .    1    .    2]" 
        82 PHI 1 48 ALA C 1 49 GLY N  1 49 GLY CA 1 49 GLY C   57.80   97.80   85.37   74.38  101.23   3.43 15  0 "[    .    1    .    2]" 
        83 PSI 1 49 GLY N 1 49 GLY CA 1 49 GLY C  1 50 ASN N  -21.60   30.50   -0.67  -18.13   16.32      .  .  0 "[    .    1    .    2]" 
        84 PHI 1 49 GLY C 1 50 ASN N  1 50 ASN CA 1 50 ASN C -147.00  -64.80 -114.12 -142.75  -75.68      .  .  0 "[    .    1    .    2]" 
        85 PSI 1 50 ASN N 1 50 ASN CA 1 50 ASN C  1 51 GLU N  110.60  166.10  146.37  154.58  151.06      .  .  0 "[    .    1    .    2]" 
        86 PHI 1 50 ASN C 1 51 GLU N  1 51 GLU CA 1 51 GLU C -106.40  -56.20  -72.04  -82.28  -93.80      .  .  0 "[    .    1    .    2]" 
        87 PSI 1 51 GLU N 1 51 GLU CA 1 51 GLU C  1 52 MET N  100.30  166.80  135.20  133.69  130.84      .  .  0 "[    .    1    .    2]" 
        88 PHI 1 51 GLU C 1 52 MET N  1 52 MET CA 1 52 MET C -151.90  -67.70  -81.28  -77.22  -79.93      .  .  0 "[    .    1    .    2]" 
        89 PSI 1 52 MET N 1 52 MET CA 1 52 MET C  1 53 ILE N  120.90  160.90  139.18  117.58  155.32   3.32 12  0 "[    .    1    .    2]" 
        90 PHI 1 52 MET C 1 53 ILE N  1 53 ILE CA 1 53 ILE C -136.30  -48.00  -85.04  -84.33  -88.02      .  .  0 "[    .    1    .    2]" 
        91 PSI 1 53 ILE N 1 53 ILE CA 1 53 ILE C  1 54 ASN N  110.90 -173.40  127.49  119.36  133.16      .  .  0 "[    .    1    .    2]" 
        92 PHI 1 53 ILE C 1 54 ASN N  1 54 ASN CA 1 54 ASN C  -78.80  -38.80  -55.08  -50.67  -52.01      .  .  0 "[    .    1    .    2]" 
        93 PSI 1 54 ASN N 1 54 ASN CA 1 54 ASN C  1 55 GLN N  -51.70  -11.70  -38.26  -50.69  -27.64      .  .  0 "[    .    1    .    2]" 
        94 PHI 1 54 ASN C 1 55 GLN N  1 55 GLN CA 1 55 GLN C -113.60  -65.50  -75.20  -86.25  -62.87   2.63 16  0 "[    .    1    .    2]" 
        95 PSI 1 55 GLN N 1 55 GLN CA 1 55 GLN C  1 56 LYS N  -27.10   12.90  -12.29  -18.72  -23.22      .  .  0 "[    .    1    .    2]" 
        96 PHI 1 55 GLN C 1 56 LYS N  1 56 LYS CA 1 56 LYS C -144.50  -30.50  -82.94 -116.45  -68.66      .  .  0 "[    .    1    .    2]" 
        97 PSI 1 56 LYS N 1 56 LYS CA 1 56 LYS C  1 57 THR N  135.00  175.00  161.16  158.86  158.54   2.01 10  0 "[    .    1    .    2]" 
        98 PHI 1 56 LYS C 1 57 THR N  1 57 THR CA 1 57 THR C -130.40  -58.80  -95.59 -122.81  -83.56      .  .  0 "[    .    1    .    2]" 
        99 PSI 1 57 THR N 1 57 THR CA 1 57 THR C  1 58 LEU N  146.50 -173.50  157.67  158.53  157.42      .  .  0 "[    .    1    .    2]" 
       100 PHI 1 57 THR C 1 58 LEU N  1 58 LEU CA 1 58 LEU C  -83.80  -43.80  -53.74  -58.75  -47.15      .  .  0 "[    .    1    .    2]" 
       101 PSI 1 58 LEU N 1 58 LEU CA 1 58 LEU C  1 59 SER N  -56.60  -16.60  -41.05  -50.66  -29.39      .  .  0 "[    .    1    .    2]" 
       102 PHI 1 58 LEU C 1 59 SER N  1 59 SER CA 1 59 SER C  -83.50  -43.50  -70.48  -78.02  -60.11      .  .  0 "[    .    1    .    2]" 
       103 PSI 1 59 SER N 1 59 SER CA 1 59 SER C  1 60 ASP N  -55.40  -15.40  -24.85  -29.39  -33.77  10.87 20  1 "[    .    1    .    +]" 
       104 PHI 1 59 SER C 1 60 ASP N  1 60 ASP CA 1 60 ASP C  -82.10  -42.10  -69.94  -83.47  -58.40   1.37  3  0 "[    .    1    .    2]" 
       105 PSI 1 60 ASP N 1 60 ASP CA 1 60 ASP C  1 61 TYR N  -48.70   -8.70  -28.00  -33.27  -35.08  11.06  3  1 "[  + .    1    .    2]" 
       106 PHI 1 60 ASP C 1 61 TYR N  1 61 TYR CA 1 61 TYR C -113.00  -73.00  -90.40 -124.36  -74.72  11.36  3  1 "[  + .    1    .    2]" 
       107 PSI 1 61 TYR N 1 61 TYR CA 1 61 TYR C  1 62 SER N  -12.60   27.40    0.91   -4.61   -7.92      .  .  0 "[    .    1    .    2]" 
       108 PHI 1 61 TYR C 1 62 SER N  1 62 SER CA 1 62 SER C   38.50   78.50   59.32   51.41   68.85      .  .  0 "[    .    1    .    2]" 
       109 PSI 1 62 SER N 1 62 SER CA 1 62 SER C  1 63 ILE N   16.20   56.20   30.61   31.53   28.78   0.42  6  0 "[    .    1    .    2]" 
       110 PHI 1 68 GLU C 1 69 GLU N  1 69 GLU CA 1 69 GLU C -161.40  -51.20  -65.12  -71.19  -74.12   2.30 19  0 "[    .    1    .    2]" 
       111 PSI 1 69 GLU N 1 69 GLU CA 1 69 GLU C  1 70 PHE N   89.00 -176.00  136.78   95.03  167.30      .  .  0 "[    .    1    .    2]" 
       112 PHI 1 69 GLU C 1 70 PHE N  1 70 PHE CA 1 70 PHE C -147.30  -54.70  -77.25  -86.42 -101.22   2.22  4  0 "[    .    1    .    2]" 
       113 PSI 1 70 PHE N 1 70 PHE CA 1 70 PHE C  1 71 THR N  110.20  150.20  135.63  144.96  140.82   8.54 20  1 "[    .    1    .    +]" 
       114 PHI 1 70 PHE C 1 71 THR N  1 71 THR CA 1 71 THR C -151.90  -80.60 -113.57 -109.66 -116.27      .  .  0 "[    .    1    .    2]" 
       115 PSI 1 71 THR N 1 71 THR CA 1 71 THR C  1 72 LEU N  110.50  150.50  127.75  126.13  125.12      .  .  0 "[    .    1    .    2]" 
       116 PHI 1 71 THR C 1 72 LEU N  1 72 LEU CA 1 72 LEU C -163.40  -58.40 -107.83 -121.39  -90.48      .  .  0 "[    .    1    .    2]" 
       117 PSI 1 72 LEU N 1 72 LEU CA 1 72 LEU C  1 73 HIS N  106.40  174.30  148.88  137.88  166.35      .  .  0 "[    .    1    .    2]" 
       118 PHI 1 72 LEU C 1 73 HIS N  1 73 HIS CA 1 73 HIS C -156.00  -57.50 -104.87 -127.88  -90.50      .  .  0 "[    .    1    .    2]" 
       119 PSI 1 73 HIS N 1 73 HIS CA 1 73 HIS C  1 74 LEU N   95.80  165.90  128.19  120.52  139.84      .  .  0 "[    .    1    .    2]" 
       120 PHI 1 73 HIS C 1 74 LEU N  1 74 LEU CA 1 74 LEU C -137.20  -68.50  -72.75  -70.52  -72.42   8.85  8  1 "[    .  + 1    .    2]" 
       121 PSI 1 74 LEU N 1 74 LEU CA 1 74 LEU C  1 75 GLU N  100.30  150.50  139.33  142.27  139.53   2.83 10  0 "[    .    1    .    2]" 
       122 PHI 1 74 LEU C 1 75 GLU N  1 75 GLU CA 1 75 GLU C -143.60  -92.60  -66.74  -65.76  -66.17  38.24  3 20  [**+********-********]  
       123 PSI 1 75 GLU N 1 75 GLU CA 1 75 GLU C  1 76 THR N  124.10  164.10  158.11  162.92  157.86  17.95  5  3 "[    + -  1 *  .    2]" 
       124 PHI 1 75 GLU C 1 76 THR N  1 76 THR CA 1 76 THR C -141.90  -79.80  -67.13 -107.36  -46.53  33.27 18 15 "[****.*  *1 ***-**+**]" 
       125 PSI 1 76 THR N 1 76 THR CA 1 76 THR C  1 77 LYS N  116.70  156.70  137.18  121.06  150.23      .  .  0 "[    .    1    .    2]" 
    stop_

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