BMRB

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
575108 2m6u RC 19155 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2m6u


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              150
    _TA_constraint_stats_list.Viol_count                    398
    _TA_constraint_stats_list.Viol_total                    51115.79
    _TA_constraint_stats_list.Viol_max                      51.22
    _TA_constraint_stats_list.Viol_rms                      3.41
    _TA_constraint_stats_list.Viol_average_all_restraints   0.85
    _TA_constraint_stats_list.Viol_average_violations_only  6.42
    _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  4 LEU C 1  5 ASP N  1  5 ASP CA 1  5 ASP C  -73.10 -53.10  -63.93  -98.35  -19.82 33.28 18  7 "[   *.*   1  -*** + 2]" 
         2 PSI 1  5 ASP N 1  5 ASP CA 1  5 ASP C  1  6 SER N  -51.80 -30.80  -44.73  -44.13  -47.12 10.72 14  4 "[    .    1*  +.- * 2]" 
         3 PHI 1  5 ASP C 1  6 SER N  1  6 SER CA 1  6 SER C  -78.20 -49.70  -66.08  -67.02  -67.88  7.89 16  1 "[    .    1    .+   2]" 
         4 PSI 1  6 SER N 1  6 SER CA 1  6 SER C  1  7 GLU N  -56.80 -26.30  -29.02  -20.25  -22.17 10.48 15  5 "[ *  .*   * -  +    2]" 
         5 PHI 1  6 SER C 1  7 GLU N  1  7 GLU CA 1  7 GLU C  -79.30 -49.00  -73.06  -98.16  -57.56 18.86  2  3 "[ +  .    * -  .    2]" 
         6 PSI 1  7 GLU N 1  7 GLU CA 1  7 GLU C  1  8 ARG N  -50.20 -30.20  -44.32  -49.66  -53.35  8.28  6  1 "[    .+   1    .    2]" 
         7 PHI 1  7 GLU C 1  8 ARG N  1  8 ARG CA 1  8 ARG C  -74.20 -52.20  -69.34  -87.45  -61.05 13.25 14  1 "[    .    1   +.    2]" 
         8 PSI 1  8 ARG N 1  8 ARG CA 1  8 ARG C  1  9 ASP N  -49.80 -29.40  -25.66  -32.20   -2.84 26.56  8  4 "[   *.  + 1-   .  * 2]" 
         9 PHI 1  8 ARG C 1  9 ASP N  1  9 ASP CA 1  9 ASP C  -81.20 -52.50  -70.30  -65.59  -66.61 10.63  8  1 "[    .  + 1    .    2]" 
        10 PSI 1  9 ASP N 1  9 ASP CA 1  9 ASP C  1 10 LYS N  -53.00 -28.70  -42.96  -39.71  -41.16  0.64  6  0 "[    .    1    .    2]" 
        11 PHI 1  9 ASP C 1 10 LYS N  1 10 LYS CA 1 10 LYS C  -78.00 -52.40  -65.74  -78.36  -51.89  0.51 16  0 "[    .    1    .    2]" 
        12 PSI 1 10 LYS N 1 10 LYS CA 1 10 LYS C  1 11 ALA N  -61.90 -27.00  -41.53  -47.40  -36.29     .  .  0 "[    .    1    .    2]" 
        13 PHI 1 10 LYS C 1 11 ALA N  1 11 ALA CA 1 11 ALA C  -76.70 -52.90  -62.68  -65.61  -56.42     .  .  0 "[    .    1    .    2]" 
        14 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C  1 12 ARG N  -61.00 -27.80  -43.89  -40.95  -41.75     .  .  0 "[    .    1    .    2]" 
        15 PHI 1 11 ALA C 1 12 ARG N  1 12 ARG CA 1 12 ARG C  -75.70 -51.70  -66.52  -67.21  -68.52     .  .  0 "[    .    1    .    2]" 
        16 PSI 1 12 ARG N 1 12 ARG CA 1 12 ARG C  1 13 LYS N  -55.00 -27.90  -38.14  -44.20  -31.20     .  .  0 "[    .    1    .    2]" 
        17 PHI 1 12 ARG C 1 13 LYS N  1 13 LYS CA 1 13 LYS C  -80.00 -51.20  -66.42  -63.62  -65.28  1.64  6  0 "[    .    1    .    2]" 
        18 PSI 1 13 LYS N 1 13 LYS CA 1 13 LYS C  1 14 GLU N  -51.20 -27.80  -39.56  -50.15  -25.94  1.86  9  0 "[    .    1    .    2]" 
        19 PHI 1 13 LYS C 1 14 GLU N  1 14 GLU CA 1 14 GLU C  -74.20 -54.20  -58.85  -57.51  -57.78  1.62 16  0 "[    .    1    .    2]" 
        20 PSI 1 14 GLU N 1 14 GLU CA 1 14 GLU C  1 15 VAL N  -49.20 -29.20  -46.23  -64.62  -38.76 15.42  9  1 "[    .   +1    .    2]" 
        21 PHI 1 14 GLU C 1 15 VAL N  1 15 VAL CA 1 15 VAL C  -74.00 -54.00  -76.39  -75.84  -77.64 10.76 17  6 "[*   .    1 * **-+  2]" 
        22 PSI 1 15 VAL N 1 15 VAL CA 1 15 VAL C  1 16 GLU N  -55.30 -32.60  -29.48  -30.06  -30.59 10.39 16  6 "[    .* **1*   .+ - 2]" 
        23 PHI 1 15 VAL C 1 16 GLU N  1 16 GLU CA 1 16 GLU C  -71.20 -51.20  -61.46  -69.02  -55.16     .  .  0 "[    .    1    .    2]" 
        24 PSI 1 16 GLU N 1 16 GLU CA 1 16 GLU C  1 17 GLU N  -52.80 -29.90  -46.80  -40.80  -43.39  2.91 18  0 "[    .    1    .    2]" 
        25 PHI 1 16 GLU C 1 17 GLU N  1 17 GLU CA 1 17 GLU C  -75.70 -55.70  -66.15  -74.12  -56.87     .  .  0 "[    .    1    .    2]" 
        26 PSI 1 17 GLU N 1 17 GLU CA 1 17 GLU C  1 18 TYR N  -52.50 -32.50  -36.31  -48.07  -14.25 18.25  6  3 "[    .+ - 1   *.    2]" 
        27 PHI 1 17 GLU C 1 18 TYR N  1 18 TYR CA 1 18 TYR C  -75.00 -50.10  -67.88  -80.82  -60.74  5.82  6  1 "[    .+   1    .    2]" 
        28 PSI 1 18 TYR N 1 18 TYR CA 1 18 TYR C  1 19 VAL N  -60.20 -36.70  -46.11  -44.65  -45.38     .  .  0 "[    .    1    .    2]" 
        29 PHI 1 18 TYR C 1 19 VAL N  1 19 VAL CA 1 19 VAL C  -73.70 -53.70  -60.61  -68.64  -54.16     .  .  0 "[    .    1    .    2]" 
        30 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C  1 20 LYS N  -61.20 -31.40  -48.98  -52.15  -53.05     .  .  0 "[    .    1    .    2]" 
        31 PHI 1 19 VAL C 1 20 LYS N  1 20 LYS CA 1 20 LYS C  -70.80 -50.10  -64.87  -66.10  -66.59  2.00 10  0 "[    .    1    .    2]" 
        32 PSI 1 20 LYS N 1 20 LYS CA 1 20 LYS C  1 21 LYS N  -59.10 -21.20  -33.96  -48.12  -25.61     .  .  0 "[    .    1    .    2]" 
        33 PHI 1 20 LYS C 1 21 LYS N  1 21 LYS CA 1 21 LYS C  -88.50 -43.10  -66.00  -61.77  -62.51     .  .  0 "[    .    1    .    2]" 
        34 PSI 1 21 LYS N 1 21 LYS CA 1 21 LYS C  1 22 ILE N  -56.70 -12.90  -48.58  -60.05  -41.61  3.35 19  0 "[    .    1    .    2]" 
        35 PHI 1 21 LYS C 1 22 ILE N  1 22 ILE CA 1 22 ILE C  -82.80 -46.70  -71.14  -80.49  -61.11     .  .  0 "[    .    1    .    2]" 
        36 PSI 1 22 ILE N 1 22 ILE CA 1 22 ILE C  1 23 VAL N  -76.20  13.60  -31.93  -47.75  -24.01     .  .  0 "[    .    1    .    2]" 
        37 PHI 1 22 ILE C 1 23 VAL N  1 23 VAL CA 1 23 VAL C  -78.70 -47.40  -60.11  -63.33  -56.21     .  .  0 "[    .    1    .    2]" 
        38 PSI 1 23 VAL N 1 23 VAL CA 1 23 VAL C  1 24 GLY N  -53.20 -33.20  -46.85  -52.69  -38.79     .  .  0 "[    .    1    .    2]" 
        39 PHI 1 23 VAL C 1 24 GLY N  1 24 GLY CA 1 24 GLY C  -77.30 -57.30  -62.41  -60.31  -61.88  0.67 18  0 "[    .    1    .    2]" 
        40 PSI 1 24 GLY N 1 24 GLY CA 1 24 GLY C  1 25 GLU N  -49.50 -26.80  -42.38  -54.71  -33.97  5.21 16  1 "[    .    1    .+   2]" 
        41 PHI 1 24 GLY C 1 25 GLU N  1 25 GLU CA 1 25 GLU C  -84.50 -47.10  -66.43  -63.46  -67.51     .  .  0 "[    .    1    .    2]" 
        42 PSI 1 25 GLU N 1 25 GLU CA 1 25 GLU C  1 26 SER N  -62.90 -20.00  -33.24  -48.08  -19.35  0.65 10  0 "[    .    1    .    2]" 
        43 PHI 1 25 GLU C 1 26 SER N  1 26 SER CA 1 26 SER C  -83.40 -49.10  -64.41  -57.71  -59.96     .  .  0 "[    .    1    .    2]" 
        44 PSI 1 26 SER N 1 26 SER CA 1 26 SER C  1 27 TYR N  -53.70 -33.70  -39.56  -44.12  -46.91 27.20  6  1 "[    .+   1    .    2]" 
        45 PHI 1 26 SER C 1 27 TYR N  1 27 TYR CA 1 27 TYR C  -78.70 -51.10  -69.99  -85.16  -59.71  6.46  6  1 "[    .+   1    .    2]" 
        46 PSI 1 27 TYR N 1 27 TYR CA 1 27 TYR C  1 28 ALA N  -61.50 -17.60  -31.55  -47.84    1.14 18.74  7  1 "[    . +  1    .    2]" 
        47 PHI 1 27 TYR C 1 28 ALA N  1 28 ALA CA 1 28 ALA C  -76.10 -55.50  -70.14  -65.14  -65.71 17.30  7  2 "[   -. +  1    .    2]" 
        48 PSI 1 28 ALA N 1 28 ALA CA 1 28 ALA C  1 29 LYS N  -51.80  -4.70  -29.44  -29.01  -29.56  3.46 20  0 "[    .    1    .    2]" 
        49 PHI 1 28 ALA C 1 29 LYS N  1 29 LYS CA 1 29 LYS C -126.80 -72.10  -97.31  -87.44  -95.44  4.30 20  0 "[    .    1    .    2]" 
        50 PSI 1 29 LYS N 1 29 LYS CA 1 29 LYS C  1 30 SER N  -21.70  12.10   -2.61   -8.93  -14.33 15.80 19  5 "[    .*   *    -  *+2]" 
        51 PHI 1 30 SER C 1 31 THR N  1 31 THR CA 1 31 THR C -159.00 -70.60 -134.18 -133.21 -133.26     .  .  0 "[    .    1    .    2]" 
        52 PSI 1 31 THR N 1 31 THR CA 1 31 THR C  1 32 LYS N  138.40 179.20  157.41  172.64  169.93  2.84 20  0 "[    .    1    .    2]" 
        53 PHI 1 32 LYS C 1 33 LYS N  1 33 LYS CA 1 33 LYS C  -80.80 -50.80  -64.26  -74.13  -54.40     .  .  0 "[    .    1    .    2]" 
        54 PSI 1 33 LYS N 1 33 LYS CA 1 33 LYS C  1 34 ARG N  -58.00 -12.00  -23.47  -22.73  -29.33 27.38 20  3 "[    .    1   *.   -+]" 
        55 PHI 1 33 LYS C 1 34 ARG N  1 34 ARG CA 1 34 ARG C -138.20 -54.90 -108.26 -135.37  -74.97     .  .  0 "[    .    1    .    2]" 
        56 PSI 1 34 ARG N 1 34 ARG CA 1 34 ARG C  1 35 HIS N  -63.60  44.40   16.04  -11.01   36.73     .  .  0 "[    .    1    .    2]" 
        57 PHI 1 34 ARG C 1 35 HIS N  1 35 HIS CA 1 35 HIS C  -71.40 -51.00  -53.09  -52.91  -56.60  5.25 19  1 "[    .    1    .   +2]" 
        58 PSI 1 35 HIS N 1 35 HIS CA 1 35 HIS C  1 36 THR N  -51.20 -19.00  -34.43  -44.74  -15.95  3.05 14  0 "[    .    1    .    2]" 
        59 PHI 1 35 HIS C 1 36 THR N  1 36 THR CA 1 36 THR C  -73.50 -53.50  -56.63  -74.97  -39.71 13.79 10  4 "[    .**  + -  .    2]" 
        60 PSI 1 36 THR N 1 36 THR CA 1 36 THR C  1 37 ILE N  -52.40 -26.70  -36.56  -31.58  -34.43 11.99 18  1 "[    .    1    .  + 2]" 
        61 PHI 1 36 THR C 1 37 ILE N  1 37 ILE CA 1 37 ILE C  -75.10 -55.10  -73.23  -70.34  -72.08 27.34 18  2 "[    .    1    .  + -]" 
        62 PSI 1 37 ILE N 1 37 ILE CA 1 37 ILE C  1 38 THR N  -58.90 -26.10  -42.78  -52.30  -34.58     .  .  0 "[    .    1    .    2]" 
        63 PHI 1 37 ILE C 1 38 THR N  1 38 THR CA 1 38 THR C -107.50 -29.10  -62.70  -68.73  -55.92     .  .  0 "[    .    1    .    2]" 
        64 PSI 1 38 THR N 1 38 THR CA 1 38 THR C  1 39 VAL N  -61.40 -16.30  -45.09  -45.46  -46.16     .  .  0 "[    .    1    .    2]" 
        65 PHI 1 38 THR C 1 39 VAL N  1 39 VAL CA 1 39 VAL C  -72.80 -52.80  -63.13  -65.58  -69.00     .  .  0 "[    .    1    .    2]" 
        66 PSI 1 39 VAL N 1 39 VAL CA 1 39 VAL C  1 40 ALA N  -53.10 -32.20  -39.44  -36.03  -38.64  1.52  2  0 "[    .    1    .    2]" 
        67 PHI 1 39 VAL C 1 40 ALA N  1 40 ALA CA 1 40 ALA C  -72.30 -52.30  -64.73  -73.30  -59.46  1.00 18  0 "[    .    1    .    2]" 
        68 PSI 1 40 ALA N 1 40 ALA CA 1 40 ALA C  1 41 LEU N  -58.30 -18.70  -44.80  -42.76  -44.06     .  .  0 "[    .    1    .    2]" 
        69 PHI 1 40 ALA C 1 41 LEU N  1 41 LEU CA 1 41 LEU C  -81.40 -55.20  -65.42  -66.52  -68.28     .  .  0 "[    .    1    .    2]" 
        70 PSI 1 41 LEU N 1 41 LEU CA 1 41 LEU C  1 42 VAL N  -51.60 -28.50  -38.95  -37.50  -38.68     .  .  0 "[    .    1    .    2]" 
        71 PHI 1 41 LEU C 1 42 VAL N  1 42 VAL CA 1 42 VAL C  -70.90 -50.90  -63.76  -73.84  -54.49  2.94  5  0 "[    .    1    .    2]" 
        72 PSI 1 42 VAL N 1 42 VAL CA 1 42 VAL C  1 43 ASN N  -52.60 -32.60  -40.75  -41.49  -42.85     .  .  0 "[    .    1    .    2]" 
        73 PHI 1 42 VAL C 1 43 ASN N  1 43 ASN CA 1 43 ASN C  -75.10 -52.30  -63.17  -57.88  -59.08     .  .  0 "[    .    1    .    2]" 
        74 PSI 1 43 ASN N 1 43 ASN CA 1 43 ASN C  1 44 GLU N  -57.30 -22.30  -36.53  -42.67  -26.00     .  .  0 "[    .    1    .    2]" 
        75 PHI 1 43 ASN C 1 44 GLU N  1 44 GLU CA 1 44 GLU C  -77.60 -52.30  -72.78  -85.84  -63.23  8.24 10  2 "[    .   -+    .    2]" 
        76 PSI 1 44 GLU N 1 44 GLU CA 1 44 GLU C  1 45 LEU N  -55.20 -29.40  -45.87  -46.47  -47.30     .  .  0 "[    .    1    .    2]" 
        77 PHI 1 44 GLU C 1 45 LEU N  1 45 LEU CA 1 45 LEU C  -81.10 -49.50  -56.49  -63.14  -50.21     .  .  0 "[    .    1    .    2]" 
        78 PSI 1 45 LEU N 1 45 LEU CA 1 45 LEU C  1 46 ASN N  -50.30 -30.30  -40.18  -50.07  -33.13     .  .  0 "[    .    1    .    2]" 
        79 PHI 1 45 LEU C 1 46 ASN N  1 46 ASN CA 1 46 ASN C  -78.90 -51.80  -70.55  -64.26  -65.19  2.27 13  0 "[    .    1    .    2]" 
        80 PSI 1 46 ASN N 1 46 ASN CA 1 46 ASN C  1 47 ASN N  -51.40 -29.70  -29.89  -39.51  -22.34  7.36 13  4 "[  * .   -*  + .    2]" 
        81 PHI 1 46 ASN C 1 47 ASN N  1 47 ASN CA 1 47 ASN C  -76.30 -55.80  -68.65  -81.51  -61.33  5.21 11  1 "[    .    1+   .    2]" 
        82 PSI 1 47 ASN N 1 47 ASN CA 1 47 ASN C  1 48 ILE N  -58.10 -25.90  -44.64  -50.50  -36.67     .  .  0 "[    .    1    .    2]" 
        83 PHI 1 47 ASN C 1 48 ILE N  1 48 ILE CA 1 48 ILE C  -71.10 -51.10  -60.72  -61.05  -61.59     .  .  0 "[    .    1    .    2]" 
        84 PSI 1 48 ILE N 1 48 ILE CA 1 48 ILE C  1 49 LYS N  -56.10 -29.90  -44.77  -47.45  -49.78     .  .  0 "[    .    1    .    2]" 
        85 PHI 1 48 ILE C 1 49 LYS N  1 49 LYS CA 1 49 LYS C  -73.40 -52.40  -57.66  -53.22  -53.97  0.26 11  0 "[    .    1    .    2]" 
        86 PSI 1 49 LYS N 1 49 LYS CA 1 49 LYS C  1 50 ASN N  -53.20 -33.20  -48.41  -55.91  -41.87  2.71 18  0 "[    .    1    .    2]" 
        87 PHI 1 49 LYS C 1 50 ASN N  1 50 ASN CA 1 50 ASN C  -72.90 -52.90  -63.36  -85.35  -51.74 12.45  5  1 "[    +    1    .    2]" 
        88 PSI 1 50 ASN N 1 50 ASN CA 1 50 ASN C  1 51 GLU N  -53.90 -29.30  -46.36  -46.35  -47.19  9.82  5  1 "[    +    1    .    2]" 
        89 PHI 1 50 ASN C 1 51 GLU N  1 51 GLU CA 1 51 GLU C  -75.90 -55.00  -60.55  -55.84  -58.40  3.22  2  0 "[    .    1    .    2]" 
        90 PSI 1 51 GLU N 1 51 GLU CA 1 51 GLU C  1 52 TYR N  -61.00 -31.80  -46.83  -45.06  -47.16     .  .  0 "[    .    1    .    2]" 
        91 PHI 1 51 GLU C 1 52 TYR N  1 52 TYR CA 1 52 TYR C  -75.90 -43.00  -77.42  -87.19  -68.38 11.29  9  6 "[ ** .   +1    *  * -]" 
        92 PSI 1 52 TYR N 1 52 TYR CA 1 52 TYR C  1 53 LEU N  -55.20 -25.10  -30.73  -31.04  -31.27  0.76  8  0 "[    .    1    .    2]" 
        93 PHI 1 52 TYR C 1 53 LEU N  1 53 LEU CA 1 53 LEU C  -75.50 -50.60  -55.91  -52.87  -53.82     .  .  0 "[    .    1    .    2]" 
        94 PSI 1 53 LEU N 1 53 LEU CA 1 53 LEU C  1 54 ASN N  -56.10 -35.40  -43.75  -47.61  -36.32     .  .  0 "[    .    1    .    2]" 
        95 PHI 1 53 LEU C 1 54 ASN N  1 54 ASN CA 1 54 ASN C  -77.20 -53.90  -64.96  -64.75  -66.01     .  .  0 "[    .    1    .    2]" 
        96 PSI 1 54 ASN N 1 54 ASN CA 1 54 ASN C  1 55 LYS N  -52.40 -32.40  -39.79  -41.92  -42.26 11.09  8  1 "[    .  + 1    .    2]" 
        97 PHI 1 54 ASN C 1 55 LYS N  1 55 LYS CA 1 55 LYS C  -73.20 -51.90  -68.77  -80.23  -60.57  7.03 19  2 "[    .  - 1    .   +2]" 
        98 PSI 1 55 LYS N 1 55 LYS CA 1 55 LYS C  1 56 ILE N  -52.00 -29.40  -31.05  -21.21  -25.99 17.65 12  4 "[ -  .    * + *.    2]" 
        99 PHI 1 55 LYS C 1 56 ILE N  1 56 ILE CA 1 56 ILE C  -75.50 -49.90  -77.83  -93.81  -60.30 18.31 12  8 "[ ** *-   1*+ **    2]" 
       100 PSI 1 56 ILE N 1 56 ILE CA 1 56 ILE C  1 57 VAL N  -53.90 -33.90  -41.78  -54.56  -27.85  6.05  6  1 "[    .+   1    .    2]" 
       101 PHI 1 56 ILE C 1 57 VAL N  1 57 VAL CA 1 57 VAL C  -85.30 -42.90  -70.81  -70.40  -73.26     .  .  0 "[    .    1    .    2]" 
       102 PSI 1 57 VAL N 1 57 VAL CA 1 57 VAL C  1 58 GLU N  -58.00 -15.70  -30.56  -41.14   -6.56  9.14  1  1 "[+   .    1    .    2]" 
       103 PHI 1 57 VAL C 1 58 GLU N  1 58 GLU CA 1 58 GLU C -124.20 -60.40  -92.89 -111.92 -118.14     .  .  0 "[    .    1    .    2]" 
       104 PSI 1 58 GLU N 1 58 GLU CA 1 58 GLU C  1 59 SER N  -47.90   7.70    2.18   25.12   14.48 19.35  2  4 "[ +* .    * -  .    2]" 
       105 PHI 1 60 THR C 1 61 SER N  1 61 SER CA 1 61 SER C -170.90 -41.30 -126.77 -162.10  -76.95     .  .  0 "[    .    1    .    2]" 
       106 PSI 1 61 SER N 1 61 SER CA 1 61 SER C  1 62 GLU N  133.60 179.80  125.36  126.58  123.07 27.93 13 13 "[**  ***  1**+**-* *2]" 
       107 PHI 1 61 SER C 1 62 GLU N  1 62 GLU CA 1 62 GLU C  -81.30 -42.10  -66.47  -70.57  -71.06     .  .  0 "[    .    1    .    2]" 
       108 PSI 1 62 GLU N 1 62 GLU CA 1 62 GLU C  1 63 SER N  -55.60 -17.00  -31.58  -22.08  -26.64 48.73 11  2 "[    .  - 1+   .    2]" 
       109 PHI 1 62 GLU C 1 63 SER N  1 63 SER CA 1 63 SER C  -76.10 -56.10  -70.25  -61.35  -64.01 51.22 11  2 "[    .  - 1+   .    2]" 
       110 PSI 1 63 SER N 1 63 SER CA 1 63 SER C  1 64 GLN N  -51.00 -31.00  -33.27  -59.92    0.86 31.86 15 13 "[*-* * * *1**  +*** *]" 
       111 PHI 1 63 SER C 1 64 GLN N  1 64 GLN CA 1 64 GLN C  -74.60 -53.60  -75.43  -68.82  -86.28 30.01 15  8 "[*   *    1 *  +*-* *]" 
       112 PSI 1 64 GLN N 1 64 GLN CA 1 64 GLN C  1 65 LEU N  -53.20 -32.50  -35.50  -44.34  -23.79  8.71 16  2 "[-   .    1    .+   2]" 
       113 PHI 1 64 GLN C 1 65 LEU N  1 65 LEU CA 1 65 LEU C  -73.50 -53.50  -54.55  -54.50  -56.15  5.26  8  1 "[    .  + 1    .    2]" 
       114 PSI 1 65 LEU N 1 65 LEU CA 1 65 LEU C  1 66 GLN N  -52.30 -29.90  -40.74  -43.39  -45.09     .  .  0 "[    .    1    .    2]" 
       115 PHI 1 65 LEU C 1 66 GLN N  1 66 GLN CA 1 66 GLN C  -76.20 -55.40  -67.97  -78.26  -60.63  2.06 11  0 "[    .    1    .    2]" 
       116 PSI 1 66 GLN N 1 66 GLN CA 1 66 GLN C  1 67 ILE N  -56.20 -29.10  -34.20  -47.64  -21.66  7.44  8  4 "[-   *  + 1 *  .    2]" 
       117 PHI 1 66 GLN C 1 67 ILE N  1 67 ILE CA 1 67 ILE C  -76.40 -56.40  -75.97  -77.80  -80.54 18.60 12  6 "[*   *    1 +  -  * *]" 
       118 PSI 1 67 ILE N 1 67 ILE CA 1 67 ILE C  1 68 LEU N  -53.20 -33.20  -33.62  -34.75  -35.75  2.16 11  0 "[    .    1    .    2]" 
       119 PHI 1 67 ILE C 1 68 LEU N  1 68 LEU CA 1 68 LEU C  -78.30 -53.20  -55.37  -57.00  -58.10  4.86 10  0 "[    .    1    .    2]" 
       120 PSI 1 68 LEU N 1 68 LEU CA 1 68 LEU C  1 69 MET N  -50.80 -30.80  -28.55  -34.86  -24.90  5.90 16  1 "[    .    1    .+   2]" 
       121 PHI 1 68 LEU C 1 69 MET N  1 69 MET CA 1 69 MET C  -72.80 -49.90  -62.57  -68.69  -57.61     .  .  0 "[    .    1    .    2]" 
       122 PSI 1 69 MET N 1 69 MET CA 1 69 MET C  1 70 MET N  -54.90 -26.60  -48.73  -21.66  -43.40  4.94  2  0 "[    .    1    .    2]" 
       123 PHI 1 69 MET C 1 70 MET N  1 70 MET CA 1 70 MET C  -77.40 -52.50  -72.60  -98.68  -66.11 21.28  2  1 "[ +  .    1    .    2]" 
       124 PSI 1 70 MET N 1 70 MET CA 1 70 MET C  1 71 GLU N  -52.60 -31.30  -36.90  -38.87  -40.76  1.07 16  0 "[    .    1    .    2]" 
       125 PHI 1 70 MET C 1 71 GLU N  1 71 GLU CA 1 71 GLU C  -79.60 -51.90  -63.89  -77.32  -56.74     .  .  0 "[    .    1    .    2]" 
       126 PSI 1 71 GLU N 1 71 GLU CA 1 71 GLU C  1 72 SER N  -62.20 -24.80  -46.28  -53.46  -32.22     .  .  0 "[    .    1    .    2]" 
       127 PHI 1 71 GLU C 1 72 SER N  1 72 SER CA 1 72 SER C  -72.50 -52.50  -63.68  -62.64  -63.46  0.49  5  0 "[    .    1    .    2]" 
       128 PSI 1 72 SER N 1 72 SER CA 1 72 SER C  1 73 ARG N  -57.20 -24.40  -40.35  -45.90  -30.44     .  .  0 "[    .    1    .    2]" 
       129 PHI 1 72 SER C 1 73 ARG N  1 73 ARG CA 1 73 ARG C  -77.60 -48.80  -60.03  -60.87  -65.44     .  .  0 "[    .    1    .    2]" 
       130 PSI 1 73 ARG N 1 73 ARG CA 1 73 ARG C  1 74 SER N  -54.20 -34.20  -44.98  -39.39  -41.31     .  .  0 "[    .    1    .    2]" 
       131 PHI 1 73 ARG C 1 74 SER N  1 74 SER CA 1 74 SER C  -72.80 -52.90  -59.97  -55.85  -57.08     .  .  0 "[    .    1    .    2]" 
       132 PSI 1 74 SER N 1 74 SER CA 1 74 SER C  1 75 LYS N  -52.90 -31.90  -42.94  -54.13  -33.90  1.23 20  0 "[    .    1    .    2]" 
       133 PHI 1 74 SER C 1 75 LYS N  1 75 LYS CA 1 75 LYS C  -75.20 -55.10  -69.24  -77.95  -59.78  2.75 15  0 "[    .    1    .    2]" 
       134 PSI 1 75 LYS N 1 75 LYS CA 1 75 LYS C  1 76 VAL N  -53.00 -30.10  -35.15  -31.92  -35.60  6.10 18  1 "[    .    1    .  + 2]" 
       135 PHI 1 75 LYS C 1 76 VAL N  1 76 VAL CA 1 76 VAL C  -79.60 -58.30  -66.55  -72.16  -59.74     .  .  0 "[    .    1    .    2]" 
       136 PSI 1 76 VAL N 1 76 VAL CA 1 76 VAL C  1 77 ASP N  -53.50 -29.40  -45.56  -41.20  -43.15     .  .  0 "[    .    1    .    2]" 
       137 PHI 1 76 VAL C 1 77 ASP N  1 77 ASP CA 1 77 ASP C  -72.50 -52.50  -66.04  -75.34  -56.24  2.84 19  0 "[    .    1    .    2]" 
       138 PSI 1 77 ASP N 1 77 ASP CA 1 77 ASP C  1 78 GLU N  -57.60 -28.40  -34.85  -38.68  -40.46 16.46 19  2 "[  - .    1    .   +2]" 
       139 PHI 1 77 ASP C 1 78 GLU N  1 78 GLU CA 1 78 GLU C  -80.80 -56.80  -64.16  -63.21  -63.98  0.89  7  0 "[    .    1    .    2]" 
       140 PSI 1 78 GLU N 1 78 GLU CA 1 78 GLU C  1 79 ALA N  -48.50 -26.90  -44.31  -53.75  -36.39  5.25 19  1 "[    .    1    .   +2]" 
       141 PHI 1 78 GLU C 1 79 ALA N  1 79 ALA CA 1 79 ALA C  -76.80 -47.70  -61.90  -68.35  -56.65     .  .  0 "[    .    1    .    2]" 
       142 PSI 1 79 ALA N 1 79 ALA CA 1 79 ALA C  1 80 VAL N  -57.90 -26.00  -43.51  -48.61  -36.53     .  .  0 "[    .    1    .    2]" 
       143 PHI 1 79 ALA C 1 80 VAL N  1 80 VAL CA 1 80 VAL C  -72.70 -52.70  -59.99  -68.28  -53.27     .  .  0 "[    .    1    .    2]" 
       144 PSI 1 80 VAL N 1 80 VAL CA 1 80 VAL C  1 81 SER N  -53.80 -33.80  -52.61  -55.55  -57.11  6.42 13  3 "[  - .    1  + *    2]" 
       145 PHI 1 80 VAL C 1 81 SER N  1 81 SER CA 1 81 SER C  -74.50 -52.10  -63.11  -75.33  -50.17  1.93  3  0 "[    .    1    .    2]" 
       146 PSI 1 81 SER N 1 81 SER CA 1 81 SER C  1 82 LYS N  -60.90 -26.80  -29.50  -41.43  -14.63 12.17 11  5 "[**  .    1+   .-*  2]" 
       147 PHI 1 81 SER C 1 82 LYS N  1 82 LYS CA 1 82 LYS C  -79.70 -47.00  -72.53  -79.96  -86.12  6.91  1  2 "[+ - .    1    .    2]" 
       148 PSI 1 82 LYS N 1 82 LYS CA 1 82 LYS C  1 83 PHE N  -53.60 -20.20  -38.11  -57.43   -3.99 16.21 10  2 "[    .-   +    .    2]" 
       149 PHI 1 82 LYS C 1 83 PHE N  1 83 PHE CA 1 83 PHE C -101.60 -53.30  -86.86  -72.58  -77.81 17.31 10  1 "[    .    +    .    2]" 
       150 PSI 1 83 PHE N 1 83 PHE CA 1 83 PHE C  1 84 GLU N  -56.60   7.90  -21.15  -37.57   -6.07     .  .  0 "[    .    1    .    2]" 
    stop_

save_