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
645030 6nu0 12032 cing 4-filtered-FRED Wattos check violation dihedral angle


data_6nu0


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              162
    _TA_constraint_stats_list.Viol_count                    493
    _TA_constraint_stats_list.Viol_total                    73927.82
    _TA_constraint_stats_list.Viol_max                      48.83
    _TA_constraint_stats_list.Viol_rms                      3.94
    _TA_constraint_stats_list.Viol_average_all_restraints   1.14
    _TA_constraint_stats_list.Viol_average_violations_only  7.50
    _TA_constraint_stats_list.Cutoff_violation_report       5.00
    _TA_constraint_stats_list.Details                       
;
Description of the tags in this list:
*  1 * Administrative tag
*  2 * ID of the restraint list.                                                                 
*  3 * Number of restraints in list.                                                             
*  4 * Number of violated restraints (each model violation is used).                             
*  5 * Sum of violations in degrees.                                                             
*  6 * Maximum violation of a restraint without averaging in any way.                            
*  7 * Rms of violations over all restraints.                                                    
*  8 *  Average violation over all restraints.                                                   
*  9 *  Average violation over violated restraints.                                              
            This violation is averaged over only those models in which the restraint is violated.
            Threshold for reporting violations (degrees) in the last columns of the next table.     
*  10 * This tag.                                                                                

Description of the tags in the per restraint table below:
*  1 * Restraint ID within restraint list.                             
*  2 * Torsion angle name where available.                             
*  3 *     First atom's:                                               
*  4 * Chain identifier (can be absent if none defined)                
*  5 * Residue number                                                  
*  6 * Residue name                                                    
*  7 * Name of (pseudo-)atom                                           
*  8 *  Second thru fourth atom's identifiers occupy columns 7 thru 18.
*  19 * Lower bound (degrees)                                               
*  20 * Upper bound (degrees)                                               
*  21 * Average angle in ensemble of models                                 
*  22 * Minimum angle in ensemble of models (counter clockwise from range)  
*  23 * Maximum angle in ensemble of models         (clockwise from range)  
*  24 * Maximum violation (without any averaging)                           
*  25 * Model number with the maximum violation                             
*  26 * Number of models with a violation above cutoff                      
*  27 * List of models with a violation above cutoff. See description above.
*  28 * Administrative tag                                                  
*  29 * Administrative tag                                                  

;


    loop_
       _TA_constraint_stats.Restraint_ID
       _TA_constraint_stats.Torsion_angle_name
       _TA_constraint_stats.Entity_assembly_ID_1
       _TA_constraint_stats.Comp_index_ID_1
       _TA_constraint_stats.Comp_ID_1
       _TA_constraint_stats.Atom_ID_1
       _TA_constraint_stats.Entity_assembly_ID_2
       _TA_constraint_stats.Comp_index_ID_2
       _TA_constraint_stats.Comp_ID_2
       _TA_constraint_stats.Atom_ID_2
       _TA_constraint_stats.Entity_assembly_ID_3
       _TA_constraint_stats.Comp_index_ID_3
       _TA_constraint_stats.Comp_ID_3
       _TA_constraint_stats.Atom_ID_3
       _TA_constraint_stats.Entity_assembly_ID_4
       _TA_constraint_stats.Comp_index_ID_4
       _TA_constraint_stats.Comp_ID_4
       _TA_constraint_stats.Atom_ID_4
       _TA_constraint_stats.Angle_lower_bound_val
       _TA_constraint_stats.Angle_upper_bound_val
       _TA_constraint_stats.Angle_average
       _TA_constraint_stats.Angle_minimum
       _TA_constraint_stats.Angle_maximum
       _TA_constraint_stats.Max_violation
       _TA_constraint_stats.Max_violation_model_number
       _TA_constraint_stats.Over_cutoff_violation_count
       _TA_constraint_stats.Over_cutoff_violation_per_model

         1 . 1  87 SER C 1  88 ARG N  1  88 ARG CA 1  88 ARG C -138.30  -81.10  -99.00  -85.98  -87.65     .  .  0 "[    .    1    .    2]" 
         2 . 1  88 ARG N 1  88 ARG CA 1  88 ARG C  1  89 TYR N  124.00  164.00  142.57  116.14  166.14  7.86 12  1 "[    .    1 +  .    2]" 
         3 . 1  88 ARG C 1  89 TYR N  1  89 TYR CA 1  89 TYR C -133.90  -71.30 -106.86 -135.21  -74.86  1.31  9  0 "[    .    1    .    2]" 
         4 . 1  89 TYR N 1  89 TYR CA 1  89 TYR C  1  90 LEU N   98.20  147.40  126.00   73.40  145.93 24.80  4  1 "[   +.    1    .    2]" 
         5 . 1  89 TYR C 1  90 LEU N  1  90 LEU CA 1  90 LEU C -112.20  -71.00 -109.16 -106.49 -109.67 14.91 14  9 "[*  -.   *1** +*  **2]" 
         6 . 1  90 LEU N 1  90 LEU CA 1  90 LEU C  1  91 THR N  106.50  146.50  124.81  104.43  140.40  2.07  7  0 "[    .    1    .    2]" 
         7 . 1  90 LEU C 1  91 THR N  1  91 THR CA 1  91 THR C -148.60 -132.60 -133.02 -135.69 -138.98 10.12  2  2 "[ +  .    1    . -  2]" 
         8 . 1  91 THR N 1  91 THR CA 1  91 THR C  1  92 ASP N  133.40  175.80  133.51  118.66  149.93 14.74 12 10 "[ ** *   *1 +- ***  *]" 
         9 . 1  92 ASP C 1  93 MET N  1  93 MET CA 1  93 MET C -172.80  -72.40 -136.37 -155.33 -116.74     .  .  0 "[    .    1    .    2]" 
        10 . 1  93 MET N 1  93 MET CA 1  93 MET C  1  94 THR N  131.50  172.10  157.74  163.24  160.25  0.45 10  0 "[    .    1    .    2]" 
        11 . 1  93 MET C 1  94 THR N  1  94 THR CA 1  94 THR C  -90.20  -70.20  -76.00  -84.98  -69.75  0.45 14  0 "[    .    1    .    2]" 
        12 . 1  94 THR N 1  94 THR CA 1  94 THR C  1  95 LEU N  144.00 -176.00  168.65  171.95  171.07     .  .  0 "[    .    1    .    2]" 
        13 . 1  94 THR C 1  95 LEU N  1  95 LEU CA 1  95 LEU C  -80.00  -40.00  -65.51  -71.89  -58.88     .  .  0 "[    .    1    .    2]" 
        14 . 1  95 LEU N 1  95 LEU CA 1  95 LEU C  1  96 GLU N  -58.00  -18.00  -30.61  -41.17  -19.10     .  .  0 "[    .    1    .    2]" 
        15 . 1  95 LEU C 1  96 GLU N  1  96 GLU CA 1  96 GLU C  -83.90  -43.90  -66.47  -64.45  -65.22     .  .  0 "[    .    1    .    2]" 
        16 . 1  96 GLU N 1  96 GLU CA 1  96 GLU C  1  97 GLU N  -61.80  -21.80  -41.57  -47.42  -48.48     .  .  0 "[    .    1    .    2]" 
        17 . 1  96 GLU C 1  97 GLU N  1  97 GLU CA 1  97 GLU C  -68.80  -48.80  -67.74  -62.25  -64.34  8.61 13  2 "[    .    1  + .    -]" 
        18 . 1  97 GLU N 1  97 GLU CA 1  97 GLU C  1  98 MET N  -61.20  -21.20  -31.09  -34.32  -37.04     .  .  0 "[    .    1    .    2]" 
        19 . 1  97 GLU C 1  98 MET N  1  98 MET CA 1  98 MET C  -80.80  -60.80  -75.32  -86.58  -64.99  5.78 19  1 "[    .    1    .   +2]" 
        20 . 1  98 MET N 1  98 MET CA 1  98 MET C  1  99 SER N  -50.70  -10.70  -24.79  -15.21  -18.30  5.50  4  1 "[   +.    1    .    2]" 
        21 . 1  98 MET C 1  99 SER N  1  99 SER CA 1  99 SER C -109.00  -89.00  -96.22 -114.86  -81.09  7.91 15  5 "[  * .    1-  *+  * 2]" 
        22 . 1  99 SER N 1  99 SER CA 1  99 SER C  1 100 ARG N  -27.50   12.50  -14.64  -24.00    0.56     .  .  0 "[    .    1    .    2]" 
        23 . 1  99 SER C 1 100 ARG N  1 100 ARG CA 1 100 ARG C  -58.40  -38.40  -63.85  -70.08  -56.68 11.68 20 13 "[****. ***1 - *** * +]" 
        24 . 1 100 ARG N 1 100 ARG CA 1 100 ARG C  1 101 ASP N  117.40  158.00  138.90  135.84  134.60     .  .  0 "[    .    1    .    2]" 
        25 . 1 100 ARG C 1 101 ASP N  1 101 ASP CA 1 101 ASP C  -86.20  -66.20  -92.96  -82.15  -86.13 31.91 15  9 "[    . -  ***  +*** *]" 
        26 . 1 101 ASP C 1 102 TRP N  1 102 TRP CA 1 102 TRP C -168.50 -148.50 -148.50 -153.96 -143.56  4.94  6  0 "[    .    1    .    2]" 
        27 . 1 102 TRP N 1 102 TRP CA 1 102 TRP C  1 103 PHE N  130.20 -176.00  166.06  159.99  177.39     .  .  0 "[    .    1    .    2]" 
        28 . 1 102 TRP C 1 103 PHE N  1 103 PHE CA 1 103 PHE C -153.60 -136.80 -135.33 -133.97 -134.57 19.84 20  3 "[    .*-  1    .    +]" 
        29 . 1 103 PHE N 1 103 PHE CA 1 103 PHE C  1 104 MET N  125.60  165.60  157.73  168.29  166.53  4.31  4  0 "[    .    1    .    2]" 
        30 . 1 103 PHE C 1 104 MET N  1 104 MET CA 1 104 MET C -152.40  -93.60 -110.28 -130.53  -76.93 16.67 15  3 "[    . -  1    +  * 2]" 
        31 . 1 104 MET N 1 104 MET CA 1 104 MET C  1 105 LEU N  105.50  150.90  129.92  131.03  128.55     .  .  0 "[    .    1    .    2]" 
        32 . 1 106 MET N 1 106 MET CA 1 106 MET C  1 107 PRO N   97.00  177.00   92.81   80.34  119.75 16.66 14 10 "[ * *.- ***   +. * **]" 
        33 . 1 108 LYS N 1 108 LYS CA 1 108 LYS C  1 109 GLN N  113.00  164.20  134.16  145.46  143.05 14.26 13  1 "[    .    1  + .    2]" 
        34 . 1 108 LYS C 1 109 GLN N  1 109 GLN CA 1 109 GLN C -142.30 -132.10 -131.86 -142.53 -120.33 11.77 14  6 "[    *-   1  *+*   *2]" 
        35 . 1 109 GLN N 1 109 GLN CA 1 109 GLN C  1 110 LYS N  119.40  159.60  140.41  152.10  147.23     .  .  0 "[    .    1    .    2]" 
        36 . 1 109 GLN C 1 110 LYS N  1 110 LYS CA 1 110 LYS C -155.00 -135.40 -144.31 -150.99 -136.42     .  .  0 "[    .    1    .    2]" 
        37 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C  1 111 VAL N  119.90  159.90  154.17  146.24  163.00  3.10 17  0 "[    .    1    .    2]" 
        38 . 1 110 LYS C 1 111 VAL N  1 111 VAL CA 1 111 VAL C -102.50  -87.90 -119.26 -120.45 -123.08 27.72  6 18 "[*****+*-******.** **]" 
        39 . 1 111 VAL N 1 111 VAL CA 1 111 VAL C  1 112 ALA N  105.40  145.40  132.33  128.40  127.93  7.57 11  1 "[    .    1+   .    2]" 
        40 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C  1 113 GLY N   89.40  148.80  116.44   83.12  141.69  6.28  9  2 "[    .   +1    .  - 2]" 
        41 . 1 114 SER C 1 115 LEU N  1 115 LEU CA 1 115 LEU C -145.50  -91.50 -104.13 -104.54 -109.54  6.53 11  2 "[    .    1+-  .    2]" 
        42 . 1 115 LEU N 1 115 LEU CA 1 115 LEU C  1 116 CYS N  117.50  157.50  132.18  115.77  144.71  1.73 16  0 "[    .    1    .    2]" 
        43 . 1 115 LEU C 1 116 CYS N  1 116 CYS CA 1 116 CYS C -133.30  -76.10  -87.80 -106.13  -75.02  1.08 13  0 "[    .    1    .    2]" 
        44 . 1 116 CYS N 1 116 CYS CA 1 116 CYS C  1 117 ILE N   99.30  139.30  128.22  129.60  126.21  3.19  2  0 "[    .    1    .    2]" 
        45 . 1 116 CYS C 1 117 ILE N  1 117 ILE CA 1 117 ILE C -108.50  -88.50 -113.20 -127.29 -100.26 18.79  2 11 "[ +**-** *1**  **   2]" 
        46 . 1 117 ILE N 1 117 ILE CA 1 117 ILE C  1 118 ARG N  110.50  150.50  125.87  133.00  131.57     .  .  0 "[    .    1    .    2]" 
        47 . 1 118 ARG N 1 118 ARG CA 1 118 ARG C  1 119 MET N  117.60  166.40  139.43  145.70  143.87     .  .  0 "[    .    1    .    2]" 
        48 . 1 118 ARG C 1 119 MET N  1 119 MET CA 1 119 MET C -170.60 -153.60 -153.20 -154.02 -155.10  5.06 17  1 "[    .    1    . +  2]" 
        49 . 1 119 MET N 1 119 MET CA 1 119 MET C  1 120 ASP N  134.20  178.40  153.49  135.83  161.21     .  .  0 "[    .    1    .    2]" 
        50 . 1 119 MET C 1 120 ASP N  1 120 ASP CA 1 120 ASP C  -95.00  -75.00  -89.99  -89.11  -90.30  2.02  4  0 "[    .    1    .    2]" 
        51 . 1 120 ASP N 1 120 ASP CA 1 120 ASP C  1 121 GLN N  103.30  165.30  107.64   95.92  124.65  7.38 13  2 "[    .    1  + -    2]" 
        52 . 1 120 ASP C 1 121 GLN N  1 121 GLN CA 1 121 GLN C  -83.20  -63.40  -73.37  -70.47  -71.70  4.87 19  0 "[    .    1    .    2]" 
        53 . 1 121 GLN N 1 121 GLN CA 1 121 GLN C  1 122 ALA N  -40.20   -0.20   -6.75   -6.22   -7.85 10.84 13  1 "[    .    1  + .    2]" 
        54 . 1 121 GLN C 1 122 ALA N  1 122 ALA CA 1 122 ALA C -111.30  -64.70  -74.47  -82.28  -66.04     .  .  0 "[    .    1    .    2]" 
        55 . 1 122 ALA N 1 122 ALA CA 1 122 ALA C  1 123 ILE N  -29.70   10.30  -20.39  -27.36  -29.15  2.03  4  0 "[    .    1    .    2]" 
        56 . 1 122 ALA C 1 123 ILE N  1 123 ILE CA 1 123 ILE C  -91.40  -71.40  -81.37 -109.88  -70.20 18.48 19  1 "[    .    1    .   +2]" 
        57 . 1 123 ILE N 1 123 ILE CA 1 123 ILE C  1 124 MET N   86.90  147.70  117.96  110.82  126.81     .  .  0 "[    .    1    .    2]" 
        58 . 1 126 LYS C 1 127 ASN N  1 127 ASN CA 1 127 ASN C -117.10  -70.50  -88.79  -81.77  -84.25     .  .  0 "[    .    1    .    2]" 
        59 . 1 127 ASN N 1 127 ASN CA 1 127 ASN C  1 128 ILE N  103.90  143.90  133.03  110.57  141.52     .  .  0 "[    .    1    .    2]" 
        60 . 1 128 ILE N 1 128 ILE CA 1 128 ILE C  1 129 ILE N  115.80  155.80  132.16  126.10  142.17     .  .  0 "[    .    1    .    2]" 
        61 . 1 129 ILE N 1 129 ILE CA 1 129 ILE C  1 130 LEU N  110.40  150.40  124.72  125.28  124.67     .  .  0 "[    .    1    .    2]" 
        62 . 1 129 ILE C 1 130 LEU N  1 130 LEU CA 1 130 LEU C -101.60  -90.60  -85.30  -95.13  -79.37 11.23 10 14 "[****.  * +**  -*****]" 
        63 . 1 130 LEU N 1 130 LEU CA 1 130 LEU C  1 131 LYS N  107.40  147.40  127.95   88.28  138.89 19.12  6  1 "[    .+   1    .    2]" 
        64 . 1 130 LEU C 1 131 LYS N  1 131 LYS CA 1 131 LYS C -153.10 -133.10 -128.91 -129.02 -130.10 46.59  6  5 "[   *.+   1- **.    2]" 
        65 . 1 131 LYS N 1 131 LYS CA 1 131 LYS C  1 132 ALA N  127.70  167.70  146.27  162.00  153.78     .  .  0 "[    .    1    .    2]" 
        66 . 1 131 LYS C 1 132 ALA N  1 132 ALA CA 1 132 ALA C -170.00 -130.00 -131.67 -147.52 -124.45  5.55  8  1 "[    .  + 1    .    2]" 
        67 . 1 132 ALA N 1 132 ALA CA 1 132 ALA C  1 133 ASN N  135.90  175.90  164.17  164.61  163.61     .  .  0 "[    .    1    .    2]" 
        68 . 1 132 ALA C 1 133 ASN N  1 133 ASN CA 1 133 ASN C -139.10  -84.90 -131.38 -127.40 -127.91  5.42 11  1 "[    .    1+   .    2]" 
        69 . 1 133 ASN N 1 133 ASN CA 1 133 ASN C  1 134 PHE N  112.80  157.80  122.19  110.50  130.45  2.30 11  0 "[    .    1    .    2]" 
        70 . 1 133 ASN C 1 134 PHE N  1 134 PHE CA 1 134 PHE C -171.40 -131.40 -154.31 -147.95 -149.77     .  .  0 "[    .    1    .    2]" 
        71 . 1 134 PHE N 1 134 PHE CA 1 134 PHE C  1 135 SER N  144.10 -175.90  160.36  143.31  173.69  0.79 17  0 "[    .    1    .    2]" 
        72 . 1 135 SER N 1 135 SER CA 1 135 SER C  1 136 VAL N  124.50  170.30  142.16  114.08  159.32 10.42 12  1 "[    .    1 +  .    2]" 
        73 . 1 146 LEU C 1 147 LEU N  1 147 LEU CA 1 147 LEU C -152.30 -112.30 -131.29 -129.74 -130.54     .  .  0 "[    .    1    .    2]" 
        74 . 1 147 LEU N 1 147 LEU CA 1 147 LEU C  1 148 ARG N  112.60  152.60  137.33  141.85  138.61     .  .  0 "[    .    1    .    2]" 
        75 . 1 147 LEU C 1 148 ARG N  1 148 ARG CA 1 148 ARG C -157.00 -145.40 -132.70 -138.25 -126.20 19.20  9 20  [****-***+***********]  
        76 . 1 148 ARG N 1 148 ARG CA 1 148 ARG C  1 149 ALA N  127.00  167.00  147.47  134.24  159.07     .  .  0 "[    .    1    .    2]" 
        77 . 1 148 ARG C 1 149 ALA N  1 149 ALA CA 1 149 ALA C -157.80  -89.80 -102.32 -102.86 -108.71  2.00 15  0 "[    .    1    .    2]" 
        78 . 1 149 ALA N 1 149 ALA CA 1 149 ALA C  1 150 PHE N  111.60  160.00  126.84  126.19  125.73  5.63 19  1 "[    .    1    .   +2]" 
        79 . 1 150 PHE N 1 150 PHE CA 1 150 PHE C  1 151 THR N  125.50  165.50  139.67  131.33  164.65     .  .  0 "[    .    1    .    2]" 
        80 . 1 150 PHE C 1 151 THR N  1 151 THR CA 1 151 THR C  -97.40  -77.40  -76.70  -71.04  -72.35 17.04 16  5 "[ *  .    *-  *.+   2]" 
        81 . 1 151 THR N 1 151 THR CA 1 151 THR C  1 152 GLU N  149.60 -170.40  171.78  166.52  177.97     .  .  0 "[    .    1    .    2]" 
        82 . 1 151 THR C 1 152 GLU N  1 152 GLU CA 1 152 GLU C  -79.80  -39.80  -59.53  -65.30  -52.63     .  .  0 "[    .    1    .    2]" 
        83 . 1 152 GLU N 1 152 GLU CA 1 152 GLU C  1 153 GLU N  -47.20   -7.20  -21.71  -20.29  -20.96     .  .  0 "[    .    1    .    2]" 
        84 . 1 152 GLU C 1 153 GLU N  1 153 GLU CA 1 153 GLU C -101.30  -81.30  -73.40  -86.67  -66.02 15.28  6 14 "[   *.+***1** -******]" 
        85 . 1 153 GLU N 1 153 GLU CA 1 153 GLU C  1 154 GLY N  -24.60   15.40  -14.91  -26.57   -6.14  1.97  4  0 "[    .    1    .    2]" 
        86 . 1 153 GLU C 1 154 GLY N  1 154 GLY CA 1 154 GLY C   71.00  111.00   89.11   86.09   85.72  0.33  4  0 "[    .    1    .    2]" 
        87 . 1 154 GLY N 1 154 GLY CA 1 154 GLY C  1 155 ALA N  -15.50   24.50    2.17    3.86    3.13  0.28  4  0 "[    .    1    .    2]" 
        88 . 1 154 GLY C 1 155 ALA N  1 155 ALA CA 1 155 ALA C  -93.40  -73.40  -81.54  -84.43  -85.73  2.23 16  0 "[    .    1    .    2]" 
        89 . 1 155 ALA N 1 155 ALA CA 1 155 ALA C  1 156 ILE N  116.20  156.20  142.30  132.81  160.41  4.21 16  0 "[    .    1    .    2]" 
        90 . 1 155 ALA C 1 156 ILE N  1 156 ILE CA 1 156 ILE C  -94.20  -54.20  -81.66  -78.25  -78.94 16.74 16  1 "[    .    1    .+   2]" 
        91 . 1 156 ILE N 1 156 ILE CA 1 156 ILE C  1 157 VAL N  103.70  143.70  128.07  123.51  134.62     .  .  0 "[    .    1    .    2]" 
        92 . 1 156 ILE C 1 157 VAL N  1 157 VAL CA 1 157 VAL C -140.70 -100.70 -125.89 -129.31 -122.60     .  .  0 "[    .    1    .    2]" 
        93 . 1 157 VAL N 1 157 VAL CA 1 157 VAL C  1 158 GLY N  -27.10   13.30    1.40    5.04    3.05     .  .  0 "[    .    1    .    2]" 
        94 . 1 157 VAL C 1 158 GLY N  1 158 GLY CA 1 158 GLY C  153.90 -161.30 -167.92 -177.91 -162.27     .  .  0 "[    .    1    .    2]" 
        95 . 1 158 GLY N 1 158 GLY CA 1 158 GLY C  1 159 GLU N  157.90 -156.70  161.94  162.56  162.34  1.95 19  0 "[    .    1    .    2]" 
        96 . 1 158 GLY C 1 159 GLU N  1 159 GLU CA 1 159 GLU C -167.20 -151.60 -154.48 -158.12 -150.11  1.49  1  0 "[    .    1    .    2]" 
        97 . 1 159 GLU N 1 159 GLU CA 1 159 GLU C  1 160 ILE N  131.40  171.40  145.29  149.13  147.16     .  .  0 "[    .    1    .    2]" 
        98 . 1 160 ILE N 1 160 ILE CA 1 160 ILE C  1 161 SER N  110.00  150.00  129.95  129.77  128.82  3.90 14  0 "[    .    1    .    2]" 
        99 . 1 160 ILE C 1 161 SER N  1 161 SER CA 1 161 SER C -152.30 -132.30 -141.10 -154.95  -94.25 38.05 14  2 "[    .    1   +. -  2]" 
       100 . 1 161 SER N 1 161 SER CA 1 161 SER C  1 162 PRO N  119.70  166.50  137.07  137.83  130.88 16.54 17  2 "[    .    1   -. +  2]" 
       101 . 1 162 PRO C 1 163 LEU N  1 163 LEU CA 1 163 LEU C  -98.10  -45.70  -67.68  -62.71  -63.78     .  .  0 "[    .    1    .    2]" 
       102 . 1 163 LEU N 1 163 LEU CA 1 163 LEU C  1 164 PRO N  112.70  165.90  139.45  150.95  146.03     .  .  0 "[    .    1    .    2]" 
       103 . 1 169 HIS C 1 170 THR N  1 170 THR CA 1 170 THR C -142.30  -70.10 -122.54 -134.88  -83.03     .  .  0 "[    .    1    .    2]" 
       104 . 1 170 THR N 1 170 THR CA 1 170 THR C  1 171 ASP N  147.60 -172.40  162.00  142.73  173.40  4.87 12  0 "[    .    1    .    2]" 
       105 . 1 170 THR C 1 171 ASP N  1 171 ASP CA 1 171 ASP C  -74.50  -54.50  -68.60  -60.60  -63.82  5.41  3  1 "[  + .    1    .    2]" 
       106 . 1 171 ASP N 1 171 ASP CA 1 171 ASP C  1 172 GLU N  -58.30  -18.30  -27.24  -41.39   -9.93  8.37  7  2 "[  - . +  1    .    2]" 
       107 . 1 171 ASP C 1 172 GLU N  1 172 GLU CA 1 172 GLU C  -84.40  -44.40  -64.04  -68.88  -57.44     .  .  0 "[    .    1    .    2]" 
       108 . 1 172 GLU N 1 172 GLU CA 1 172 GLU C  1 173 ASP N  -60.90  -20.90  -36.08  -46.11  -27.74     .  .  0 "[    .    1    .    2]" 
       109 . 1 172 GLU C 1 173 ASP N  1 173 ASP CA 1 173 ASP C  -83.60  -43.60  -66.82  -74.69  -60.42     .  .  0 "[    .    1    .    2]" 
       110 . 1 173 ASP N 1 173 ASP CA 1 173 ASP C  1 174 VAL N  -62.40  -22.40  -40.64  -37.52  -40.01     .  .  0 "[    .    1    .    2]" 
       111 . 1 173 ASP C 1 174 VAL N  1 174 VAL CA 1 174 VAL C  -83.60  -43.60  -69.37  -70.68  -71.34     .  .  0 "[    .    1    .    2]" 
       112 . 1 174 VAL N 1 174 VAL CA 1 174 VAL C  1 175 LYS N  -63.10  -23.10  -39.61  -44.31  -32.28     .  .  0 "[    .    1    .    2]" 
       113 . 1 174 VAL C 1 175 LYS N  1 175 LYS CA 1 175 LYS C  -82.90  -42.90  -62.46  -73.57  -54.98     .  .  0 "[    .    1    .    2]" 
       114 . 1 175 LYS N 1 175 LYS CA 1 175 LYS C  1 176 ASN N  -60.90  -20.90  -41.63  -42.24  -44.61     .  .  0 "[    .    1    .    2]" 
       115 . 1 175 LYS C 1 176 ASN N  1 176 ASN CA 1 176 ASN C  -85.30  -45.30  -67.57  -66.11  -66.78     .  .  0 "[    .    1    .    2]" 
       116 . 1 176 ASN N 1 176 ASN CA 1 176 ASN C  1 177 ALA N  -61.20  -21.20  -40.25  -37.83  -37.90     .  .  0 "[    .    1    .    2]" 
       117 . 1 176 ASN C 1 177 ALA N  1 177 ALA CA 1 177 ALA C  -82.80  -42.80  -65.31  -64.71  -65.18     .  .  0 "[    .    1    .    2]" 
       118 . 1 177 ALA N 1 177 ALA CA 1 177 ALA C  1 178 VAL N  -62.90  -22.90  -42.22  -49.67  -39.71     .  .  0 "[    .    1    .    2]" 
       119 . 1 177 ALA C 1 178 VAL N  1 178 VAL CA 1 178 VAL C  -65.00  -45.00  -69.11  -63.97  -64.20 10.62 18  9 "[    * * *1* * -**+ 2]" 
       120 . 1 178 VAL N 1 178 VAL CA 1 178 VAL C  1 179 GLY N  -62.50  -22.50  -29.72  -40.48  -16.17  6.33 18  1 "[    .    1    .  + 2]" 
       121 . 1 178 VAL C 1 179 GLY N  1 179 GLY CA 1 179 GLY C  -81.80  -41.80  -62.36  -60.35  -60.57     .  .  0 "[    .    1    .    2]" 
       122 . 1 179 GLY N 1 179 GLY CA 1 179 GLY C  1 180 VAL N  -61.40  -21.40  -37.80  -42.83  -30.75     .  .  0 "[    .    1    .    2]" 
       123 . 1 179 GLY C 1 180 VAL N  1 180 VAL CA 1 180 VAL C  -73.90  -53.90  -66.42  -64.56  -65.45     .  .  0 "[    .    1    .    2]" 
       124 . 1 180 VAL N 1 180 VAL CA 1 180 VAL C  1 181 LEU N  -62.80  -22.80  -47.95  -47.36  -48.26     .  .  0 "[    .    1    .    2]" 
       125 . 1 180 VAL C 1 181 LEU N  1 181 LEU CA 1 181 LEU C  -83.80  -43.80  -67.88  -67.82  -67.87     .  .  0 "[    .    1    .    2]" 
       126 . 1 181 LEU N 1 181 LEU CA 1 181 LEU C  1 182 ILE N  -64.70  -24.70  -47.05  -46.32  -46.43     .  .  0 "[    .    1    .    2]" 
       127 . 1 181 LEU C 1 182 ILE N  1 182 ILE CA 1 182 ILE C  -62.00  -42.20  -65.43  -60.94  -61.27  9.27 17  6 "[    . * *1 -  .*+* 2]" 
       128 . 1 182 ILE N 1 182 ILE CA 1 182 ILE C  1 183 GLY N  -64.10  -24.10  -45.19  -46.00  -46.46     .  .  0 "[    .    1    .    2]" 
       129 . 1 182 ILE C 1 183 GLY N  1 183 GLY CA 1 183 GLY C  -83.20  -43.20  -61.19  -60.96  -61.34     .  .  0 "[    .    1    .    2]" 
       130 . 1 183 GLY N 1 183 GLY CA 1 183 GLY C  1 184 GLY N  -61.70  -21.70  -38.51  -46.14  -30.14     .  .  0 "[    .    1    .    2]" 
       131 . 1 183 GLY C 1 184 GLY N  1 184 GLY CA 1 184 GLY C  -83.60  -43.60  -69.37  -73.29  -64.91     .  .  0 "[    .    1    .    2]" 
       132 . 1 184 GLY N 1 184 GLY CA 1 184 GLY C  1 185 LEU N  -63.40  -23.40  -42.85  -39.15  -40.57     .  .  0 "[    .    1    .    2]" 
       133 . 1 184 GLY C 1 185 LEU N  1 185 LEU CA 1 185 LEU C  -76.00  -56.00  -71.30  -78.02  -65.68  2.02 19  0 "[    .    1    .    2]" 
       134 . 1 185 LEU N 1 185 LEU CA 1 185 LEU C  1 186 GLU N  -61.70  -21.70  -35.21  -36.73  -39.41     .  .  0 "[    .    1    .    2]" 
       135 . 1 185 LEU C 1 186 GLU N  1 186 GLU CA 1 186 GLU C  -70.30  -50.30  -68.24  -73.94  -63.48  3.64  9  0 "[    .    1    .    2]" 
       136 . 1 186 GLU N 1 186 GLU CA 1 186 GLU C  1 187 ARG N  -57.60  -17.60  -34.33  -35.07  -35.93     .  .  0 "[    .    1    .    2]" 
       137 . 1 186 GLU C 1 187 ARG N  1 187 ARG CA 1 187 ARG C  -86.00  -46.00  -67.95  -74.73  -63.87     .  .  0 "[    .    1    .    2]" 
       138 . 1 187 ARG N 1 187 ARG CA 1 187 ARG C  1 188 ASN N  -43.90   -3.90  -23.37  -21.26  -22.80     .  .  0 "[    .    1    .    2]" 
       139 . 1 187 ARG C 1 188 ASN N  1 188 ASN CA 1 188 ASN C -117.40 -101.40  -90.12  -93.46  -95.23 25.99 16 17 "[-****** ***** *+***2]" 
       140 . 1 188 ASN N 1 188 ASN CA 1 188 ASN C  1 189 ASP N   -7.90   32.10   18.21    7.99   25.85     .  .  0 "[    .    1    .    2]" 
       141 . 1 189 ASP N 1 189 ASP CA 1 189 ASP C  1 190 ASN N   14.70   54.70   26.80   17.04   12.54  5.07 17  1 "[    .    1    . +  2]" 
       142 . 1 190 ASN C 1 191 THR N  1 191 THR CA 1 191 THR C -112.00  -54.00  -84.98  -73.56  -78.57  6.14 15  1 "[    .    1    +    2]" 
       143 . 1 191 THR N 1 191 THR CA 1 191 THR C  1 192 VAL N  101.30  152.10  136.37  128.44  122.01  3.98  8  0 "[    .    1    .    2]" 
       144 . 1 192 VAL N 1 192 VAL CA 1 192 VAL C  1 193 ARG N  109.20  149.20  129.04  123.31  121.47  2.21  5  0 "[    .    1    .    2]" 
       145 . 1 193 ARG N 1 193 ARG CA 1 193 ARG C  1 194 VAL N  119.30  171.50  146.32  109.33  161.63  9.97  5  1 "[    +    1    .    2]" 
       146 . 1 194 VAL N 1 194 VAL CA 1 194 VAL C  1 195 SER N  119.90  165.90  146.10  139.21  138.47     .  .  0 "[    .    1    .    2]" 
       147 . 1 194 VAL C 1 195 SER N  1 195 SER CA 1 195 SER C  -86.20  -46.20  -69.93  -82.69  -55.84     .  .  0 "[    .    1    .    2]" 
       148 . 1 195 SER N 1 195 SER CA 1 195 SER C  1 196 GLU N  136.30  176.30  162.49  167.15  166.01  0.41 15  0 "[    .    1    .    2]" 
       149 . 1 195 SER C 1 196 GLU N  1 196 GLU CA 1 196 GLU C  -78.10  -38.10  -60.01  -65.64  -54.40     .  .  0 "[    .    1    .    2]" 
       150 . 1 196 GLU N 1 196 GLU CA 1 196 GLU C  1 197 THR N  -59.80  -19.80  -38.90  -45.60  -48.47     .  .  0 "[    .    1    .    2]" 
       151 . 1 196 GLU C 1 197 THR N  1 197 THR CA 1 197 THR C  -82.60  -62.60  -85.78 -100.73  -67.75 18.13 10  9 "[ **-**   + * *.    *]" 
       152 . 1 197 THR N 1 197 THR CA 1 197 THR C  1 198 LEU N  -60.40  -20.40  -31.82  -29.21  -31.46     .  .  0 "[    .    1    .    2]" 
       153 . 1 197 THR C 1 198 LEU N  1 198 LEU CA 1 198 LEU C  -90.00  -50.00  -66.95  -60.27  -61.96     .  .  0 "[    .    1    .    2]" 
       154 . 1 198 LEU N 1 198 LEU CA 1 198 LEU C  1 199 GLN N  -58.50  -18.50  -37.03  -50.07  -23.10     .  .  0 "[    .    1    .    2]" 
       155 . 1 198 LEU C 1 199 GLN N  1 199 GLN CA 1 199 GLN C  -84.50  -44.50  -63.99  -70.64  -53.27     .  .  0 "[    .    1    .    2]" 
       156 . 1 199 GLN N 1 199 GLN CA 1 199 GLN C  1 200 ARG N  -59.80  -19.80  -21.96  -19.25  -19.77  7.98 18  2 "[    .    1    .  +-2]" 
       157 . 1 199 GLN C 1 200 ARG N  1 200 ARG CA 1 200 ARG C  -87.00  -47.00  -73.03  -68.81  -69.55  2.88 12  0 "[    .    1    .    2]" 
       158 . 1 200 ARG N 1 200 ARG CA 1 200 ARG C  1 201 PHE N  -58.20  -18.20  -38.56  -59.53  -64.99  6.79  1  1 "[+   .    1    .    2]" 
       159 . 1 200 ARG C 1 201 PHE N  1 201 PHE CA 1 201 PHE C  -89.00  -49.00 -105.71 -137.83  -73.25 48.83 17 15 "[ **-**** ** *** + **]" 
       160 . 1 201 PHE N 1 201 PHE CA 1 201 PHE C  1 202 ALA N  -51.80  -11.80  -36.23  -51.91   -8.35  3.45  8  0 "[    .    1    .    2]" 
       161 . 1 201 PHE C 1 202 ALA N  1 202 ALA CA 1 202 ALA C -108.40  -63.20  -86.08  -98.19 -104.43 12.40  8  4 "[* * .  + 1 -  .    2]" 
       162 . 1 202 ALA N 1 202 ALA CA 1 202 ALA C  1 203 TRP N  -29.00   11.20  -26.11  -48.24    5.37 19.24  3  9 "[  + * **-1**  **   2]" 
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