NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype subsubtype
405216 1x53 cing 4-filtered-FRED Wattos check violation dihedral angle


data_1x53


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              146
    _TA_constraint_stats_list.Viol_count                    316
    _TA_constraint_stats_list.Viol_total                    5778.83
    _TA_constraint_stats_list.Viol_max                      4.16
    _TA_constraint_stats_list.Viol_rms                      0.46
    _TA_constraint_stats_list.Viol_average_all_restraints   0.10
    _TA_constraint_stats_list.Viol_average_violations_only  0.91
    _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   9 PRO C 1  10 THR N  1  10 THR CA 1  10 THR C -160.00 -100.00 -140.35 -140.99 -141.34    .  . 0 "[    .    1    .    2]" 
         2 PSI 1  10 THR N 1  10 THR CA 1  10 THR C  1  11 CYS N  118.00  178.00  176.59  177.19  176.56 0.85 19 0 "[    .    1    .    2]" 
         3 PHI 1  10 THR C 1  11 CYS N  1  11 CYS CA 1  11 CYS C -171.00 -111.00 -150.98 -155.35 -144.36    .  . 0 "[    .    1    .    2]" 
         4 PSI 1  11 CYS N 1  11 CYS CA 1  11 CYS C  1  12 LYS N  122.00 -178.00  178.05  169.08 -177.81 0.19 19 0 "[    .    1    .    2]" 
         5 PHI 1  11 CYS C 1  12 LYS N  1  12 LYS CA 1  12 LYS C -150.00  -90.00 -104.47 -110.83 -113.43    .  . 0 "[    .    1    .    2]" 
         6 PSI 1  12 LYS N 1  12 LYS CA 1  12 LYS C  1  13 ILE N  117.00  177.00  140.90  137.45  136.53    .  . 0 "[    .    1    .    2]" 
         7 PHI 1  13 ILE C 1  14 THR N  1  14 THR CA 1  14 THR C -144.00  -84.00  -97.71  -91.10  -91.36    .  . 0 "[    .    1    .    2]" 
         8 PSI 1  14 THR N 1  14 THR CA 1  14 THR C  1  15 LEU N   94.00  154.00  113.81  109.98  101.62    .  . 0 "[    .    1    .    2]" 
         9 PHI 1  14 THR C 1  15 LEU N  1  15 LEU CA 1  15 LEU C -165.00 -105.00 -122.84 -136.55 -112.22    .  . 0 "[    .    1    .    2]" 
        10 PSI 1  15 LEU N 1  15 LEU CA 1  15 LEU C  1  16 LYS N  122.00 -178.00  127.06  127.35  125.39 0.56  3 0 "[    .    1    .    2]" 
        11 PHI 1  15 LEU C 1  16 LYS N  1  16 LYS CA 1  16 LYS C -147.00  -87.00 -122.11 -118.41 -120.75    .  . 0 "[    .    1    .    2]" 
        12 PSI 1  16 LYS N 1  16 LYS CA 1  16 LYS C  1  17 GLU N  101.00  161.00  104.91  102.52  101.94 0.31 14 0 "[    .    1    .    2]" 
        13 PHI 1  16 LYS C 1  17 GLU N  1  17 GLU CA 1  17 GLU C -168.00 -108.00 -122.60 -121.85 -123.44    .  . 0 "[    .    1    .    2]" 
        14 PSI 1  17 GLU N 1  17 GLU CA 1  17 GLU C  1  18 THR N  111.00  171.00  149.45  136.52  171.11 0.11  8 0 "[    .    1    .    2]" 
        15 PHI 1  17 GLU C 1  18 THR N  1  18 THR CA 1  18 THR C -123.00  -63.00 -100.04 -106.24 -107.37    .  . 0 "[    .    1    .    2]" 
        16 PSI 1  18 THR N 1  18 THR CA 1  18 THR C  1  19 PHE N   99.00  159.00  137.87  120.72  151.25    .  . 0 "[    .    1    .    2]" 
        17 PHI 1  18 THR C 1  19 PHE N  1  19 PHE CA 1  19 PHE C -157.00  -97.00 -113.41 -116.11 -118.56    .  . 0 "[    .    1    .    2]" 
        18 PSI 1  19 PHE N 1  19 PHE CA 1  19 PHE C  1  20 LEU N  114.00  174.00  141.14  137.41  143.78    .  . 0 "[    .    1    .    2]" 
        19 PHI 1  23 PRO C 1  24 GLU N  1  24 GLU CA 1  24 GLU C  -97.00  -37.00  -43.74  -49.22  -39.22    .  . 0 "[    .    1    .    2]" 
        20 PSI 1  24 GLU N 1  24 GLU CA 1  24 GLU C  1  25 GLU N  -69.00   -9.00  -42.68  -37.27  -37.57    .  . 0 "[    .    1    .    2]" 
        21 PHI 1  24 GLU C 1  25 GLU N  1  25 GLU CA 1  25 GLU C  -96.00  -36.00  -59.73  -62.83  -63.78    .  . 0 "[    .    1    .    2]" 
        22 PSI 1  25 GLU N 1  25 GLU CA 1  25 GLU C  1  26 LEU N  -70.00  -10.00  -63.73  -68.30  -68.80 0.51  7 0 "[    .    1    .    2]" 
        23 PHI 1  25 GLU C 1  26 LEU N  1  26 LEU CA 1  26 LEU C  -97.00  -37.00  -61.57  -82.27  -53.68    .  . 0 "[    .    1    .    2]" 
        24 PSI 1  26 LEU N 1  26 LEU CA 1  26 LEU C  1  27 TYR N  -70.00  -10.00  -19.67  -24.33   -9.29 0.71 19 0 "[    .    1    .    2]" 
        25 PHI 1  26 LEU C 1  27 TYR N  1  27 TYR CA 1  27 TYR C  -96.00  -36.00  -64.11  -61.32  -61.90    .  . 0 "[    .    1    .    2]" 
        26 PSI 1  27 TYR N 1  27 TYR CA 1  27 TYR C  1  28 ARG N  -71.00  -11.00  -21.74  -39.81  -14.63    .  . 0 "[    .    1    .    2]" 
        27 PHI 1  27 TYR C 1  28 ARG N  1  28 ARG CA 1  28 ARG C -101.00  -41.00  -92.38  -97.59  -98.09    .  . 0 "[    .    1    .    2]" 
        28 PSI 1  28 ARG N 1  28 ARG CA 1  28 ARG C  1  29 VAL N  -68.00   -8.00  -50.13  -49.81  -49.97    .  . 0 "[    .    1    .    2]" 
        29 PHI 1  28 ARG C 1  29 VAL N  1  29 VAL CA 1  29 VAL C -101.00  -41.00  -44.68  -47.77  -41.19    .  . 0 "[    .    1    .    2]" 
        30 PSI 1  29 VAL N 1  29 VAL CA 1  29 VAL C  1  30 PHE N  -72.00  -12.00  -23.64  -20.38  -21.08    .  . 0 "[    .    1    .    2]" 
        31 PHI 1  29 VAL C 1  30 PHE N  1  30 PHE CA 1  30 PHE C -113.00  -53.00 -102.79 -106.70  -95.35    .  . 0 "[    .    1    .    2]" 
        32 PSI 1  30 PHE N 1  30 PHE CA 1  30 PHE C  1  31 THR N  -60.00    0.00  -23.31  -28.14  -19.60    .  . 0 "[    .    1    .    2]" 
        33 PHI 1  32 THR C 1  33 GLN N  1  33 GLN CA 1  33 GLN C  -89.00  -29.00  -44.46  -48.95  -41.91    .  . 0 "[    .    1    .    2]" 
        34 PSI 1  33 GLN N 1  33 GLN CA 1  33 GLN C  1  34 GLU N  -65.00   -5.00  -61.11  -63.02  -63.10 0.27  5 0 "[    .    1    .    2]" 
        35 PHI 1  33 GLN C 1  34 GLU N  1  34 GLU CA 1  34 GLU C  -95.00  -35.00  -42.86  -40.35  -40.90    .  . 0 "[    .    1    .    2]" 
        36 PSI 1  34 GLU N 1  34 GLU CA 1  34 GLU C  1  35 LEU N  -67.00   -7.00  -62.61  -66.38  -59.31    .  . 0 "[    .    1    .    2]" 
        37 PHI 1  34 GLU C 1  35 LEU N  1  35 LEU CA 1  35 LEU C  -94.00  -34.00  -48.05  -48.05  -48.44    .  . 0 "[    .    1    .    2]" 
        38 PSI 1  35 LEU N 1  35 LEU CA 1  35 LEU C  1  36 VAL N  -74.00  -14.00  -34.61  -41.00  -27.99    .  . 0 "[    .    1    .    2]" 
        39 PHI 1  35 LEU C 1  36 VAL N  1  36 VAL CA 1  36 VAL C  -96.00  -36.00  -68.72  -69.53  -69.95    .  . 0 "[    .    1    .    2]" 
        40 PSI 1  36 VAL N 1  36 VAL CA 1  36 VAL C  1  37 GLN N  -70.00  -10.00  -46.64  -42.77  -44.57    .  . 0 "[    .    1    .    2]" 
        41 PHI 1  36 VAL C 1  37 GLN N  1  37 GLN CA 1  37 GLN C  -97.00  -37.00  -66.27  -72.17  -63.68    .  . 0 "[    .    1    .    2]" 
        42 PSI 1  37 GLN N 1  37 GLN CA 1  37 GLN C  1  38 ALA N  -65.00   -5.00   -3.44   -3.59   -3.73 3.17 11 0 "[    .    1    .    2]" 
        43 PHI 1  38 ALA C 1  39 PHE N  1  39 PHE CA 1  39 PHE C -112.00  -52.00  -89.15  -84.39  -85.51    .  . 0 "[    .    1    .    2]" 
        44 PSI 1  39 PHE N 1  39 PHE CA 1  39 PHE C  1  40 THR N  -45.00   15.00   -4.14  -10.57    8.80    .  . 0 "[    .    1    .    2]" 
        45 PHI 1  44 ALA C 1  45 THR N  1  45 THR CA 1  45 THR C -142.00  -82.00 -124.61 -127.90 -119.83    .  . 0 "[    .    1    .    2]" 
        46 PSI 1  45 THR N 1  45 THR CA 1  45 THR C  1  46 LEU N  100.00  160.00   99.76   99.82   99.78 1.10  9 0 "[    .    1    .    2]" 
        47 PHI 1  45 THR C 1  46 LEU N  1  46 LEU CA 1  46 LEU C -154.00  -94.00 -108.42 -113.12 -106.38    .  . 0 "[    .    1    .    2]" 
        48 PSI 1  46 LEU N 1  46 LEU CA 1  46 LEU C  1  47 GLU N   99.00  159.00  139.54  135.57  142.09    .  . 0 "[    .    1    .    2]" 
        49 PHI 1  46 LEU C 1  47 GLU N  1  47 GLU CA 1  47 GLU C -136.00  -76.00 -131.14 -131.13 -131.53    .  . 0 "[    .    1    .    2]" 
        50 PSI 1  47 GLU N 1  47 GLU CA 1  47 GLU C  1  48 ALA N   96.00  156.00   96.69   95.72   99.14 0.28 12 0 "[    .    1    .    2]" 
        51 PHI 1  47 GLU C 1  48 ALA N  1  48 ALA CA 1  48 ALA C -120.00  -60.00  -62.40  -64.41  -60.87    .  . 0 "[    .    1    .    2]" 
        52 PSI 1  48 ALA N 1  48 ALA CA 1  48 ALA C  1  49 ASP N   89.00  149.00   95.71   95.94   95.89    .  . 0 "[    .    1    .    2]" 
        53 PHI 1  52 GLY C 1  53 LYS N  1  53 LYS CA 1  53 LYS C -135.00  -75.00 -117.74 -119.02 -120.17    .  . 0 "[    .    1    .    2]" 
        54 PSI 1  53 LYS N 1  53 LYS CA 1  53 LYS C  1  54 PHE N  120.00  180.00  135.56  131.79  130.22    .  . 0 "[    .    1    .    2]" 
        55 PHI 1  54 PHE C 1  55 HIS N  1  55 HIS CA 1  55 HIS C -143.00  -83.00 -119.37 -118.08 -118.09    .  . 0 "[    .    1    .    2]" 
        56 PSI 1  55 HIS N 1  55 HIS CA 1  55 HIS C  1  56 MET N  108.00  168.00  136.20  132.54  140.52    .  . 0 "[    .    1    .    2]" 
        57 PHI 1  55 HIS C 1  56 MET N  1  56 MET CA 1  56 MET C -147.00  -87.00 -147.09 -146.05 -146.51 2.01 11 0 "[    .    1    .    2]" 
        58 PSI 1  56 MET N 1  56 MET CA 1  56 MET C  1  57 VAL N  117.00  177.00  174.22  177.18  177.07 0.54  6 0 "[    .    1    .    2]" 
        59 PHI 1  60 ASN C 1  61 VAL N  1  61 VAL CA 1  61 VAL C -164.00 -104.00 -129.48 -132.35 -125.24    .  . 0 "[    .    1    .    2]" 
        60 PSI 1  61 VAL N 1  61 VAL CA 1  61 VAL C  1  62 SER N  117.00  177.00  116.10  115.97  115.86 1.73  8 0 "[    .    1    .    2]" 
        61 PHI 1  61 VAL C 1  62 SER N  1  62 SER CA 1  62 SER C -142.00  -82.00 -123.35 -129.95 -121.09    .  . 0 "[    .    1    .    2]" 
        62 PSI 1  62 SER N 1  62 SER CA 1  62 SER C  1  63 GLY N  125.00 -175.00  174.61  152.32  178.32    .  . 0 "[    .    1    .    2]" 
        63 PHI 1  63 GLY C 1  64 GLU N  1  64 GLU CA 1  64 GLU C -153.00  -93.00 -150.98 -153.16 -145.72 0.16  7 0 "[    .    1    .    2]" 
        64 PSI 1  64 GLU N 1  64 GLU CA 1  64 GLU C  1  65 PHE N  111.00  171.00  137.16  135.39  134.93    .  . 0 "[    .    1    .    2]" 
        65 PHI 1  67 ASP C 1  68 LEU N  1  68 LEU CA 1  68 LEU C -144.00  -84.00 -143.86 -144.61 -142.83 0.61  8 0 "[    .    1    .    2]" 
        66 PSI 1  68 LEU N 1  68 LEU CA 1  68 LEU C  1  69 VAL N   91.00  151.00  109.89  107.34  107.13    .  . 0 "[    .    1    .    2]" 
        67 PHI 1  68 LEU C 1  69 VAL N  1  69 VAL CA 1  69 VAL C -130.00  -70.00 -111.34 -115.14 -107.85    .  . 0 "[    .    1    .    2]" 
        68 PSI 1  69 VAL N 1  69 VAL CA 1  69 VAL C  1  70 PRO N  106.00  166.00  138.84  138.90  138.88    .  . 0 "[    .    1    .    2]" 
        69 PHI 1  72 LYS C 1  73 HIS N  1  73 HIS CA 1  73 HIS C -166.00 -106.00 -164.74 -164.50 -164.84 0.28  6 0 "[    .    1    .    2]" 
        70 PSI 1  73 HIS N 1  73 HIS CA 1  73 HIS C  1  74 ILE N  102.00  162.00  162.95  163.16  163.04 1.52  3 0 "[    .    1    .    2]" 
        71 PHI 1  73 HIS C 1  74 ILE N  1  74 ILE CA 1  74 ILE C -165.00 -105.00 -140.32 -139.58 -140.18    .  . 0 "[    .    1    .    2]" 
        72 PSI 1  74 ILE N 1  74 ILE CA 1  74 ILE C  1  75 VAL N  100.00  160.00  127.86  124.64  130.27    .  . 0 "[    .    1    .    2]" 
        73 PHI 1  74 ILE C 1  75 VAL N  1  75 VAL CA 1  75 VAL C -134.00  -74.00 -117.55 -117.19 -117.57    .  . 0 "[    .    1    .    2]" 
        74 PSI 1  75 VAL N 1  75 VAL CA 1  75 VAL C  1  76 MET N   95.00  155.00  120.68  119.93  119.61    .  . 0 "[    .    1    .    2]" 
        75 PHI 1  75 VAL C 1  76 MET N  1  76 MET CA 1  76 MET C -151.00  -91.00 -150.32 -151.66 -147.51 0.66  8 0 "[    .    1    .    2]" 
        76 PSI 1  76 MET N 1  76 MET CA 1  76 MET C  1  77 LYS N  121.00 -179.00  173.10  169.35  177.85    .  . 0 "[    .    1    .    2]" 
        77 PHI 1  76 MET C 1  77 LYS N  1  77 LYS CA 1  77 LYS C -138.00  -78.00  -93.19  -93.15  -94.53    .  . 0 "[    .    1    .    2]" 
        78 PSI 1  77 LYS N 1  77 LYS CA 1  77 LYS C  1  78 TRP N   98.00  158.00  152.59  148.60  158.01 0.01  8 0 "[    .    1    .    2]" 
        79 PHI 1  87 HIS C 1  88 PHE N  1  88 PHE CA 1  88 PHE C -127.00  -67.00 -122.37 -127.76 -118.50 0.76 17 0 "[    .    1    .    2]" 
        80 PSI 1  88 PHE N 1  88 PHE CA 1  88 PHE C  1  89 ALA N  114.00  174.00  169.39  174.23  173.77 0.23  2 0 "[    .    1    .    2]" 
        81 PHI 1  88 PHE C 1  89 ALA N  1  89 ALA CA 1  89 ALA C -141.00  -81.00 -121.52 -124.91 -115.96    .  . 0 "[    .    1    .    2]" 
        82 PSI 1  89 ALA N 1  89 ALA CA 1  89 ALA C  1  90 THR N  103.00  163.00  132.41  132.56  132.16    .  . 0 "[    .    1    .    2]" 
        83 PHI 1  89 ALA C 1  90 THR N  1  90 THR CA 1  90 THR C -137.00  -77.00  -77.92  -80.89  -76.23 0.77 20 0 "[    .    1    .    2]" 
        84 PSI 1  90 THR N 1  90 THR CA 1  90 THR C  1  91 ILE N   96.00  156.00  110.27  114.75  112.31    .  . 0 "[    .    1    .    2]" 
        85 PHI 1  90 THR C 1  91 ILE N  1  91 ILE CA 1  91 ILE C -155.00  -95.00 -110.98 -118.76 -104.07    .  . 0 "[    .    1    .    2]" 
        86 PSI 1  91 ILE N 1  91 ILE CA 1  91 ILE C  1  92 THR N  103.00  163.00  133.51  124.57  141.70    .  . 0 "[    .    1    .    2]" 
        87 PHI 1  91 ILE C 1  92 THR N  1  92 THR CA 1  92 THR C -142.00  -82.00 -128.21 -134.19 -119.55    .  . 0 "[    .    1    .    2]" 
        88 PSI 1  92 THR N 1  92 THR CA 1  92 THR C  1  93 LEU N  100.00  160.00  100.46   99.48   99.42 0.72 17 0 "[    .    1    .    2]" 
        89 PHI 1  94 THR C 1  95 PHE N  1  95 PHE CA 1  95 PHE C -134.00  -74.00 -105.44 -111.03  -98.93    .  . 0 "[    .    1    .    2]" 
        90 PSI 1  95 PHE N 1  95 PHE CA 1  95 PHE C  1  96 ILE N   99.00  159.00  123.01  118.61  129.26    .  . 0 "[    .    1    .    2]" 
        91 PHI 1  95 PHE C 1  96 ILE N  1  96 ILE CA 1  96 ILE C -128.00  -68.00 -114.28 -113.95 -114.62    .  . 0 "[    .    1    .    2]" 
        92 PSI 1  96 ILE N 1  96 ILE CA 1  96 ILE C  1  97 ASP N   96.00  156.00  152.14  144.71  156.28 0.28  7 0 "[    .    1    .    2]" 
        93 PHI 1 100 GLY C 1 101 GLU N  1 101 GLU CA 1 101 GLU C -154.00  -94.00 -125.25 -131.05 -120.94    .  . 0 "[    .    1    .    2]" 
        94 PSI 1 101 GLU N 1 101 GLU CA 1 101 GLU C  1 102 THR N  124.00 -176.00  162.38  143.27  170.81    .  . 0 "[    .    1    .    2]" 
        95 PHI 1 101 GLU C 1 102 THR N  1 102 THR CA 1 102 THR C -136.00  -76.00 -125.79 -125.37 -127.22    .  . 0 "[    .    1    .    2]" 
        96 PSI 1 102 THR N 1 102 THR CA 1 102 THR C  1 103 GLU N   97.00  157.00  123.46  127.95  125.46    .  . 0 "[    .    1    .    2]" 
        97 PHI 1 102 THR C 1 103 GLU N  1 103 GLU CA 1 103 GLU C -152.00  -92.00  -91.60  -91.88  -91.12 0.88 16 0 "[    .    1    .    2]" 
        98 PSI 1 103 GLU N 1 103 GLU CA 1 103 GLU C  1 104 LEU N  102.00  162.00  104.04  101.46  107.98 0.54  3 0 "[    .    1    .    2]" 
        99 PHI 1 103 GLU C 1 104 LEU N  1 104 LEU CA 1 104 LEU C -145.00  -85.00  -85.33  -87.24  -84.43 0.57 11 0 "[    .    1    .    2]" 
       100 PSI 1 104 LEU N 1 104 LEU CA 1 104 LEU C  1 105 CYS N  100.00  160.00  105.26  105.46  104.59    .  . 0 "[    .    1    .    2]" 
       101 PHI 1 104 LEU C 1 105 CYS N  1 105 CYS CA 1 105 CYS C -127.00  -67.00  -93.83 -101.54  -87.00    .  . 0 "[    .    1    .    2]" 
       102 PSI 1 105 CYS N 1 105 CYS CA 1 105 CYS C  1 106 MET N   94.00  154.00   95.61   93.47  112.43 0.53  7 0 "[    .    1    .    2]" 
       103 PHI 1 105 CYS C 1 106 MET N  1 106 MET CA 1 106 MET C -139.00  -79.00  -83.53  -84.65  -87.13 0.36 13 0 "[    .    1    .    2]" 
       104 PSI 1 106 MET N 1 106 MET CA 1 106 MET C  1 107 GLU N   95.00  155.00  133.57  137.60  136.95    .  . 0 "[    .    1    .    2]" 
       105 PHI 1 106 MET C 1 107 GLU N  1 107 GLU CA 1 107 GLU C -138.00  -78.00 -134.26 -134.60 -134.69    .  . 0 "[    .    1    .    2]" 
       106 PSI 1 107 GLU N 1 107 GLU CA 1 107 GLU C  1 108 GLY N   98.00  158.00  100.75   97.41  120.04 0.59  5 0 "[    .    1    .    2]" 
       107 PHI 1 108 GLY C 1 109 ARG N  1 109 ARG CA 1 109 ARG C -141.00  -81.00 -138.66 -141.65 -129.70 0.65 15 0 "[    .    1    .    2]" 
       108 PSI 1 109 ARG N 1 109 ARG CA 1 109 ARG C  1 110 GLY N  104.00  164.00  113.51  105.43  119.51    .  . 0 "[    .    1    .    2]" 
       109 PHI 1 110 GLY C 1 111 ILE N  1 111 ILE CA 1 111 ILE C -120.00  -60.00  -72.63  -74.76  -75.50    .  . 0 "[    .    1    .    2]" 
       110 PSI 1 111 ILE N 1 111 ILE CA 1 111 ILE C  1 112 PRO N   93.00  153.00  122.77  119.06  128.08    .  . 0 "[    .    1    .    2]" 
       111 PHI 1 115 GLU C 1 116 GLU N  1 116 GLU CA 1 116 GLU C  -92.00  -32.00  -46.12  -39.60  -42.14    .  . 0 "[    .    1    .    2]" 
       112 PSI 1 116 GLU N 1 116 GLU CA 1 116 GLU C  1 117 GLU N  -68.00   -8.00  -54.86  -48.42  -52.72 0.19  4 0 "[    .    1    .    2]" 
       113 PHI 1 116 GLU C 1 117 GLU N  1 117 GLU CA 1 117 GLU C  -93.00  -33.00  -61.74  -84.81  -47.82    .  . 0 "[    .    1    .    2]" 
       114 PSI 1 117 GLU N 1 117 GLU CA 1 117 GLU C  1 118 ARG N  -70.00  -10.00  -64.12  -70.80  -48.75 0.80 15 0 "[    .    1    .    2]" 
       115 PHI 1 117 GLU C 1 118 ARG N  1 118 ARG CA 1 118 ARG C  -92.00  -32.00  -40.34  -44.16  -46.43    .  . 0 "[    .    1    .    2]" 
       116 PSI 1 118 ARG N 1 118 ARG CA 1 118 ARG C  1 119 THR N  -70.00  -10.00  -49.55  -60.99  -36.88    .  . 0 "[    .    1    .    2]" 
       117 PHI 1 118 ARG C 1 119 THR N  1 119 THR CA 1 119 THR C  -99.00  -39.00  -52.98  -50.46  -51.95 0.27 15 0 "[    .    1    .    2]" 
       118 PSI 1 119 THR N 1 119 THR CA 1 119 THR C  1 120 ARG N  -70.00  -10.00  -68.92  -71.11  -58.61 1.11  2 0 "[    .    1    .    2]" 
       119 PHI 1 119 THR C 1 120 ARG N  1 120 ARG CA 1 120 ARG C  -94.00  -34.00  -52.67  -69.25  -42.36    .  . 0 "[    .    1    .    2]" 
       120 PSI 1 120 ARG N 1 120 ARG CA 1 120 ARG C  1 121 GLN N  -74.00  -14.00  -28.95  -27.86  -34.75    .  . 0 "[    .    1    .    2]" 
       121 PHI 1 120 ARG C 1 121 GLN N  1 121 GLN CA 1 121 GLN C  -95.00  -35.00  -70.60  -88.38  -53.18    .  . 0 "[    .    1    .    2]" 
       122 PSI 1 121 GLN N 1 121 GLN CA 1 121 GLN C  1 122 GLY N  -65.00   -5.00  -36.70  -24.76  -29.50    .  . 0 "[    .    1    .    2]" 
       123 PHI 1 122 GLY C 1 123 TRP N  1 123 TRP CA 1 123 TRP C  -95.00  -35.00  -92.14  -90.17  -92.03 0.50 16 0 "[    .    1    .    2]" 
       124 PSI 1 123 TRP N 1 123 TRP CA 1 123 TRP C  1 124 GLN N  -67.00   -7.00  -67.30  -67.85  -66.08 0.85  3 0 "[    .    1    .    2]" 
       125 PHI 1 123 TRP C 1 124 GLN N  1 124 GLN CA 1 124 GLN C  -93.00  -33.00  -68.00  -68.85  -70.61    .  . 0 "[    .    1    .    2]" 
       126 PSI 1 124 GLN N 1 124 GLN CA 1 124 GLN C  1 125 ARG N  -70.00  -10.00  -32.94  -37.17  -28.26    .  . 0 "[    .    1    .    2]" 
       127 PHI 1 124 GLN C 1 125 ARG N  1 125 ARG CA 1 125 ARG C  -94.00  -34.00  -46.72  -44.84  -45.22    .  . 0 "[    .    1    .    2]" 
       128 PSI 1 125 ARG N 1 125 ARG CA 1 125 ARG C  1 126 TYR N  -70.00  -10.00  -25.99  -27.19  -27.75    .  . 0 "[    .    1    .    2]" 
       129 PHI 1 126 TYR C 1 127 TYR N  1 127 TYR CA 1 127 TYR C -113.00  -53.00  -62.91  -57.98  -60.05    .  . 0 "[    .    1    .    2]" 
       130 PSI 1 127 TYR N 1 127 TYR CA 1 127 TYR C  1 128 PHE N  -63.00   -3.00  -66.75  -66.56  -66.63 4.16 15 0 "[    .    1    .    2]" 
       131 PHI 1 127 TYR C 1 128 PHE N  1 128 PHE CA 1 128 PHE C  -90.00  -30.00  -93.34  -92.79  -93.00 3.80 15 0 "[    .    1    .    2]" 
       132 PSI 1 128 PHE N 1 128 PHE CA 1 128 PHE C  1 129 GLU N  -71.00  -11.00  -67.80  -70.57  -62.98    .  . 0 "[    .    1    .    2]" 
       133 PHI 1 128 PHE C 1 129 GLU N  1 129 GLU CA 1 129 GLU C  -91.00  -31.00  -34.62  -33.87  -34.64    .  . 0 "[    .    1    .    2]" 
       134 PSI 1 129 GLU N 1 129 GLU CA 1 129 GLU C  1 130 GLY N  -69.00   -9.00  -34.10  -42.27  -26.96    .  . 0 "[    .    1    .    2]" 
       135 PHI 1 129 GLU C 1 130 GLY N  1 130 GLY CA 1 130 GLY C  -97.00  -37.00  -75.35  -74.32  -75.67    .  . 0 "[    .    1    .    2]" 
       136 PSI 1 130 GLY N 1 130 GLY CA 1 130 GLY C  1 131 ILE N  -71.00  -11.00  -59.88  -70.74  -44.05    .  . 0 "[    .    1    .    2]" 
       137 PHI 1 130 GLY C 1 131 ILE N  1 131 ILE CA 1 131 ILE C  -97.00  -37.00  -58.51  -69.67  -70.58    .  . 0 "[    .    1    .    2]" 
       138 PSI 1 131 ILE N 1 131 ILE CA 1 131 ILE C  1 132 LYS N  -75.00  -15.00  -47.08  -49.41  -53.73    .  . 0 "[    .    1    .    2]" 
       139 PHI 1 131 ILE C 1 132 LYS N  1 132 LYS CA 1 132 LYS C  -93.00  -33.00  -47.10  -57.53  -34.17    .  . 0 "[    .    1    .    2]" 
       140 PSI 1 132 LYS N 1 132 LYS CA 1 132 LYS C  1 133 GLN N  -72.00  -12.00  -32.34  -38.23  -39.78    .  . 0 "[    .    1    .    2]" 
       141 PHI 1 132 LYS C 1 133 GLN N  1 133 GLN CA 1 133 GLN C -100.00  -40.00  -96.96 -100.15  -88.26 0.15 16 0 "[    .    1    .    2]" 
       142 PSI 1 133 GLN N 1 133 GLN CA 1 133 GLN C  1 134 THR N  -71.00  -11.00  -53.87  -58.28  -47.79    .  . 0 "[    .    1    .    2]" 
       143 PHI 1 133 GLN C 1 134 THR N  1 134 THR CA 1 134 THR C  -99.00  -39.00  -52.60  -50.71  -51.09    .  . 0 "[    .    1    .    2]" 
       144 PSI 1 134 THR N 1 134 THR CA 1 134 THR C  1 135 PHE N  -65.00   -5.00  -58.41  -60.58  -62.26    .  . 0 "[    .    1    .    2]" 
       145 PHI 1 134 THR C 1 135 PHE N  1 135 PHE CA 1 135 PHE C -129.00  -69.00  -84.92  -91.60  -81.19    .  . 0 "[    .    1    .    2]" 
       146 PSI 1 135 PHE N 1 135 PHE CA 1 135 PHE C  1 136 GLY N  -25.00   35.00  -22.48  -25.21  -17.04 0.21 11 0 "[    .    1    .    2]" 
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