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
419755 2edg cing 4-filtered-FRED Wattos check violation dihedral angle


data_2edg


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              157
    _TA_constraint_stats_list.Viol_count                    54
    _TA_constraint_stats_list.Viol_total                    114.23
    _TA_constraint_stats_list.Viol_max                      0.55
    _TA_constraint_stats_list.Viol_rms                      0.02
    _TA_constraint_stats_list.Viol_average_all_restraints   0.00
    _TA_constraint_stats_list.Viol_average_violations_only  0.11
    _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 CHI1 1  36 LEU N  1  36 LEU CA 1  36 LEU CB 1  36 LEU CG   120.00 -120.00 -151.99 -157.16 -149.87    .  . 0 "[    .    1    .    2]" 
         2 CHI2 1  36 LEU CA 1  36 LEU CB 1  36 LEU CG 1  36 LEU CD1    0.00  120.00   81.79   73.16   89.80    .  . 0 "[    .    1    .    2]" 
         3 CHI2 1  51 LEU CA 1  51 LEU CB 1  51 LEU CG 1  51 LEU CD1  120.00 -120.00  165.49  156.05  175.70    .  . 0 "[    .    1    .    2]" 
         4 CHI2 1  73 LEU CA 1  73 LEU CB 1  73 LEU CG 1  73 LEU CD1   30.00 -150.00   91.21   86.65   85.55    .  . 0 "[    .    1    .    2]" 
         5 CHI2 1 112 LEU CA 1 112 LEU CB 1 112 LEU CG 1 112 LEU CD1  120.00 -120.00  162.56  164.96  163.64    .  . 0 "[    .    1    .    2]" 
         6 PHI  1   7 GLY C  1   8 ARG N  1   8 ARG CA 1   8 ARG C   -112.50  -52.50  -76.90 -111.98  -54.60    .  . 0 "[    .    1    .    2]" 
         7 PSI  1   8 ARG N  1   8 ARG CA 1   8 ARG C  1   9 LYS N    110.15  170.15  135.82  111.45  163.23    .  . 0 "[    .    1    .    2]" 
         8 PHI  1   8 ARG C  1   9 LYS N  1   9 LYS CA 1   9 LYS C   -147.79  -87.79 -104.14  -94.05  -94.47 0.12 15 0 "[    .    1    .    2]" 
         9 PSI  1   9 LYS N  1   9 LYS CA 1   9 LYS C  1  10 PHE N    122.92 -177.08  157.03  168.43  160.56    .  . 0 "[    .    1    .    2]" 
        10 PHI  1   9 LYS C  1  10 PHE N  1  10 PHE CA 1  10 PHE C   -160.47 -100.47 -135.87 -154.73 -102.81    .  . 0 "[    .    1    .    2]" 
        11 PSI  1  10 PHE N  1  10 PHE CA 1  10 PHE C  1  11 THR N    111.23  171.23  158.82  155.71  154.04    .  . 0 "[    .    1    .    2]" 
        12 PHI  1  10 PHE C  1  11 THR N  1  11 THR CA 1  11 THR C   -134.61  -74.61 -123.72 -134.49 -110.64    .  . 0 "[    .    1    .    2]" 
        13 PSI  1  11 THR N  1  11 THR CA 1  11 THR C  1  12 GLU N    127.04 -172.96  178.75  162.93 -175.15    .  . 0 "[    .    1    .    2]" 
        14 PHI  1  12 GLU C  1  13 LYS N  1  13 LYS CA 1  13 LYS C   -124.66  -64.66  -94.38 -101.92 -108.69    .  . 0 "[    .    1    .    2]" 
        15 PSI  1  13 LYS N  1  13 LYS CA 1  13 LYS C  1  14 HIS N    -14.64   45.36   31.76   14.73   45.35    .  . 0 "[    .    1    .    2]" 
        16 PHI  1  15 GLU C  1  16 TRP N  1  16 TRP CA 1  16 TRP C   -161.72 -101.72 -122.61 -104.58 -109.97    .  . 0 "[    .    1    .    2]" 
        17 PSI  1  16 TRP N  1  16 TRP CA 1  16 TRP C  1  17 ILE N    121.51 -178.49  159.64  152.98  151.34    .  . 0 "[    .    1    .    2]" 
        18 PHI  1  16 TRP C  1  17 ILE N  1  17 ILE CA 1  17 ILE C   -160.17 -100.17 -148.89 -159.58 -135.19    .  . 0 "[    .    1    .    2]" 
        19 PSI  1  17 ILE N  1  17 ILE CA 1  17 ILE C  1  18 THR N    110.36  170.36  120.77  111.82  140.26    .  . 0 "[    .    1    .    2]" 
        20 PHI  1  17 ILE C  1  18 THR N  1  18 THR CA 1  18 THR C   -146.54  -86.54  -96.26  -90.11  -93.39 0.03 12 0 "[    .    1    .    2]" 
        21 PSI  1  18 THR N  1  18 THR CA 1  18 THR C  1  19 THR N    111.56  171.56  157.42  161.17  158.71 0.03 20 0 "[    .    1    .    2]" 
        22 PHI  1  18 THR C  1  19 THR N  1  19 THR CA 1  19 THR C   -151.88  -91.88 -124.68 -142.50  -94.47    .  . 0 "[    .    1    .    2]" 
        23 PSI  1  19 THR N  1  19 THR CA 1  19 THR C  1  20 GLU N    113.05  173.05  119.05  117.22  116.42    .  . 0 "[    .    1    .    2]" 
        24 PHI  1  19 THR C  1  20 GLU N  1  20 GLU CA 1  20 GLU C   -161.75 -101.75 -146.27 -158.83 -131.03    .  . 0 "[    .    1    .    2]" 
        25 PSI  1  20 GLU N  1  20 GLU CA 1  20 GLU C  1  21 GLU N     90.73  150.73  112.80   91.27  136.51    .  . 0 "[    .    1    .    2]" 
        26 PHI  1  22 GLY C  1  23 ILE N  1  23 ILE CA 1  23 ILE C   -124.35  -64.35 -106.69 -114.89 -117.08    .  . 0 "[    .    1    .    2]" 
        27 PSI  1  23 ILE N  1  23 ILE CA 1  23 ILE C  1  24 GLY N    100.52  160.52  119.78  106.21  156.10    .  . 0 "[    .    1    .    2]" 
        28 PHI  1  23 ILE C  1  24 GLY N  1  24 GLY CA 1  24 GLY C   -151.14  -91.14 -104.60  -98.96 -100.76    .  . 0 "[    .    1    .    2]" 
        29 PSI  1  24 GLY N  1  24 GLY CA 1  24 GLY C  1  25 THR N     92.07  152.07  102.94   92.82  112.37    .  . 0 "[    .    1    .    2]" 
        30 PHI  1  24 GLY C  1  25 THR N  1  25 THR CA 1  25 THR C   -130.78  -70.78  -84.52  -86.20  -87.45    .  . 0 "[    .    1    .    2]" 
        31 PSI  1  25 THR N  1  25 THR CA 1  25 THR C  1  26 VAL N     99.75  159.75  132.41  116.75  159.75 0.00  5 0 "[    .    1    .    2]" 
        32 PHI  1  25 THR C  1  26 VAL N  1  26 VAL CA 1  26 VAL C   -150.13  -90.13 -101.49 -125.02  -91.30    .  . 0 "[    .    1    .    2]" 
        33 PSI  1  26 VAL N  1  26 VAL CA 1  26 VAL C  1  27 GLY N    117.05  177.05  141.80  131.19  156.10    .  . 0 "[    .    1    .    2]" 
        34 PHI  1  27 GLY C  1  28 ILE N  1  28 ILE CA 1  28 ILE C   -150.91  -90.91 -103.97  -99.57 -102.31    .  . 0 "[    .    1    .    2]" 
        35 PSI  1  28 ILE N  1  28 ILE CA 1  28 ILE C  1  29 SER N    114.52  174.52  155.49  148.24  166.36    .  . 0 "[    .    1    .    2]" 
        36 PHI  1  28 ILE C  1  29 SER N  1  29 SER CA 1  29 SER C   -142.68  -82.68  -85.39  -88.36  -89.30 0.02  5 0 "[    .    1    .    2]" 
        37 PSI  1  29 SER N  1  29 SER CA 1  29 SER C  1  30 ASN N    134.13 -165.87  169.20  151.75 -175.25    .  . 0 "[    .    1    .    2]" 
        38 PHI  1  29 SER C  1  30 ASN N  1  30 ASN CA 1  30 ASN C    -92.98  -32.98  -60.79  -49.56  -53.14    .  . 0 "[    .    1    .    2]" 
        39 PSI  1  30 ASN N  1  30 ASN CA 1  30 ASN C  1  31 PHE N    -64.19   -4.19  -28.01  -50.88  -11.74    .  . 0 "[    .    1    .    2]" 
        40 PHI  1  30 ASN C  1  31 PHE N  1  31 PHE CA 1  31 PHE C    -94.67  -34.67  -66.30  -65.00  -67.56    .  . 0 "[    .    1    .    2]" 
        41 PSI  1  31 PHE N  1  31 PHE CA 1  31 PHE C  1  32 ALA N    -70.96  -10.96  -31.60  -49.67  -24.36    .  . 0 "[    .    1    .    2]" 
        42 PHI  1  31 PHE C  1  32 ALA N  1  32 ALA CA 1  32 ALA C    -91.29  -31.29  -76.79  -76.08  -77.91    .  . 0 "[    .    1    .    2]" 
        43 PSI  1  32 ALA N  1  32 ALA CA 1  32 ALA C  1  33 GLN N    -69.97   -9.97  -59.30  -69.98  -35.60 0.01  9 0 "[    .    1    .    2]" 
        44 PHI  1  32 ALA C  1  33 GLN N  1  33 GLN CA 1  33 GLN C    -96.06  -36.06  -53.08  -73.89  -42.02    .  . 0 "[    .    1    .    2]" 
        45 PSI  1  33 GLN N  1  33 GLN CA 1  33 GLN C  1  34 GLU N    -70.71  -10.71  -29.11  -25.44  -26.43    .  . 0 "[    .    1    .    2]" 
        46 PHI  1  33 GLN C  1  34 GLU N  1  34 GLU CA 1  34 GLU C    -92.28  -32.28  -76.25  -85.66  -64.11    .  . 0 "[    .    1    .    2]" 
        47 PSI  1  34 GLU N  1  34 GLU CA 1  34 GLU C  1  35 ALA N    -73.74  -13.74  -40.87  -22.56  -24.35    .  . 0 "[    .    1    .    2]" 
        48 PHI  1  34 GLU C  1  35 ALA N  1  35 ALA CA 1  35 ALA C    -94.03  -34.03  -71.04  -89.37  -90.36    .  . 0 "[    .    1    .    2]" 
        49 PSI  1  35 ALA N  1  35 ALA CA 1  35 ALA C  1  36 LEU N    -67.77   -7.77  -53.07  -62.55  -36.18    .  . 0 "[    .    1    .    2]" 
        50 PHI  1  35 ALA C  1  36 LEU N  1  36 LEU CA 1  36 LEU C   -105.53  -45.53  -55.22  -59.92  -64.22    .  . 0 "[    .    1    .    2]" 
        51 PSI  1  36 LEU N  1  36 LEU CA 1  36 LEU C  1  37 GLY N    -59.94    0.06  -51.62  -59.89  -40.51    .  . 0 "[    .    1    .    2]" 
        52 PHI  1  37 GLY C  1  38 ASP N  1  38 ASP CA 1  38 ASP C   -102.16  -42.16  -83.93  -99.14  -67.08    .  . 0 "[    .    1    .    2]" 
        53 PSI  1  38 ASP N  1  38 ASP CA 1  38 ASP C  1  39 VAL N     88.14  148.14  102.02   92.63  109.34    .  . 0 "[    .    1    .    2]" 
        54 PHI  1  41 TYR C  1  42 CYS N  1  42 CYS CA 1  42 CYS C   -151.78  -91.78 -140.06 -150.73 -123.95    .  . 0 "[    .    1    .    2]" 
        55 PSI  1  42 CYS N  1  42 CYS CA 1  42 CYS C  1  43 SER N     92.83  152.83  112.98  113.85  109.70    .  . 0 "[    .    1    .    2]" 
        56 PHI  1  42 CYS C  1  43 SER N  1  43 SER CA 1  43 SER C   -126.47  -66.47  -89.87  -86.70  -90.86    .  . 0 "[    .    1    .    2]" 
        57 PSI  1  43 SER N  1  43 SER CA 1  43 SER C  1  44 LEU N     96.27  156.27  105.90   96.59  127.58    .  . 0 "[    .    1    .    2]" 
        58 PHI  1  43 SER C  1  44 LEU N  1  44 LEU CA 1  44 LEU C   -143.14  -83.14 -122.66 -119.03 -120.22    .  . 0 "[    .    1    .    2]" 
        59 PSI  1  44 LEU N  1  44 LEU CA 1  44 LEU C  1  45 PRO N     90.26  150.26  145.65  146.74  146.57    .  . 0 "[    .    1    .    2]" 
        60 PHI  1  45 PRO C  1  46 GLU N  1  46 GLU CA 1  46 GLU C   -120.05  -60.05 -100.90 -101.01 -103.25 0.04 17 0 "[    .    1    .    2]" 
        61 PSI  1  46 GLU N  1  46 GLU CA 1  46 GLU C  1  47 VAL N    117.67  177.67  133.36  133.52  131.93    .  . 0 "[    .    1    .    2]" 
        62 PHI  1  46 GLU C  1  47 VAL N  1  47 VAL CA 1  47 VAL C    -91.85  -31.85  -47.49  -74.90  -34.91    .  . 0 "[    .    1    .    2]" 
        63 PSI  1  47 VAL N  1  47 VAL CA 1  47 VAL C  1  48 GLY N    104.60  164.60  138.57  122.29  150.26    .  . 0 "[    .    1    .    2]" 
        64 PHI  1  47 VAL C  1  48 GLY N  1  48 GLY CA 1  48 GLY C     65.45  125.45  103.70  107.87  104.60    .  . 0 "[    .    1    .    2]" 
        65 PSI  1  48 GLY N  1  48 GLY CA 1  48 GLY C  1  49 THR N    -41.40   18.60   -6.39  -33.31   14.12    .  . 0 "[    .    1    .    2]" 
        66 PHI  1  48 GLY C  1  49 THR N  1  49 THR CA 1  49 THR C   -109.13  -49.13  -83.01  -87.67  -91.50    .  . 0 "[    .    1    .    2]" 
        67 PSI  1  49 THR N  1  49 THR CA 1  49 THR C  1  50 LYS N    104.45  164.45  134.58  144.45  142.30    .  . 0 "[    .    1    .    2]" 
        68 PHI  1  49 THR C  1  50 LYS N  1  50 LYS CA 1  50 LYS C   -127.87  -67.87  -86.69  -89.09  -89.73    .  . 0 "[    .    1    .    2]" 
        69 PSI  1  50 LYS N  1  50 LYS CA 1  50 LYS C  1  51 LEU N     91.46  151.46  112.48  101.39   94.98    .  . 0 "[    .    1    .    2]" 
        70 PHI  1  50 LYS C  1  51 LEU N  1  51 LEU CA 1  51 LEU C   -134.36  -74.36 -100.30 -128.18  -76.77    .  . 0 "[    .    1    .    2]" 
        71 PSI  1  51 LEU N  1  51 LEU CA 1  51 LEU C  1  52 LYS N    106.06  166.06  159.45  147.42  165.81    .  . 0 "[    .    1    .    2]" 
        72 PHI  1  51 LEU C  1  52 LYS N  1  52 LYS CA 1  52 LYS C   -125.55  -65.55 -118.73 -125.69 -107.45 0.14 16 0 "[    .    1    .    2]" 
        73 PSI  1  52 LYS N  1  52 LYS CA 1  52 LYS C  1  53 LYS N    120.17 -179.83  163.83  147.08  179.35    .  . 0 "[    .    1    .    2]" 
        74 PHI  1  58 GLY C  1  59 ALA N  1  59 ALA CA 1  59 ALA C   -150.00  -90.00 -144.42 -143.38 -143.54 0.11 14 0 "[    .    1    .    2]" 
        75 PSI  1  59 ALA N  1  59 ALA CA 1  59 ALA C  1  60 LEU N    112.19  172.19  160.19  162.47  160.81    .  . 0 "[    .    1    .    2]" 
        76 PHI  1  59 ALA C  1  60 LEU N  1  60 LEU CA 1  60 LEU C   -158.78  -98.78 -116.04 -119.59 -122.46    .  . 0 "[    .    1    .    2]" 
        77 PSI  1  60 LEU N  1  60 LEU CA 1  60 LEU C  1  61 GLU N    113.94  173.94  149.14  135.23  166.52    .  . 0 "[    .    1    .    2]" 
        78 PHI  1  60 LEU C  1  61 GLU N  1  61 GLU CA 1  61 GLU C   -159.49  -99.49 -139.70 -126.66 -128.52    .  . 0 "[    .    1    .    2]" 
        79 PSI  1  61 GLU N  1  61 GLU CA 1  61 GLU C  1  62 SER N    108.35  168.35  126.57  127.03  124.59    .  . 0 "[    .    1    .    2]" 
        80 PHI  1  61 GLU C  1  62 SER N  1  62 SER CA 1  62 SER C   -152.82  -92.82 -127.18 -145.99 -103.31    .  . 0 "[    .    1    .    2]" 
        81 PSI  1  62 SER N  1  62 SER CA 1  62 SER C  1  63 VAL N    124.49 -175.51  178.23  165.81 -175.49 0.02  5 0 "[    .    1    .    2]" 
        82 PHI  1  65 ALA C  1  66 ALA N  1  66 ALA CA 1  66 ALA C   -156.20  -96.20 -116.51 -141.40 -107.92    .  . 0 "[    .    1    .    2]" 
        83 PSI  1  66 ALA N  1  66 ALA CA 1  66 ALA C  1  67 SER N    107.08  167.08  160.36  149.33  167.09 0.01  5 0 "[    .    1    .    2]" 
        84 PHI  1  66 ALA C  1  67 SER N  1  67 SER CA 1  67 SER C   -176.47 -116.47 -146.47 -149.73 -151.52    .  . 0 "[    .    1    .    2]" 
        85 PSI  1  67 SER N  1  67 SER CA 1  67 SER C  1  68 GLU N    113.70  173.70  145.63  148.57  143.32    .  . 0 "[    .    1    .    2]" 
        86 PHI  1  67 SER C  1  68 GLU N  1  68 GLU CA 1  68 GLU C   -116.25  -56.25  -90.41 -111.80  -66.83    .  . 0 "[    .    1    .    2]" 
        87 PSI  1  68 GLU N  1  68 GLU CA 1  68 GLU C  1  69 LEU N    112.11  172.11  150.91  147.21  145.89    .  . 0 "[    .    1    .    2]" 
        88 PHI  1  68 GLU C  1  69 LEU N  1  69 LEU CA 1  69 LEU C   -140.79  -80.79 -120.80 -113.16 -113.50    .  . 0 "[    .    1    .    2]" 
        89 PSI  1  69 LEU N  1  69 LEU CA 1  69 LEU C  1  70 TYR N    105.46  165.46  135.32  140.00  139.51    .  . 0 "[    .    1    .    2]" 
        90 PHI  1  69 LEU C  1  70 TYR N  1  70 TYR CA 1  70 TYR C   -137.45  -77.45 -127.93 -137.02 -115.39    .  . 0 "[    .    1    .    2]" 
        91 PSI  1  70 TYR N  1  70 TYR CA 1  70 TYR C  1  71 SER N    112.82  172.82  138.54  157.14  150.70    .  . 0 "[    .    1    .    2]" 
        92 PHI  1  70 TYR C  1  71 SER N  1  71 SER CA 1  71 SER C   -119.69  -59.69  -66.53  -90.44  -59.97    .  . 0 "[    .    1    .    2]" 
        93 PSI  1  71 SER N  1  71 SER CA 1  71 SER C  1  72 PRO N     98.16  158.16  140.04  142.27  142.23    .  . 0 "[    .    1    .    2]" 
        94 PHI  1  75 GLY C  1  76 GLU N  1  76 GLU CA 1  76 GLU C   -149.89  -89.89 -125.58 -140.26 -110.86    .  . 0 "[    .    1    .    2]" 
        95 PSI  1  76 GLU N  1  76 GLU CA 1  76 GLU C  1  77 VAL N    104.64  164.64  123.24  129.80  126.72    .  . 0 "[    .    1    .    2]" 
        96 PHI  1  76 GLU C  1  77 VAL N  1  77 VAL CA 1  77 VAL C   -108.81  -48.81  -58.76  -71.30  -49.56    .  . 0 "[    .    1    .    2]" 
        97 PSI  1  77 VAL N  1  77 VAL CA 1  77 VAL C  1  78 THR N    103.11  163.11  119.02  105.52  128.99    .  . 0 "[    .    1    .    2]" 
        98 PHI  1  78 THR C  1  79 GLU N  1  79 GLU CA 1  79 GLU C   -177.70 -117.70 -163.79 -174.36 -148.34    .  . 0 "[    .    1    .    2]" 
        99 PSI  1  79 GLU N  1  79 GLU CA 1  79 GLU C  1  80 VAL N    121.56 -178.44  156.86  148.79  168.93    .  . 0 "[    .    1    .    2]" 
       100 PHI  1  79 GLU C  1  80 VAL N  1  80 VAL CA 1  80 VAL C   -147.97  -87.97 -128.29 -133.50 -137.40    .  . 0 "[    .    1    .    2]" 
       101 PSI  1  80 VAL N  1  80 VAL CA 1  80 VAL C  1  81 ASN N    113.75  173.75  152.40  158.22  155.30    .  . 0 "[    .    1    .    2]" 
       102 PHI  1  81 ASN C  1  82 GLU N  1  82 GLU CA 1  82 GLU C    -93.14  -33.14  -91.37  -93.29  -86.25 0.15 18 0 "[    .    1    .    2]" 
       103 PSI  1  82 GLU N  1  82 GLU CA 1  82 GLU C  1  83 ALA N    -64.28   -4.28  -28.76  -38.54  -14.50    .  . 0 "[    .    1    .    2]" 
       104 PHI  1  85 ALA C  1  86 GLU N  1  86 GLU CA 1  86 GLU C   -118.04  -58.04 -105.71 -118.01  -89.82    .  . 0 "[    .    1    .    2]" 
       105 PSI  1  86 GLU N  1  86 GLU CA 1  86 GLU C  1  87 ASN N    -45.16   14.84  -43.26  -43.25  -43.59 0.00 14 0 "[    .    1    .    2]" 
       106 PHI  1  89 GLY C  1  90 LEU N  1  90 LEU CA 1  90 LEU C    -98.31  -38.31  -50.95  -74.13  -40.62    .  . 0 "[    .    1    .    2]" 
       107 PSI  1  90 LEU N  1  90 LEU CA 1  90 LEU C  1  91 VAL N    -70.55  -10.55  -40.88  -22.44  -30.32    .  . 0 "[    .    1    .    2]" 
       108 PHI  1  90 LEU C  1  91 VAL N  1  91 VAL CA 1  91 VAL C    -89.21  -29.21  -41.03  -64.83  -32.60    .  . 0 "[    .    1    .    2]" 
       109 PSI  1  91 VAL N  1  91 VAL CA 1  91 VAL C  1  92 ASN N    -78.45  -18.45  -28.63  -28.41  -30.27 0.13  6 0 "[    .    1    .    2]" 
       110 PHI  1  91 VAL C  1  92 ASN N  1  92 ASN CA 1  92 ASN C    -90.59  -30.59  -73.05  -86.76  -58.52    .  . 0 "[    .    1    .    2]" 
       111 PSI  1  92 ASN N  1  92 ASN CA 1  92 ASN C  1  93 LYS N    -72.92  -12.92  -65.94  -60.70  -65.09 0.08  3 0 "[    .    1    .    2]" 
       112 PHI  1  92 ASN C  1  93 LYS N  1  93 LYS CA 1  93 LYS C   -113.55  -53.55  -60.60  -79.87  -53.49 0.06 11 0 "[    .    1    .    2]" 
       113 PSI  1  93 LYS N  1  93 LYS CA 1  93 LYS C  1  94 SER N    -45.45   14.55  -45.29  -45.81  -43.58 0.36 11 0 "[    .    1    .    2]" 
       114 PHI  1  93 LYS C  1  94 SER N  1  94 SER CA 1  94 SER C   -125.19  -65.19 -119.00 -120.55 -121.73 0.17 12 0 "[    .    1    .    2]" 
       115 PSI  1  94 SER N  1  94 SER CA 1  94 SER C  1  95 CYS N     84.01  144.01  113.07   89.83  123.75    .  . 0 "[    .    1    .    2]" 
       116 PHI  1  94 SER C  1  95 CYS N  1  95 CYS CA 1  95 CYS C    -88.73  -28.73  -87.92  -86.38  -87.78 0.55 16 0 "[    .    1    .    2]" 
       117 PSI  1  95 CYS N  1  95 CYS CA 1  95 CYS C  1  96 TYR N    -58.61    1.39  -39.80  -49.88  -54.38    .  . 0 "[    .    1    .    2]" 
       118 PHI  1 101 LEU C  1 102 ILE N  1 102 ILE CA 1 102 ILE C   -167.60 -107.60 -151.74 -148.74 -149.76    .  . 0 "[    .    1    .    2]" 
       119 PSI  1 102 ILE N  1 102 ILE CA 1 102 ILE C  1 103 LYS N    124.78 -175.22  174.97  176.40  174.14    .  . 0 "[    .    1    .    2]" 
       120 PHI  1 102 ILE C  1 103 LYS N  1 103 LYS CA 1 103 LYS C   -152.79  -92.79 -130.48 -142.41 -117.23    .  . 0 "[    .    1    .    2]" 
       121 PSI  1 103 LYS N  1 103 LYS CA 1 103 LYS C  1 104 MET N    109.17  169.17  134.48  129.16  128.03    .  . 0 "[    .    1    .    2]" 
       122 PHI  1 103 LYS C  1 104 MET N  1 104 MET CA 1 104 MET C   -170.98 -110.98 -145.85 -170.90 -135.19    .  . 0 "[    .    1    .    2]" 
       123 PSI  1 104 MET N  1 104 MET CA 1 104 MET C  1 105 THR N    109.53  169.53  167.54  160.36  169.58 0.05 11 0 "[    .    1    .    2]" 
       124 PHI  1 104 MET C  1 105 THR N  1 105 THR CA 1 105 THR C   -143.60  -83.60  -87.18  -92.00  -83.54 0.06 18 0 "[    .    1    .    2]" 
       125 PSI  1 105 THR N  1 105 THR CA 1 105 THR C  1 106 LEU N    116.52  176.52  155.92  133.03  173.15    .  . 0 "[    .    1    .    2]" 
       126 PHI  1 109 PRO C  1 110 SER N  1 110 SER CA 1 110 SER C    -94.57  -34.57  -63.08  -65.67  -69.34    .  . 0 "[    .    1    .    2]" 
       127 PSI  1 110 SER N  1 110 SER CA 1 110 SER C  1 111 GLU N    -69.15   -9.15  -30.34  -39.25  -13.52    .  . 0 "[    .    1    .    2]" 
       128 PHI  1 110 SER C  1 111 GLU N  1 111 GLU CA 1 111 GLU C    -95.05  -35.05  -65.57  -68.14  -71.72    .  . 0 "[    .    1    .    2]" 
       129 PSI  1 111 GLU N  1 111 GLU CA 1 111 GLU C  1 112 LEU N    -73.39  -13.39  -29.76  -30.12  -30.68    .  . 0 "[    .    1    .    2]" 
       130 PHI  1 111 GLU C  1 112 LEU N  1 112 LEU CA 1 112 LEU C    -95.54  -35.54  -49.61  -66.23  -35.66    .  . 0 "[    .    1    .    2]" 
       131 PSI  1 112 LEU N  1 112 LEU CA 1 112 LEU C  1 113 ASP N    -68.08   -8.08  -31.63  -17.41  -22.05    .  . 0 "[    .    1    .    2]" 
       132 PHI  1 112 LEU C  1 113 ASP N  1 113 ASP CA 1 113 ASP C    -97.08  -37.08  -54.85  -76.58  -37.10    .  . 0 "[    .    1    .    2]" 
       133 PSI  1 113 ASP N  1 113 ASP CA 1 113 ASP C  1 114 GLU N    -57.78    2.22  -40.35  -20.43  -28.26    .  . 0 "[    .    1    .    2]" 
       134 PHI  1 113 ASP C  1 114 GLU N  1 114 GLU CA 1 114 GLU C   -110.16  -50.16  -73.03 -107.83  -51.19    .  . 0 "[    .    1    .    2]" 
       135 PSI  1 114 GLU N  1 114 GLU CA 1 114 GLU C  1 115 LEU N    -56.10    3.90  -35.71  -51.58  -12.74    .  . 0 "[    .    1    .    2]" 
       136 PHI  1 116 MET C  1 117 SER N  1 117 SER CA 1 117 SER C   -115.31  -55.31  -87.84  -83.02  -83.63    .  . 0 "[    .    1    .    2]" 
       137 PSI  1 117 SER N  1 117 SER CA 1 117 SER C  1 118 GLU N    136.47 -163.53  174.14  171.07  166.06    .  . 0 "[    .    1    .    2]" 
       138 PHI  1 117 SER C  1 118 GLU N  1 118 GLU CA 1 118 GLU C    -88.31  -28.31  -53.54  -75.42  -35.00    .  . 0 "[    .    1    .    2]" 
       139 PSI  1 118 GLU N  1 118 GLU CA 1 118 GLU C  1 119 GLU N    -67.68   -7.68  -39.34  -40.20  -42.14    .  . 0 "[    .    1    .    2]" 
       140 PHI  1 118 GLU C  1 119 GLU N  1 119 GLU CA 1 119 GLU C    -93.49  -33.49  -74.17  -90.82  -56.89    .  . 0 "[    .    1    .    2]" 
       141 PSI  1 119 GLU N  1 119 GLU CA 1 119 GLU C  1 120 ALA N    -73.23  -13.23  -51.88  -48.53  -52.43    .  . 0 "[    .    1    .    2]" 
       142 PHI  1 119 GLU C  1 120 ALA N  1 120 ALA CA 1 120 ALA C   -100.06  -40.06  -57.06  -51.36  -53.37    .  . 0 "[    .    1    .    2]" 
       143 PSI  1 120 ALA N  1 120 ALA CA 1 120 ALA C  1 121 TYR N    -65.40   -5.40  -39.07  -35.52  -40.15    .  . 0 "[    .    1    .    2]" 
       144 PHI  1 120 ALA C  1 121 TYR N  1 121 TYR CA 1 121 TYR C    -94.99  -34.99  -47.24  -74.95  -35.00    .  . 0 "[    .    1    .    2]" 
       145 PSI  1 121 TYR N  1 121 TYR CA 1 121 TYR C  1 122 GLU N    -72.11  -12.11  -50.17  -62.17  -29.07    .  . 0 "[    .    1    .    2]" 
       146 PHI  1 121 TYR C  1 122 GLU N  1 122 GLU CA 1 122 GLU C    -92.83  -32.83  -55.02  -62.25  -67.93    .  . 0 "[    .    1    .    2]" 
       147 PSI  1 122 GLU N  1 122 GLU CA 1 122 GLU C  1 123 LYS N    -74.41  -14.41  -51.24  -68.24  -39.11    .  . 0 "[    .    1    .    2]" 
       148 PHI  1 122 GLU C  1 123 LYS N  1 123 LYS CA 1 123 LYS C    -91.52  -31.52  -56.57  -61.68  -66.17    .  . 0 "[    .    1    .    2]" 
       149 PSI  1 123 LYS N  1 123 LYS CA 1 123 LYS C  1 124 TYR N    -72.33  -12.33  -36.44  -58.57  -16.12    .  . 0 "[    .    1    .    2]" 
       150 PHI  1 123 LYS C  1 124 TYR N  1 124 TYR CA 1 124 TYR C    -98.26  -38.26  -68.54  -75.32  -82.62    .  . 0 "[    .    1    .    2]" 
       151 PSI  1 124 TYR N  1 124 TYR CA 1 124 TYR C  1 125 VAL N    -74.37  -14.37  -38.95  -51.75  -18.65    .  . 0 "[    .    1    .    2]" 
       152 PHI  1 124 TYR C  1 125 VAL N  1 125 VAL CA 1 125 VAL C    -93.14  -33.14  -71.16  -70.59  -78.72    .  . 0 "[    .    1    .    2]" 
       153 PSI  1 125 VAL N  1 125 VAL CA 1 125 VAL C  1 126 LYS N    -74.46  -14.46  -46.91  -66.99  -22.22    .  . 0 "[    .    1    .    2]" 
       154 PHI  1 125 VAL C  1 126 LYS N  1 126 LYS CA 1 126 LYS C    -90.79  -30.79  -50.81  -64.53  -79.45    .  . 0 "[    .    1    .    2]" 
       155 PSI  1 126 LYS N  1 126 LYS CA 1 126 LYS C  1 127 SER N    -64.05   -4.05  -37.26  -36.06  -36.50    .  . 0 "[    .    1    .    2]" 
       156 PHI  1 126 LYS C  1 127 SER N  1 127 SER CA 1 127 SER C   -105.01  -45.01  -61.70  -59.90  -61.99    .  . 0 "[    .    1    .    2]" 
       157 PSI  1 127 SER N  1 127 SER CA 1 127 SER C  1 128 ILE N    -64.78   -4.78  -37.08  -54.89  -15.86    .  . 0 "[    .    1    .    2]" 
    stop_

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