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
465092 2kw4 16807 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2kw4


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              158
    _TA_constraint_stats_list.Viol_count                    998
    _TA_constraint_stats_list.Viol_total                    16351.03
    _TA_constraint_stats_list.Viol_max                      5.90
    _TA_constraint_stats_list.Viol_rms                      0.62
    _TA_constraint_stats_list.Viol_average_all_restraints   0.26
    _TA_constraint_stats_list.Viol_average_violations_only  0.82
    _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   7 TYR C 1   8 ASP N  1   8 ASP CA 1   8 ASP C -148.80  -44.20  -70.36  -50.63  -50.83 4.76  6 0 "[    .    1    .    2]" 
         2 PSI 1   8 ASP N 1   8 ASP CA 1   8 ASP C  1   9 VAL N  114.60  165.00  155.25  134.20  165.12 0.12  7 0 "[    .    1    .    2]" 
         3 PHI 1   8 ASP C 1   9 VAL N  1   9 VAL CA 1   9 VAL C -129.40  -91.70  -93.91 -111.43  -89.74 1.96 20 0 "[    .    1    .    2]" 
         4 PSI 1   9 VAL N 1   9 VAL CA 1   9 VAL C  1  10 TYR N   88.00  169.60  143.46  139.37  147.68    .  . 0 "[    .    1    .    2]" 
         5 PHI 1   9 VAL C 1  10 TYR N  1  10 TYR CA 1  10 TYR C -159.30  -65.70  -70.51  -72.62  -68.39    .  . 0 "[    .    1    .    2]" 
         6 PSI 1  10 TYR N 1  10 TYR CA 1  10 TYR C  1  11 THR N   79.40 -158.80   79.38   78.07   85.22 1.33  2 0 "[    .    1    .    2]" 
         7 PHI 1  10 TYR C 1  11 THR N  1  11 THR CA 1  11 THR C -155.30 -109.40 -125.46 -131.46 -135.42 1.58 17 0 "[    .    1    .    2]" 
         8 PSI 1  11 THR N 1  11 THR CA 1  11 THR C  1  12 ASP N  144.40  177.80  173.51  172.95  164.91 2.08 17 0 "[    .    1    .    2]" 
         9 PHI 1  15 TYR C 1  16 VAL N  1  16 VAL CA 1  16 VAL C -141.70  -78.50 -140.13 -143.41 -129.08 1.71 19 0 "[    .    1    .    2]" 
        10 PSI 1  16 VAL N 1  16 VAL CA 1  16 VAL C  1  17 ASN N   97.50  150.80  117.61  109.12  131.01    .  . 0 "[    .    1    .    2]" 
        11 PHI 1  18 GLY C 1  19 GLN N  1  19 GLN CA 1  19 GLN C -149.80  -82.20 -108.47  -83.19  -90.78    .  . 0 "[    .    1    .    2]" 
        12 PSI 1  19 GLN N 1  19 GLN CA 1  19 GLN C  1  20 TYR N  128.40 -175.80 -177.77  174.74 -175.59 0.21  5 0 "[    .    1    .    2]" 
        13 PHI 1  19 GLN C 1  20 TYR N  1  20 TYR CA 1  20 TYR C -152.50  -96.60 -123.28 -116.59 -125.67    .  . 0 "[    .    1    .    2]" 
        14 PSI 1  20 TYR N 1  20 TYR CA 1  20 TYR C  1  21 ALA N  134.70  169.00  136.50  168.06  136.56 0.45 16 0 "[    .    1    .    2]" 
        15 PHI 1  20 TYR C 1  21 ALA N  1  21 ALA CA 1  21 ALA C -152.50 -107.50 -136.22 -147.54 -121.01    .  . 0 "[    .    1    .    2]" 
        16 PSI 1  21 ALA N 1  21 ALA CA 1  21 ALA C  1  22 TRP N  113.30  173.00  164.03  161.32  159.48 0.17 19 0 "[    .    1    .    2]" 
        17 PHI 1  21 ALA C 1  22 TRP N  1  22 TRP CA 1  22 TRP C -173.10  -96.60 -137.20 -155.70 -110.21    .  . 0 "[    .    1    .    2]" 
        18 PSI 1  22 TRP N 1  22 TRP CA 1  22 TRP C  1  23 ALA N  130.70  176.80  131.79  130.11  154.28 0.59 10 0 "[    .    1    .    2]" 
        19 PHI 1  22 TRP C 1  23 ALA N  1  23 ALA CA 1  23 ALA C  179.60 -117.20 -136.27 -129.75 -131.64    .  . 0 "[    .    1    .    2]" 
        20 PSI 1  23 ALA N 1  23 ALA CA 1  23 ALA C  1  24 TYR N  132.70 -177.60  162.02  168.14  166.22 0.02  7 0 "[    .    1    .    2]" 
        21 PHI 1  23 ALA C 1  24 TYR N  1  24 TYR CA 1  24 TYR C -161.70 -115.90 -155.89 -160.05 -161.08 1.35 19 0 "[    .    1    .    2]" 
        22 PSI 1  24 TYR N 1  24 TYR CA 1  24 TYR C  1  25 ALA N  138.50  178.20  161.36  167.63  165.21 0.31 10 0 "[    .    1    .    2]" 
        23 PHI 1  24 TYR C 1  25 ALA N  1  25 ALA CA 1  25 ALA C -178.70  -67.40 -104.73 -117.21  -87.31    .  . 0 "[    .    1    .    2]" 
        24 PSI 1  25 ALA N 1  25 ALA CA 1  25 ALA C  1  26 PHE N  107.50  146.00  123.14  107.06  146.92 0.92  9 0 "[    .    1    .    2]" 
        25 PHI 1  25 ALA C 1  26 PHE N  1  26 PHE CA 1  26 PHE C -152.80  -88.80 -109.74 -140.41  -91.14    .  . 0 "[    .    1    .    2]" 
        26 PSI 1  26 PHE N 1  26 PHE CA 1  26 PHE C  1  27 VAL N  113.80  139.90  137.40  113.65  140.76 0.86 10 0 "[    .    1    .    2]" 
        27 PHI 1  26 PHE C 1  27 VAL N  1  27 VAL CA 1  27 VAL C -154.40  -94.90 -144.98 -152.46 -126.89    .  . 0 "[    .    1    .    2]" 
        28 PSI 1  27 VAL N 1  27 VAL CA 1  27 VAL C  1  28 LYS N  110.00  146.80  128.20  129.68  129.41 1.41 16 0 "[    .    1    .    2]" 
        29 PHI 1  27 VAL C 1  28 LYS N  1  28 LYS CA 1  28 LYS C -174.00 -102.60 -125.33 -139.39 -110.74    .  . 0 "[    .    1    .    2]" 
        30 PSI 1  28 LYS N 1  28 LYS CA 1  28 LYS C  1  29 ASP N  112.20  141.30  135.82  137.37  136.02 1.47  7 0 "[    .    1    .    2]" 
        31 PHI 1  30 GLY C 1  31 LYS N  1  31 LYS CA 1  31 LYS C -149.20  -75.30 -147.06 -149.94 -132.96 0.74 16 0 "[    .    1    .    2]" 
        32 PSI 1  31 LYS N 1  31 LYS CA 1  31 LYS C  1  32 VAL N  118.60 -178.80  162.32  155.08 -179.09    .  . 0 "[    .    1    .    2]" 
        33 PHI 1  31 LYS C 1  32 VAL N  1  32 VAL CA 1  32 VAL C -108.80  -55.40  -60.80  -55.95  -58.24 1.34 10 0 "[    .    1    .    2]" 
        34 PSI 1  32 VAL N 1  32 VAL CA 1  32 VAL C  1  33 HIS N   99.90  136.50  120.84  123.12  122.54 0.13 17 0 "[    .    1    .    2]" 
        35 PHI 1  32 VAL C 1  33 HIS N  1  33 HIS CA 1  33 HIS C -107.40  -69.00 -103.24 -106.75 -107.53 0.45 15 0 "[    .    1    .    2]" 
        36 PSI 1  33 HIS N 1  33 HIS CA 1  33 HIS C  1  34 TYR N  -59.30  -27.20  -50.19  -45.06  -45.96 0.18 15 0 "[    .    1    .    2]" 
        37 PHI 1  33 HIS C 1  34 TYR N  1  34 TYR CA 1  34 TYR C  170.10 -130.40 -135.78 -177.95 -130.04 0.36  6 0 "[    .    1    .    2]" 
        38 PSI 1  34 TYR N 1  34 TYR CA 1  34 TYR C  1  35 GLU N  130.00 -173.90  168.23  134.46 -173.90 0.00  9 0 "[    .    1    .    2]" 
        39 PHI 1  37 ALA C 1  38 ASP N  1  38 ASP CA 1  38 ASP C -161.30  -57.00 -152.17 -155.10 -156.63    .  . 0 "[    .    1    .    2]" 
        40 PSI 1  38 ASP N 1  38 ASP CA 1  38 ASP C  1  39 VAL N  130.90 -172.10  153.05  168.34  161.73 0.11 17 0 "[    .    1    .    2]" 
        41 PHI 1  38 ASP C 1  39 VAL N  1  39 VAL CA 1  39 VAL C -163.50  -81.50 -112.45 -125.07 -101.77    .  . 0 "[    .    1    .    2]" 
        42 PSI 1  39 VAL N 1  39 VAL CA 1  39 VAL C  1  40 GLY N  151.70  174.30  160.52  156.92  155.67 0.73 14 0 "[    .    1    .    2]" 
        43 PHI 1  50 ASN C 1  51 VAL N  1  51 VAL CA 1  51 VAL C  -72.40  -52.40  -70.61  -76.12  -49.85 3.72 20 0 "[    .    1    .    2]" 
        44 PSI 1  51 VAL N 1  51 VAL CA 1  51 VAL C  1  52 ALA N  -50.90  -30.90  -41.76  -40.58  -42.38 0.46 18 0 "[    .    1    .    2]" 
        45 PHI 1  51 VAL C 1  52 ALA N  1  52 ALA CA 1  52 ALA C  -75.50  -48.10  -69.70  -77.27  -51.29 1.77 14 0 "[    .    1    .    2]" 
        46 PSI 1  52 ALA N 1  52 ALA CA 1  52 ALA C  1  53 GLY N  -59.30  -20.40  -36.12  -58.66  -20.13 0.27 19 0 "[    .    1    .    2]" 
        47 PHI 1  52 ALA C 1  53 GLY N  1  53 GLY CA 1  53 GLY C  -75.30  -55.30  -65.64  -66.14  -69.92 0.46 20 0 "[    .    1    .    2]" 
        48 PSI 1  53 GLY N 1  53 GLY CA 1  53 GLY C  1  54 GLU N  -51.40  -20.80  -37.44  -26.26  -33.57 0.41 16 0 "[    .    1    .    2]" 
        49 PHI 1  53 GLY C 1  54 GLU N  1  54 GLU CA 1  54 GLU C  -73.10  -53.10  -60.81  -73.46  -52.28 0.82 13 0 "[    .    1    .    2]" 
        50 PSI 1  54 GLU N 1  54 GLU CA 1  54 GLU C  1  55 ILE N  -53.90  -29.80  -50.60  -55.65  -36.46 1.75  4 0 "[    .    1    .    2]" 
        51 PHI 1  54 GLU C 1  55 ILE N  1  55 ILE CA 1  55 ILE C  -74.00  -53.70  -71.28  -76.45  -65.23 2.45  8 0 "[    .    1    .    2]" 
        52 PSI 1  55 ILE N 1  55 ILE CA 1  55 ILE C  1  56 ALA N  -53.80  -33.10  -31.37  -32.46  -30.19 2.91  1 0 "[    .    1    .    2]" 
        53 PHI 1  55 ILE C 1  56 ALA N  1  56 ALA CA 1  56 ALA C  -71.40  -46.70  -48.33  -59.42  -46.19 0.51  1 0 "[    .    1    .    2]" 
        54 PSI 1  56 ALA N 1  56 ALA CA 1  56 ALA C  1  57 ALA N  -54.90  -31.90  -39.35  -38.02  -42.29 0.41  8 0 "[    .    1    .    2]" 
        55 PHI 1  56 ALA C 1  57 ALA N  1  57 ALA CA 1  57 ALA C  -74.40  -49.70  -54.90  -65.64  -49.78    .  . 0 "[    .    1    .    2]" 
        56 PSI 1  57 ALA N 1  57 ALA CA 1  57 ALA C  1  58 ALA N  -57.50  -30.30  -51.28  -48.56  -49.37 0.33  4 0 "[    .    1    .    2]" 
        57 PHI 1  57 ALA C 1  58 ALA N  1  58 ALA CA 1  58 ALA C  -75.60  -53.00  -52.56  -54.48  -51.64 1.36 10 0 "[    .    1    .    2]" 
        58 PSI 1  58 ALA N 1  58 ALA CA 1  58 ALA C  1  59 LEU N  -53.70  -28.70  -35.01  -29.36  -29.61    .  . 0 "[    .    1    .    2]" 
        59 PHI 1  58 ALA C 1  59 LEU N  1  59 LEU CA 1  59 LEU C  -82.30  -52.50  -61.68  -62.81  -65.24 0.19 13 0 "[    .    1    .    2]" 
        60 PSI 1  59 LEU N 1  59 LEU CA 1  59 LEU C  1  60 TYR N  -66.60  -22.60  -66.89  -67.39  -67.57 1.16  1 0 "[    .    1    .    2]" 
        61 PHI 1  59 LEU C 1  60 TYR N  1  60 TYR CA 1  60 TYR C  -81.60  -46.80  -59.85  -66.07  -53.64    .  . 0 "[    .    1    .    2]" 
        62 PSI 1  60 TYR N 1  60 TYR CA 1  60 TYR C  1  61 ALA N  -51.60  -21.80  -28.24  -36.18  -21.26 0.54  3 0 "[    .    1    .    2]" 
        63 PHI 1  60 TYR C 1  61 ALA N  1  61 ALA CA 1  61 ALA C  -82.50  -41.50  -62.57  -64.11  -64.32    .  . 0 "[    .    1    .    2]" 
        64 PSI 1  61 ALA N 1  61 ALA CA 1  61 ALA C  1  62 VAL N  -63.40  -25.00  -40.89  -47.58  -38.06    .  . 0 "[    .    1    .    2]" 
        65 PHI 1  61 ALA C 1  62 VAL N  1  62 VAL CA 1  62 VAL C  -75.80  -55.80  -76.08  -76.26  -76.27 1.28 15 0 "[    .    1    .    2]" 
        66 PSI 1  62 VAL N 1  62 VAL CA 1  62 VAL C  1  63 LYS N  -50.00  -30.00  -44.27  -48.30  -36.77    .  . 0 "[    .    1    .    2]" 
        67 PHI 1  62 VAL C 1  63 LYS N  1  63 LYS CA 1  63 LYS C  -72.20  -52.20  -52.15  -51.61  -51.62 1.14  8 0 "[    .    1    .    2]" 
        68 PSI 1  63 LYS N 1  63 LYS CA 1  63 LYS C  1  64 LYS N  -56.60  -28.40  -47.95  -44.59  -45.37    .  . 0 "[    .    1    .    2]" 
        69 PHI 1  63 LYS C 1  64 LYS N  1  64 LYS CA 1  64 LYS C  -76.20  -56.20  -75.64  -75.24  -75.94 1.33 16 0 "[    .    1    .    2]" 
        70 PSI 1  64 LYS N 1  64 LYS CA 1  64 LYS C  1  65 ALA N  -54.90  -28.10  -30.58  -32.57  -27.93 0.17 15 0 "[    .    1    .    2]" 
        71 PHI 1  64 LYS C 1  65 ALA N  1  65 ALA CA 1  65 ALA C  -71.50  -49.40  -51.96  -51.19  -51.58    .  . 0 "[    .    1    .    2]" 
        72 PSI 1  65 ALA N 1  65 ALA CA 1  65 ALA C  1  66 SER N  -56.60  -24.10  -33.95  -41.83  -31.32    .  . 0 "[    .    1    .    2]" 
        73 PHI 1  65 ALA C 1  66 SER N  1  66 SER CA 1  66 SER C  -75.80  -55.70  -73.82  -71.15  -72.53 0.50  6 0 "[    .    1    .    2]" 
        74 PSI 1  66 SER N 1  66 SER CA 1  66 SER C  1  67 GLN N  -48.80  -28.80  -29.32  -33.82  -28.00 0.80 14 0 "[    .    1    .    2]" 
        75 PHI 1  66 SER C 1  67 GLN N  1  67 GLN CA 1  67 GLN C  -82.50  -49.10  -70.96  -75.88  -62.41    .  . 0 "[    .    1    .    2]" 
        76 PSI 1  67 GLN N 1  67 GLN CA 1  67 GLN C  1  68 LEU N  -54.40  -20.80  -40.82  -40.62  -41.01    .  . 0 "[    .    1    .    2]" 
        77 PHI 1  71 LYS C 1  72 ILE N  1  72 ILE CA 1  72 ILE C -171.40 -100.50 -122.79 -145.07  -99.57 0.93  6 0 "[    .    1    .    2]" 
        78 PSI 1  72 ILE N 1  72 ILE CA 1  72 ILE C  1  73 ARG N  121.20  178.70  171.22  179.48  179.24 2.92 18 0 "[    .    1    .    2]" 
        79 PHI 1  72 ILE C 1  73 ARG N  1  73 ARG CA 1  73 ARG C -171.50  -56.30  -63.76 -133.68  -52.50 3.80 19 0 "[    .    1    .    2]" 
        80 PSI 1  73 ARG N 1  73 ARG CA 1  73 ARG C  1  74 ILE N   84.90  172.00  129.85  136.05  128.27 0.18 17 0 "[    .    1    .    2]" 
        81 PHI 1  80 GLY C 1  81 ILE N  1  81 ILE CA 1  81 ILE C  -79.90  -46.20  -66.79  -80.78  -50.56 0.88 17 0 "[    .    1    .    2]" 
        82 PSI 1  81 ILE N 1  81 ILE CA 1  81 ILE C  1  82 ALA N  -45.90  -20.90  -38.17  -46.44  -20.44 0.54  9 0 "[    .    1    .    2]" 
        83 PHI 1  81 ILE C 1  82 ALA N  1  82 ALA CA 1  82 ALA C  -82.80  -49.90  -72.36  -71.86  -73.11    .  . 0 "[    .    1    .    2]" 
        84 PSI 1  82 ALA N 1  82 ALA CA 1  82 ALA C  1  83 PHE N  -35.70   -6.10  -17.86  -37.03   -5.44 1.33 20 0 "[    .    1    .    2]" 
        85 PHI 1  82 ALA C 1  83 PHE N  1  83 PHE CA 1  83 PHE C -143.00  -33.40  -70.13  -63.80  -67.31    .  . 0 "[    .    1    .    2]" 
        86 PSI 1  83 PHE N 1  83 PHE CA 1  83 PHE C  1  84 TRP N  -55.10   13.50  -52.06  -57.12  -57.51 4.17 11 0 "[    .    1    .    2]" 
        87 PHI 1  83 PHE C 1  84 TRP N  1  84 TRP CA 1  84 TRP C  -80.60  -53.00  -80.39  -81.95  -82.45 4.37 11 0 "[    .    1    .    2]" 
        88 PSI 1  84 TRP N 1  84 TRP CA 1  84 TRP C  1  85 ALA N  -62.30   -6.70  -21.59  -39.11  -10.81    .  . 0 "[    .    1    .    2]" 
        89 PHI 1  84 TRP C 1  85 ALA N  1  85 ALA CA 1  85 ALA C  -80.40  -48.60  -56.19  -54.42  -58.03 1.51  4 0 "[    .    1    .    2]" 
        90 PSI 1  85 ALA N 1  85 ALA CA 1  85 ALA C  1  86 THR N  -54.60   -4.90  -24.56  -36.92  -10.94    .  . 0 "[    .    1    .    2]" 
        91 PHI 1  85 ALA C 1  86 THR N  1  86 THR CA 1  86 THR C -113.90  -65.20  -66.38  -64.56  -64.71 2.43 16 0 "[    .    1    .    2]" 
        92 PSI 1  86 THR N 1  86 THR CA 1  86 THR C  1  87 GLY N  -41.00   12.70  -28.34  -42.49   12.95 1.49 10 0 "[    .    1    .    2]" 
        93 PHI 1  87 GLY C 1  88 GLU N  1  88 GLU CA 1  88 GLU C  -99.80  -34.00  -84.97  -73.19  -99.83 0.69 16 0 "[    .    1    .    2]" 
        94 PSI 1  88 GLU N 1  88 GLU CA 1  88 GLU C  1  89 TRP N  -62.40  -19.80  -46.59  -27.72  -29.25 1.59 19 0 "[    .    1    .    2]" 
        95 PHI 1  88 GLU C 1  89 TRP N  1  89 TRP CA 1  89 TRP C -175.00  -76.80 -110.34 -128.51 -149.86 0.48 19 0 "[    .    1    .    2]" 
        96 PSI 1  89 TRP N 1  89 TRP CA 1  89 TRP C  1  90 LYS N  119.00  158.30  147.06  158.91  158.79 1.84 14 0 "[    .    1    .    2]" 
        97 PHI 1  89 TRP C 1  90 LYS N  1  90 LYS CA 1  90 LYS C -117.90  -48.60  -66.65  -50.03  -50.50 0.02  7 0 "[    .    1    .    2]" 
        98 PSI 1  90 LYS N 1  90 LYS CA 1  90 LYS C  1  91 ALA N   89.50  154.30  107.38   86.33  154.71 3.17 10 0 "[    .    1    .    2]" 
        99 PHI 1  90 LYS C 1  91 ALA N  1  91 ALA CA 1  91 ALA C  -76.60  -47.90  -74.63  -50.65  -61.30 4.41 14 0 "[    .    1    .    2]" 
       100 PSI 1  91 ALA N 1  91 ALA CA 1  91 ALA C  1  92 LYS N  -48.80   -1.40  -24.57  -30.23  -35.58 3.05 14 0 "[    .    1    .    2]" 
       101 PHI 1  91 ALA C 1  92 LYS N  1  92 LYS CA 1  92 LYS C  -90.60  -46.00  -68.17  -50.89  -57.38 1.29 14 0 "[    .    1    .    2]" 
       102 PSI 1  92 LYS N 1  92 LYS CA 1  92 LYS C  1  93 ASN N  -54.30    1.70  -32.80  -37.97  -42.46 0.63  6 0 "[    .    1    .    2]" 
       103 PHI 1  95 PHE C 1  96 THR N  1  96 THR CA 1  96 THR C  -75.10  -53.80  -57.13  -76.18  -50.82 2.98 16 0 "[    .    1    .    2]" 
       104 PSI 1  96 THR N 1  96 THR CA 1  96 THR C  1  97 GLN N  -48.10  -28.10  -33.83  -25.93  -26.49 3.64  7 0 "[    .    1    .    2]" 
       105 PHI 1  96 THR C 1  97 GLN N  1  97 GLN CA 1  97 GLN C  -76.60  -50.10  -51.30  -65.00  -47.32 2.78  7 0 "[    .    1    .    2]" 
       106 PSI 1  97 GLN N 1  97 GLN CA 1  97 GLN C  1  98 ALA N  -59.60  -24.20  -44.82  -52.46  -39.68    .  . 0 "[    .    1    .    2]" 
       107 PHI 1  97 GLN C 1  98 ALA N  1  98 ALA CA 1  98 ALA C -100.10  -42.40  -51.19  -61.70  -43.74    .  . 0 "[    .    1    .    2]" 
       108 PSI 1  98 ALA N 1  98 ALA CA 1  98 ALA C  1  99 TYR N  -73.50   -0.60  -37.73  -46.32  -31.05    .  . 0 "[    .    1    .    2]" 
       109 PHI 1  98 ALA C 1  99 TYR N  1  99 TYR CA 1  99 TYR C  -74.40  -54.40  -53.55  -53.11  -53.39 2.13 20 0 "[    .    1    .    2]" 
       110 PSI 1  99 TYR N 1  99 TYR CA 1  99 TYR C  1 100 ALA N  -54.00  -30.00  -48.27  -44.68  -48.57 1.51 20 0 "[    .    1    .    2]" 
       111 PHI 1  99 TYR C 1 100 ALA N  1 100 ALA CA 1 100 ALA C  -71.50  -51.50  -60.66  -72.33  -51.43 0.83  2 0 "[    .    1    .    2]" 
       112 PSI 1 100 ALA N 1 100 ALA CA 1 100 ALA C  1 101 LYS N  -47.40  -27.20  -30.26  -30.89  -31.58 0.09  4 0 "[    .    1    .    2]" 
       113 PHI 1 100 ALA C 1 101 LYS N  1 101 LYS CA 1 101 LYS C  -73.80  -53.50  -74.78  -74.20  -74.27 3.13 20 0 "[    .    1    .    2]" 
       114 PSI 1 101 LYS N 1 101 LYS CA 1 101 LYS C  1 102 LEU N  -55.40  -25.30  -48.24  -45.60  -47.01 1.12 20 0 "[    .    1    .    2]" 
       115 PHI 1 101 LYS C 1 102 LEU N  1 102 LEU CA 1 102 LEU C  -73.80  -52.80  -58.69  -66.93  -52.00 0.80  9 0 "[    .    1    .    2]" 
       116 PSI 1 102 LEU N 1 102 LEU CA 1 102 LEU C  1 103 MET N  -61.50  -15.20  -21.96  -19.91  -20.03    .  . 0 "[    .    1    .    2]" 
       117 PHI 1 102 LEU C 1 103 MET N  1 103 MET CA 1 103 MET C -105.50  -36.80  -54.30  -53.42  -54.38    .  . 0 "[    .    1    .    2]" 
       118 PSI 1 103 MET N 1 103 MET CA 1 103 MET C  1 104 ASN N  -65.50    8.90  -66.56  -66.19  -66.26 2.06 15 0 "[    .    1    .    2]" 
       119 PHI 1 103 MET C 1 104 ASN N  1 104 ASN CA 1 104 ASN C  -73.40  -51.90  -54.68  -57.94  -51.15 0.75  3 0 "[    .    1    .    2]" 
       120 PSI 1 104 ASN N 1 104 ASN CA 1 104 ASN C  1 105 GLN N  -53.50  -29.50  -31.07  -33.46  -29.22 0.28 12 0 "[    .    1    .    2]" 
       121 PHI 1 104 ASN C 1 105 GLN N  1 105 GLN CA 1 105 GLN C  -84.90  -50.50  -51.22  -53.56  -49.70 0.80  9 0 "[    .    1    .    2]" 
       122 PSI 1 105 GLN N 1 105 GLN CA 1 105 GLN C  1 106 TYR N  -48.90  -20.70  -46.41  -49.62  -40.90 0.72 18 0 "[    .    1    .    2]" 
       123 PHI 1 105 GLN C 1 106 TYR N  1 106 TYR CA 1 106 TYR C -137.90  -56.60 -126.95 -116.79 -121.50 0.12 15 0 "[    .    1    .    2]" 
       124 PSI 1 106 TYR N 1 106 TYR CA 1 106 TYR C  1 107 ARG N  -49.10   34.70   33.83   25.74   40.60 5.90 15 1 "[    .    1    +    2]" 
       125 PHI 1 108 GLY C 1 109 ILE N  1 109 ILE CA 1 109 ILE C -123.70  -67.10 -103.22 -117.32  -69.28    .  . 0 "[    .    1    .    2]" 
       126 PSI 1 109 ILE N 1 109 ILE CA 1 109 ILE C  1 110 TYR N  -45.40   38.80  -33.61  -40.66  -27.76    .  . 0 "[    .    1    .    2]" 
       127 PHI 1 109 ILE C 1 110 TYR N  1 110 TYR CA 1 110 TYR C -169.20  -91.70 -119.64 -128.93 -109.68    .  . 0 "[    .    1    .    2]" 
       128 PSI 1 110 TYR N 1 110 TYR CA 1 110 TYR C  1 111 SER N  146.40  177.10  177.29  177.82  177.75 1.21 13 0 "[    .    1    .    2]" 
       129 PHI 1 110 TYR C 1 111 SER N  1 111 SER CA 1 111 SER C -169.70  -86.90 -147.51 -167.42 -130.61    .  . 0 "[    .    1    .    2]" 
       130 PSI 1 111 SER N 1 111 SER CA 1 111 SER C  1 112 PHE N  128.10  170.70  153.02  129.10  163.71    .  . 0 "[    .    1    .    2]" 
       131 PHI 1 111 SER C 1 112 PHE N  1 112 PHE CA 1 112 PHE C -175.60  -95.10 -165.20 -159.12 -163.43 0.88  9 0 "[    .    1    .    2]" 
       132 PSI 1 112 PHE N 1 112 PHE CA 1 112 PHE C  1 113 GLU N  116.00  171.80  163.02  172.10  171.92 1.32  4 0 "[    .    1    .    2]" 
       133 PHI 1 121 ASN C 1 122 GLU N  1 122 GLU CA 1 122 GLU C -106.50  -24.50  -96.59  -84.00  -95.28 3.89 13 0 "[    .    1    .    2]" 
       134 PSI 1 122 GLU N 1 122 GLU CA 1 122 GLU C  1 123 PHE N  -65.80    8.30   -1.64  -33.91   11.93 3.63 16 0 "[    .    1    .    2]" 
       135 PHI 1 122 GLU C 1 123 PHE N  1 123 PHE CA 1 123 PHE C  -76.00  -50.70  -52.20  -75.98  -48.01 2.69 18 0 "[    .    1    .    2]" 
       136 PSI 1 123 PHE N 1 123 PHE CA 1 123 PHE C  1 124 ASN N  -52.20  -31.80  -33.38  -45.55  -26.50 5.30 19 1 "[    .    1    .   +2]" 
       137 PHI 1 123 PHE C 1 124 ASN N  1 124 ASN CA 1 124 ASN C  -75.60  -52.30  -74.83  -74.63  -75.52 2.08 16 0 "[    .    1    .    2]" 
       138 PSI 1 124 ASN N 1 124 ASN CA 1 124 ASN C  1 125 ASP N  -64.40  -23.90  -39.31  -39.08  -39.93 0.05 12 0 "[    .    1    .    2]" 
       139 PHI 1 124 ASN C 1 125 ASP N  1 125 ASP CA 1 125 ASP C  -73.70  -53.70  -54.92  -71.67  -51.36 2.34 10 0 "[    .    1    .    2]" 
       140 PSI 1 125 ASP N 1 125 ASP CA 1 125 ASP C  1 126 TYR N  -52.50  -26.40  -24.38  -24.93  -24.95 4.02 12 0 "[    .    1    .    2]" 
       141 PHI 1 125 ASP C 1 126 TYR N  1 126 TYR CA 1 126 TYR C  -75.30  -53.30  -52.59  -52.43  -52.66 1.71 11 0 "[    .    1    .    2]" 
       142 PSI 1 126 TYR N 1 126 TYR CA 1 126 TYR C  1 127 VAL N  -54.70  -24.10  -36.78  -34.70  -35.77    .  . 0 "[    .    1    .    2]" 
       143 PHI 1 126 TYR C 1 127 VAL N  1 127 VAL CA 1 127 VAL C  -77.30  -56.50  -56.06  -55.58  -55.78 1.31 17 0 "[    .    1    .    2]" 
       144 PSI 1 127 VAL N 1 127 VAL CA 1 127 VAL C  1 128 ASP N  -54.30   -7.80  -22.87  -25.40  -20.24    .  . 0 "[    .    1    .    2]" 
       145 PHI 1 127 VAL C 1 128 ASP N  1 128 ASP CA 1 128 ASP C  -77.20  -52.50  -60.62  -56.59  -59.08    .  . 0 "[    .    1    .    2]" 
       146 PSI 1 128 ASP N 1 128 ASP CA 1 128 ASP C  1 129 MET N  -53.00  -29.50  -50.84  -53.59  -46.58 0.59 20 0 "[    .    1    .    2]" 
       147 PHI 1 128 ASP C 1 129 MET N  1 129 MET CA 1 129 MET C  -72.10  -52.10  -71.84  -72.39  -72.42 1.01 17 0 "[    .    1    .    2]" 
       148 PSI 1 129 MET N 1 129 MET CA 1 129 MET C  1 130 LYS N  -53.20  -30.60  -42.27  -41.12  -41.21    .  . 0 "[    .    1    .    2]" 
       149 PHI 1 129 MET C 1 130 LYS N  1 130 LYS CA 1 130 LYS C  -75.20  -54.80  -60.45  -58.56  -59.92 0.22  3 0 "[    .    1    .    2]" 
       150 PSI 1 130 LYS N 1 130 LYS CA 1 130 LYS C  1 131 ALA N  -55.80  -28.40  -50.34  -52.29  -53.29 0.30 12 0 "[    .    1    .    2]" 
       151 PHI 1 130 LYS C 1 131 ALA N  1 131 ALA CA 1 131 ALA C  -73.60  -53.60  -57.17  -73.74  -52.81 0.79 17 0 "[    .    1    .    2]" 
       152 PSI 1 131 ALA N 1 131 ALA CA 1 131 ALA C  1 132 LYS N  -54.40  -34.40  -34.57  -38.37  -33.49 0.91 12 0 "[    .    1    .    2]" 
       153 PHI 1 131 ALA C 1 132 LYS N  1 132 LYS CA 1 132 LYS C  -72.80  -52.80  -52.68  -59.58  -51.62 1.18 12 0 "[    .    1    .    2]" 
       154 PSI 1 132 LYS N 1 132 LYS CA 1 132 LYS C  1 133 SER N  -56.30  -18.60  -33.44  -31.38  -32.15    .  . 0 "[    .    1    .    2]" 
       155 PHI 1 132 LYS C 1 133 SER N  1 133 SER CA 1 133 SER C  -78.60  -48.60  -71.91  -79.38  -53.96 0.78 17 0 "[    .    1    .    2]" 
       156 PSI 1 133 SER N 1 133 SER CA 1 133 SER C  1 134 ALA N  -52.80  -32.40  -35.04  -45.84  -31.49 0.91 13 0 "[    .    1    .    2]" 
       157 PHI 1 133 SER C 1 134 ALA N  1 134 ALA CA 1 134 ALA C  -85.10  -50.40  -61.41  -69.79  -75.42    .  . 0 "[    .    1    .    2]" 
       158 PSI 1 134 ALA N 1 134 ALA CA 1 134 ALA C  1 135 LEU N  -42.80  -15.90  -37.87  -35.91  -39.44 0.09  4 0 "[    .    1    .    2]" 
    stop_

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