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
521027 2lja 17927 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2lja


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              163
    _TA_constraint_stats_list.Viol_count                    272
    _TA_constraint_stats_list.Viol_total                    6348.42
    _TA_constraint_stats_list.Viol_max                      6.51
    _TA_constraint_stats_list.Viol_rms                      0.48
    _TA_constraint_stats_list.Viol_average_all_restraints   0.10
    _TA_constraint_stats_list.Viol_average_violations_only  1.17
    _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  12 SER C 1  13 PHE N  1  13 PHE CA 1  13 PHE C  173.00  -55.00  -99.08 -157.65  -60.77    .  . 0 "[    .    1    .    2]" 
         2 . 1  13 PHE N 1  13 PHE CA 1  13 PHE C  1  14 SER N  109.00 -175.00  162.60  175.17  171.03    .  . 0 "[    .    1    .    2]" 
         3 . 1  13 PHE C 1  14 SER N  1  14 SER CA 1  14 SER C -142.00  -70.00 -139.80 -142.37 -142.46 1.75 16 0 "[    .    1    .    2]" 
         4 . 1  14 SER N 1  14 SER CA 1  14 SER C  1  15 TYR N  108.00  168.00  122.49  127.53  126.03 1.44 16 0 "[    .    1    .    2]" 
         5 . 1  14 SER C 1  15 TYR N  1  15 TYR CA 1  15 TYR C -169.00  -93.00 -137.13 -146.07 -128.19    .  . 0 "[    .    1    .    2]" 
         6 . 1  15 TYR N 1  15 TYR CA 1  15 TYR C  1  16 PRO N   81.00 -175.00  152.40  141.13  161.72    .  . 0 "[    .    1    .    2]" 
         7 . 1  15 TYR C 1  16 PRO N  1  16 PRO CA 1  16 PRO C  -88.00  -48.00  -81.30  -85.15  -86.18 0.44 15 0 "[    .    1    .    2]" 
         8 . 1  16 PRO N 1  16 PRO CA 1  16 PRO C  1  17 ASP N  126.00  174.00  127.10  126.77  125.89 1.63  4 0 "[    .    1    .    2]" 
         9 . 1  16 PRO C 1  17 ASP N  1  17 ASP CA 1  17 ASP C -142.00  -54.00  -67.83  -80.00  -60.76    .  . 0 "[    .    1    .    2]" 
        10 . 1  17 ASP N 1  17 ASP CA 1  17 ASP C  1  18 ILE N  132.00 -172.00  160.50  161.16  160.12    .  . 0 "[    .    1    .    2]" 
        11 . 1  20 GLY C 1  21 LYS N  1  21 LYS CA 1  21 LYS C -120.00  -44.00 -104.22  -94.86  -98.09    .  . 0 "[    .    1    .    2]" 
        12 . 1  21 LYS N 1  21 LYS CA 1  21 LYS C  1  22 THR N  107.00  151.00  119.76  105.97  140.85 1.03 16 0 "[    .    1    .    2]" 
        13 . 1  21 LYS C 1  22 THR N  1  22 THR CA 1  22 THR C -159.00  -27.00  -72.17  -91.32  -63.00    .  . 0 "[    .    1    .    2]" 
        14 . 1  22 THR N 1  22 THR CA 1  22 THR C  1  23 VAL N  100.00  144.00  105.53  106.86  105.73 0.94 19 0 "[    .    1    .    2]" 
        15 . 1  22 THR C 1  23 VAL N  1  23 VAL CA 1  23 VAL C -153.00  -73.00 -113.12 -126.48  -92.61    .  . 0 "[    .    1    .    2]" 
        16 . 1  23 VAL N 1  23 VAL CA 1  23 VAL C  1  24 SER N   93.00  161.00  130.63  133.07  127.99    .  . 0 "[    .    1    .    2]" 
        17 . 1  23 VAL C 1  24 SER N  1  24 SER CA 1  24 SER C -122.00  -70.00 -113.06 -122.77  -97.45 0.77 10 0 "[    .    1    .    2]" 
        18 . 1  24 SER N 1  24 SER CA 1  24 SER C  1  25 LEU N  146.00 -174.00  174.12  156.50 -173.19 0.81 16 0 "[    .    1    .    2]" 
        19 . 1  32 TYR C 1  33 ILE N  1  33 ILE CA 1  33 ILE C -177.00  -77.00 -119.15 -129.38  -94.60    .  . 0 "[    .    1    .    2]" 
        20 . 1  33 ILE N 1  33 ILE CA 1  33 ILE C  1  34 TYR N  116.00  156.00  130.64  132.63  132.31 0.65 20 0 "[    .    1    .    2]" 
        21 . 1  33 ILE C 1  34 TYR N  1  34 TYR CA 1  34 TYR C -154.00  -82.00 -116.39 -129.70  -92.03    .  . 0 "[    .    1    .    2]" 
        22 . 1  34 TYR N 1  34 TYR CA 1  34 TYR C  1  35 ILE N  107.00  147.00  117.88  120.71  118.98    .  . 0 "[    .    1    .    2]" 
        23 . 1  34 TYR C 1  35 ILE N  1  35 ILE CA 1  35 ILE C -132.00  -92.00 -104.66 -130.26  -91.56 0.44 17 0 "[    .    1    .    2]" 
        24 . 1  35 ILE N 1  35 ILE CA 1  35 ILE C  1  36 ASP N  110.00  154.00  122.77  126.03  123.13 0.27  1 0 "[    .    1    .    2]" 
        25 . 1  35 ILE C 1  36 ASP N  1  36 ASP CA 1  36 ASP C -146.00  -94.00 -118.52 -140.77  -99.04    .  . 0 "[    .    1    .    2]" 
        26 . 1  36 ASP N 1  36 ASP CA 1  36 ASP C  1  37 VAL N   90.00  158.00  152.91  158.55  158.43 4.76  5 0 "[    .    1    .    2]" 
        27 . 1  36 ASP C 1  37 VAL N  1  37 VAL CA 1  37 VAL C -135.00  -63.00  -99.63 -110.46  -79.49    .  . 0 "[    .    1    .    2]" 
        28 . 1  37 VAL N 1  37 VAL CA 1  37 VAL C  1  38 TRP N  113.00  153.00  121.72  111.47  137.94 1.53  2 0 "[    .    1    .    2]" 
        29 . 1  37 VAL C 1  38 TRP N  1  38 TRP CA 1  38 TRP C -168.00  -88.00 -112.98 -113.31 -118.95    .  . 0 "[    .    1    .    2]" 
        30 . 1  38 TRP N 1  38 TRP CA 1  38 TRP C  1  39 ALA N  137.00 -175.00  134.19  130.49  141.77 6.51 10 1 "[    .    +    .    2]" 
        31 . 1  38 TRP C 1  39 ALA N  1  39 ALA CA 1  39 ALA C -144.00  -36.00 -147.19 -150.19 -145.03 6.19 10 1 "[    .    +    .    2]" 
        32 . 1  39 ALA N 1  39 ALA CA 1  39 ALA C  1  40 THR N  146.00 -174.00  163.12  161.70  158.28    .  . 0 "[    .    1    .    2]" 
        33 . 1  43 GLY C 1  44 PRO N  1  44 PRO CA 1  44 PRO C  -79.00  -39.00  -53.67  -56.12  -50.75    .  . 0 "[    .    1    .    2]" 
        34 . 1  44 PRO N 1  44 PRO CA 1  44 PRO C  1  45 CYS N  -52.00  -12.00  -31.98  -35.91  -38.34    .  . 0 "[    .    1    .    2]" 
        35 . 1  44 PRO C 1  45 CYS N  1  45 CYS CA 1  45 CYS C  -84.00  -44.00  -56.66  -57.57  -58.42    .  . 0 "[    .    1    .    2]" 
        36 . 1  45 CYS N 1  45 CYS CA 1  45 CYS C  1  46 ARG N  -57.00  -17.00  -32.04  -22.85  -29.15 1.03 12 0 "[    .    1    .    2]" 
        37 . 1  45 CYS C 1  46 ARG N  1  46 ARG CA 1  46 ARG C  -83.00  -43.00  -70.59  -83.65  -58.75 0.65 10 0 "[    .    1    .    2]" 
        38 . 1  46 ARG C 1  47 GLY N  1  47 GLY CA 1  47 GLY C  -84.00  -44.00  -77.38  -84.45  -63.20 0.45 20 0 "[    .    1    .    2]" 
        39 . 1  47 GLY N 1  47 GLY CA 1  47 GLY C  1  48 GLU N  -57.00    7.00  -27.05  -19.93  -22.47    .  . 0 "[    .    1    .    2]" 
        40 . 1  47 GLY C 1  48 GLU N  1  48 GLU CA 1  48 GLU C -142.00  -50.00  -99.04  -99.34 -104.63    .  . 0 "[    .    1    .    2]" 
        41 . 1  48 GLU N 1  48 GLU CA 1  48 GLU C  1  49 LEU N  -53.00   39.00   -4.73  -26.34   24.56    .  . 0 "[    .    1    .    2]" 
        42 . 1  48 GLU C 1  49 LEU N  1  49 LEU CA 1  49 LEU C  -69.00  -29.00  -54.01  -52.74  -53.64 0.05 10 0 "[    .    1    .    2]" 
        43 . 1  49 LEU N 1  49 LEU CA 1  49 LEU C  1  50 PRO N  -68.00  -28.00  -48.29  -45.99  -46.69    .  . 0 "[    .    1    .    2]" 
        44 . 1  49 LEU C 1  50 PRO N  1  50 PRO CA 1  50 PRO C  -77.00  -37.00  -55.38  -54.57  -54.97    .  . 0 "[    .    1    .    2]" 
        45 . 1  50 PRO N 1  50 PRO CA 1  50 PRO C  1  51 ALA N  -58.00  -18.00  -38.20  -36.42  -37.37    .  . 0 "[    .    1    .    2]" 
        46 . 1  50 PRO C 1  51 ALA N  1  51 ALA CA 1  51 ALA C  -89.00  -49.00  -73.55  -85.06  -67.30    .  . 0 "[    .    1    .    2]" 
        47 . 1  51 ALA N 1  51 ALA CA 1  51 ALA C  1  52 LEU N  -54.00  -14.00  -26.73  -25.40  -26.03    .  . 0 "[    .    1    .    2]" 
        48 . 1  51 ALA C 1  52 LEU N  1  52 LEU CA 1  52 LEU C  -84.00  -44.00  -68.16  -79.02  -63.94    .  . 0 "[    .    1    .    2]" 
        49 . 1  52 LEU N 1  52 LEU CA 1  52 LEU C  1  53 LYS N  -61.00  -21.00  -43.36  -38.02  -39.28    .  . 0 "[    .    1    .    2]" 
        50 . 1  52 LEU C 1  53 LYS N  1  53 LYS CA 1  53 LYS C  -80.00  -40.00  -63.47  -75.21  -51.59    .  . 0 "[    .    1    .    2]" 
        51 . 1  53 LYS N 1  53 LYS CA 1  53 LYS C  1  54 GLU N  -64.00  -24.00  -45.30  -43.99  -46.71    .  . 0 "[    .    1    .    2]" 
        52 . 1  53 LYS C 1  54 GLU N  1  54 GLU CA 1  54 GLU C  -85.00  -45.00  -54.15  -48.20  -50.20 0.14  9 0 "[    .    1    .    2]" 
        53 . 1  54 GLU N 1  54 GLU CA 1  54 GLU C  1  55 LEU N  -61.00  -21.00  -44.90  -59.09  -23.32    .  . 0 "[    .    1    .    2]" 
        54 . 1  54 GLU C 1  55 LEU N  1  55 LEU CA 1  55 LEU C  -82.00  -42.00  -63.28  -59.01  -59.32    .  . 0 "[    .    1    .    2]" 
        55 . 1  55 LEU N 1  55 LEU CA 1  55 LEU C  1  56 GLU N  -65.00  -25.00  -47.24  -57.81  -34.00    .  . 0 "[    .    1    .    2]" 
        56 . 1  55 LEU C 1  56 GLU N  1  56 GLU CA 1  56 GLU C  -85.00  -45.00  -56.88  -49.46  -57.39 1.59 14 0 "[    .    1    .    2]" 
        57 . 1  56 GLU N 1  56 GLU CA 1  56 GLU C  1  57 GLU N  -59.00  -19.00  -50.36  -60.64  -35.28 1.64  2 0 "[    .    1    .    2]" 
        58 . 1  56 GLU C 1  57 GLU N  1  57 GLU CA 1  57 GLU C  -84.00  -44.00  -68.59  -82.75  -50.20    .  . 0 "[    .    1    .    2]" 
        59 . 1  57 GLU N 1  57 GLU CA 1  57 GLU C  1  58 LYS N  -60.00  -20.00  -33.18  -54.41  -19.24 0.76  1 0 "[    .    1    .    2]" 
        60 . 1  57 GLU C 1  58 LYS N  1  58 LYS CA 1  58 LYS C  -85.00  -45.00  -69.36  -78.38  -82.37 1.21 20 0 "[    .    1    .    2]" 
        61 . 1  58 LYS N 1  58 LYS CA 1  58 LYS C  1  59 TYR N  -58.00  -18.00  -37.90  -58.12  -25.04 0.12 12 0 "[    .    1    .    2]" 
        62 . 1  58 LYS C 1  59 TYR N  1  59 TYR CA 1  59 TYR C -123.00  -75.00 -107.41 -102.91 -103.90 1.26  5 0 "[    .    1    .    2]" 
        63 . 1  59 TYR N 1  59 TYR CA 1  59 TYR C  1  60 ALA N  -18.00   30.00   11.41   -2.50   25.17    .  . 0 "[    .    1    .    2]" 
        64 . 1  59 TYR C 1  60 ALA N  1  60 ALA CA 1  60 ALA C -122.00  -38.00  -60.58  -70.44  -47.16    .  . 0 "[    .    1    .    2]" 
        65 . 1  60 ALA N 1  60 ALA CA 1  60 ALA C  1  61 GLY N  112.00  160.00  128.12  122.75  120.79 1.77  5 0 "[    .    1    .    2]" 
        66 . 1  63 ASP C 1  64 ILE N  1  64 ILE CA 1  64 ILE C -156.00  -84.00 -147.87 -157.97 -128.80 1.97  5 0 "[    .    1    .    2]" 
        67 . 1  64 ILE N 1  64 ILE CA 1  64 ILE C  1  65 HIS N  112.00  168.00  149.25  146.57  143.54    .  . 0 "[    .    1    .    2]" 
        68 . 1  64 ILE C 1  65 HIS N  1  65 HIS CA 1  65 HIS C -158.00 -102.00 -122.02 -156.83 -101.55 0.45  1 0 "[    .    1    .    2]" 
        69 . 1  65 HIS N 1  65 HIS CA 1  65 HIS C  1  66 PHE N  109.00  153.00  124.28  137.72  125.80 2.42 12 0 "[    .    1    .    2]" 
        70 . 1  65 HIS C 1  66 PHE N  1  66 PHE CA 1  66 PHE C -121.00  -69.00  -89.20 -110.43  -76.77    .  . 0 "[    .    1    .    2]" 
        71 . 1  66 PHE N 1  66 PHE CA 1  66 PHE C  1  67 VAL N  104.00  144.00  109.08  109.98  108.93 1.07 20 0 "[    .    1    .    2]" 
        72 . 1  66 PHE C 1  67 VAL N  1  67 VAL CA 1  67 VAL C -133.00  -93.00 -120.26 -112.63 -115.82    .  . 0 "[    .    1    .    2]" 
        73 . 1  67 VAL N 1  67 VAL CA 1  67 VAL C  1  68 SER N  105.00  145.00  111.69  109.26  106.32 1.06 15 0 "[    .    1    .    2]" 
        74 . 1  67 VAL C 1  68 SER N  1  68 SER CA 1  68 SER C -137.00  -89.00  -94.24 -114.05  -87.81 1.19 18 0 "[    .    1    .    2]" 
        75 . 1  68 SER N 1  68 SER CA 1  68 SER C  1  69 LEU N  110.00  150.00  136.72  114.00  150.64 0.64  8 0 "[    .    1    .    2]" 
        76 . 1  68 SER C 1  69 LEU N  1  69 LEU CA 1  69 LEU C -142.00  -94.00 -119.79 -109.83 -110.00    .  . 0 "[    .    1    .    2]" 
        77 . 1  69 LEU N 1  69 LEU CA 1  69 LEU C  1  70 SER N  120.00  164.00  129.41  130.02  129.98 0.10 13 0 "[    .    1    .    2]" 
        78 . 1  69 LEU C 1  70 SER N  1  70 SER CA 1  70 SER C -134.00  -78.00 -109.78 -110.09 -112.09    .  . 0 "[    .    1    .    2]" 
        79 . 1  70 SER N 1  70 SER CA 1  70 SER C  1  71 CYS N  107.00  147.00  119.51  109.03  129.94    .  . 0 "[    .    1    .    2]" 
        80 . 1  74 ASN C 1  75 LYS N  1  75 LYS CA 1  75 LYS C  -77.00  -37.00  -60.56  -81.45  -47.75 4.45  8 0 "[    .    1    .    2]" 
        81 . 1  75 LYS N 1  75 LYS CA 1  75 LYS C  1  76 LYS N  -64.00  -16.00  -57.60  -66.33  -49.54 2.33 14 0 "[    .    1    .    2]" 
        82 . 1  75 LYS C 1  76 LYS N  1  76 LYS CA 1  76 LYS C  -82.00  -42.00  -53.15  -52.43  -52.66    .  . 0 "[    .    1    .    2]" 
        83 . 1  76 LYS N 1  76 LYS CA 1  76 LYS C  1  77 ALA N  -58.00  -18.00  -48.76  -57.44  -37.70    .  . 0 "[    .    1    .    2]" 
        84 . 1  76 LYS C 1  77 ALA N  1  77 ALA CA 1  77 ALA C  -84.00  -44.00  -59.43  -64.84  -66.47    .  . 0 "[    .    1    .    2]" 
        85 . 1  77 ALA N 1  77 ALA CA 1  77 ALA C  1  78 TRP N  -63.00  -23.00  -37.81  -44.05  -27.59    .  . 0 "[    .    1    .    2]" 
        86 . 1  77 ALA C 1  78 TRP N  1  78 TRP CA 1  78 TRP C  -86.00  -46.00  -72.81  -76.91  -79.02    .  . 0 "[    .    1    .    2]" 
        87 . 1  78 TRP N 1  78 TRP CA 1  78 TRP C  1  79 GLU N  -62.00  -22.00  -45.89  -58.51  -34.22    .  . 0 "[    .    1    .    2]" 
        88 . 1  78 TRP C 1  79 GLU N  1  79 GLU CA 1  79 GLU C  -81.00  -41.00  -54.78  -53.66  -60.38    .  . 0 "[    .    1    .    2]" 
        89 . 1  79 GLU N 1  79 GLU CA 1  79 GLU C  1  80 ASN N  -63.00  -19.00  -41.74  -54.01  -27.92    .  . 0 "[    .    1    .    2]" 
        90 . 1  79 GLU C 1  80 ASN N  1  80 ASN CA 1  80 ASN C  -86.00  -46.00  -68.00  -66.23  -71.16    .  . 0 "[    .    1    .    2]" 
        91 . 1  80 ASN N 1  80 ASN CA 1  80 ASN C  1  81 MET N  -58.00  -18.00  -39.88  -54.32  -23.17    .  . 0 "[    .    1    .    2]" 
        92 . 1  80 ASN C 1  81 MET N  1  81 MET CA 1  81 MET C  -82.00  -42.00  -64.05  -64.27  -64.61    .  . 0 "[    .    1    .    2]" 
        93 . 1  81 MET N 1  81 MET CA 1  81 MET C  1  82 VAL N  -65.00  -25.00  -48.19  -42.32  -45.99    .  . 0 "[    .    1    .    2]" 
        94 . 1  81 MET C 1  82 VAL N  1  82 VAL CA 1  82 VAL C  -84.00  -44.00  -61.85  -68.58  -58.52    .  . 0 "[    .    1    .    2]" 
        95 . 1  82 VAL N 1  82 VAL CA 1  82 VAL C  1  83 THR N  -62.00  -22.00  -32.37  -37.90  -23.23    .  . 0 "[    .    1    .    2]" 
        96 . 1  82 VAL C 1  83 THR N  1  83 THR CA 1  83 THR C  -82.00  -42.00  -69.93  -81.72  -61.51    .  . 0 "[    .    1    .    2]" 
        97 . 1  83 THR N 1  83 THR CA 1  83 THR C  1  84 LYS N  -62.00  -22.00  -37.08  -37.00  -38.09 0.61 17 0 "[    .    1    .    2]" 
        98 . 1  83 THR C 1  84 LYS N  1  84 LYS CA 1  84 LYS C  -84.00  -44.00  -76.41  -74.08  -75.91 0.73  9 0 "[    .    1    .    2]" 
        99 . 1  84 LYS N 1  84 LYS CA 1  84 LYS C  1  85 ASP N  -59.00  -19.00  -43.44  -53.68  -29.96    .  . 0 "[    .    1    .    2]" 
       100 . 1  84 LYS C 1  85 ASP N  1  85 ASP CA 1  85 ASP C -109.00  -65.00  -76.53  -85.81  -64.55 0.45 11 0 "[    .    1    .    2]" 
       101 . 1  85 ASP N 1  85 ASP CA 1  85 ASP C  1  86 GLN N  -30.00   34.00   -8.90    4.29    0.49    .  . 0 "[    .    1    .    2]" 
       102 . 1  89 GLY C 1  90 ILE N  1  90 ILE CA 1  90 ILE C -111.00  -55.00  -95.78  -97.31 -103.51 1.03  9 0 "[    .    1    .    2]" 
       103 . 1  90 ILE N 1  90 ILE CA 1  90 ILE C  1  91 GLN N  114.00  154.00  112.96  108.02  117.48 5.98  9 1 "[    .   +1    .    2]" 
       104 . 1  90 ILE C 1  91 GLN N  1  91 GLN CA 1  91 GLN C -141.00  -57.00 -132.37 -130.72 -135.20 2.24 12 0 "[    .    1    .    2]" 
       105 . 1  91 GLN N 1  91 GLN CA 1  91 GLN C  1  92 LEU N   93.00  169.00  112.02   95.17  146.78    .  . 0 "[    .    1    .    2]" 
       106 . 1  91 GLN C 1  92 LEU N  1  92 LEU CA 1  92 LEU C -167.00  -91.00 -106.87 -121.23 -134.13 1.11 18 0 "[    .    1    .    2]" 
       107 . 1  92 LEU N 1  92 LEU CA 1  92 LEU C  1  93 HIS N  122.00  174.00  151.44  140.58  167.51    .  . 0 "[    .    1    .    2]" 
       108 . 1  92 LEU C 1  93 HIS N  1  93 HIS CA 1  93 HIS C -169.00  -33.00 -120.10 -123.98 -129.43    .  . 0 "[    .    1    .    2]" 
       109 . 1  93 HIS N 1  93 HIS CA 1  93 HIS C  1  94 MET N  110.00  166.00  125.88  134.14  131.34    .  . 0 "[    .    1    .    2]" 
       110 . 1  98 ARG C 1  99 THR N  1  99 THR CA 1  99 THR C  -78.00  -38.00  -65.79  -66.74  -70.18 0.32  3 0 "[    .    1    .    2]" 
       111 . 1  99 THR N 1  99 THR CA 1  99 THR C  1 100 PHE N  -56.00  -12.00  -28.41  -24.35  -28.09    .  . 0 "[    .    1    .    2]" 
       112 . 1  99 THR C 1 100 PHE N  1 100 PHE CA 1 100 PHE C  -81.00  -41.00  -76.88  -83.11  -70.95 2.11  5 0 "[    .    1    .    2]" 
       113 . 1 100 PHE N 1 100 PHE CA 1 100 PHE C  1 101 MET N  -65.00  -25.00  -31.36  -24.83  -25.43 1.13  4 0 "[    .    1    .    2]" 
       114 . 1 100 PHE C 1 101 MET N  1 101 MET CA 1 101 MET C  -80.00  -40.00  -64.70  -78.66  -56.08    .  . 0 "[    .    1    .    2]" 
       115 . 1 101 MET N 1 101 MET CA 1 101 MET C  1 102 ASP N  -61.00  -21.00  -41.79  -48.47  -51.44 0.08 10 0 "[    .    1    .    2]" 
       116 . 1 101 MET C 1 102 ASP N  1 102 ASP CA 1 102 ASP C  -83.00  -43.00  -65.87  -57.16  -58.70    .  . 0 "[    .    1    .    2]" 
       117 . 1 102 ASP N 1 102 ASP CA 1 102 ASP C  1 103 ALA N  -63.00  -23.00  -33.69  -50.98  -21.43 1.57 17 0 "[    .    1    .    2]" 
       118 . 1 102 ASP C 1 103 ALA N  1 103 ALA CA 1 103 ALA C  -87.00  -47.00  -65.50  -73.93  -59.97    .  . 0 "[    .    1    .    2]" 
       119 . 1 103 ALA N 1 103 ALA CA 1 103 ALA C  1 104 TYR N  -53.00  -13.00  -26.27  -47.35  -12.76 0.24 15 0 "[    .    1    .    2]" 
       120 . 1 103 ALA C 1 104 TYR N  1 104 TYR CA 1 104 TYR C -108.00  -68.00 -100.46 -107.49 -108.28 1.27 13 0 "[    .    1    .    2]" 
       121 . 1 104 TYR N 1 104 TYR CA 1 104 TYR C  1 105 LEU N  -26.00   26.00   -1.68  -13.27   10.81    .  . 0 "[    .    1    .    2]" 
       122 . 1 110 PRO C 1 111 ARG N  1 111 ARG CA 1 111 ARG C -155.00  -71.00 -108.94 -134.79  -82.26    .  . 0 "[    .    1    .    2]" 
       123 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C  1 112 PHE N  104.00  160.00  141.81  127.90  160.30 0.30 10 0 "[    .    1    .    2]" 
       124 . 1 111 ARG C 1 112 PHE N  1 112 PHE CA 1 112 PHE C -145.00  -81.00 -110.15 -103.20 -104.04    .  . 0 "[    .    1    .    2]" 
       125 . 1 112 PHE N 1 112 PHE CA 1 112 PHE C  1 113 ILE N  115.00  155.00  118.66  113.74  132.41 1.26 17 0 "[    .    1    .    2]" 
       126 . 1 112 PHE C 1 113 ILE N  1 113 ILE CA 1 113 ILE C -147.00 -107.00 -132.10 -147.53 -123.57 0.53  6 0 "[    .    1    .    2]" 
       127 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C  1 114 LEU N  124.00  168.00  146.21  138.16  163.99    .  . 0 "[    .    1    .    2]" 
       128 . 1 113 ILE C 1 114 LEU N  1 114 LEU CA 1 114 LEU C -157.00 -113.00 -129.64 -132.10 -136.29 1.45 12 0 "[    .    1    .    2]" 
       129 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C  1 115 LEU N  114.00  154.00  137.87  132.56  154.24 0.24 12 0 "[    .    1    .    2]" 
       130 . 1 114 LEU C 1 115 LEU N  1 115 LEU CA 1 115 LEU C -148.00  -80.00 -134.23 -134.87 -135.20    .  . 0 "[    .    1    .    2]" 
       131 . 1 115 LEU N 1 115 LEU CA 1 115 LEU C  1 116 ASP N  121.00  161.00  154.31  158.83  156.70 0.13  5 0 "[    .    1    .    2]" 
       132 . 1 115 LEU C 1 116 ASP N  1 116 ASP CA 1 116 ASP C -150.00  -42.00  -73.79  -86.12  -65.75    .  . 0 "[    .    1    .    2]" 
       133 . 1 116 ASP N 1 116 ASP CA 1 116 ASP C  1 117 ARG N  146.00 -154.00  165.89  162.55  160.85    .  . 0 "[    .    1    .    2]" 
       134 . 1 119 GLY C 1 120 LYS N  1 120 LYS CA 1 120 LYS C -121.00  -53.00  -96.80 -112.56  -81.27    .  . 0 "[    .    1    .    2]" 
       135 . 1 120 LYS N 1 120 LYS CA 1 120 LYS C  1 121 ILE N  105.00  169.00  110.91  102.85  147.21 2.15 16 0 "[    .    1    .    2]" 
       136 . 1 121 ILE C 1 122 ILE N  1 122 ILE CA 1 122 ILE C -122.00  -38.00  -91.97 -100.53  -83.56    .  . 0 "[    .    1    .    2]" 
       137 . 1 122 ILE N 1 122 ILE CA 1 122 ILE C  1 123 SER N  -61.00  -17.00  -45.08  -47.69  -50.38    .  . 0 "[    .    1    .    2]" 
       138 . 1 122 ILE C 1 123 SER N  1 123 SER CA 1 123 SER C -179.00 -127.00 -139.06 -154.40 -125.99 1.01 13 0 "[    .    1    .    2]" 
       139 . 1 123 SER N 1 123 SER CA 1 123 SER C  1 124 ALA N  115.00  155.00  118.83  114.21  142.72 0.79  9 0 "[    .    1    .    2]" 
       140 . 1 131 ASP C 1 132 PRO N  1 132 PRO CA 1 132 PRO C  -76.00  -36.00  -59.39  -48.24  -53.91    .  . 0 "[    .    1    .    2]" 
       141 . 1 132 PRO N 1 132 PRO CA 1 132 PRO C  1 133 LYS N  -53.00  -13.00  -30.38  -41.23  -18.11    .  . 0 "[    .    1    .    2]" 
       142 . 1 132 PRO C 1 133 LYS N  1 133 LYS CA 1 133 LYS C  -88.00  -48.00  -61.92  -58.20  -61.04    .  . 0 "[    .    1    .    2]" 
       143 . 1 133 LYS N 1 133 LYS CA 1 133 LYS C  1 134 THR N  -57.00  -17.00  -34.68  -55.31  -19.24    .  . 0 "[    .    1    .    2]" 
       144 . 1 133 LYS C 1 134 THR N  1 134 THR CA 1 134 THR C  -89.00  -49.00  -65.29  -65.58  -67.13    .  . 0 "[    .    1    .    2]" 
       145 . 1 134 THR N 1 134 THR CA 1 134 THR C  1 135 ALA N  -62.00  -22.00  -48.96  -59.62  -35.52    .  . 0 "[    .    1    .    2]" 
       146 . 1 134 THR C 1 135 ALA N  1 135 ALA CA 1 135 ALA C  -82.00  -42.00  -59.86  -62.48  -62.85    .  . 0 "[    .    1    .    2]" 
       147 . 1 135 ALA N 1 135 ALA CA 1 135 ALA C  1 136 GLU N  -62.00  -22.00  -45.29  -41.21  -41.53    .  . 0 "[    .    1    .    2]" 
       148 . 1 135 ALA C 1 136 GLU N  1 136 GLU CA 1 136 GLU C  -83.00  -43.00  -63.01  -77.12  -53.50    .  . 0 "[    .    1    .    2]" 
       149 . 1 136 GLU N 1 136 GLU CA 1 136 GLU C  1 137 LYS N  -64.00  -24.00  -36.74  -30.39  -38.22 1.14 13 0 "[    .    1    .    2]" 
       150 . 1 136 GLU C 1 137 LYS N  1 137 LYS CA 1 137 LYS C  -84.00  -44.00  -62.35  -79.28  -43.78 0.22 11 0 "[    .    1    .    2]" 
       151 . 1 137 LYS N 1 137 LYS CA 1 137 LYS C  1 138 PHE N  -66.00  -26.00  -39.93  -34.09  -39.17    .  . 0 "[    .    1    .    2]" 
       152 . 1 137 LYS C 1 138 PHE N  1 138 PHE CA 1 138 PHE C  -83.00  -43.00  -59.54  -66.76  -53.68    .  . 0 "[    .    1    .    2]" 
       153 . 1 138 PHE N 1 138 PHE CA 1 138 PHE C  1 139 ASN N  -61.00  -21.00  -49.60  -43.20  -47.12 0.20 18 0 "[    .    1    .    2]" 
       154 . 1 138 PHE C 1 139 ASN N  1 139 ASN CA 1 139 ASN C  -85.00  -45.00  -60.41  -72.28  -47.53    .  . 0 "[    .    1    .    2]" 
       155 . 1 139 ASN N 1 139 ASN CA 1 139 ASN C  1 140 GLU N  -59.00  -19.00  -41.41  -59.72  -17.37 1.63 14 0 "[    .    1    .    2]" 
       156 . 1 139 ASN C 1 140 GLU N  1 140 GLU CA 1 140 GLU C  -85.00  -45.00  -56.49  -53.88  -57.65 1.93  2 0 "[    .    1    .    2]" 
       157 . 1 140 GLU N 1 140 GLU CA 1 140 GLU C  1 141 LEU N  -60.00  -20.00  -52.34  -51.81  -54.47 0.66 12 0 "[    .    1    .    2]" 
       158 . 1 140 GLU C 1 141 LEU N  1 141 LEU CA 1 141 LEU C  -85.00  -45.00  -62.55  -61.48  -64.40    .  . 0 "[    .    1    .    2]" 
       159 . 1 141 LEU N 1 141 LEU CA 1 141 LEU C  1 142 LEU N  -60.00  -20.00  -32.13  -45.93  -19.38 0.62  9 0 "[    .    1    .    2]" 
       160 . 1 141 LEU C 1 142 LEU N  1 142 LEU CA 1 142 LEU C -150.00  -54.00  -82.36  -86.27  -89.37    .  . 0 "[    .    1    .    2]" 
       161 . 1 142 LEU N 1 142 LEU CA 1 142 LEU C  1 143 GLY N  -51.00   45.00  -16.27   -7.16  -10.82    .  . 0 "[    .    1    .    2]" 
       162 . 1 142 LEU C 1 143 GLY N  1 143 GLY CA 1 143 GLY C   10.00  118.00   82.50   82.40   78.22    .  . 0 "[    .    1    .    2]" 
       163 . 1 143 GLY N 1 143 GLY CA 1 143 GLY C  1 144 LEU N   -2.00   62.00   25.01    6.16   41.49    .  . 0 "[    .    1    .    2]" 
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