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
651560 6yel 50114 cing 4-filtered-FRED Wattos check violation dihedral angle


data_6yel


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              138
    _TA_constraint_stats_list.Viol_count                    108
    _TA_constraint_stats_list.Viol_total                    3254.09
    _TA_constraint_stats_list.Viol_max                      4.86
    _TA_constraint_stats_list.Viol_rms                      0.46
    _TA_constraint_stats_list.Viol_average_all_restraints   0.06
    _TA_constraint_stats_list.Viol_average_violations_only  1.51
    _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   6 ASN C 1   7 ARG N  1   7 ARG CA 1   7 ARG C  -84.70 -44.70 -62.97  -62.59 -63.41    .  . 0 "[    .    1    .    2]" 
         2 . 1   7 ARG N 1   7 ARG CA 1   7 ARG C  1   8 TYR N  -49.50  -9.50 -34.77  -46.81  -9.33 0.17  4 0 "[    .    1    .    2]" 
         3 . 1   7 ARG C 1   8 TYR N  1   8 TYR CA 1   8 TYR C -126.90 -86.90 -95.92 -108.11 -82.13 4.77  4 0 "[    .    1    .    2]" 
         4 . 1   8 TYR N 1   8 TYR CA 1   8 TYR C  1   9 SER N  -20.10  31.30   0.56    9.41   6.14 0.96  9 0 "[    .    1    .    2]" 
         5 . 1   8 TYR C 1   9 SER N  1   9 SER CA 1   9 SER C  -85.50 -45.50 -55.69  -53.55 -54.26    .  . 0 "[    .    1    .    2]" 
         6 . 1   9 SER N 1   9 SER CA 1   9 SER C  1  10 LYS N  -56.20 -13.80 -36.87  -44.80 -27.49    .  . 0 "[    .    1    .    2]" 
         7 . 1  10 LYS C 1  11 GLU N  1  11 GLU CA 1  11 GLU C  -86.00 -46.00 -79.90  -86.00 -74.79    .  . 0 "[    .    1    .    2]" 
         8 . 1  11 GLU N 1  11 GLU CA 1  11 GLU C  1  12 HIS N  -51.20 -11.20 -30.90  -34.88 -37.62    .  . 0 "[    .    1    .    2]" 
         9 . 1  15 LYS C 1  16 MET N  1  16 MET CA 1  16 MET C  -83.70 -43.70 -56.92  -48.76 -53.42    .  . 0 "[    .    1    .    2]" 
        10 . 1  16 MET N 1  16 MET CA 1  16 MET C  1  17 MET N  -57.10 -17.10 -42.84  -55.28 -26.45    .  . 0 "[    .    1    .    2]" 
        11 . 1  16 MET C 1  17 MET N  1  17 MET CA 1  17 MET C  -87.20 -47.20 -63.25  -68.16 -58.48    .  . 0 "[    .    1    .    2]" 
        12 . 1  17 MET N 1  17 MET CA 1  17 MET C  1  18 LYS N  -54.50 -14.50 -47.43  -44.95 -47.37    .  . 0 "[    .    1    .    2]" 
        13 . 1  17 MET C 1  18 LYS N  1  18 LYS CA 1  18 LYS C  -90.60 -50.60 -66.43  -83.77 -55.51    .  . 0 "[    .    1    .    2]" 
        14 . 1  18 LYS N 1  18 LYS CA 1  18 LYS C  1  19 ASP N  -55.00 -15.00 -41.81  -43.00 -46.54    .  . 0 "[    .    1    .    2]" 
        15 . 1  18 LYS C 1  19 ASP N  1  19 ASP CA 1  19 ASP C  -88.30 -48.30 -72.12  -72.08 -73.40    .  . 0 "[    .    1    .    2]" 
        16 . 1  19 ASP N 1  19 ASP CA 1  19 ASP C  1  20 LEU N  -55.00 -15.00 -31.85  -48.74 -15.06    .  . 0 "[    .    1    .    2]" 
        17 . 1  19 ASP C 1  20 LEU N  1  20 LEU CA 1  20 LEU C  -89.00 -49.00 -81.23  -88.99 -76.35    .  . 0 "[    .    1    .    2]" 
        18 . 1  20 LEU N 1  20 LEU CA 1  20 LEU C  1  21 GLU N  -54.50 -14.50 -25.60  -27.51 -29.43    .  . 0 "[    .    1    .    2]" 
        19 . 1  20 LEU C 1  21 GLU N  1  21 GLU CA 1  21 GLU C  -87.00 -47.00 -65.18  -63.49 -63.87    .  . 0 "[    .    1    .    2]" 
        20 . 1  21 GLU N 1  21 GLU CA 1  21 GLU C  1  22 GLY N  -59.80 -19.80 -38.90  -48.20 -25.75    .  . 0 "[    .    1    .    2]" 
        21 . 1  21 GLU C 1  22 GLY N  1  22 GLY CA 1  22 GLY C  -86.40 -46.40 -65.58  -69.14 -59.90    .  . 0 "[    .    1    .    2]" 
        22 . 1  22 GLY N 1  22 GLY CA 1  22 GLY C  1  23 LEU N  -58.80 -18.80 -38.26  -42.29 -31.27    .  . 0 "[    .    1    .    2]" 
        23 . 1  22 GLY C 1  23 LEU N  1  23 LEU CA 1  23 LEU C  -88.70 -48.70 -64.07  -63.55 -63.80    .  . 0 "[    .    1    .    2]" 
        24 . 1  23 LEU N 1  23 LEU CA 1  23 LEU C  1  24 HIS N  -59.70 -19.70 -40.74  -41.86 -42.56    .  . 0 "[    .    1    .    2]" 
        25 . 1  23 LEU C 1  24 HIS N  1  24 HIS CA 1  24 HIS C  -89.90 -49.90 -66.30  -76.29 -59.86    .  . 0 "[    .    1    .    2]" 
        26 . 1  24 HIS N 1  24 HIS CA 1  24 HIS C  1  25 ARG N  -55.50 -15.50 -34.59  -36.11 -37.43    .  . 0 "[    .    1    .    2]" 
        27 . 1  24 HIS C 1  25 ARG N  1  25 ARG CA 1  25 ARG C  -87.70 -47.70 -67.13  -75.35 -60.80    .  . 0 "[    .    1    .    2]" 
        28 . 1  25 ARG N 1  25 ARG CA 1  25 ARG C  1  26 ALA N  -60.60 -20.60 -27.01  -37.13 -20.57 0.03  8 0 "[    .    1    .    2]" 
        29 . 1  25 ARG C 1  26 ALA N  1  26 ALA CA 1  26 ALA C  -88.30 -48.30 -72.04  -74.69 -75.44    .  . 0 "[    .    1    .    2]" 
        30 . 1  26 ALA N 1  26 ALA CA 1  26 ALA C  1  27 GLU N  -58.00 -18.00 -33.99  -33.33 -33.66    .  . 0 "[    .    1    .    2]" 
        31 . 1  26 ALA C 1  27 GLU N  1  27 GLU CA 1  27 GLU C  -85.10 -45.10 -65.79  -65.80 -66.62    .  . 0 "[    .    1    .    2]" 
        32 . 1  27 GLU N 1  27 GLU CA 1  27 GLU C  1  28 GLN N  -60.50 -20.50 -43.65  -41.98 -42.56    .  . 0 "[    .    1    .    2]" 
        33 . 1  27 GLU C 1  28 GLN N  1  28 GLN CA 1  28 GLN C  -87.80 -47.80 -62.18  -67.68 -57.75    .  . 0 "[    .    1    .    2]" 
        34 . 1  28 GLN N 1  28 GLN CA 1  28 GLN C  1  29 SER N  -58.70 -18.70 -30.91  -30.63 -33.08 0.57  5 0 "[    .    1    .    2]" 
        35 . 1  28 GLN C 1  29 SER N  1  29 SER CA 1  29 SER C  -87.10 -47.10 -71.03  -83.54 -58.85    .  . 0 "[    .    1    .    2]" 
        36 . 1  29 SER N 1  29 SER CA 1  29 SER C  1  30 LEU N  -58.70 -18.70 -36.42  -34.19 -35.57    .  . 0 "[    .    1    .    2]" 
        37 . 1  29 SER C 1  30 LEU N  1  30 LEU CA 1  30 LEU C  -86.40 -46.40 -60.59  -67.92 -54.12    .  . 0 "[    .    1    .    2]" 
        38 . 1  30 LEU N 1  30 LEU CA 1  30 LEU C  1  31 HIS N  -60.60 -20.60 -51.67  -60.58 -43.08    .  . 0 "[    .    1    .    2]" 
        39 . 1  30 LEU C 1  31 HIS N  1  31 HIS CA 1  31 HIS C  -86.90 -46.90 -69.22  -68.30 -68.86    .  . 0 "[    .    1    .    2]" 
        40 . 1  31 HIS N 1  31 HIS CA 1  31 HIS C  1  32 ASP N  -55.60 -15.60 -33.76  -41.30 -24.32    .  . 0 "[    .    1    .    2]" 
        41 . 1  31 HIS C 1  32 ASP N  1  32 ASP CA 1  32 ASP C  -86.20 -46.20 -67.25  -68.94 -69.34    .  . 0 "[    .    1    .    2]" 
        42 . 1  32 ASP N 1  32 ASP CA 1  32 ASP C  1  33 LEU N  -59.50 -19.50 -37.33  -37.03 -37.40    .  . 0 "[    .    1    .    2]" 
        43 . 1  32 ASP C 1  33 LEU N  1  33 LEU CA 1  33 LEU C  -84.70 -44.70 -62.47  -70.50 -54.66    .  . 0 "[    .    1    .    2]" 
        44 . 1  33 LEU N 1  33 LEU CA 1  33 LEU C  1  34 GLN N  -61.30 -21.30 -49.60  -57.86 -37.89    .  . 0 "[    .    1    .    2]" 
        45 . 1  33 LEU C 1  34 GLN N  1  34 GLN CA 1  34 GLN C  -81.60 -41.60 -64.91  -71.91 -53.71    .  . 0 "[    .    1    .    2]" 
        46 . 1  34 GLN N 1  34 GLN CA 1  34 GLN C  1  35 GLU N  -62.50 -22.50 -42.65  -59.38 -34.40    .  . 0 "[    .    1    .    2]" 
        47 . 1  34 GLN C 1  35 GLU N  1  35 GLU CA 1  35 GLU C  -85.60 -45.60 -64.39  -69.13 -56.66    .  . 0 "[    .    1    .    2]" 
        48 . 1  35 GLU N 1  35 GLU CA 1  35 GLU C  1  36 ARG N  -56.60 -16.60 -43.69  -50.97 -32.19    .  . 0 "[    .    1    .    2]" 
        49 . 1  35 GLU C 1  36 ARG N  1  36 ARG CA 1  36 ARG C  -88.80 -48.80 -69.38  -75.40 -63.60    .  . 0 "[    .    1    .    2]" 
        50 . 1  36 ARG N 1  36 ARG CA 1  36 ARG C  1  37 LEU N  -55.50 -15.50 -32.19  -35.72 -37.76    .  . 0 "[    .    1    .    2]" 
        51 . 1  38 HIS C 1  39 LYS N  1  39 LYS CA 1  39 LYS C  -86.90 -46.90 -67.32  -68.22 -70.90    .  . 0 "[    .    1    .    2]" 
        52 . 1  39 LYS N 1  39 LYS CA 1  39 LYS C  1  40 ALA N  -57.10 -17.10 -39.07  -49.09 -25.57    .  . 0 "[    .    1    .    2]" 
        53 . 1  39 LYS C 1  40 ALA N  1  40 ALA CA 1  40 ALA C  -87.20 -47.20 -61.91  -62.74 -63.01    .  . 0 "[    .    1    .    2]" 
        54 . 1  40 ALA N 1  40 ALA CA 1  40 ALA C  1  41 GLN N  -56.60 -16.60 -36.05  -44.07 -27.89    .  . 0 "[    .    1    .    2]" 
        55 . 1  40 ALA C 1  41 GLN N  1  41 GLN CA 1  41 GLN C  -86.80 -46.80 -72.52  -73.82 -77.44    .  . 0 "[    .    1    .    2]" 
        56 . 1  41 GLN N 1  41 GLN CA 1  41 GLN C  1  42 GLU N  -59.10 -19.10 -61.51  -61.07 -61.88 4.86 10 0 "[    .    1    .    2]" 
        57 . 1  41 GLN C 1  42 GLU N  1  42 GLU CA 1  42 GLU C  -86.90 -46.90 -51.74  -60.41 -45.06 1.84  9 0 "[    .    1    .    2]" 
        58 . 1  42 GLU N 1  42 GLU CA 1  42 GLU C  1  43 GLU N  -52.20 -12.20 -43.09  -44.48 -44.60    .  . 0 "[    .    1    .    2]" 
        59 . 1  42 GLU C 1  43 GLU N  1  43 GLU CA 1  43 GLU C  -96.00 -51.80 -94.95  -97.44 -88.70 1.44  9 0 "[    .    1    .    2]" 
        60 . 1  43 GLU N 1  43 GLU CA 1  43 GLU C  1  44 HIS N  -46.40   1.00 -43.30  -44.27 -46.04 0.16  7 0 "[    .    1    .    2]" 
        61 . 1  43 GLU C 1  44 HIS N  1  44 HIS CA 1  44 HIS C  -96.80 -56.80 -98.59 -101.52 -96.75 4.72  7 0 "[    .    1    .    2]" 
        62 . 1  44 HIS N 1  44 HIS CA 1  44 HIS C  1  45 ARG N  -38.00   2.00 -26.13   -6.21  -9.82 1.54 12 0 "[    .    1    .    2]" 
        63 . 1  51 LYS C 1  52 VAL N  1  52 VAL CA 1  52 VAL C  -84.40 -44.40 -58.49  -44.95 -54.44    .  . 0 "[    .    1    .    2]" 
        64 . 1  52 VAL N 1  52 VAL CA 1  52 VAL C  1  53 HIS N  -53.60 -13.60 -31.24  -53.40 -13.13 0.47  5 0 "[    .    1    .    2]" 
        65 . 1  55 GLU C 1  56 LYS N  1  56 LYS CA 1  56 LYS C  -89.60 -49.60 -63.30  -69.49 -57.93    .  . 0 "[    .    1    .    2]" 
        66 . 1  56 LYS N 1  56 LYS CA 1  56 LYS C  1  57 LYS N  -56.20 -16.20 -48.75  -50.45 -54.51 3.55 13 0 "[    .    1    .    2]" 
        67 . 1  57 LYS C 1  58 LEU N  1  58 LEU CA 1  58 LEU C  -90.20 -50.20 -60.69  -62.60 -63.24    .  . 0 "[    .    1    .    2]" 
        68 . 1  58 LEU N 1  58 LEU CA 1  58 LEU C  1  59 ARG N  -52.50  -9.90 -46.62  -51.12 -37.32    .  . 0 "[    .    1    .    2]" 
        69 . 1  61 GLU C 1  62 ILE N  1  62 ILE CA 1  62 ILE C  -82.20 -42.20 -67.07  -74.52 -59.71    .  . 0 "[    .    1    .    2]" 
        70 . 1  62 ILE N 1  62 ILE CA 1  62 ILE C  1  63 ASN N  -57.50 -17.50 -27.36  -36.79 -17.47 0.03  1 0 "[    .    1    .    2]" 
        71 . 1  62 ILE C 1  63 ASN N  1  63 ASN CA 1  63 ASN C  -85.80 -45.80 -69.84  -69.49 -73.45    .  . 0 "[    .    1    .    2]" 
        72 . 1  63 ASN N 1  63 ASN CA 1  63 ASN C  1  64 LEU N  -57.00 -17.00 -35.54  -48.01 -28.91    .  . 0 "[    .    1    .    2]" 
        73 . 1  63 ASN C 1  64 LEU N  1  64 LEU CA 1  64 LEU C  -87.70 -47.70 -66.78  -61.25 -62.51    .  . 0 "[    .    1    .    2]" 
        74 . 1  64 LEU N 1  64 LEU CA 1  64 LEU C  1  65 ALA N  -62.00 -22.00 -46.30  -47.40 -48.08    .  . 0 "[    .    1    .    2]" 
        75 . 1  64 LEU C 1  65 ALA N  1  65 ALA CA 1  65 ALA C  -84.30 -44.30 -62.72  -64.76 -65.36    .  . 0 "[    .    1    .    2]" 
        76 . 1  65 ALA N 1  65 ALA CA 1  65 ALA C  1  66 LYS N  -60.40 -20.40 -33.86  -39.67 -27.04    .  . 0 "[    .    1    .    2]" 
        77 . 1  65 ALA C 1  66 LYS N  1  66 LYS CA 1  66 LYS C  -83.60 -43.60 -66.64  -73.99 -63.72    .  . 0 "[    .    1    .    2]" 
        78 . 1  66 LYS N 1  66 LYS CA 1  66 LYS C  1  67 GLN N  -61.50 -21.50 -32.85  -24.51 -28.81    .  . 0 "[    .    1    .    2]" 
        79 . 1  66 LYS C 1  67 GLN N  1  67 GLN CA 1  67 GLN C  -85.90 -45.90 -67.02  -71.89 -62.11    .  . 0 "[    .    1    .    2]" 
        80 . 1  67 GLN N 1  67 GLN CA 1  67 GLN C  1  68 GLU N  -61.10 -21.10 -48.78  -46.87 -46.90    .  . 0 "[    .    1    .    2]" 
        81 . 1  67 GLN C 1  68 GLU N  1  68 GLU CA 1  68 GLU C  -87.00 -47.00 -54.75  -72.76 -49.12    .  . 0 "[    .    1    .    2]" 
        82 . 1  68 GLU N 1  68 GLU CA 1  68 GLU C  1  69 ALA N  -56.30 -16.30 -46.42  -50.65 -51.30    .  . 0 "[    .    1    .    2]" 
        83 . 1  68 GLU C 1  69 ALA N  1  69 ALA CA 1  69 ALA C  -84.50 -44.50 -60.03  -58.30 -58.76    .  . 0 "[    .    1    .    2]" 
        84 . 1  69 ALA N 1  69 ALA CA 1  69 ALA C  1  70 GLN N  -60.30 -20.30 -38.81  -42.92 -31.59    .  . 0 "[    .    1    .    2]" 
        85 . 1  69 ALA C 1  70 GLN N  1  70 GLN CA 1  70 GLN C  -86.10 -46.10 -63.20  -60.92 -61.84    .  . 0 "[    .    1    .    2]" 
        86 . 1  70 GLN N 1  70 GLN CA 1  70 GLN C  1  71 ARG N  -58.60 -18.60 -41.26  -45.89 -35.53    .  . 0 "[    .    1    .    2]" 
        87 . 1  70 GLN C 1  71 ARG N  1  71 ARG CA 1  71 ARG C  -86.60 -46.60 -64.00  -65.81 -67.11    .  . 0 "[    .    1    .    2]" 
        88 . 1  71 ARG N 1  71 ARG CA 1  71 ARG C  1  72 LEU N  -63.00 -23.00 -38.13  -46.53 -31.16    .  . 0 "[    .    1    .    2]" 
        89 . 1  71 ARG C 1  72 LEU N  1  72 LEU CA 1  72 LEU C  -85.40 -45.40 -69.13  -75.57 -62.76    .  . 0 "[    .    1    .    2]" 
        90 . 1  72 LEU N 1  72 LEU CA 1  72 LEU C  1  73 LYS N  -61.20 -21.20 -31.59  -33.57 -35.84    .  . 0 "[    .    1    .    2]" 
        91 . 1  72 LEU C 1  73 LYS N  1  73 LYS CA 1  73 LYS C  -82.50 -42.50 -68.25  -79.90 -59.22    .  . 0 "[    .    1    .    2]" 
        92 . 1  73 LYS N 1  73 LYS CA 1  73 LYS C  1  74 GLU N  -57.40 -17.40 -44.98  -52.42 -32.24    .  . 0 "[    .    1    .    2]" 
        93 . 1  73 LYS C 1  74 GLU N  1  74 GLU CA 1  74 GLU C  -87.20 -47.20 -64.54  -72.31 -55.71    .  . 0 "[    .    1    .    2]" 
        94 . 1  74 GLU N 1  74 GLU CA 1  74 GLU C  1  75 LEU N  -57.40 -17.40 -36.81  -40.70 -41.95    .  . 0 "[    .    1    .    2]" 
        95 . 1  74 GLU C 1  75 LEU N  1  75 LEU CA 1  75 LEU C  -88.20 -48.20 -65.67  -70.04 -72.75    .  . 0 "[    .    1    .    2]" 
        96 . 1  75 LEU N 1  75 LEU CA 1  75 LEU C  1  76 ARG N  -54.20 -14.20 -44.08  -49.81 -33.69    .  . 0 "[    .    1    .    2]" 
        97 . 1  75 LEU C 1  76 ARG N  1  76 ARG CA 1  76 ARG C  -88.80 -48.80 -62.55  -62.21 -63.58    .  . 0 "[    .    1    .    2]" 
        98 . 1  76 ARG N 1  76 ARG CA 1  76 ARG C  1  77 GLU N  -48.70  -8.70 -26.97  -41.47 -13.67    .  . 0 "[    .    1    .    2]" 
        99 . 1  76 ARG C 1  77 GLU N  1  77 GLU CA 1  77 GLU C  -98.10 -51.70 -80.76  -98.08 -57.38    .  . 0 "[    .    1    .    2]" 
       100 . 1  77 GLU N 1  77 GLU CA 1  77 GLU C  1  78 GLY N  -65.20  15.40  -1.89   -6.64 -16.10    .  . 0 "[    .    1    .    2]" 
       101 . 1  88 TYR C 1  89 ALA N  1  89 ALA CA 1  89 ALA C  -86.70 -46.70 -65.59  -61.05 -63.22    .  . 0 "[    .    1    .    2]" 
       102 . 1  89 ALA N 1  89 ALA CA 1  89 ALA C  1  90 GLU N  -56.60 -16.60 -56.29  -57.97 -59.50 4.86 11 0 "[    .    1    .    2]" 
       103 . 1  89 ALA C 1  90 GLU N  1  90 GLU CA 1  90 GLU C  -85.30 -45.30 -74.09  -76.82 -77.93    .  . 0 "[    .    1    .    2]" 
       104 . 1  90 GLU N 1  90 GLU CA 1  90 GLU C  1  91 GLU N  -56.80 -16.80 -18.54  -26.00 -14.19 2.61 20 0 "[    .    1    .    2]" 
       105 . 1  90 GLU C 1  91 GLU N  1  91 GLU CA 1  91 GLU C  -88.20 -48.20 -65.19  -71.27 -58.66    .  . 0 "[    .    1    .    2]" 
       106 . 1  91 GLU N 1  91 GLU CA 1  91 GLU C  1  92 GLU N  -59.40 -19.40 -32.46  -36.51 -37.68 0.26 20 0 "[    .    1    .    2]" 
       107 . 1  91 GLU C 1  92 GLU N  1  92 GLU CA 1  92 GLU C  -87.30 -47.30 -66.87  -68.71 -70.20    .  . 0 "[    .    1    .    2]" 
       108 . 1  92 GLU N 1  92 GLU CA 1  92 GLU C  1  93 LEU N  -58.30 -18.30 -29.32  -22.90 -23.45    .  . 0 "[    .    1    .    2]" 
       109 . 1  95 GLN C 1  96 VAL N  1  96 VAL CA 1  96 VAL C  -83.00 -43.00 -67.66  -82.86 -60.92    .  . 0 "[    .    1    .    2]" 
       110 . 1  96 VAL N 1  96 VAL CA 1  96 VAL C  1  97 ARG N  -60.90 -20.90 -41.40  -44.20 -45.11    .  . 0 "[    .    1    .    2]" 
       111 . 1  96 VAL C 1  97 ARG N  1  97 ARG CA 1  97 ARG C  -80.30 -40.30 -60.58  -61.83 -62.51    .  . 0 "[    .    1    .    2]" 
       112 . 1  97 ARG N 1  97 ARG CA 1  97 ARG C  1  98 GLU N  -58.00 -18.00 -38.70  -50.17 -25.78    .  . 0 "[    .    1    .    2]" 
       113 . 1  97 ARG C 1  98 GLU N  1  98 GLU CA 1  98 GLU C  -86.00 -46.00 -71.37  -72.48 -74.94    .  . 0 "[    .    1    .    2]" 
       114 . 1  98 GLU N 1  98 GLU CA 1  98 GLU C  1  99 ALA N  -60.60 -20.60 -34.57  -36.35 -37.08    .  . 0 "[    .    1    .    2]" 
       115 . 1  98 GLU C 1  99 ALA N  1  99 ALA CA 1  99 ALA C  -84.90 -44.90 -59.95  -65.71 -53.72    .  . 0 "[    .    1    .    2]" 
       116 . 1  99 ALA N 1  99 ALA CA 1  99 ALA C  1 100 LEU N  -62.80 -22.80 -50.14  -49.25 -49.36    .  . 0 "[    .    1    .    2]" 
       117 . 1  99 ALA C 1 100 LEU N  1 100 LEU CA 1 100 LEU C  -84.20 -44.20 -62.48  -66.34 -58.55    .  . 0 "[    .    1    .    2]" 
       118 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C  1 101 ARG N  -59.00 -19.00 -41.51  -40.64 -41.92    .  . 0 "[    .    1    .    2]" 
       119 . 1 100 LEU C 1 101 ARG N  1 101 ARG CA 1 101 ARG C  -85.20 -45.20 -63.83  -69.17 -59.02    .  . 0 "[    .    1    .    2]" 
       120 . 1 101 ARG N 1 101 ARG CA 1 101 ARG C  1 102 LYS N  -57.90 -17.90 -36.27  -35.44 -35.96    .  . 0 "[    .    1    .    2]" 
       121 . 1 101 ARG C 1 102 LYS N  1 102 LYS CA 1 102 LYS C  -87.80 -47.80 -64.95  -68.40 -61.66    .  . 0 "[    .    1    .    2]" 
       122 . 1 102 LYS N 1 102 LYS CA 1 102 LYS C  1 103 ALA N  -58.00 -18.00 -43.60  -41.21 -42.30    .  . 0 "[    .    1    .    2]" 
       123 . 1 102 LYS C 1 103 ALA N  1 103 ALA CA 1 103 ALA C  -86.20 -46.20 -63.38  -61.67 -62.89    .  . 0 "[    .    1    .    2]" 
       124 . 1 103 ALA N 1 103 ALA CA 1 103 ALA C  1 104 GLU N  -58.50 -18.50 -45.04  -51.68 -38.38    .  . 0 "[    .    1    .    2]" 
       125 . 1 103 ALA C 1 104 GLU N  1 104 GLU CA 1 104 GLU C  -84.80 -44.80 -59.94  -59.71 -61.21    .  . 0 "[    .    1    .    2]" 
       126 . 1 104 GLU N 1 104 GLU CA 1 104 GLU C  1 105 LYS N  -58.00 -18.00 -44.79  -53.84 -33.41    .  . 0 "[    .    1    .    2]" 
       127 . 1 104 GLU C 1 105 LYS N  1 105 LYS CA 1 105 LYS C  -88.70 -48.70 -67.42  -63.77 -65.63    .  . 0 "[    .    1    .    2]" 
       128 . 1 105 LYS N 1 105 LYS CA 1 105 LYS C  1 106 GLU N  -57.80 -17.80 -34.30  -44.16 -18.41    .  . 0 "[    .    1    .    2]" 
       129 . 1 106 GLU C 1 107 LEU N  1 107 LEU CA 1 107 LEU C  -88.20 -48.20 -62.34  -71.01 -56.82    .  . 0 "[    .    1    .    2]" 
       130 . 1 107 LEU N 1 107 LEU CA 1 107 LEU C  1 108 GLU N  -55.40 -15.40 -38.60  -44.00 -23.14    .  . 0 "[    .    1    .    2]" 
       131 . 1 107 LEU C 1 108 GLU N  1 108 GLU CA 1 108 GLU C  -82.60 -42.60 -58.77  -66.59 -54.93    .  . 0 "[    .    1    .    2]" 
       132 . 1 108 GLU N 1 108 GLU CA 1 108 GLU C  1 109 SER N  -53.40 -13.40 -48.77  -42.65 -46.28    .  . 0 "[    .    1    .    2]" 
       133 . 1 108 GLU C 1 109 SER N  1 109 SER CA 1 109 SER C  -91.30 -51.30 -62.81  -67.18 -57.45    .  . 0 "[    .    1    .    2]" 
       134 . 1 109 SER N 1 109 SER CA 1 109 SER C  1 110 HIS N  -43.60  -3.60 -32.50  -31.34 -32.05    .  . 0 "[    .    1    .    2]" 
       135 . 1 109 SER C 1 110 HIS N  1 110 HIS CA 1 110 HIS C -118.10 -78.10 -77.31  -78.41 -73.90 4.20  9 0 "[    .    1    .    2]" 
       136 . 1 110 HIS N 1 110 HIS CA 1 110 HIS C  1 111 SER N  -20.70  23.90 -17.58  -20.80 -21.98 4.09  9 0 "[    .    1    .    2]" 
       137 . 1 111 SER C 1 112 SER N  1 112 SER CA 1 112 SER C -106.10 -28.30 -68.72  -63.93 -66.58    .  . 0 "[    .    1    .    2]" 
       138 . 1 112 SER N 1 112 SER CA 1 112 SER C  1 113 TRP N  -51.60   9.80 -10.52  -51.52  13.69 3.89  3 0 "[    .    1    .    2]" 
    stop_

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