NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage program type subtype subsubtype
516307 1e8l 1093 cing recoord 4-filtered-FRED Wattos check violation dihedral angle


data_1e8l


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              110
    _TA_constraint_stats_list.Viol_count                    1002
    _TA_constraint_stats_list.Viol_total                    54939.49
    _TA_constraint_stats_list.Viol_max                      5.36
    _TA_constraint_stats_list.Viol_rms                      0.63
    _TA_constraint_stats_list.Viol_average_all_restraints   0.20
    _TA_constraint_stats_list.Viol_average_violations_only  1.10
    _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   1 LYS C 1   2 VAL N  1   2 VAL CA 1   2 VAL C   -160.00  -80.00 -102.11 -113.76  -84.96    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         2 . 1   4 GLY C 1   5 ARG N  1   5 ARG CA 1   5 ARG C    -90.00  -30.00  -79.70  -90.47  -90.49 0.81 11 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         3 . 1   5 ARG C 1   6 CYS N  1   6 CYS CA 1   6 CYS C    -90.00  -30.00  -83.03  -86.65  -78.77    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         4 . 1   6 CYS C 1   7 GLU N  1   7 GLU CA 1   7 GLU C    -90.00  -30.00  -45.87  -45.90  -45.96    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         5 . 1   7 GLU C 1   8 LEU N  1   8 LEU CA 1   8 LEU C    -90.00  -30.00  -66.09  -70.09  -62.02    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         6 . 1   8 LEU C 1   9 ALA N  1   9 ALA CA 1   9 ALA C    -90.00  -30.00  -59.78  -61.37  -61.55    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         7 . 1   9 ALA C 1  10 ALA N  1  10 ALA CA 1  10 ALA C    -90.00  -30.00  -50.83  -52.74  -49.63    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         8 . 1  10 ALA C 1  11 ALA N  1  11 ALA CA 1  11 ALA C    -90.00  -30.00  -65.05  -64.25  -64.37    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
         9 . 1  11 ALA C 1  12 MET N  1  12 MET CA 1  12 MET C    -90.00  -30.00  -60.45  -61.25  -61.46    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        10 . 1  12 MET C 1  13 LYS N  1  13 LYS CA 1  13 LYS C    -90.00  -30.00  -51.94  -55.50  -49.46    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        11 . 1  13 LYS C 1  14 ARG N  1  14 ARG CA 1  14 ARG C    -90.00  -30.00  -63.86  -62.11  -62.33    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        12 . 1  14 ARG C 1  15 HIS N  1  15 HIS CA 1  15 HIS C   -160.00  -80.00  -76.76  -76.48  -76.51 3.85 50 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        13 . 1  26 GLY C 1  27 ASN N  1  27 ASN CA 1  27 ASN C    -90.00  -30.00  -68.39  -73.85  -59.61    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        14 . 1  29 VAL C 1  30 CYS N  1  30 CYS CA 1  30 CYS C    -90.00  -30.00  -59.40  -57.54  -57.91    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        15 . 1  30 CYS C 1  31 ALA N  1  31 ALA CA 1  31 ALA C    -90.00  -30.00  -63.06  -65.68  -61.22    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        16 . 1  31 ALA C 1  32 ALA N  1  32 ALA CA 1  32 ALA C    -90.00  -30.00  -67.92  -68.56  -68.64    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        17 . 1  32 ALA C 1  33 LYS N  1  33 LYS CA 1  33 LYS C    -90.00  -30.00  -48.77  -46.34  -46.57    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        18 . 1  35 GLU C 1  36 SER N  1  36 SER CA 1  36 SER C   -160.00  -80.00 -132.25 -136.13 -125.70    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        19 . 1  38 PHE C 1  39 ASN N  1  39 ASN CA 1  39 ASN C   -160.00  -80.00  -83.05  -89.28  -79.04 0.96  5 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        20 . 1  40 THR C 1  41 GLN N  1  41 GLN CA 1  41 GLN C   -160.00  -80.00 -104.90 -116.95  -89.83    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        21 . 1  42 ALA C 1  43 THR N  1  43 THR CA 1  43 THR C   -160.00  -80.00 -126.93 -122.65 -122.95    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        22 . 1  43 THR C 1  44 ASN N  1  44 ASN CA 1  44 ASN C   -160.00  -80.00 -130.88 -126.39 -126.58    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        23 . 1  45 ARG C 1  46 ASN N  1  46 ASN CA 1  46 ASN C   -160.00  -80.00 -103.92 -108.91 -109.90    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        24 . 1  50 SER C 1  51 THR N  1  51 THR CA 1  51 THR C   -160.00  -80.00 -149.58 -161.02 -138.99 1.02 31 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        25 . 1  51 THR C 1  52 ASP N  1  52 ASP CA 1  52 ASP C   -160.00  -80.00 -114.16 -115.42 -115.96    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        26 . 1  52 ASP C 1  53 TYR N  1  53 TYR CA 1  53 TYR C   -160.00  -80.00  -96.15 -103.30  -85.75    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        27 . 1  55 ILE C 1  56 LEU N  1  56 LEU CA 1  56 LEU C   -160.00  -80.00 -109.76 -109.40 -109.80    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        28 . 1  61 ARG C 1  62 TRP N  1  62 TRP CA 1  62 TRP C   -160.00  -80.00 -132.29 -162.03  -78.20 2.03 16 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        29 . 1  64 CYS C 1  65 ASN N  1  65 ASN CA 1  65 ASN C   -160.00  -80.00  -97.81 -105.38  -89.63    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        30 . 1  65 ASN C 1  66 ASP N  1  66 ASP CA 1  66 ASP C   -160.00  -80.00  -97.73  -97.06  -97.37    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        31 . 1  67 GLY C 1  68 ARG N  1  68 ARG CA 1  68 ARG C   -160.00  -80.00  -91.72 -133.06  -80.03    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        32 . 1  68 ARG C 1  69 THR N  1  69 THR CA 1  69 THR C   -160.00  -80.00 -132.95 -151.76  -74.64 5.36 38 2 "[    .    1    .    2    .    3    .  +-4    .    5]" 
        33 . 1  79 PRO C 1  80 CYS N  1  80 CYS CA 1  80 CYS C    -90.00  -30.00  -60.92  -69.83  -53.28    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        34 . 1  80 CYS C 1  81 SER N  1  81 SER CA 1  81 SER C    -90.00  -30.00  -55.79  -66.91  -46.12    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        35 . 1  83 LEU C 1  84 LEU N  1  84 LEU CA 1  84 LEU C   -160.00  -80.00 -104.85 -116.71  -88.18    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        36 . 1  88 ILE C 1  89 THR N  1  89 THR CA 1  89 THR C    -90.00  -30.00  -49.83  -46.63  -46.91    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        37 . 1  89 THR C 1  90 ALA N  1  90 ALA CA 1  90 ALA C    -90.00  -30.00  -63.75  -68.94  -56.85    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        38 . 1  92 VAL C 1  93 ASN N  1  93 ASN CA 1  93 ASN C    -90.00  -30.00  -46.93  -42.71  -42.94    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        39 . 1  95 ALA C 1  96 LYS N  1  96 LYS CA 1  96 LYS C    -90.00  -30.00  -51.13  -55.27  -47.82    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        40 . 1  97 LYS C 1  98 ILE N  1  98 ILE CA 1  98 ILE C    -90.00  -30.00  -61.73  -67.47  -57.91    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        41 . 1 107 ALA C 1 108 TRP N  1 108 TRP CA 1 108 TRP C   -160.00  -80.00  -83.33  -80.76  -82.45 1.60 25 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        42 . 1 108 TRP C 1 109 VAL N  1 109 VAL CA 1 109 VAL C    -90.00  -30.00  -75.07  -73.57  -73.78    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        43 . 1 111 TRP C 1 112 ARG N  1 112 ARG CA 1 112 ARG C    -90.00  -30.00  -92.90  -94.01  -90.68 4.01 30 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        44 . 1 113 ASN C 1 114 ARG N  1 114 ARG CA 1 114 ARG C   -160.00  -80.00 -105.45 -116.11  -94.60    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        45 . 1 114 ARG C 1 115 CYS N  1 115 CYS CA 1 115 CYS C   -160.00  -80.00 -113.39 -118.59  -94.67    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        46 . 1 117 GLY C 1 118 THR N  1 118 THR CA 1 118 THR C   -160.00  -80.00 -117.94 -117.16 -117.19    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        47 . 1 119 ASP C 1 120 VAL N  1 120 VAL CA 1 120 VAL C    -90.00  -30.00  -74.62  -75.46  -75.59    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        48 . 1 120 VAL C 1 121 GLN N  1 121 GLN CA 1 121 GLN C    -90.00  -30.00  -59.30  -59.19  -59.23    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        49 . 1 121 GLN C 1 122 ALA N  1 122 ALA CA 1 122 ALA C    -90.00  -30.00  -90.10  -90.29  -87.36 0.29 44 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        50 . 1 123 TRP C 1 124 ILE N  1 124 ILE CA 1 124 ILE C   -160.00  -80.00 -124.79 -129.13 -113.05    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        51 . 1 128 ARG C 1 129 LEU N  1 129 LEU CA 1 129 LEU C   -160.00  -80.00 -138.41 -160.07  -93.95 0.07 26 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        52 . 1   3 PHE N 1   3 PHE CA 1   3 PHE CB 1   3 PHE CG   -90.00  -30.00  -73.11  -68.22  -69.87 0.24 33 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        53 . 1   6 CYS N 1   6 CYS CA 1   6 CYS CB 1   6 CYS SG   -90.00  -30.00  -37.74  -42.47  -42.80 0.04 29 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        54 . 1  15 HIS N 1  15 HIS CA 1  15 HIS CB 1  15 HIS CG   -90.00  -30.00  -84.14  -87.55  -88.20 0.23 15 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        55 . 1  18 ASP N 1  18 ASP CA 1  18 ASP CB 1  18 ASP CG   150.00 -150.00  157.13  152.24  152.11    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        56 . 1  20 TYR N 1  20 TYR CA 1  20 TYR CB 1  20 TYR CG   150.00 -150.00 -171.14 -178.73 -161.43    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        57 . 1  23 TYR N 1  23 TYR CA 1  23 TYR CB 1  23 TYR CG   -90.00  -30.00  -77.30  -90.32  -68.18 0.32 48 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        58 . 1  27 ASN N 1  27 ASN CA 1  27 ASN CB 1  27 ASN CG   -90.00  -30.00  -54.30  -57.34  -58.93    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        59 . 1  30 CYS N 1  30 CYS CA 1  30 CYS CB 1  30 CYS SG   150.00 -150.00 -164.61 -163.31 -163.80    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        60 . 1  34 PHE N 1  34 PHE CA 1  34 PHE CB 1  34 PHE CG   -90.00  -30.00  -91.11  -91.23  -90.69 1.23 28 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        61 . 1  39 ASN N 1  39 ASN CA 1  39 ASN CB 1  39 ASN CG   150.00 -150.00 -166.34 -170.64 -171.35 0.43 32 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        62 . 1  46 ASN N 1  46 ASN CA 1  46 ASN CB 1  46 ASN CG   -90.00  -30.00  -38.68  -47.31  -35.23    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        63 . 1  48 ASP N 1  48 ASP CA 1  48 ASP CB 1  48 ASP CG    30.00   90.00   54.65   64.34   53.61    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        64 . 1  52 ASP N 1  52 ASP CA 1  52 ASP CB 1  52 ASP CG   -90.00  -30.00  -59.78  -66.69  -29.89 0.11  4 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        65 . 1  53 TYR N 1  53 TYR CA 1  53 TYR CB 1  53 TYR CG   -90.00  -30.00  -58.02  -55.27  -55.74    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        66 . 1  59 ASN N 1  59 ASN CA 1  59 ASN CB 1  59 ASN CG   150.00 -150.00 -178.00 -175.62 -175.80    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        67 . 1  61 ARG N 1  61 ARG CA 1  61 ARG CB 1  61 ARG CG   150.00 -150.00 -156.62 -174.32 -149.59 0.41  4 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        68 . 1  64 CYS N 1  64 CYS CA 1  64 CYS CB 1  64 CYS SG    30.00   90.00   86.21   72.89   92.10 2.10 18 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        69 . 1  66 ASP N 1  66 ASP CA 1  66 ASP CB 1  66 ASP CG    30.00   90.00   68.34   51.95   73.74    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        70 . 1  75 LEU N 1  75 LEU CA 1  75 LEU CB 1  75 LEU CG   -90.00  -30.00  -93.24  -93.12  -93.31 4.60 27 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        71 . 1  87 ASP N 1  87 ASP CA 1  87 ASP CB 1  87 ASP CG   150.00 -150.00 -169.77  178.65 -165.05    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        72 . 1  94 CYS N 1  94 CYS CA 1  94 CYS CB 1  94 CYS SG   150.00 -150.00 -151.37 -161.81 -148.05 1.95 11 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        73 . 1 119 ASP N 1 119 ASP CA 1 119 ASP CB 1 119 ASP CG   150.00 -150.00 -149.74 -149.94 -149.59 0.41  9 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        74 . 1 123 TRP N 1 123 TRP CA 1 123 TRP CB 1 123 TRP CG   -90.00  -30.00  -89.90  -90.25  -90.26 0.54 33 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        75 . 1 127 CYS N 1 127 CYS CA 1 127 CYS CB 1 127 CYS SG   -90.00  -30.00  -87.63  -91.06  -28.85 1.15 29 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        76 . 1   2 VAL N 1   2 VAL CA 1   2 VAL CB 1   2 VAL CG1  150.00 -150.00  171.33  171.43  171.20    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        77 . 1   8 LEU N 1   8 LEU CA 1   8 LEU CB 1   8 LEU CG   150.00 -150.00  170.75 -176.50 -177.27 0.40 43 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        78 . 1  12 MET N 1  12 MET CA 1  12 MET CB 1  12 MET CG   -90.00  -30.00  -44.66  -67.06  -39.43    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        79 . 1  17 LEU N 1  17 LEU CA 1  17 LEU CB 1  17 LEU CG   -90.00  -30.00  -39.39  -43.26  -35.90    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        80 . 1  24 SER N 1  24 SER CA 1  24 SER CB 1  24 SER OG    30.00   90.00   69.22   70.39   70.22    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        81 . 1  28 TRP N 1  28 TRP CA 1  28 TRP CB 1  28 TRP CG   -90.00  -30.00  -60.93  -65.07  -54.88    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        82 . 1  29 VAL N 1  29 VAL CA 1  29 VAL CB 1  29 VAL CG1  150.00 -150.00  178.09  178.64  177.82    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        83 . 1  33 LYS N 1  33 LYS CA 1  33 LYS CB 1  33 LYS CG   150.00 -150.00 -175.81  158.84 -160.01    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        84 . 1  36 SER N 1  36 SER CA 1  36 SER CB 1  36 SER OG    30.00   90.00   50.30   47.82   47.63    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        85 . 1  38 PHE N 1  38 PHE CA 1  38 PHE CB 1  38 PHE CG   -90.00  -30.00  -67.34  -77.54  -50.98    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        86 . 1  40 THR N 1  40 THR CA 1  40 THR CB 1  40 THR OG1   30.00   90.00   91.61   90.97   92.66 2.66 45 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        87 . 1  41 GLN N 1  41 GLN CA 1  41 GLN CB 1  41 GLN CG   -90.00  -30.00  -91.93  -91.83  -91.87 2.85 42 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        88 . 1  43 THR N 1  43 THR CA 1  43 THR CB 1  43 THR OG1   30.00   90.00   84.61   88.67   88.29 0.36 12 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        89 . 1  47 THR N 1  47 THR CA 1  47 THR CB 1  47 THR OG1   30.00   90.00   56.47   53.42   64.49    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        90 . 1  50 SER N 1  50 SER CA 1  50 SER CB 1  50 SER OG    30.00   90.00   30.02   29.26   36.43 0.74 17 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        91 . 1  51 THR N 1  51 THR CA 1  51 THR CB 1  51 THR OG1  -90.00  -30.00  -41.51  -65.39  -29.79 0.21 46 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        92 . 1  57 GLN N 1  57 GLN CA 1  57 GLN CB 1  57 GLN CG   -90.00  -30.00  -57.59  -57.97  -58.45    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        93 . 1  60 SER N 1  60 SER CA 1  60 SER CB 1  60 SER OG    30.00   90.00   86.01   82.08   81.77 0.17 28 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        94 . 1  65 ASN N 1  65 ASN CA 1  65 ASN CB 1  65 ASN CG   150.00 -150.00 -170.44 -165.35 -167.48 0.13 39 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        95 . 1  69 THR N 1  69 THR CA 1  69 THR CB 1  69 THR OG1  -90.00  -30.00  -36.69  -29.89  -29.91 0.21 20 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        96 . 1  74 ASN N 1  74 ASN CA 1  74 ASN CB 1  74 ASN CG   150.00 -150.00 -156.63 -149.86 -149.89 0.19 10 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        97 . 1  80 CYS N 1  80 CYS CA 1  80 CYS CB 1  80 CYS SG   -90.00  -30.00  -47.66  -35.60  -36.24 1.33 17 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        98 . 1  81 SER N 1  81 SER CA 1  81 SER CB 1  81 SER OG    30.00   90.00   59.35   69.80   67.70    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
        99 . 1  84 LEU N 1  84 LEU CA 1  84 LEU CB 1  84 LEU CG   -90.00  -30.00  -38.77  -67.18  -29.81 0.19 21 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       100 . 1  88 ILE N 1  88 ILE CA 1  88 ILE CB 1  88 ILE CG1   30.00   90.00   30.23   29.42   29.36 1.09  6 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       101 . 1  89 THR N 1  89 THR CA 1  89 THR CB 1  89 THR OG1  -90.00  -30.00  -47.07  -63.10  -31.88    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       102 . 1  92 VAL N 1  92 VAL CA 1  92 VAL CB 1  92 VAL CG1  150.00 -150.00  169.61  171.02  170.80    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       103 . 1 105 MET N 1 105 MET CA 1 105 MET CB 1 105 MET CG   -90.00  -30.00  -36.12  -59.44  -28.72 1.28 45 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       104 . 1 106 ASN N 1 106 ASN CA 1 106 ASN CB 1 106 ASN CG   -90.00  -30.00  -57.50  -91.69  -91.75 1.76 14 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       105 . 1 111 TRP N 1 111 TRP CA 1 111 TRP CB 1 111 TRP CG   150.00 -150.00 -179.87  179.81  179.74    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       106 . 1 114 ARG N 1 114 ARG CA 1 114 ARG CB 1 114 ARG CG   -90.00  -30.00  -90.78  -91.89  -90.50 1.89 32 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       107 . 1 116 LYS N 1 116 LYS CA 1 116 LYS CB 1 116 LYS CG   150.00 -150.00 -163.08 -179.97 -149.91 0.09 32 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       108 . 1 118 THR N 1 118 THR CA 1 118 THR CB 1 118 THR OG1   30.00   90.00   59.20   60.20   60.00    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       109 . 1 120 VAL N 1 120 VAL CA 1 120 VAL CB 1 120 VAL CG1  -90.00  -30.00  -64.99  -63.67  -64.75    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
       110 . 1 124 ILE N 1 124 ILE CA 1 124 ILE CB 1 124 ILE CG1   30.00   90.00   48.52   36.10   53.26    .  . 0 "[    .    1    .    2    .    3    .    4    .    5]" 
    stop_

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