NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord in_dress stage program type subtype subsubtype
372263 1d5v cing recoord dress 4-filtered-FRED Wattos check violation dihedral angle


data_1d5v


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              137
    _TA_constraint_stats_list.Viol_count                    105
    _TA_constraint_stats_list.Viol_total                    2786.71
    _TA_constraint_stats_list.Viol_max                      3.95
    _TA_constraint_stats_list.Viol_rms                      0.23
    _TA_constraint_stats_list.Viol_average_all_restraints   0.03
    _TA_constraint_stats_list.Viol_average_violations_only  1.06
    _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 MET C  1  2 LEU N  1  2 LEU CA  1  2 LEU C   -178.00   -2.00  -91.30  -86.93  -98.59    .  . 0 "[    .    1    .    2    .]" 
         2 . 1  2 LEU C  1  3 VAL N  1  3 VAL CA  1  3 VAL C   -178.00   -2.00 -134.66 -130.49 -135.13    .  . 0 "[    .    1    .    2    .]" 
         3 . 1  3 VAL C  1  4 LYS N  1  4 LYS CA  1  4 LYS C    -90.00  -40.00  -70.52  -59.63  -66.74    .  . 0 "[    .    1    .    2    .]" 
         4 . 1  4 LYS C  1  5 PRO N  1  5 PRO CA  1  5 PRO C    -90.00  -30.00  -66.42  -50.79  -72.15    .  . 0 "[    .    1    .    2    .]" 
         5 . 1  5 PRO C  1  6 PRO N  1  6 PRO CA  1  6 PRO C    -90.00  -30.00  -66.55  -82.25  -39.64    .  . 0 "[    .    1    .    2    .]" 
         6 . 1  6 PRO C  1  7 TYR N  1  7 TYR CA  1  7 TYR C   -178.00   -2.00  -77.41 -111.31  -59.96    .  . 0 "[    .    1    .    2    .]" 
         7 . 1  7 TYR C  1  8 SER N  1  8 SER CA  1  8 SER C    -90.00  -40.00  -75.67  -72.08  -73.33    .  . 0 "[    .    1    .    2    .]" 
         8 . 1  8 SER C  1  9 TYR N  1  9 TYR CA  1  9 TYR C    -90.00  -40.00  -60.01  -59.92  -59.93    .  . 0 "[    .    1    .    2    .]" 
         9 . 1  9 TYR C  1 10 ILE N  1 10 ILE CA  1 10 ILE C    -90.00  -40.00  -65.43  -65.83  -65.95    .  . 0 "[    .    1    .    2    .]" 
        10 . 1 10 ILE C  1 11 ALA N  1 11 ALA CA  1 11 ALA C    -90.00  -40.00  -63.57  -65.65  -66.71    .  . 0 "[    .    1    .    2    .]" 
        11 . 1 11 ALA C  1 12 LEU N  1 12 LEU CA  1 12 LEU C    -90.00  -40.00  -60.09  -59.85  -59.93    .  . 0 "[    .    1    .    2    .]" 
        12 . 1 12 LEU C  1 13 ILE N  1 13 ILE CA  1 13 ILE C    -90.00  -40.00  -66.89  -70.08  -60.03    .  . 0 "[    .    1    .    2    .]" 
        13 . 1 13 ILE C  1 14 THR N  1 14 THR CA  1 14 THR C    -90.00  -40.00  -63.01  -64.38  -65.28    .  . 0 "[    .    1    .    2    .]" 
        14 . 1 14 THR C  1 15 MET N  1 15 MET CA  1 15 MET C    -90.00  -40.00  -68.59  -70.02  -70.04    .  . 0 "[    .    1    .    2    .]" 
        15 . 1 15 MET C  1 16 ALA N  1 16 ALA CA  1 16 ALA C    -90.00  -40.00  -58.74  -61.10  -50.37    .  . 0 "[    .    1    .    2    .]" 
        16 . 1 16 ALA C  1 17 ILE N  1 17 ILE CA  1 17 ILE C    -90.00  -40.00  -61.17  -62.33  -64.46    .  . 0 "[    .    1    .    2    .]" 
        17 . 1 17 ILE C  1 18 GLN N  1 18 GLN CA  1 18 GLN C    -90.00  -40.00  -64.34  -63.87  -65.19    .  . 0 "[    .    1    .    2    .]" 
        18 . 1 18 GLN C  1 19 ASN N  1 19 ASN CA  1 19 ASN C    -90.00  -40.00  -78.91  -84.01  -89.98 1.11 15 0 "[    .    1    .    2    .]" 
        19 . 1 19 ASN C  1 20 ALA N  1 20 ALA CA  1 20 ALA C   -160.00  -80.00  -78.74  -79.07  -79.20 3.22 10 0 "[    .    1    .    2    .]" 
        20 . 1 20 ALA C  1 21 PRO N  1 21 PRO CA  1 21 PRO C    -90.00  -30.00  -50.74  -66.97  -33.60    .  . 0 "[    .    1    .    2    .]" 
        21 . 1 21 PRO C  1 22 GLU N  1 22 GLU CA  1 22 GLU C   -178.00   -2.00 -116.21 -120.03 -122.92    .  . 0 "[    .    1    .    2    .]" 
        22 . 1 22 GLU C  1 23 LYS N  1 23 LYS CA  1 23 LYS C   -178.00   -2.00  -67.30  -59.97  -60.00    .  . 0 "[    .    1    .    2    .]" 
        23 . 1 23 LYS C  1 24 LYS N  1 24 LYS CA  1 24 LYS C   -160.00  -80.00  -80.29  -83.87  -85.99 3.03 21 0 "[    .    1    .    2    .]" 
        24 . 1 24 LYS C  1 25 ILE N  1 25 ILE CA  1 25 ILE C   -178.00   -2.00 -128.12 -150.16  -56.87    .  . 0 "[    .    1    .    2    .]" 
        25 . 1 25 ILE C  1 26 THR N  1 26 THR CA  1 26 THR C   -160.00  -80.00  -81.24  -90.37  -79.03 0.97 18 0 "[    .    1    .    2    .]" 
        26 . 1 26 THR C  1 27 LEU N  1 27 LEU CA  1 27 LEU C    -90.00  -40.00  -60.35  -66.32  -59.93    .  . 0 "[    .    1    .    2    .]" 
        27 . 1 27 LEU C  1 28 ASN N  1 28 ASN CA  1 28 ASN C    -90.00  -40.00  -60.96  -62.77  -63.46    .  . 0 "[    .    1    .    2    .]" 
        28 . 1 29 GLY C  1 30 ILE N  1 30 ILE CA  1 30 ILE C    -90.00  -40.00  -60.20  -60.80  -59.95    .  . 0 "[    .    1    .    2    .]" 
        29 . 1 30 ILE C  1 31 TYR N  1 31 TYR CA  1 31 TYR C    -90.00  -40.00  -60.49  -59.89  -59.96    .  . 0 "[    .    1    .    2    .]" 
        30 . 1 31 TYR C  1 32 GLN N  1 32 GLN CA  1 32 GLN C    -90.00  -40.00  -60.52  -66.85  -57.37    .  . 0 "[    .    1    .    2    .]" 
        31 . 1 32 GLN C  1 33 PHE N  1 33 PHE CA  1 33 PHE C    -90.00  -40.00  -60.52  -59.98  -59.99    .  . 0 "[    .    1    .    2    .]" 
        32 . 1 33 PHE C  1 34 ILE N  1 34 ILE CA  1 34 ILE C    -90.00  -40.00  -61.95  -69.98  -59.93    .  . 0 "[    .    1    .    2    .]" 
        33 . 1 34 ILE C  1 35 MET N  1 35 MET CA  1 35 MET C    -90.00  -40.00  -61.88  -60.34  -60.64    .  . 0 "[    .    1    .    2    .]" 
        34 . 1 35 MET C  1 36 ASP N  1 36 ASP CA  1 36 ASP C    -90.00  -40.00  -66.93  -72.09  -73.99    .  . 0 "[    .    1    .    2    .]" 
        35 . 1 36 ASP C  1 37 ARG N  1 37 ARG CA  1 37 ARG C   -178.00   -2.00  -70.82  -89.17  -60.06    .  . 0 "[    .    1    .    2    .]" 
        36 . 1 37 ARG C  1 38 PHE N  1 38 PHE CA  1 38 PHE C   -160.00  -80.00 -116.07 -120.13 -121.63    .  . 0 "[    .    1    .    2    .]" 
        37 . 1 38 PHE C  1 39 PRO N  1 39 PRO CA  1 39 PRO C    -90.00  -40.00  -69.74  -80.64  -81.51    .  . 0 "[    .    1    .    2    .]" 
        38 . 1 39 PRO C  1 40 PHE N  1 40 PHE CA  1 40 PHE C    -90.00  -40.00  -59.91  -60.57  -58.47    .  . 0 "[    .    1    .    2    .]" 
        39 . 1 40 PHE C  1 41 TYR N  1 41 TYR CA  1 41 TYR C   -178.00   -2.00  -68.58  -70.98  -63.89    .  . 0 "[    .    1    .    2    .]" 
        40 . 1 41 TYR C  1 42 ARG N  1 42 ARG CA  1 42 ARG C    -90.00  -40.00  -59.82  -58.84  -59.20    .  . 0 "[    .    1    .    2    .]" 
        41 . 1 42 ARG C  1 43 GLU N  1 43 GLU CA  1 43 GLU C   -178.00   -2.00  -71.45  -93.20  -60.04    .  . 0 "[    .    1    .    2    .]" 
        42 . 1 43 GLU C  1 44 ASN N  1 44 ASN CA  1 44 ASN C   -178.00   -2.00 -119.68 -147.68  -93.96    .  . 0 "[    .    1    .    2    .]" 
        43 . 1 44 ASN C  1 45 LYS N  1 45 LYS CA  1 45 LYS C   -178.00   -2.00  -99.90  -89.16  -90.41    .  . 0 "[    .    1    .    2    .]" 
        44 . 1 45 LYS C  1 46 GLN N  1 46 GLN CA  1 46 GLN C    -90.00  -40.00  -74.61  -90.66  -47.39 0.66 23 0 "[    .    1    .    2    .]" 
        45 . 1 47 GLY C  1 48 TRP N  1 48 TRP CA  1 48 TRP C    -90.00  -40.00  -74.98  -89.98  -51.18    .  . 0 "[    .    1    .    2    .]" 
        46 . 1 48 TRP C  1 49 GLN N  1 49 GLN CA  1 49 GLN C    -90.00  -40.00  -64.90  -86.37  -59.83    .  . 0 "[    .    1    .    2    .]" 
        47 . 1 49 GLN C  1 50 ASN N  1 50 ASN CA  1 50 ASN C    -90.00  -40.00  -71.07  -70.05  -70.07    .  . 0 "[    .    1    .    2    .]" 
        48 . 1 50 ASN C  1 51 SER N  1 51 SER CA  1 51 SER C    -90.00  -40.00  -59.28  -59.85  -59.89    .  . 0 "[    .    1    .    2    .]" 
        49 . 1 51 SER C  1 52 ILE N  1 52 ILE CA  1 52 ILE C    -90.00  -40.00  -62.21  -75.74  -54.06    .  . 0 "[    .    1    .    2    .]" 
        50 . 1 52 ILE C  1 53 ARG N  1 53 ARG CA  1 53 ARG C    -90.00  -40.00  -68.89  -83.59  -59.99    .  . 0 "[    .    1    .    2    .]" 
        51 . 1 53 ARG C  1 54 HIS N  1 54 HIS CA  1 54 HIS C    -90.00  -40.00  -60.55  -59.93  -59.97    .  . 0 "[    .    1    .    2    .]" 
        52 . 1 54 HIS C  1 55 ASN N  1 55 ASN CA  1 55 ASN C    -90.00  -40.00  -65.13  -75.02  -59.98    .  . 0 "[    .    1    .    2    .]" 
        53 . 1 55 ASN C  1 56 LEU N  1 56 LEU CA  1 56 LEU C    -90.00  -40.00  -62.47  -66.72  -68.51    .  . 0 "[    .    1    .    2    .]" 
        54 . 1 56 LEU C  1 57 SER N  1 57 SER CA  1 57 SER C   -178.00   -2.00  -71.85  -75.02 -159.97    .  . 0 "[    .    1    .    2    .]" 
        55 . 1 57 SER C  1 58 LEU N  1 58 LEU CA  1 58 LEU C   -178.00   -2.00  -67.80  -64.17  -65.84    .  . 0 "[    .    1    .    2    .]" 
        56 . 1 58 LEU C  1 59 ASN N  1 59 ASN CA  1 59 ASN C   -178.00   -2.00  -73.67  -85.07  -62.02    .  . 0 "[    .    1    .    2    .]" 
        57 . 1 59 ASN C  1 60 GLU N  1 60 GLU CA  1 60 GLU C    -90.00  -40.00  -89.06  -91.01  -81.97 1.01 18 0 "[    .    1    .    2    .]" 
        58 . 1 60 GLU C  1 61 CYS N  1 61 CYS CA  1 61 CYS C    -90.00  -40.00  -62.53  -62.82  -64.14    .  . 0 "[    .    1    .    2    .]" 
        59 . 1 61 CYS C  1 62 PHE N  1 62 PHE CA  1 62 PHE C   -160.00  -80.00  -80.37  -78.77  -78.95 2.70  9 0 "[    .    1    .    2    .]" 
        60 . 1 62 PHE C  1 63 VAL N  1 63 VAL CA  1 63 VAL C   -160.00  -80.00 -113.17 -115.96 -117.63    .  . 0 "[    .    1    .    2    .]" 
        61 . 1 63 VAL C  1 64 LYS N  1 64 LYS CA  1 64 LYS C   -178.00   -2.00  -82.25  -86.96  -90.64    .  . 0 "[    .    1    .    2    .]" 
        62 . 1 64 LYS C  1 65 VAL N  1 65 VAL CA  1 65 VAL C   -178.00   -2.00 -120.96 -140.19  -84.68    .  . 0 "[    .    1    .    2    .]" 
        63 . 1 65 VAL C  1 66 PRO N  1 66 PRO CA  1 66 PRO C    -90.00  -30.00  -61.95  -82.82  -35.52    .  . 0 "[    .    1    .    2    .]" 
        64 . 1 66 PRO C  1 67 ARG N  1 67 ARG CA  1 67 ARG C   -178.00   -2.00  -91.57 -140.85  -59.32    .  . 0 "[    .    1    .    2    .]" 
        65 . 1 67 ARG C  1 68 ASP N  1 68 ASP CA  1 68 ASP C   -178.00   -2.00  -71.35  -62.67  -64.51    .  . 0 "[    .    1    .    2    .]" 
        66 . 1 68 ASP C  1 69 ASP N  1 69 ASP CA  1 69 ASP C    -90.00  -40.00  -67.25  -62.27  -65.42    .  . 0 "[    .    1    .    2    .]" 
        67 . 1 69 ASP C  1 70 LYS N  1 70 LYS CA  1 70 LYS C   -178.00   -2.00  -66.05  -60.08  -60.11    .  . 0 "[    .    1    .    2    .]" 
        68 . 1 70 LYS C  1 71 LYS N  1 71 LYS CA  1 71 LYS C   -160.00  -80.00 -107.14 -137.65  -77.00 3.00 12 0 "[    .    1    .    2    .]" 
        69 . 1 71 LYS C  1 72 PRO N  1 72 PRO CA  1 72 PRO C    -90.00  -30.00  -74.12  -77.12  -81.40 0.44 23 0 "[    .    1    .    2    .]" 
        70 . 1 73 GLY C  1 74 LYS N  1 74 LYS CA  1 74 LYS C   -178.00   -2.00  -86.57  -61.26  -62.74    .  . 0 "[    .    1    .    2    .]" 
        71 . 1 75 GLY C  1 76 SER N  1 76 SER CA  1 76 SER C   -160.00  -80.00 -121.08 -100.42 -130.03 1.42  6 0 "[    .    1    .    2    .]" 
        72 . 1 76 SER C  1 77 TYR N  1 77 TYR CA  1 77 TYR C   -178.00   -2.00  -89.26 -110.57 -132.10    .  . 0 "[    .    1    .    2    .]" 
        73 . 1 77 TYR C  1 78 TRP N  1 78 TRP CA  1 78 TRP C   -160.00  -80.00 -122.20 -122.96 -126.53    .  . 0 "[    .    1    .    2    .]" 
        74 . 1 78 TRP C  1 79 THR N  1 79 THR CA  1 79 THR C   -160.00  -80.00 -150.26 -155.04 -157.23    .  . 0 "[    .    1    .    2    .]" 
        75 . 1 79 THR C  1 80 LEU N  1 80 LEU CA  1 80 LEU C   -178.00   -2.00  -80.80 -103.96  -59.69    .  . 0 "[    .    1    .    2    .]" 
        76 . 1 80 LEU C  1 81 ASP N  1 81 ASP CA  1 81 ASP C   -178.00   -2.00  -97.35 -140.04 -149.35    .  . 0 "[    .    1    .    2    .]" 
        77 . 1 81 ASP C  1 82 PRO N  1 82 PRO CA  1 82 PRO C    -90.00  -40.00  -65.26  -66.82  -74.55    .  . 0 "[    .    1    .    2    .]" 
        78 . 1 82 PRO C  1 83 ASP N  1 83 ASP CA  1 83 ASP C   -178.00   -2.00  -89.89  -73.45  -76.18    .  . 0 "[    .    1    .    2    .]" 
        79 . 1 83 ASP C  1 84 SER N  1 84 SER CA  1 84 SER C   -178.00   -2.00  -59.81  -69.99  -79.59 3.95 17 0 "[    .    1    .    2    .]" 
        80 . 1 84 SER C  1 85 TYR N  1 85 TYR CA  1 85 TYR C    -90.00  -40.00  -68.17  -64.65  -69.42 0.07 17 0 "[    .    1    .    2    .]" 
        81 . 1 85 TYR C  1 86 ASN N  1 86 ASN CA  1 86 ASN C   -178.00   -2.00 -107.45  -86.91  -96.06    .  . 0 "[    .    1    .    2    .]" 
        82 . 1 86 ASN C  1 87 MET N  1 87 MET CA  1 87 MET C    -90.00  -40.00  -76.24  -91.09  -47.49 1.09 12 0 "[    .    1    .    2    .]" 
        83 . 1 87 MET C  1 88 PHE N  1 88 PHE CA  1 88 PHE C   -178.00   -2.00  -86.98 -150.03  -59.15    .  . 0 "[    .    1    .    2    .]" 
        84 . 1 88 PHE C  1 89 GLU N  1 89 GLU CA  1 89 GLU C   -178.00   -2.00  -91.77  -78.70  -91.66    .  . 0 "[    .    1    .    2    .]" 
        85 . 1 89 GLU C  1 90 ASN N  1 90 ASN CA  1 90 ASN C   -178.00   -2.00  -96.51  -99.97 -125.54    .  . 0 "[    .    1    .    2    .]" 
        86 . 1 91 GLY C  1 92 SER N  1 92 SER CA  1 92 SER C   -178.00   -2.00  -98.07  -73.42  -77.90    .  . 0 "[    .    1    .    2    .]" 
        87 . 1 92 SER C  1 93 PHE N  1 93 PHE CA  1 93 PHE C   -178.00   -2.00  -83.35  -94.75 -103.48    .  . 0 "[    .    1    .    2    .]" 
        88 . 1 93 PHE C  1 94 LEU N  1 94 LEU CA  1 94 LEU C   -178.00   -2.00  -86.91  -91.30 -103.40    .  . 0 "[    .    1    .    2    .]" 
        89 . 1  9 TYR N  1  9 TYR CA 1  9 TYR C   1 10 ILE N    -70.00  -10.00  -39.49  -43.05  -33.93    .  . 0 "[    .    1    .    2    .]" 
        90 . 1 11 ALA N  1 11 ALA CA 1 11 ALA C   1 12 LEU N    -70.00  -10.00  -43.26  -40.00  -40.27    .  . 0 "[    .    1    .    2    .]" 
        91 . 1 12 LEU N  1 12 LEU CA 1 12 LEU C   1 13 ILE N    -70.00  -10.00  -41.23  -41.68  -42.84    .  . 0 "[    .    1    .    2    .]" 
        92 . 1 15 MET N  1 15 MET CA 1 15 MET C   1 16 ALA N    -70.00  -10.00  -38.83  -38.49  -39.12    .  . 0 "[    .    1    .    2    .]" 
        93 . 1 16 ALA N  1 16 ALA CA 1 16 ALA C   1 17 ILE N    -70.00  -10.00  -46.26  -52.34  -41.40    .  . 0 "[    .    1    .    2    .]" 
        94 . 1 27 LEU N  1 27 LEU CA 1 27 LEU C   1 28 ASN N    -70.00  -10.00  -45.86  -51.59  -39.99    .  . 0 "[    .    1    .    2    .]" 
        95 . 1 28 ASN N  1 28 ASN CA 1 28 ASN C   1 29 GLY N    -70.00  -10.00  -40.13  -39.98  -39.99    .  . 0 "[    .    1    .    2    .]" 
        96 . 1 31 TYR N  1 31 TYR CA 1 31 TYR C   1 32 GLN N    -70.00  -10.00  -41.73  -41.34  -41.95    .  . 0 "[    .    1    .    2    .]" 
        97 . 1 32 GLN N  1 32 GLN CA 1 32 GLN C   1 33 PHE N    -70.00  -10.00  -40.26  -44.27  -37.32    .  . 0 "[    .    1    .    2    .]" 
        98 . 1 33 PHE N  1 33 PHE CA 1 33 PHE C   1 34 ILE N    -70.00  -10.00  -47.37  -49.04  -49.08    .  . 0 "[    .    1    .    2    .]" 
        99 . 1 36 ASP N  1 36 ASP CA 1 36 ASP C   1 37 ARG N    -70.00  -10.00  -44.76  -40.13  -43.05    .  . 0 "[    .    1    .    2    .]" 
       100 . 1 40 PHE N  1 40 PHE CA 1 40 PHE C   1 41 TYR N    -70.00  -10.00  -39.86  -44.74  -34.33    .  . 0 "[    .    1    .    2    .]" 
       101 . 1 49 GLN N  1 49 GLN CA 1 49 GLN C   1 50 ASN N    -70.00  -10.00  -50.67  -61.70  -40.89    .  . 0 "[    .    1    .    2    .]" 
       102 . 1 50 ASN N  1 50 ASN CA 1 50 ASN C   1 51 SER N    -70.00  -10.00  -35.02  -35.06  -36.77    .  . 0 "[    .    1    .    2    .]" 
       103 . 1 52 ILE N  1 52 ILE CA 1 52 ILE C   1 53 ARG N    -70.00  -10.00  -51.55  -68.69  -40.05    .  . 0 "[    .    1    .    2    .]" 
       104 . 1 53 ARG N  1 53 ARG CA 1 53 ARG C   1 54 HIS N    -70.00  -10.00  -37.73  -49.62  -27.01    .  . 0 "[    .    1    .    2    .]" 
       105 . 1 54 HIS N  1 54 HIS CA 1 54 HIS C   1 55 ASN N    -70.00  -10.00  -41.00  -42.01  -44.18    .  . 0 "[    .    1    .    2    .]" 
       106 . 1 10 ILE N  1 10 ILE CA 1 10 ILE CB  1 10 ILE CG1  -90.00  -30.00  -60.71  -69.95  -50.06    .  . 0 "[    .    1    .    2    .]" 
       107 . 1 12 LEU N  1 12 LEU CA 1 12 LEU CB  1 12 LEU CG   -90.00  -30.00  -68.52  -69.65  -69.95    .  . 0 "[    .    1    .    2    .]" 
       108 . 1 15 MET N  1 15 MET CA 1 15 MET CB  1 15 MET CG   -90.00  -30.00  -70.08  -71.27  -69.91    .  . 0 "[    .    1    .    2    .]" 
       109 . 1 18 GLN N  1 18 GLN CA 1 18 GLN CB  1 18 GLN CG   -90.00  -30.00  -69.08  -68.11  -68.32    .  . 0 "[    .    1    .    2    .]" 
       110 . 1 28 ASN N  1 28 ASN CA 1 28 ASN CB  1 28 ASN CG   -90.00  -30.00  -70.03  -69.93  -69.96    .  . 0 "[    .    1    .    2    .]" 
       111 . 1 30 ILE N  1 30 ILE CA 1 30 ILE CB  1 30 ILE CG1  -90.00  -30.00  -66.90  -70.02  -62.51    .  . 0 "[    .    1    .    2    .]" 
       112 . 1 31 TYR N  1 31 TYR CA 1 31 TYR CB  1 31 TYR CG   -90.00  -30.00  -76.83  -83.71  -56.67    .  . 0 "[    .    1    .    2    .]" 
       113 . 1 35 MET N  1 35 MET CA 1 35 MET CB  1 35 MET CG   -90.00  -30.00  -71.10  -77.85  -64.84    .  . 0 "[    .    1    .    2    .]" 
       114 . 1 36 ASP N  1 36 ASP CA 1 36 ASP CB  1 36 ASP CG   -90.00  -30.00  -70.27  -70.52  -71.28    .  . 0 "[    .    1    .    2    .]" 
       115 . 1 41 TYR N  1 41 TYR CA 1 41 TYR CB  1 41 TYR CG   -90.00  -30.00  -66.63  -67.53  -68.08    .  . 0 "[    .    1    .    2    .]" 
       116 . 1 50 ASN N  1 50 ASN CA 1 50 ASN CB  1 50 ASN CG   -90.00  -30.00  -68.08  -65.62  -68.42    .  . 0 "[    .    1    .    2    .]" 
       117 . 1 52 ILE N  1 52 ILE CA 1 52 ILE CB  1 52 ILE CG1  -90.00  -30.00  -66.28  -63.55  -63.93    .  . 0 "[    .    1    .    2    .]" 
       118 . 1 69 ASP N  1 69 ASP CA 1 69 ASP CB  1 69 ASP CG   -90.00  -30.00  -69.19  -72.59  -54.89    .  . 0 "[    .    1    .    2    .]" 
       119 . 1 70 LYS N  1 70 LYS CA 1 70 LYS CB  1 70 LYS CG   -90.00  -30.00  -68.77  -69.43  -69.78    .  . 0 "[    .    1    .    2    .]" 
       120 . 1 74 LYS N  1 74 LYS CA 1 74 LYS CB  1 74 LYS CG   -90.00  -30.00  -67.89  -83.85  -48.37    .  . 0 "[    .    1    .    2    .]" 
       121 . 1 10 ILE CA 1 10 ILE CB 1 10 ILE CG1 1 10 ILE CD1  150.00  -30.00  -86.82  167.84  -49.58    .  . 0 "[    .    1    .    2    .]" 
       122 . 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG  1 12 LEU CD1  150.00 -150.00  170.78  167.78  175.82    .  . 0 "[    .    1    .    2    .]" 
       123 . 1 30 ILE CA 1 30 ILE CB 1 30 ILE CG1 1 30 ILE CD1  150.00  -30.00  169.71  164.29  172.66    .  . 0 "[    .    1    .    2    .]" 
       124 . 1 52 ILE CA 1 52 ILE CB 1 52 ILE CG1 1 52 ILE CD1  150.00  -30.00  -84.31 -178.07  -57.54    .  . 0 "[    .    1    .    2    .]" 
       125 . 1  2 LEU N  1  2 LEU CA 1  2 LEU CB  1  2 LEU CG   -90.00  -30.00  -56.15  -63.47  -50.59    .  . 0 "[    .    1    .    2    .]" 
       126 . 1  7 TYR N  1  7 TYR CA 1  7 TYR CB  1  7 TYR CG   -90.00  -30.00  -51.26  -57.93  -39.70    .  . 0 "[    .    1    .    2    .]" 
       127 . 1  9 TYR N  1  9 TYR CA 1  9 TYR CB  1  9 TYR CG   -90.00  -30.00  -69.39  -73.27  -75.29    .  . 0 "[    .    1    .    2    .]" 
       128 . 1 27 LEU N  1 27 LEU CA 1 27 LEU CB  1 27 LEU CG   150.00 -150.00 -176.79 -175.16 -176.54    .  . 0 "[    .    1    .    2    .]" 
       129 . 1 33 PHE N  1 33 PHE CA 1 33 PHE CB  1 33 PHE CG   150.00 -150.00 -178.46  178.92  178.21    .  . 0 "[    .    1    .    2    .]" 
       130 . 1 38 PHE N  1 38 PHE CA 1 38 PHE CB  1 38 PHE CG   -90.00  -30.00  -56.37  -68.46  -47.62    .  . 0 "[    .    1    .    2    .]" 
       131 . 1 45 LYS N  1 45 LYS CA 1 45 LYS CB  1 45 LYS CG   -90.00  -30.00  -65.56  -70.04  -60.21    .  . 0 "[    .    1    .    2    .]" 
       132 . 1 56 LEU N  1 56 LEU CA 1 56 LEU CB  1 56 LEU CG   -90.00  -30.00  -72.74  -70.69  -71.76    .  . 0 "[    .    1    .    2    .]" 
       133 . 1 60 GLU N  1 60 GLU CA 1 60 GLU CB  1 60 GLU CG   -90.00  -30.00  -62.95  -61.38  -63.01    .  . 0 "[    .    1    .    2    .]" 
       134 . 1 78 TRP N  1 78 TRP CA 1 78 TRP CB  1 78 TRP CG   -90.00  -30.00  -68.91  -66.61  -67.50    .  . 0 "[    .    1    .    2    .]" 
       135 . 1  2 LEU CA 1  2 LEU CB 1  2 LEU CG  1  2 LEU CD1  150.00 -150.00  177.81  169.79 -174.05    .  . 0 "[    .    1    .    2    .]" 
       136 . 1 27 LEU CA 1 27 LEU CB 1 27 LEU CG  1 27 LEU CD1   30.00   90.00   57.46   78.65   65.32    .  . 0 "[    .    1    .    2    .]" 
       137 . 1 56 LEU CA 1 56 LEU CB 1 56 LEU CG  1 56 LEU CD1  150.00 -150.00  171.13  175.79  174.71    .  . 0 "[    .    1    .    2    .]" 
    stop_

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