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
375136 1ev0 4237 cing 4-filtered-FRED Wattos check violation dihedral angle


data_1ev0


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              192
    _TA_constraint_stats_list.Viol_count                    508
    _TA_constraint_stats_list.Viol_total                    41292.04
    _TA_constraint_stats_list.Viol_max                      38.29
    _TA_constraint_stats_list.Viol_rms                      3.76
    _TA_constraint_stats_list.Viol_average_all_restraints   0.54
    _TA_constraint_stats_list.Viol_average_violations_only  4.06
    _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  2 SER N 1  2 SER CA 1  2 SER CB 1  2 SER OG   -80.00  -40.00  -44.16  -58.61  -39.67  0.33 12  0 "[    .    1    .    2]" 
         2 . 1  3 ASP C 1  4 ALA N  1  4 ALA CA 1  4 ALA C   -180.00  -20.00  -91.36  -92.39  -90.52     .  .  0 "[    .    1    .    2]" 
         3 . 1  4 ALA C 1  5 GLU N  1  5 GLU CA 1  5 GLU C    -80.00  -40.00  -64.55  -80.36  -56.26  0.36 16  0 "[    .    1    .    2]" 
         4 . 1  8 TYR N 1  8 TYR CA 1  8 TYR CB 1  8 TYR CG    40.00   80.00   47.33   48.06   47.77     .  .  0 "[    .    1    .    2]" 
         5 . 1  8 TYR C 1  9 LEU N  1  9 LEU CA 1  9 LEU C    -80.00  -40.00  -51.90  -55.78  -49.72     .  .  0 "[    .    1    .    2]" 
         6 . 1  9 LEU N 1  9 LEU CA 1  9 LEU C  1 10 PRO N   -100.00    0.00  -50.94  -50.91  -51.22     .  .  0 "[    .    1    .    2]" 
         7 . 1  9 LEU N 1  9 LEU CA 1  9 LEU CB 1  9 LEU CG   160.00 -160.00 -124.51 -122.10 -122.69 38.26  2 20  [*+**********-*******]  
         8 . 1 10 PRO C 1 11 GLN N  1 11 GLN CA 1 11 GLN C    -80.00  -40.00  -76.21  -78.22  -72.80     .  .  0 "[    .    1    .    2]" 
         9 . 1 11 GLN N 1 11 GLN CA 1 11 GLN C  1 12 LEU N   -100.00    0.00  -33.79  -32.11  -32.32     .  .  0 "[    .    1    .    2]" 
        10 . 1 11 GLN N 1 11 GLN CA 1 11 GLN CB 1 11 GLN CG   160.00 -160.00  176.28  178.95  178.20     .  .  0 "[    .    1    .    2]" 
        11 . 1 11 GLN C 1 12 LEU N  1 12 LEU CA 1 12 LEU C    -80.00  -40.00  -75.32  -77.85  -71.98     .  .  0 "[    .    1    .    2]" 
        12 . 1 12 LEU N 1 12 LEU CA 1 12 LEU C  1 13 ARG N   -100.00    0.00  -46.64  -42.21  -42.51     .  .  0 "[    .    1    .    2]" 
        13 . 1 12 LEU N 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG   -80.00  -40.00  -65.34  -67.06  -63.58     .  .  0 "[    .    1    .    2]" 
        14 . 1 12 LEU C 1 13 ARG N  1 13 ARG CA 1 13 ARG C    -80.00  -40.00  -57.35  -62.15  -48.11     .  .  0 "[    .    1    .    2]" 
        15 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C  1 14 LYS N   -100.00    0.00  -43.56  -44.34  -44.39     .  .  0 "[    .    1    .    2]" 
        16 . 1 13 ARG N 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG    40.00   80.00   67.14   67.53   67.41     .  .  0 "[    .    1    .    2]" 
        17 . 1 13 ARG C 1 14 LYS N  1 14 LYS CA 1 14 LYS C    -40.00  -80.00  -65.68  -64.63  -65.07 15.37  2 20  [*+*****-************]  
        18 . 1 14 LYS N 1 14 LYS CA 1 14 LYS C  1 15 ASP N   -100.00    0.00  -30.61  -32.36  -28.52     .  .  0 "[    .    1    .    2]" 
        19 . 1 14 LYS N 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG   -80.00   80.00   65.03   61.60   68.24     .  .  0 "[    .    1    .    2]" 
        20 . 1 14 LYS C 1 15 ASP N  1 15 ASP CA 1 15 ASP C    -80.00  -40.00  -65.04  -64.59  -65.02     .  .  0 "[    .    1    .    2]" 
        21 . 1 15 ASP N 1 15 ASP CA 1 15 ASP C  1 16 ILE N   -100.00    0.00  -46.70  -47.06  -47.45     .  .  0 "[    .    1    .    2]" 
        22 . 1 15 ASP N 1 15 ASP CA 1 15 ASP CB 1 15 ASP CG   -80.00  -40.00  -71.30  -74.46  -75.32     .  .  0 "[    .    1    .    2]" 
        23 . 1 15 ASP C 1 16 ILE N  1 16 ILE CA 1 16 ILE C    -80.00  -40.00  -59.18  -62.63  -56.81     .  .  0 "[    .    1    .    2]" 
        24 . 1 16 ILE N 1 16 ILE CA 1 16 ILE C  1 17 LEU N   -100.00    0.00  -30.84  -29.11  -29.22     .  .  0 "[    .    1    .    2]" 
        25 . 1 16 ILE C 1 17 LEU N  1 17 LEU CA 1 17 LEU C    -80.00  -40.00  -65.79  -68.39  -60.28     .  .  0 "[    .    1    .    2]" 
        26 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C  1 18 GLU N   -100.00    0.00  -46.77  -48.09  -48.37     .  .  0 "[    .    1    .    2]" 
        27 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG   -80.00  -40.00  -80.60  -80.63  -80.67  0.97 19  0 "[    .    1    .    2]" 
        28 . 1 17 LEU C 1 18 GLU N  1 18 GLU CA 1 18 GLU C    -80.00  -40.00  -68.89  -67.08  -67.18     .  .  0 "[    .    1    .    2]" 
        29 . 1 18 GLU N 1 18 GLU CA 1 18 GLU C  1 19 VAL N   -100.00    0.00  -37.58  -39.50  -36.52     .  .  0 "[    .    1    .    2]" 
        30 . 1 18 GLU C 1 19 VAL N  1 19 VAL CA 1 19 VAL C    -80.00  -40.00  -59.94  -61.65  -58.24     .  .  0 "[    .    1    .    2]" 
        31 . 1 19 VAL N 1 19 VAL CA 1 19 VAL C  1 20 ILE N   -100.00    0.00  -56.52  -54.34  -54.81     .  .  0 "[    .    1    .    2]" 
        32 . 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1  160.00 -160.00 -179.76  175.32 -176.90     .  .  0 "[    .    1    .    2]" 
        33 . 1 19 VAL C 1 20 ILE N  1 20 ILE CA 1 20 ILE C    -80.00  -40.00  -55.53  -57.44  -54.22     .  .  0 "[    .    1    .    2]" 
        34 . 1 20 ILE N 1 20 ILE CA 1 20 ILE C  1 21 CYS N   -100.00    0.00  -24.08  -25.56  -22.15     .  .  0 "[    .    1    .    2]" 
        35 . 1 20 ILE N 1 20 ILE CA 1 20 ILE CB 1 20 ILE CG1  -80.00  -40.00  -57.51  -57.28  -57.40     .  .  0 "[    .    1    .    2]" 
        36 . 1 20 ILE C 1 21 CYS N  1 21 CYS CA 1 21 CYS C    -80.00  -40.00  -74.69  -75.40  -75.51     .  .  0 "[    .    1    .    2]" 
        37 . 1 21 CYS C 1 22 LYS N  1 22 LYS CA 1 22 LYS C    -80.00  -40.00  -57.40  -57.53  -57.66     .  .  0 "[    .    1    .    2]" 
        38 . 1 22 LYS N 1 22 LYS CA 1 22 LYS C  1 23 TYR N   -100.00    0.00  -32.27  -33.59  -29.66     .  .  0 "[    .    1    .    2]" 
        39 . 1 22 LYS N 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG   -80.00  -40.00  -56.50  -58.84  -53.84     .  .  0 "[    .    1    .    2]" 
        40 . 1 22 LYS C 1 23 TYR N  1 23 TYR CA 1 23 TYR C   -140.00 -100.00 -102.37 -102.23 -102.49     .  .  0 "[    .    1    .    2]" 
        41 . 1 23 TYR N 1 23 TYR CA 1 23 TYR CB 1 23 TYR CG   -80.00  -40.00  -61.93  -63.13  -61.38     .  .  0 "[    .    1    .    2]" 
        42 . 1 23 TYR C 1 24 VAL N  1 24 VAL CA 1 24 VAL C    160.00  -80.00 -151.19 -152.17 -150.47     .  .  0 "[    .    1    .    2]" 
        43 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C  1 25 GLN N     40.00 -140.00 -138.40 -138.80 -138.07  1.93 20  0 "[    .    1    .    2]" 
        44 . 1 24 VAL N 1 24 VAL CA 1 24 VAL CB 1 24 VAL CG1  160.00 -160.00 -156.26 -155.94 -156.12  4.26  2  0 "[    .    1    .    2]" 
        45 . 1 25 GLN C 1 26 ILE N  1 26 ILE CA 1 26 ILE C   -140.00 -100.00 -140.63 -140.87 -140.37  0.87  2  0 "[    .    1    .    2]" 
        46 . 1 26 ILE N 1 26 ILE CA 1 26 ILE C  1 27 ASP N     40.00 -140.00  167.86  165.83  169.01     .  .  0 "[    .    1    .    2]" 
        47 . 1 26 ILE N 1 26 ILE CA 1 26 ILE CB 1 26 ILE CG1   40.00   80.00   39.42   39.50   39.44  0.88 11  0 "[    .    1    .    2]" 
        48 . 1 26 ILE C 1 27 ASP N  1 27 ASP CA 1 27 ASP C   -180.00  -80.00 -101.21 -105.71  -94.08     .  .  0 "[    .    1    .    2]" 
        49 . 1 27 ASP N 1 27 ASP CA 1 27 ASP C  1 28 PRO N     40.00 -140.00  163.48  163.87  163.49     .  .  0 "[    .    1    .    2]" 
        50 . 1 28 PRO C 1 29 GLU N  1 29 GLU CA 1 29 GLU C    -80.00  -40.00  -68.45  -69.35  -69.74     .  .  0 "[    .    1    .    2]" 
        51 . 1 29 GLU N 1 29 GLU CA 1 29 GLU CB 1 29 GLU CG   -80.00  -40.00  -68.43  -80.11  -54.73  0.11 19  0 "[    .    1    .    2]" 
        52 . 1 29 GLU C 1 30 MET N  1 30 MET CA 1 30 MET C   -150.00  -90.00  -90.61  -95.39  -89.29  0.71 11  0 "[    .    1    .    2]" 
        53 . 1 30 MET N 1 30 MET CA 1 30 MET CB 1 30 MET CG   -80.00  -40.00  -79.67  -80.40  -76.44  0.40  2  0 "[    .    1    .    2]" 
        54 . 1 30 MET C 1 31 VAL N  1 31 VAL CA 1 31 VAL C   -150.00  -90.00 -101.29 -124.10  -95.31     .  .  0 "[    .    1    .    2]" 
        55 . 1 31 VAL N 1 31 VAL CA 1 31 VAL CB 1 31 VAL CG1  160.00 -160.00 -174.73 -176.47 -173.24     .  .  0 "[    .    1    .    2]" 
        56 . 1 31 VAL C 1 32 THR N  1 32 THR CA 1 32 THR C   -150.00  -90.00  -94.84 -103.90  -89.68  0.32  1  0 "[    .    1    .    2]" 
        57 . 1 32 THR N 1 32 THR CA 1 32 THR CB 1 32 THR OG1  -80.00  -40.00  -41.31  -50.39  -39.27  0.73 17  0 "[    .    1    .    2]" 
        58 . 1 32 THR C 1 33 VAL N  1 33 VAL CA 1 33 VAL C   -150.00  -90.00 -142.86 -148.53 -138.74     .  .  0 "[    .    1    .    2]" 
        59 . 1 33 VAL N 1 33 VAL CA 1 33 VAL CB 1 33 VAL CG1  160.00 -160.00 -174.48 -175.75 -172.59     .  .  0 "[    .    1    .    2]" 
        60 . 1 33 VAL C 1 34 GLN N  1 34 GLN CA 1 34 GLN C   -150.00  -90.00 -132.96 -146.92 -150.04  0.04  1  0 "[    .    1    .    2]" 
        61 . 1 34 GLN N 1 34 GLN CA 1 34 GLN C  1 35 LEU N     40.00 -140.00  129.19  125.39  124.45     .  .  0 "[    .    1    .    2]" 
        62 . 1 34 GLN C 1 35 LEU N  1 35 LEU CA 1 35 LEU C   -150.00  -90.00 -103.16 -113.18  -92.93     .  .  0 "[    .    1    .    2]" 
        63 . 1 35 LEU N 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG    40.00   80.00   53.71   47.72   57.47     .  .  0 "[    .    1    .    2]" 
        64 . 1 35 LEU C 1 36 GLU N  1 36 GLU CA 1 36 GLU C   -150.00  -90.00 -134.65 -150.07 -110.49  0.07 16  0 "[    .    1    .    2]" 
        65 . 1 36 GLU N 1 36 GLU CA 1 36 GLU CB 1 36 GLU CG   -80.00  -40.00  -71.51  -73.49  -75.38     .  .  0 "[    .    1    .    2]" 
        66 . 1 36 GLU C 1 37 GLN N  1 37 GLN CA 1 37 GLN C   -150.00  -90.00 -145.57 -150.87  -95.29  0.87 11  0 "[    .    1    .    2]" 
        67 . 1 37 GLN C 1 38 LYS N  1 38 LYS CA 1 38 LYS C   -150.00  -90.00 -112.11 -113.89 -115.60     .  .  0 "[    .    1    .    2]" 
        68 . 1 38 LYS C 1 39 ASP N  1 39 ASP CA 1 39 ASP C    -80.00  -40.00  -78.40  -77.03  -79.27  0.65 16  0 "[    .    1    .    2]" 
        69 . 1 41 ASP N 1 41 ASP CA 1 41 ASP CB 1 41 ASP CG   -80.00  -40.00  -79.73  -79.30  -79.84  0.42 16  0 "[    .    1    .    2]" 
        70 . 1 41 ASP C 1 42 ILE N  1 42 ILE CA 1 42 ILE C   -150.00  -90.00 -127.20 -128.23 -125.42     .  .  0 "[    .    1    .    2]" 
        71 . 1 42 ILE N 1 42 ILE CA 1 42 ILE CB 1 42 ILE CG1  -80.00  -40.00  -47.09  -48.69  -45.24     .  .  0 "[    .    1    .    2]" 
        72 . 1 42 ILE C 1 43 SER N  1 43 SER CA 1 43 SER C   -150.00  -90.00 -117.65 -129.24  -98.71     .  .  0 "[    .    1    .    2]" 
        73 . 1 43 SER N 1 43 SER CA 1 43 SER CB 1 43 SER OG   -80.00  -40.00  -63.26  -42.50  -48.87  0.07  2  0 "[    .    1    .    2]" 
        74 . 1 43 SER C 1 44 ILE N  1 44 ILE CA 1 44 ILE C   -150.00  -90.00 -144.32 -143.91 -147.53  0.18 19  0 "[    .    1    .    2]" 
        75 . 1 44 ILE N 1 44 ILE CA 1 44 ILE C  1 45 LEU N     40.00 -140.00  107.13  151.75   90.81     .  .  0 "[    .    1    .    2]" 
        76 . 1 44 ILE N 1 44 ILE CA 1 44 ILE CB 1 44 ILE CG1  -80.00  -40.00  -61.09  -61.36  -63.44  0.99 20  0 "[    .    1    .    2]" 
        77 . 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG   160.00 -160.00 -168.47 -174.25 -160.92     .  .  0 "[    .    1    .    2]" 
        78 . 1 45 LEU C 1 46 GLU N  1 46 GLU CA 1 46 GLU C   -150.00  -90.00 -102.43  -97.18 -100.05     .  .  0 "[    .    1    .    2]" 
        79 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C  1 47 LEU N     40.00 -140.00  130.98   97.63  153.26     .  .  0 "[    .    1    .    2]" 
        80 . 1 46 GLU C 1 47 LEU N  1 47 LEU CA 1 47 LEU C   -150.00  -90.00 -123.98 -150.21  -90.37  0.21 12  0 "[    .    1    .    2]" 
        81 . 1 47 LEU N 1 47 LEU CA 1 47 LEU CB 1 47 LEU CG    40.00   80.00   51.64   49.42   63.32     .  .  0 "[    .    1    .    2]" 
        82 . 1 47 LEU C 1 48 ASN N  1 48 ASN CA 1 48 ASN C   -150.00  -90.00  -89.51  -89.59  -89.64  1.18  3  0 "[    .    1    .    2]" 
        83 . 1 48 ASN N 1 48 ASN CA 1 48 ASN CB 1 48 ASN CG   -80.00  -40.00  -49.94  -55.74  -46.88     .  .  0 "[    .    1    .    2]" 
        84 . 1 48 ASN C 1 49 VAL N  1 49 VAL CA 1 49 VAL C   -150.00  -90.00 -124.17 -126.79 -120.42     .  .  0 "[    .    1    .    2]" 
        85 . 1 49 VAL N 1 49 VAL CA 1 49 VAL C  1 50 THR N     40.00 -140.00   92.68   93.14   91.76     .  .  0 "[    .    1    .    2]" 
        86 . 1 49 VAL N 1 49 VAL CA 1 49 VAL CB 1 49 VAL CG1  160.00 -160.00 -169.83 -169.66 -170.01     .  .  0 "[    .    1    .    2]" 
        87 . 1 49 VAL C 1 50 THR N  1 50 THR CA 1 50 THR C   -180.00  -20.00  -81.80  -94.53  -73.97     .  .  0 "[    .    1    .    2]" 
        88 . 1 50 THR N 1 50 THR CA 1 50 THR CB 1 50 THR OG1  -80.00  -40.00  -55.76  -63.98  -53.39     .  .  0 "[    .    1    .    2]" 
        89 . 1 51 LEU N 1 51 LEU CA 1 51 LEU C  1 52 PRO N     40.00 -140.00  139.26  139.06  138.67     .  .  0 "[    .    1    .    2]" 
        90 . 1 50 THR C 1 51 LEU N  1 51 LEU CA 1 51 LEU C    -90.00  -30.00  -86.61  -90.53  -76.63  0.53 17  0 "[    .    1    .    2]" 
        91 . 1 51 LEU N 1 51 LEU CA 1 51 LEU CB 1 51 LEU CG   -80.00  -40.00  -64.05  -71.26  -76.00     .  .  0 "[    .    1    .    2]" 
        92 . 1 52 PRO C 1 53 GLU N  1 53 GLU CA 1 53 GLU C    -80.00  -40.00  -60.35  -60.85  -61.09     .  .  0 "[    .    1    .    2]" 
        93 . 1 53 GLU C 1 54 ALA N  1 54 ALA CA 1 54 ALA C   -180.00  -20.00 -176.74 -171.56 -174.85  0.05  5  0 "[    .    1    .    2]" 
        94 . 1 54 ALA C 1 55 GLU N  1 55 GLU CA 1 55 GLU C   -180.00  -20.00 -142.19  -66.95 -154.16     .  .  0 "[    .    1    .    2]" 
        95 . 1 56 GLU C 1 57 LEU N  1 57 LEU CA 1 57 LEU C   -150.00  -90.00 -114.32 -150.20  -89.77  0.23  1  0 "[    .    1    .    2]" 
        96 . 1 57 LEU C 1 58 LYS N  1 58 LYS CA 1 58 LYS C   -150.00  -90.00 -123.61 -117.74 -121.09     .  .  0 "[    .    1    .    2]" 
        97 . 2  2 SER N 2  2 SER CA 2  2 SER CB 2  2 SER OG   -80.00  -40.00  -44.16  -58.62  -39.70  0.30 12  0 "[    .    1    .    2]" 
        98 . 2  3 ASP C 2  4 ALA N  2  4 ALA CA 2  4 ALA C   -180.00  -20.00  -91.36  -92.36  -90.48     .  .  0 "[    .    1    .    2]" 
        99 . 2  4 ALA C 2  5 GLU N  2  5 GLU CA 2  5 GLU C    -80.00  -40.00  -64.55  -80.40  -56.28  0.40 16  0 "[    .    1    .    2]" 
       100 . 2  8 TYR N 2  8 TYR CA 2  8 TYR CB 2  8 TYR CG    40.00   80.00   47.33   47.98   47.71     .  .  0 "[    .    1    .    2]" 
       101 . 2  8 TYR C 2  9 LEU N  2  9 LEU CA 2  9 LEU C    -80.00  -40.00  -51.89  -55.71  -49.73     .  .  0 "[    .    1    .    2]" 
       102 . 2  9 LEU N 2  9 LEU CA 2  9 LEU C  2 10 PRO N   -100.00    0.00  -50.98  -50.92  -51.27     .  .  0 "[    .    1    .    2]" 
       103 . 2  9 LEU N 2  9 LEU CA 2  9 LEU CB 2  9 LEU CG   160.00 -160.00 -124.50 -122.05 -122.66 38.29  2 20  [*+**********-*******]  
       104 . 2 10 PRO C 2 11 GLN N  2 11 GLN CA 2 11 GLN C    -80.00  -40.00  -76.19  -78.16  -72.83     .  .  0 "[    .    1    .    2]" 
       105 . 2 11 GLN N 2 11 GLN CA 2 11 GLN C  2 12 LEU N   -100.00    0.00  -33.80  -32.27  -32.38     .  .  0 "[    .    1    .    2]" 
       106 . 2 11 GLN N 2 11 GLN CA 2 11 GLN CB 2 11 GLN CG   160.00 -160.00  176.31  178.99  178.20     .  .  0 "[    .    1    .    2]" 
       107 . 2 11 GLN C 2 12 LEU N  2 12 LEU CA 2 12 LEU C    -80.00  -40.00  -75.32  -77.88  -72.01     .  .  0 "[    .    1    .    2]" 
       108 . 2 12 LEU N 2 12 LEU CA 2 12 LEU C  2 13 ARG N   -100.00    0.00  -46.65  -42.22  -42.50     .  .  0 "[    .    1    .    2]" 
       109 . 2 12 LEU N 2 12 LEU CA 2 12 LEU CB 2 12 LEU CG   -80.00  -40.00  -65.35  -67.06  -63.52     .  .  0 "[    .    1    .    2]" 
       110 . 2 12 LEU C 2 13 ARG N  2 13 ARG CA 2 13 ARG C    -80.00  -40.00  -57.34  -62.15  -48.07     .  .  0 "[    .    1    .    2]" 
       111 . 2 13 ARG N 2 13 ARG CA 2 13 ARG C  2 14 LYS N   -100.00    0.00  -43.57  -44.26  -44.30     .  .  0 "[    .    1    .    2]" 
       112 . 2 13 ARG N 2 13 ARG CA 2 13 ARG CB 2 13 ARG CG    40.00   80.00   67.12   67.46   67.37     .  .  0 "[    .    1    .    2]" 
       113 . 2 13 ARG C 2 14 LYS N  2 14 LYS CA 2 14 LYS C    -80.00  -40.00  -65.67  -64.69  -65.08     .  .  0 "[    .    1    .    2]" 
       114 . 2 14 LYS N 2 14 LYS CA 2 14 LYS C  2 15 ASP N   -100.00    0.00  -30.63  -32.39  -28.46     .  .  0 "[    .    1    .    2]" 
       115 . 2 14 LYS N 2 14 LYS CA 2 14 LYS CB 2 14 LYS CG   -80.00   80.00   65.00   61.64   68.30     .  .  0 "[    .    1    .    2]" 
       116 . 2 14 LYS C 2 15 ASP N  2 15 ASP CA 2 15 ASP C    -80.00  -40.00  -65.06  -64.50  -65.08     .  .  0 "[    .    1    .    2]" 
       117 . 2 15 ASP N 2 15 ASP CA 2 15 ASP C  2 16 ILE N   -100.00    0.00  -46.68  -47.02  -47.48     .  .  0 "[    .    1    .    2]" 
       118 . 2 15 ASP N 2 15 ASP CA 2 15 ASP CB 2 15 ASP CG   -80.00  -40.00  -71.33  -74.39  -75.34     .  .  0 "[    .    1    .    2]" 
       119 . 2 15 ASP C 2 16 ILE N  2 16 ILE CA 2 16 ILE C    -80.00  -40.00  -59.19  -62.66  -56.75     .  .  0 "[    .    1    .    2]" 
       120 . 2 16 ILE N 2 16 ILE CA 2 16 ILE C  2 17 LEU N   -100.00    0.00  -30.85  -29.23  -29.34     .  .  0 "[    .    1    .    2]" 
       121 . 2 16 ILE C 2 17 LEU N  2 17 LEU CA 2 17 LEU C    -80.00  -40.00  -65.77  -68.53  -60.33     .  .  0 "[    .    1    .    2]" 
       122 . 2 17 LEU N 2 17 LEU CA 2 17 LEU C  2 18 GLU N   -100.00    0.00  -46.78  -48.53  -48.76     .  .  0 "[    .    1    .    2]" 
       123 . 2 17 LEU N 2 17 LEU CA 2 17 LEU CB 2 17 LEU CG   -80.00  -40.00  -80.62  -80.59  -80.67  0.95 19  0 "[    .    1    .    2]" 
       124 . 2 17 LEU C 2 18 GLU N  2 18 GLU CA 2 18 GLU C    -80.00  -40.00  -68.87  -67.16  -67.24     .  .  0 "[    .    1    .    2]" 
       125 . 2 18 GLU N 2 18 GLU CA 2 18 GLU C  2 19 VAL N   -100.00    0.00  -37.60  -39.55  -36.63     .  .  0 "[    .    1    .    2]" 
       126 . 2 18 GLU C 2 19 VAL N  2 19 VAL CA 2 19 VAL C    -80.00  -40.00  -59.91  -58.97  -59.03     .  .  0 "[    .    1    .    2]" 
       127 . 2 19 VAL N 2 19 VAL CA 2 19 VAL C  2 20 ILE N   -100.00    0.00  -56.54  -54.72  -55.06     .  .  0 "[    .    1    .    2]" 
       128 . 2 19 VAL N 2 19 VAL CA 2 19 VAL CB 2 19 VAL CG1  160.00 -160.00 -179.76  175.31 -176.95     .  .  0 "[    .    1    .    2]" 
       129 . 2 19 VAL C 2 20 ILE N  2 20 ILE CA 2 20 ILE C    -80.00  -40.00  -55.51  -56.49  -56.63     .  .  0 "[    .    1    .    2]" 
       130 . 2 20 ILE N 2 20 ILE CA 2 20 ILE C  2 21 CYS N   -100.00    0.00  -24.08  -25.52  -22.21     .  .  0 "[    .    1    .    2]" 
       131 . 2 20 ILE N 2 20 ILE CA 2 20 ILE CB 2 20 ILE CG1  -80.00  -40.00  -57.50  -57.26  -57.41     .  .  0 "[    .    1    .    2]" 
       132 . 2 20 ILE C 2 21 CYS N  2 21 CYS CA 2 21 CYS C    -80.00  -40.00  -74.69  -75.27  -75.45     .  .  0 "[    .    1    .    2]" 
       133 . 2 21 CYS C 2 22 LYS N  2 22 LYS CA 2 22 LYS C    -80.00  -40.00  -57.38  -57.14  -57.29     .  .  0 "[    .    1    .    2]" 
       134 . 2 22 LYS N 2 22 LYS CA 2 22 LYS C  2 23 TYR N   -100.00    0.00  -32.28  -33.51  -29.71     .  .  0 "[    .    1    .    2]" 
       135 . 2 22 LYS N 2 22 LYS CA 2 22 LYS CB 2 22 LYS CG   -80.00  -40.00  -56.48  -58.87  -53.78     .  .  0 "[    .    1    .    2]" 
       136 . 2 22 LYS C 2 23 TYR N  2 23 TYR CA 2 23 TYR C   -140.00 -100.00 -102.38 -102.25 -102.48     .  .  0 "[    .    1    .    2]" 
       137 . 2 23 TYR N 2 23 TYR CA 2 23 TYR CB 2 23 TYR CG   -80.00  -40.00  -61.94  -63.21  -61.34     .  .  0 "[    .    1    .    2]" 
       138 . 2 23 TYR C 2 24 VAL N  2 24 VAL CA 2 24 VAL C    160.00  -80.00 -151.18 -152.09 -150.46     .  .  0 "[    .    1    .    2]" 
       139 . 2 24 VAL N 2 24 VAL CA 2 24 VAL C  2 25 GLN N     40.00 -140.00 -138.41 -138.86 -138.06  1.94 17  0 "[    .    1    .    2]" 
       140 . 2 24 VAL N 2 24 VAL CA 2 24 VAL CB 2 24 VAL CG1  160.00 -160.00 -156.26 -155.90 -156.09  4.30  2  0 "[    .    1    .    2]" 
       141 . 2 25 GLN C 2 26 ILE N  2 26 ILE CA 2 26 ILE C   -140.00 -100.00 -140.63 -140.88 -140.39  0.88  2  0 "[    .    1    .    2]" 
       142 . 2 26 ILE N 2 26 ILE CA 2 26 ILE C  2 27 ASP N     40.00 -140.00  167.86  165.85  169.06     .  .  0 "[    .    1    .    2]" 
       143 . 2 26 ILE N 2 26 ILE CA 2 26 ILE CB 2 26 ILE CG1   40.00   80.00   39.43   39.51   39.46  0.98 20  0 "[    .    1    .    2]" 
       144 . 2 26 ILE C 2 27 ASP N  2 27 ASP CA 2 27 ASP C   -180.00  -80.00 -101.20 -105.60  -94.15     .  .  0 "[    .    1    .    2]" 
       145 . 2 27 ASP N 2 27 ASP CA 2 27 ASP C  2 28 PRO N     40.00 -140.00  163.49  163.79  163.49     .  .  0 "[    .    1    .    2]" 
       146 . 2 28 PRO C 2 29 GLU N  2 29 GLU CA 2 29 GLU C    -80.00  -40.00  -68.45  -69.26  -69.70     .  .  0 "[    .    1    .    2]" 
       147 . 2 29 GLU N 2 29 GLU CA 2 29 GLU CB 2 29 GLU CG   -80.00  -40.00  -68.41  -80.18  -54.76  0.18 19  0 "[    .    1    .    2]" 
       148 . 2 29 GLU C 2 30 MET N  2 30 MET CA 2 30 MET C   -150.00  -90.00  -90.59  -95.43  -89.32  0.68 11  0 "[    .    1    .    2]" 
       149 . 2 30 MET N 2 30 MET CA 2 30 MET CB 2 30 MET CG   -80.00  -40.00  -79.68  -80.44  -76.58  0.44  2  0 "[    .    1    .    2]" 
       150 . 2 30 MET C 2 31 VAL N  2 31 VAL CA 2 31 VAL C   -150.00  -90.00 -101.31 -124.15  -95.41     .  .  0 "[    .    1    .    2]" 
       151 . 2 31 VAL N 2 31 VAL CA 2 31 VAL CB 2 31 VAL CG1  160.00 -160.00 -174.76 -176.49 -173.27     .  .  0 "[    .    1    .    2]" 
       152 . 2 31 VAL C 2 32 THR N  2 32 THR CA 2 32 THR C   -150.00  -90.00  -94.82 -103.91  -89.67  0.33  1  0 "[    .    1    .    2]" 
       153 . 2 32 THR N 2 32 THR CA 2 32 THR CB 2 32 THR OG1  -80.00  -40.00  -41.32  -50.42  -39.26  0.74 17  0 "[    .    1    .    2]" 
       154 . 2 32 THR C 2 33 VAL N  2 33 VAL CA 2 33 VAL C   -150.00  -90.00 -142.85 -148.47 -138.71     .  .  0 "[    .    1    .    2]" 
       155 . 2 33 VAL N 2 33 VAL CA 2 33 VAL CB 2 33 VAL CG1  160.00 -160.00 -174.47 -175.79 -172.59     .  .  0 "[    .    1    .    2]" 
       156 . 2 33 VAL C 2 34 GLN N  2 34 GLN CA 2 34 GLN C   -150.00  -90.00 -132.97 -146.97 -150.03  0.03  1  0 "[    .    1    .    2]" 
       157 . 2 34 GLN N 2 34 GLN CA 2 34 GLN C  2 35 LEU N     40.00 -140.00  129.18  125.37  124.50     .  .  0 "[    .    1    .    2]" 
       158 . 2 34 GLN C 2 35 LEU N  2 35 LEU CA 2 35 LEU C   -150.00  -90.00 -103.15 -113.07  -92.88     .  .  0 "[    .    1    .    2]" 
       159 . 2 35 LEU N 2 35 LEU CA 2 35 LEU CB 2 35 LEU CG    40.00   80.00   53.70   47.82   57.50     .  .  0 "[    .    1    .    2]" 
       160 . 2 35 LEU C 2 36 GLU N  2 36 GLU CA 2 36 GLU C   -150.00  -90.00 -134.66 -150.13 -110.51  0.13 16  0 "[    .    1    .    2]" 
       161 . 2 36 GLU N 2 36 GLU CA 2 36 GLU CB 2 36 GLU CG   -80.00  -40.00  -71.43  -73.38  -75.20     .  .  0 "[    .    1    .    2]" 
       162 . 2 36 GLU C 2 37 GLN N  2 37 GLN CA 2 37 GLN C   -150.00  -90.00 -145.56 -150.90  -95.29  0.90 11  0 "[    .    1    .    2]" 
       163 . 2 37 GLN C 2 38 LYS N  2 38 LYS CA 2 38 LYS C   -150.00  -90.00 -112.11 -113.89 -115.56     .  .  0 "[    .    1    .    2]" 
       164 . 2 38 LYS C 2 39 ASP N  2 39 ASP CA 2 39 ASP C    -80.00  -40.00  -78.39  -76.95  -79.28  0.69 16  0 "[    .    1    .    2]" 
       165 . 2 41 ASP N 2 41 ASP CA 2 41 ASP CB 2 41 ASP CG   -80.00  -40.00  -79.71  -79.25  -79.74  0.39 20  0 "[    .    1    .    2]" 
       166 . 2 41 ASP C 2 42 ILE N  2 42 ILE CA 2 42 ILE C   -150.00  -90.00 -127.22 -128.23 -125.45     .  .  0 "[    .    1    .    2]" 
       167 . 2 42 ILE N 2 42 ILE CA 2 42 ILE CB 2 42 ILE CG1  -80.00  -40.00  -47.09  -48.67  -45.22     .  .  0 "[    .    1    .    2]" 
       168 . 2 42 ILE C 2 43 SER N  2 43 SER CA 2 43 SER C   -150.00  -90.00 -117.67 -129.31  -98.70     .  .  0 "[    .    1    .    2]" 
       169 . 2 43 SER N 2 43 SER CA 2 43 SER CB 2 43 SER OG   -80.00  -40.00  -63.25  -42.47  -48.89  0.03  2  0 "[    .    1    .    2]" 
       170 . 2 43 SER C 2 44 ILE N  2 44 ILE CA 2 44 ILE C   -150.00  -90.00 -144.33 -143.95 -147.56  0.17 19  0 "[    .    1    .    2]" 
       171 . 2 44 ILE N 2 44 ILE CA 2 44 ILE C  2 45 LEU N     40.00 -140.00  107.13  151.76   90.88     .  .  0 "[    .    1    .    2]" 
       172 . 2 44 ILE N 2 44 ILE CA 2 44 ILE CB 2 44 ILE CG1  -80.00  -40.00  -61.11  -61.46  -63.39  0.98 20  0 "[    .    1    .    2]" 
       173 . 2 45 LEU N 2 45 LEU CA 2 45 LEU CB 2 45 LEU CG   160.00 -160.00 -168.47 -174.25 -160.90     .  .  0 "[    .    1    .    2]" 
       174 . 2 45 LEU C 2 46 GLU N  2 46 GLU CA 2 46 GLU C   -150.00  -90.00 -102.41  -97.19  -99.99     .  .  0 "[    .    1    .    2]" 
       175 . 2 46 GLU N 2 46 GLU CA 2 46 GLU C  2 47 LEU N     40.00 -140.00  130.98   97.68  153.34     .  .  0 "[    .    1    .    2]" 
       176 . 2 46 GLU C 2 47 LEU N  2 47 LEU CA 2 47 LEU C   -150.00  -90.00 -123.99 -150.22  -90.46  0.22 12  0 "[    .    1    .    2]" 
       177 . 2 47 LEU N 2 47 LEU CA 2 47 LEU CB 2 47 LEU CG    40.00   80.00   51.65   49.43   63.41     .  .  0 "[    .    1    .    2]" 
       178 . 2 47 LEU C 2 48 ASN N  2 48 ASN CA 2 48 ASN C   -150.00  -90.00  -89.51  -89.56  -89.66  1.12  5  0 "[    .    1    .    2]" 
       179 . 2 48 ASN N 2 48 ASN CA 2 48 ASN CB 2 48 ASN CG   -80.00  -40.00  -49.96  -55.76  -46.86     .  .  0 "[    .    1    .    2]" 
       180 . 2 48 ASN C 2 49 VAL N  2 49 VAL CA 2 49 VAL C   -150.00  -90.00 -124.15 -126.75 -120.41     .  .  0 "[    .    1    .    2]" 
       181 . 2 49 VAL N 2 49 VAL CA 2 49 VAL C  2 50 THR N     40.00 -140.00   92.70   93.17   91.83     .  .  0 "[    .    1    .    2]" 
       182 . 2 49 VAL N 2 49 VAL CA 2 49 VAL CB 2 49 VAL CG1  160.00 -160.00 -169.81 -169.37 -169.70     .  .  0 "[    .    1    .    2]" 
       183 . 2 49 VAL C 2 50 THR N  2 50 THR CA 2 50 THR C   -180.00  -20.00  -81.81  -94.45  -74.08     .  .  0 "[    .    1    .    2]" 
       184 . 2 50 THR N 2 50 THR CA 2 50 THR CB 2 50 THR OG1  -80.00  -40.00  -55.77  -64.00  -53.36     .  .  0 "[    .    1    .    2]" 
       185 . 2 51 LEU N 2 51 LEU CA 2 51 LEU C  2 52 PRO N     40.00 -140.00  139.27  139.10  138.71     .  .  0 "[    .    1    .    2]" 
       186 . 2 50 THR C 2 51 LEU N  2 51 LEU CA 2 51 LEU C    -90.00  -30.00  -86.61  -90.50  -76.63  0.50 17  0 "[    .    1    .    2]" 
       187 . 2 51 LEU N 2 51 LEU CA 2 51 LEU CB 2 51 LEU CG   -80.00  -40.00  -64.05  -71.23  -76.03     .  .  0 "[    .    1    .    2]" 
       188 . 2 52 PRO C 2 53 GLU N  2 53 GLU CA 2 53 GLU C    -80.00  -40.00  -60.34  -60.87  -61.02     .  .  0 "[    .    1    .    2]" 
       189 . 2 53 GLU C 2 54 ALA N  2 54 ALA CA 2 54 ALA C   -180.00  -20.00 -176.75 -171.54 -174.97  0.06  5  0 "[    .    1    .    2]" 
       190 . 2 54 ALA C 2 55 GLU N  2 55 GLU CA 2 55 GLU C   -180.00  -20.00 -142.17  -67.01 -154.17     .  .  0 "[    .    1    .    2]" 
       191 . 2 56 GLU C 2 57 LEU N  2 57 LEU CA 2 57 LEU C   -150.00  -90.00 -114.32 -150.16  -89.75  0.25  1  0 "[    .    1    .    2]" 
       192 . 2 57 LEU C 2 58 LYS N  2 58 LYS CA 2 58 LYS C   -150.00  -90.00 -123.61 -117.62 -121.09     .  .  0 "[    .    1    .    2]" 
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