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
426889 2hga 7226 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2hga


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              195
    _TA_constraint_stats_list.Viol_count                    125
    _TA_constraint_stats_list.Viol_total                    2542.68
    _TA_constraint_stats_list.Viol_max                      3.19
    _TA_constraint_stats_list.Viol_rms                      0.22
    _TA_constraint_stats_list.Viol_average_all_restraints   0.03
    _TA_constraint_stats_list.Viol_average_violations_only  1.02
    _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  26 GLY C 1  27 VAL N  1  27 VAL CA 1  27 VAL C -165.00  -67.00 -101.33  -80.99  -98.09    .  . 0 "[    .    1    .    2]" 
         2 . 1  27 VAL N 1  27 VAL CA 1  27 VAL C  1  28 GLN N  111.00 -179.00  142.68  140.15  134.37    .  . 0 "[    .    1    .    2]" 
         3 . 1  27 VAL C 1  28 GLN N  1  28 GLN CA 1  28 GLN C -159.00  -61.00 -115.46 -129.67  -97.04    .  . 0 "[    .    1    .    2]" 
         4 . 1  28 GLN N 1  28 GLN CA 1  28 GLN C  1  29 ILE N  123.00 -173.00  150.68  154.65  153.32    .  . 0 "[    .    1    .    2]" 
         5 . 1  28 GLN C 1  29 ILE N  1  29 ILE CA 1  29 ILE C -103.00  -59.00  -79.50  -81.70  -82.31    .  . 0 "[    .    1    .    2]" 
         6 . 1  29 ILE N 1  29 ILE CA 1  29 ILE C  1  30 ASP N   93.00  165.00  112.64   98.49  130.81    .  . 0 "[    .    1    .    2]" 
         7 . 1  31 SER C 1  32 VAL N  1  32 VAL CA 1  32 VAL C -159.00  -83.00 -100.55 -114.60 -115.49 0.76 15 0 "[    .    1    .    2]" 
         8 . 1  32 VAL N 1  32 VAL CA 1  32 VAL C  1  33 VAL N   97.00  165.00  126.43  114.07  113.73    .  . 0 "[    .    1    .    2]" 
         9 . 1  59 LEU C 1  60 THR N  1  60 THR CA 1  60 THR C  -87.00  -51.00  -66.54  -64.44  -65.08    .  . 0 "[    .    1    .    2]" 
        10 . 1  60 THR N 1  60 THR CA 1  60 THR C  1  61 THR N  -59.00  -21.00  -39.49  -40.54  -41.82    .  . 0 "[    .    1    .    2]" 
        11 . 1  60 THR C 1  61 THR N  1  61 THR CA 1  61 THR C  -75.00  -55.00  -66.60  -64.50  -64.92    .  . 0 "[    .    1    .    2]" 
        12 . 1  61 THR N 1  61 THR CA 1  61 THR C  1  62 TYR N  -53.00  -27.00  -35.13  -44.52  -26.70 0.30  9 0 "[    .    1    .    2]" 
        13 . 1  61 THR C 1  62 TYR N  1  62 TYR CA 1  62 TYR C  -75.00  -51.00  -64.14  -71.63  -59.26    .  . 0 "[    .    1    .    2]" 
        14 . 1  62 TYR N 1  62 TYR CA 1  62 TYR C  1  63 SER N  -57.00  -35.00  -42.27  -43.76  -44.15    .  . 0 "[    .    1    .    2]" 
        15 . 1  62 TYR C 1  63 SER N  1  63 SER CA 1  63 SER C  -75.00  -53.00  -64.30  -66.07  -66.62    .  . 0 "[    .    1    .    2]" 
        16 . 1  63 SER N 1  63 SER CA 1  63 SER C  1  64 ALA N  -51.00  -29.00  -45.60  -50.94  -37.52    .  . 0 "[    .    1    .    2]" 
        17 . 1  63 SER C 1  64 ALA N  1  64 ALA CA 1  64 ALA C  -75.00  -51.00  -63.42  -69.70  -60.02    .  . 0 "[    .    1    .    2]" 
        18 . 1  64 ALA N 1  64 ALA CA 1  64 ALA C  1  65 ALA N  -61.00  -27.00  -32.66  -31.97  -32.45 0.66 13 0 "[    .    1    .    2]" 
        19 . 1  64 ALA C 1  65 ALA N  1  65 ALA CA 1  65 ALA C  -79.00  -51.00  -73.12  -79.27  -65.11 0.27 13 0 "[    .    1    .    2]" 
        20 . 1  65 ALA N 1  65 ALA CA 1  65 ALA C  1  66 LEU N  -61.00  -21.00  -43.78  -45.16  -45.54    .  . 0 "[    .    1    .    2]" 
        21 . 1  65 ALA C 1  66 LEU N  1  66 LEU CA 1  66 LEU C  -93.00  -51.00  -60.11  -59.88  -60.23    .  . 0 "[    .    1    .    2]" 
        22 . 1  66 LEU N 1  66 LEU CA 1  66 LEU C  1  67 LYS N  -63.00  -15.00  -38.32  -45.99  -29.91    .  . 0 "[    .    1    .    2]" 
        23 . 1  66 LEU C 1  67 LYS N  1  67 LYS CA 1  67 LYS C  -87.00  -49.00  -62.40  -63.33  -64.97    .  . 0 "[    .    1    .    2]" 
        24 . 1  67 LYS N 1  67 LYS CA 1  67 LYS C  1  68 THR N  -51.00   -7.00  -24.49  -39.41   -6.43 0.57 20 0 "[    .    1    .    2]" 
        25 . 1  67 LYS C 1  68 THR N  1  68 THR CA 1  68 THR C -139.00  -53.00  -93.19  -92.84  -99.34    .  . 0 "[    .    1    .    2]" 
        26 . 1  68 THR N 1  68 THR CA 1  68 THR C  1  69 ILE N  -55.00  -15.00  -13.59  -14.71  -11.81 3.19  8 0 "[    .    1    .    2]" 
        27 . 1  72 GLY C 1  73 GLU N  1  73 GLU CA 1  73 GLU C -113.00  -45.00  -92.36 -109.50  -80.29    .  . 0 "[    .    1    .    2]" 
        28 . 1  73 GLU N 1  73 GLU CA 1  73 GLU C  1  74 VAL N  145.00  161.00  149.13  151.97  150.30    .  . 0 "[    .    1    .    2]" 
        29 . 1  73 GLU C 1  74 VAL N  1  74 VAL CA 1  74 VAL C -123.00  -63.00 -104.44 -110.10 -110.98    .  . 0 "[    .    1    .    2]" 
        30 . 1  74 VAL N 1  74 VAL CA 1  74 VAL C  1  75 ILE N   99.00  149.00  114.15   98.56  127.95 0.44 20 0 "[    .    1    .    2]" 
        31 . 1  74 VAL C 1  75 ILE N  1  75 ILE CA 1  75 ILE C -155.00  -79.00 -106.67 -109.84 -110.07    .  . 0 "[    .    1    .    2]" 
        32 . 1  75 ILE N 1  75 ILE CA 1  75 ILE C  1  76 ASN N  155.00 -169.00  158.30  153.49  174.79 1.51  7 0 "[    .    1    .    2]" 
        33 . 1  76 ASN C 1  77 ILE N  1  77 ILE CA 1  77 ILE C -145.00  -63.00 -116.66 -114.34 -117.48    .  . 0 "[    .    1    .    2]" 
        34 . 1  77 ILE N 1  77 ILE CA 1  77 ILE C  1  78 THR N  105.00  149.00  110.54  103.73  119.41 1.27  9 0 "[    .    1    .    2]" 
        35 . 1  77 ILE C 1  78 THR N  1  78 THR CA 1  78 THR C -127.00  -69.00  -89.83  -91.00  -91.93    .  . 0 "[    .    1    .    2]" 
        36 . 1  78 THR N 1  78 THR CA 1  78 THR C  1  79 THR N  103.00  145.00  117.11  102.25  130.17 0.75 18 0 "[    .    1    .    2]" 
        37 . 1  78 THR C 1  79 THR N  1  79 THR CA 1  79 THR C -159.00  -65.00 -112.88 -117.17 -119.81    .  . 0 "[    .    1    .    2]" 
        38 . 1  79 THR N 1  79 THR CA 1  79 THR C  1  80 ASP N  137.00 -171.00  175.04  167.65 -173.38    .  . 0 "[    .    1    .    2]" 
        39 . 1  82 GLY C 1  83 THR N  1  83 THR CA 1  83 THR C -139.00  -63.00 -100.50 -117.50  -77.84    .  . 0 "[    .    1    .    2]" 
        40 . 1  83 THR N 1  83 THR CA 1  83 THR C  1  84 PHE N  107.00  145.00  122.44  106.72  138.23 0.28 15 0 "[    .    1    .    2]" 
        41 . 1  83 THR C 1  84 PHE N  1  84 PHE CA 1  84 PHE C -157.00 -107.00 -124.21 -116.69 -121.02    .  . 0 "[    .    1    .    2]" 
        42 . 1  84 PHE N 1  84 PHE CA 1  84 PHE C  1  85 HIS N  135.00  177.00  159.78  147.39  177.46 0.46 18 0 "[    .    1    .    2]" 
        43 . 1  84 PHE C 1  85 HIS N  1  85 HIS CA 1  85 HIS C -137.00  -79.00 -116.77 -102.51 -106.57    .  . 0 "[    .    1    .    2]" 
        44 . 1  85 HIS N 1  85 HIS CA 1  85 HIS C  1  86 LEU N  115.00  165.00  129.47  125.42  124.31 0.43  5 0 "[    .    1    .    2]" 
        45 . 1  85 HIS C 1  86 LEU N  1  86 LEU CA 1  86 LEU C -159.00  -95.00 -122.05 -114.16 -116.69    .  . 0 "[    .    1    .    2]" 
        46 . 1  86 LEU N 1  86 LEU CA 1  86 LEU C  1  87 LYS N  135.00  157.00  145.19  136.71  135.95 0.42 14 0 "[    .    1    .    2]" 
        47 . 1  86 LEU C 1  87 LYS N  1  87 LYS CA 1  87 LYS C -133.00  -67.00 -105.95 -127.08  -91.94    .  . 0 "[    .    1    .    2]" 
        48 . 1  87 LYS N 1  87 LYS CA 1  87 LYS C  1  88 THR N  105.00  145.00  124.45  111.32  146.58 1.58 19 0 "[    .    1    .    2]" 
        49 . 1 101 GLY C 1 102 ILE N  1 102 ILE CA 1 102 ILE C -155.00 -115.00 -133.80 -147.69 -114.58 0.42  1 0 "[    .    1    .    2]" 
        50 . 1 102 ILE N 1 102 ILE CA 1 102 ILE C  1 103 ARG N  125.00  173.00  154.95  158.31  154.54 0.29 14 0 "[    .    1    .    2]" 
        51 . 1 102 ILE C 1 103 ARG N  1 103 ARG CA 1 103 ARG C -161.00  -65.00  -93.81 -114.63  -69.52    .  . 0 "[    .    1    .    2]" 
        52 . 1 103 ARG N 1 103 ARG CA 1 103 ARG C  1 104 THR N   97.00  171.00  137.46  132.49  130.46    .  . 0 "[    .    1    .    2]" 
        53 . 1 103 ARG C 1 104 THR N  1 104 THR CA 1 104 THR C -153.00 -111.00 -121.09 -131.59 -133.21 1.52  4 0 "[    .    1    .    2]" 
        54 . 1 104 THR N 1 104 THR CA 1 104 THR C  1 105 SER N  123.00 -171.00  144.72  148.97  145.58 0.90  8 0 "[    .    1    .    2]" 
        55 . 1 104 THR C 1 105 SER N  1 105 SER CA 1 105 SER C -155.00  -45.00 -137.81 -128.60 -135.67 1.97  6 0 "[    .    1    .    2]" 
        56 . 1 105 SER N 1 105 SER CA 1 105 SER C  1 106 ASN N  143.00 -173.00  166.58  160.29  157.45    .  . 0 "[    .    1    .    2]" 
        57 . 1  24 PRO C 1  25 ASP N  1  25 ASP CA 1  25 ASP C   45.00  -45.00 -164.88   69.64  -91.53    .  . 0 "[    .    1    .    2]" 
        58 . 1  24 PRO C 1  25 ASP N  1  25 ASP CA 1  25 ASP C  175.00   75.00 -164.88   69.64  -91.53 0.94 14 0 "[    .    1    .    2]" 
        59 . 1  25 ASP N 1  25 ASP CA 1  25 ASP C  1  26 GLY N  -85.00  105.00   -7.15  -54.91   86.08    .  . 0 "[    .    1    .    2]" 
        60 . 1  25 ASP C 1  26 GLY N  1  26 GLY CA 1  26 GLY C   45.00  -45.00  138.59  134.53  115.64    .  . 0 "[    .    1    .    2]" 
        61 . 1  26 GLY N 1  26 GLY CA 1  26 GLY C  1  27 VAL N  115.00 -115.00  148.39  115.94  176.10    .  . 0 "[    .    1    .    2]" 
        62 . 1  29 ILE C 1  30 ASP N  1  30 ASP CA 1  30 ASP C  175.00  -45.00  -69.48  -71.20  -74.12    .  . 0 "[    .    1    .    2]" 
        63 . 1  30 ASP N 1  30 ASP CA 1  30 ASP C  1  31 SER N  -85.00  -25.00  -62.53  -63.78  -64.77    .  . 0 "[    .    1    .    2]" 
        64 . 1  30 ASP C 1  31 SER N  1  31 SER CA 1  31 SER C   45.00  -45.00 -155.45 -150.03 -150.06    .  . 0 "[    .    1    .    2]" 
        65 . 1  30 ASP C 1  31 SER N  1  31 SER CA 1  31 SER C  175.00   75.00 -155.45 -150.03 -150.06    .  . 0 "[    .    1    .    2]" 
        66 . 1  31 SER N 1  31 SER CA 1  31 SER C  1  32 VAL N  125.00 -155.00  153.79  140.47  173.51    .  . 0 "[    .    1    .    2]" 
        67 . 1  45 GLY C 1  46 LEU N  1  46 LEU CA 1  46 LEU C -125.00  -45.00  -87.75  -80.63  -81.79    .  . 0 "[    .    1    .    2]" 
        68 . 1  46 LEU N 1  46 LEU CA 1  46 LEU C  1  47 VAL N  165.00 -165.00  164.07  163.32  163.29 2.99  7 0 "[    .    1    .    2]" 
        69 . 1  46 LEU C 1  47 VAL N  1  47 VAL CA 1  47 VAL C -155.00  -45.00 -107.31 -111.28 -113.32    .  . 0 "[    .    1    .    2]" 
        70 . 1  47 VAL N 1  47 VAL CA 1  47 VAL C  1  48 ILE N   45.00  165.00  136.47  135.09  130.20    .  . 0 "[    .    1    .    2]" 
        71 . 1  47 VAL C 1  48 ILE N  1  48 ILE CA 1  48 ILE C   45.00  -45.00  -94.86 -104.36  -84.59    .  . 0 "[    .    1    .    2]" 
        72 . 1  47 VAL C 1  48 ILE N  1  48 ILE CA 1  48 ILE C -155.00   65.00  -94.86 -104.36  -84.59    .  . 0 "[    .    1    .    2]" 
        73 . 1  48 ILE N 1  48 ILE CA 1  48 ILE C  1  49 GLU N   75.00 -165.00  121.64  119.12  115.51    .  . 0 "[    .    1    .    2]" 
        74 . 1  48 ILE C 1  49 GLU N  1  49 GLU CA 1  49 GLU C  175.00  -55.00  -83.19  -79.82  -81.96    .  . 0 "[    .    1    .    2]" 
        75 . 1  49 GLU N 1  49 GLU CA 1  49 GLU C  1  50 SER N  -75.00  -25.00  -50.13  -57.00  -42.52    .  . 0 "[    .    1    .    2]" 
        76 . 1  49 GLU C 1  50 SER N  1  50 SER CA 1  50 SER C   45.00  -45.00 -157.06 -161.83 -162.73    .  . 0 "[    .    1    .    2]" 
        77 . 1  49 GLU C 1  50 SER N  1  50 SER CA 1  50 SER C  175.00   75.00 -157.06 -161.83 -162.73    .  . 0 "[    .    1    .    2]" 
        78 . 1  50 SER N 1  50 SER CA 1  50 SER C  1  51 ILE N  125.00 -155.00  153.62  153.77  153.15    .  . 0 "[    .    1    .    2]" 
        79 . 1  50 SER C 1  51 ILE N  1  51 ILE CA 1  51 ILE C   45.00  -45.00 -113.52 -135.95  -96.86    .  . 0 "[    .    1    .    2]" 
        80 . 1  50 SER C 1  51 ILE N  1  51 ILE CA 1  51 ILE C  175.00   65.00 -113.52 -135.95  -96.86    .  . 0 "[    .    1    .    2]" 
        81 . 1  51 ILE N 1  51 ILE CA 1  51 ILE C  1  52 ASN N   45.00 -165.00  122.17   85.44 -171.37    .  . 0 "[    .    1    .    2]" 
        82 . 1  51 ILE C 1  52 ASN N  1  52 ASN CA 1  52 ASN C   45.00  -45.00   41.88   54.72  -48.72    .  . 0 "[    .    1    .    2]" 
        83 . 1  51 ILE C 1  52 ASN N  1  52 ASN CA 1  52 ASN C  175.00   75.00   41.88   54.72  -48.72    .  . 0 "[    .    1    .    2]" 
        84 . 1  51 ILE C 1  52 ASN N  1  52 ASN CA 1  52 ASN C  -95.00 -145.00   41.88   54.72  -48.72    .  . 0 "[    .    1    .    2]" 
        85 . 1  52 ASN N 1  52 ASN CA 1  52 ASN C  1  53 GLY N  -85.00 -155.00  144.91 -152.65  103.44 3.15  8 0 "[    .    1    .    2]" 
        86 . 1  52 ASN C 1  53 GLY N  1  53 GLY CA 1  53 GLY C   45.00  -45.00  125.44 -140.09  108.95    .  . 0 "[    .    1    .    2]" 
        87 . 1  53 GLY N 1  53 GLY CA 1  53 GLY C  1  54 MET N -125.00  125.00   -5.24    7.28    3.77    .  . 0 "[    .    1    .    2]" 
        88 . 1  56 THR C 1  57 SER N  1  57 SER CA 1  57 SER C   65.00  -45.00  -93.16  -89.05  -91.06    .  . 0 "[    .    1    .    2]" 
        89 . 1  56 THR C 1  57 SER N  1  57 SER CA 1  57 SER C  175.00   75.00  -93.16  -89.05  -91.06    .  . 0 "[    .    1    .    2]" 
        90 . 1  57 SER N 1  57 SER CA 1  57 SER C  1  58 ASN N   85.00  -15.00  -19.35  -12.72  -13.48 2.80  2 0 "[    .    1    .    2]" 
        91 . 1  57 SER N 1  57 SER CA 1  57 SER C  1  58 ASN N  -85.00 -165.00  -19.35  -12.72  -13.48    .  . 0 "[    .    1    .    2]" 
        92 . 1  57 SER C 1  58 ASN N  1  58 ASN CA 1  58 ASN C   45.00  -45.00 -126.19 -146.63  -86.24    .  . 0 "[    .    1    .    2]" 
        93 . 1  57 SER C 1  58 ASN N  1  58 ASN CA 1  58 ASN C  175.00   75.00 -126.19 -146.63  -86.24    .  . 0 "[    .    1    .    2]" 
        94 . 1  58 ASN N 1  58 ASN CA 1  58 ASN C  1  59 LEU N  135.00 -155.00  169.61  177.89  176.08    .  . 0 "[    .    1    .    2]" 
        95 . 1  58 ASN C 1  59 LEU N  1  59 LEU CA 1  59 LEU C -125.00  -45.00  -75.39  -90.08  -65.11    .  . 0 "[    .    1    .    2]" 
        96 . 1  59 LEU N 1  59 LEU CA 1  59 LEU C  1  60 THR N   65.00   35.00  -34.76  -36.45  -38.55    .  . 0 "[    .    1    .    2]" 
        97 . 1  59 LEU N 1  59 LEU CA 1  59 LEU C  1  60 THR N  165.00  145.00  -34.76  -36.45  -38.55    .  . 0 "[    .    1    .    2]" 
        98 . 1  59 LEU N 1  59 LEU CA 1  59 LEU C  1  60 THR N  -85.00 -165.00  -34.76  -36.45  -38.55    .  . 0 "[    .    1    .    2]" 
        99 . 1  68 THR C 1  69 ILE N  1  69 ILE CA 1  69 ILE C -125.00  -45.00  -78.23  -85.66  -88.75    .  . 0 "[    .    1    .    2]" 
       100 . 1  69 ILE N 1  69 ILE CA 1  69 ILE C  1  70 SER N   75.00  165.00  139.50  126.74  148.33    .  . 0 "[    .    1    .    2]" 
       101 . 1  69 ILE C 1  70 SER N  1  70 SER CA 1  70 SER C   45.00  -45.00  -96.48  -94.03 -102.11    .  . 0 "[    .    1    .    2]" 
       102 . 1  69 ILE C 1  70 SER N  1  70 SER CA 1  70 SER C  175.00   75.00  -96.48  -94.03 -102.11    .  . 0 "[    .    1    .    2]" 
       103 . 1  70 SER N 1  70 SER CA 1  70 SER C  1  71 VAL N  135.00 -155.00  165.11  143.99 -171.80    .  . 0 "[    .    1    .    2]" 
       104 . 1  70 SER C 1  71 VAL N  1  71 VAL CA 1  71 VAL C -145.00  -45.00  -77.82  -74.26  -76.75    .  . 0 "[    .    1    .    2]" 
       105 . 1  71 VAL N 1  71 VAL CA 1  71 VAL C  1  72 GLY N   95.00  165.00  124.41  133.96  129.79    .  . 0 "[    .    1    .    2]" 
       106 . 1  71 VAL C 1  72 GLY N  1  72 GLY CA 1  72 GLY C   45.00  -45.00   89.28   69.02  102.58    .  . 0 "[    .    1    .    2]" 
       107 . 1  72 GLY N 1  72 GLY CA 1  72 GLY C  1  73 GLU N  -95.00   95.00   13.06   21.29   15.12    .  . 0 "[    .    1    .    2]" 
       108 . 1  75 ILE C 1  76 ASN N  1  76 ASN CA 1  76 ASN C -165.00  -45.00 -105.66  -95.85  -99.08    .  . 0 "[    .    1    .    2]" 
       109 . 1  76 ASN N 1  76 ASN CA 1  76 ASN C  1  77 ILE N  105.00 -175.00  117.39  104.41  136.60 0.59  3 0 "[    .    1    .    2]" 
       110 . 1  79 THR C 1  80 ASP N  1  80 ASP CA 1  80 ASP C   45.00  -45.00  -57.36  -56.71  -57.86    .  . 0 "[    .    1    .    2]" 
       111 . 1  79 THR C 1  80 ASP N  1  80 ASP CA 1  80 ASP C  175.00   65.00  -57.36  -56.71  -57.86    .  . 0 "[    .    1    .    2]" 
       112 . 1  80 ASP N 1  80 ASP CA 1  80 ASP C  1  81 GLN N  -85.00   95.00  -31.86  -32.71  -33.37    .  . 0 "[    .    1    .    2]" 
       113 . 1  80 ASP C 1  81 GLN N  1  81 GLN CA 1  81 GLN C   45.00  -85.00 -106.77 -132.86  -90.73    .  . 0 "[    .    1    .    2]" 
       114 . 1  80 ASP C 1  81 GLN N  1  81 GLN CA 1  81 GLN C  175.00   75.00 -106.77 -132.86  -90.73    .  . 0 "[    .    1    .    2]" 
       115 . 1  81 GLN N 1  81 GLN CA 1  81 GLN C  1  82 GLY N    5.00   75.00   16.69    4.42   31.09 0.58  7 0 "[    .    1    .    2]" 
       116 . 1  81 GLN C 1  82 GLY N  1  82 GLY CA 1  82 GLY C   45.00  -45.00  138.13  134.08  128.74    .  . 0 "[    .    1    .    2]" 
       117 . 1  82 GLY N 1  82 GLY CA 1  82 GLY C  1  83 THR N    5.00 -125.00  169.02  119.96 -169.35    .  . 0 "[    .    1    .    2]" 
       118 . 1  87 LYS C 1  88 THR N  1  88 THR CA 1  88 THR C   45.00  -45.00  -70.61  -83.92  -59.25    .  . 0 "[    .    1    .    2]" 
       119 . 1  87 LYS C 1  88 THR N  1  88 THR CA 1  88 THR C  175.00   75.00  -70.61  -83.92  -59.25    .  . 0 "[    .    1    .    2]" 
       120 . 1  88 THR N 1  88 THR CA 1  88 THR C  1  89 GLY N  125.00 -165.00  135.84  123.49  148.17 1.51 18 0 "[    .    1    .    2]" 
       121 . 1  88 THR C 1  89 GLY N  1  89 GLY CA 1  89 GLY C   45.00  -45.00 -103.82 -159.92  -72.91    .  . 0 "[    .    1    .    2]" 
       122 . 1  89 GLY N 1  89 GLY CA 1  89 GLY C  1  90 ARG N    5.00   -5.00 -171.06 -171.88 -177.56    .  . 0 "[    .    1    .    2]" 
       123 . 1  89 GLY N 1  89 GLY CA 1  89 GLY C  1  90 ARG N  105.00   15.00 -171.06 -171.88 -177.56 1.66  4 0 "[    .    1    .    2]" 
       124 . 1  89 GLY N 1  89 GLY CA 1  89 GLY C  1  90 ARG N  -15.00 -105.00 -171.06 -171.88 -177.56    .  . 0 "[    .    1    .    2]" 
       125 . 1  89 GLY C 1  90 ARG N  1  90 ARG CA 1  90 ARG C   45.00  -45.00 -119.02 -156.36   47.97    .  . 0 "[    .    1    .    2]" 
       126 . 1  89 GLY C 1  90 ARG N  1  90 ARG CA 1  90 ARG C  175.00   75.00 -119.02 -156.36   47.97    .  . 0 "[    .    1    .    2]" 
       127 . 1  90 ARG N 1  90 ARG CA 1  90 ARG C  1  91 ASN N  -85.00 -165.00  132.49   75.64   35.55    .  . 0 "[    .    1    .    2]" 
       128 . 1  93 ASN C 1  94 ASN N  1  94 ASN CA 1  94 ASN C   45.00  -45.00 -126.83   58.49  -77.96    .  . 0 "[    .    1    .    2]" 
       129 . 1  93 ASN C 1  94 ASN N  1  94 ASN CA 1  94 ASN C  175.00   75.00 -126.83   58.49  -77.96    .  . 0 "[    .    1    .    2]" 
       130 . 1  94 ASN N 1  94 ASN CA 1  94 ASN C  1  95 SER N  -85.00 -155.00  148.46   44.92  -14.86 0.69  6 0 "[    .    1    .    2]" 
       131 . 1  94 ASN C 1  95 SER N  1  95 SER CA 1  95 SER C   45.00  -45.00  -94.86   57.21  -52.27    .  . 0 "[    .    1    .    2]" 
       132 . 1  94 ASN C 1  95 SER N  1  95 SER CA 1  95 SER C  175.00   75.00  -94.86   57.21  -52.27 1.24 13 0 "[    .    1    .    2]" 
       133 . 1  95 SER N 1  95 SER CA 1  95 SER C  1  96 SER N  -85.00 -155.00   96.67  177.17  146.62    .  . 0 "[    .    1    .    2]" 
       134 . 1  95 SER C 1  96 SER N  1  96 SER CA 1  96 SER C   45.00  -45.00  -99.55   61.52  -58.23    .  . 0 "[    .    1    .    2]" 
       135 . 1  95 SER C 1  96 SER N  1  96 SER CA 1  96 SER C  175.00   75.00  -99.55   61.52  -58.23    .  . 0 "[    .    1    .    2]" 
       136 . 1  96 SER N 1  96 SER CA 1  96 SER C  1  97 ARG N   95.00   15.00  145.65   98.22   15.79 0.79 20 0 "[    .    1    .    2]" 
       137 . 1  96 SER N 1  96 SER CA 1  96 SER C  1  97 ARG N  -85.00 -155.00  145.65   98.22   15.79    .  . 0 "[    .    1    .    2]" 
       138 . 1  96 SER C 1  97 ARG N  1  97 ARG CA 1  97 ARG C -165.00  -45.00 -116.52 -149.99  -72.08    .  . 0 "[    .    1    .    2]" 
       139 . 1  97 ARG N 1  97 ARG CA 1  97 ARG C  1  98 ALA N  105.00 -165.00  155.57  145.46  136.14 0.74 20 0 "[    .    1    .    2]" 
       140 . 1  97 ARG C 1  98 ALA N  1  98 ALA CA 1  98 ALA C   45.00  -45.00   35.75   65.90   62.24    .  . 0 "[    .    1    .    2]" 
       141 . 1  97 ARG C 1  98 ALA N  1  98 ALA CA 1  98 ALA C  175.00   75.00   35.75   65.90   62.24    .  . 0 "[    .    1    .    2]" 
       142 . 1  98 ALA N 1  98 ALA CA 1  98 ALA C  1  99 TYR N  -15.00 -155.00   92.60   68.02  139.16    .  . 0 "[    .    1    .    2]" 
       143 . 1  98 ALA C 1  99 TYR N  1  99 TYR CA 1  99 TYR C   45.00  -45.00 -102.46  -96.49 -107.45    .  . 0 "[    .    1    .    2]" 
       144 . 1  98 ALA C 1  99 TYR N  1  99 TYR CA 1  99 TYR C  175.00   75.00 -102.46  -96.49 -107.45    .  . 0 "[    .    1    .    2]" 
       145 . 1  99 TYR N 1  99 TYR CA 1  99 TYR C  1 100 MET N  -85.00 -165.00  111.32  109.35  102.04    .  . 0 "[    .    1    .    2]" 
       146 . 1  99 TYR C 1 100 MET N  1 100 MET CA 1 100 MET C   45.00  -45.00  -73.71 -108.06   70.63    .  . 0 "[    .    1    .    2]" 
       147 . 1  99 TYR C 1 100 MET N  1 100 MET CA 1 100 MET C  175.00   75.00  -73.71 -108.06   70.63    .  . 0 "[    .    1    .    2]" 
       148 . 1 100 MET N 1 100 MET CA 1 100 MET C  1 101 GLY N  -85.00 -155.00  -22.86   94.74  -16.25 1.03 20 0 "[    .    1    .    2]" 
       149 . 1 100 MET C 1 101 GLY N  1 101 GLY CA 1 101 GLY C   45.00  -45.00  124.75 -155.53  124.21    .  . 0 "[    .    1    .    2]" 
       150 . 1 105 SER C 1 106 ASN N  1 106 ASN CA 1 106 ASN C   55.00  -45.00  -92.88 -114.60  -68.01    .  . 0 "[    .    1    .    2]" 
       151 . 1 105 SER C 1 106 ASN N  1 106 ASN CA 1 106 ASN C  175.00   65.00  -92.88 -114.60  -68.01    .  . 0 "[    .    1    .    2]" 
       152 . 1 106 ASN N 1 106 ASN CA 1 106 ASN C  1 107 HIS N  -85.00   75.00   -1.81    3.62   -8.82    .  . 0 "[    .    1    .    2]" 
       153 . 1 106 ASN C 1 107 HIS N  1 107 HIS CA 1 107 HIS C   45.00  -45.00   40.34   62.84   59.58 1.84  8 0 "[    .    1    .    2]" 
       154 . 1 106 ASN C 1 107 HIS N  1 107 HIS CA 1 107 HIS C  175.00   75.00   40.34   62.84   59.58    .  . 0 "[    .    1    .    2]" 
       155 . 1 107 HIS N 1 107 HIS CA 1 107 HIS C  1 108 LEU N   25.00 -165.00   60.57   34.90  149.49    .  . 0 "[    .    1    .    2]" 
       156 . 1 107 HIS C 1 108 LEU N  1 108 LEU CA 1 108 LEU C -135.00  -45.00  -79.52 -135.42  -45.38 0.42  2 0 "[    .    1    .    2]" 
       157 . 1 108 LEU N 1 108 LEU CA 1 108 LEU C  1 109 ARG N  135.00 -165.00  173.08 -176.41  172.82 1.51 12 0 "[    .    1    .    2]" 
       158 . 1 108 LEU C 1 109 ARG N  1 109 ARG CA 1 109 ARG C   45.00  -45.00  -89.76   60.95  -66.15    .  . 0 "[    .    1    .    2]" 
       159 . 1 108 LEU C 1 109 ARG N  1 109 ARG CA 1 109 ARG C  175.00   75.00  -89.76   60.95  -66.15    .  . 0 "[    .    1    .    2]" 
       160 . 1 109 ARG N 1 109 ARG CA 1 109 ARG C  1 110 VAL N   35.00 -165.00  119.03   69.29  166.31    .  . 0 "[    .    1    .    2]" 
       161 . 1 109 ARG C 1 110 VAL N  1 110 VAL CA 1 110 VAL C -165.00  -45.00  -91.49 -158.03  -55.96    .  . 0 "[    .    1    .    2]" 
       162 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C  1 111 ARG N   25.00  165.00  137.02  145.79  142.77    .  . 0 "[    .    1    .    2]" 
       163 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C  1 111 ARG N  115.00   35.00  137.02  145.79  142.77    .  . 0 "[    .    1    .    2]" 
       164 . 1 110 VAL C 1 111 ARG N  1 111 ARG CA 1 111 ARG C   45.00  -45.00 -121.05 -134.72 -150.74    .  . 0 "[    .    1    .    2]" 
       165 . 1 110 VAL C 1 111 ARG N  1 111 ARG CA 1 111 ARG C  175.00   75.00 -121.05 -134.72 -150.74    .  . 0 "[    .    1    .    2]" 
       166 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C  1 112 ASP N   75.00   45.00  131.36  -27.44 -172.40    .  . 0 "[    .    1    .    2]" 
       167 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C  1 112 ASP N  -85.00 -165.00  131.36  -27.44 -172.40    .  . 0 "[    .    1    .    2]" 
       168 . 1 111 ARG C 1 112 ASP N  1 112 ASP CA 1 112 ASP C   45.00  -45.00 -111.85   60.84  -53.97    .  . 0 "[    .    1    .    2]" 
       169 . 1 111 ARG C 1 112 ASP N  1 112 ASP CA 1 112 ASP C  175.00   75.00 -111.85   60.84  -53.97    .  . 0 "[    .    1    .    2]" 
       170 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C  1 113 SER N   15.00 -165.00   97.41  143.25  125.81    .  . 0 "[    .    1    .    2]" 
       171 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C  1 113 SER N -175.00  175.00   97.41  143.25  125.81    .  . 0 "[    .    1    .    2]" 
       172 . 1 112 ASP C 1 113 SER N  1 113 SER CA 1 113 SER C   45.00  -45.00 -115.26  -82.18  -90.67    .  . 0 "[    .    1    .    2]" 
       173 . 1 112 ASP C 1 113 SER N  1 113 SER CA 1 113 SER C  175.00   75.00 -115.26  -82.18  -90.67    .  . 0 "[    .    1    .    2]" 
       174 . 1 113 SER N 1 113 SER CA 1 113 SER C  1 114 VAL N   15.00 -155.00  105.04   27.70 -177.48    .  . 0 "[    .    1    .    2]" 
       175 . 1 113 SER C 1 114 VAL N  1 114 VAL CA 1 114 VAL C -145.00  -45.00  -92.10 -124.33  -63.53    .  . 0 "[    .    1    .    2]" 
       176 . 1 114 VAL N 1 114 VAL CA 1 114 VAL C  1 115 ALA N   95.00 -165.00  135.58   94.73  170.30 0.27  4 0 "[    .    1    .    2]" 
       177 . 1 114 VAL C 1 115 ALA N  1 115 ALA CA 1 115 ALA C   45.00  -45.00 -126.04 -105.86 -113.93    .  . 0 "[    .    1    .    2]" 
       178 . 1 114 VAL C 1 115 ALA N  1 115 ALA CA 1 115 ALA C  175.00   75.00 -126.04 -105.86 -113.93    .  . 0 "[    .    1    .    2]" 
       179 . 1 115 ALA N 1 115 ALA CA 1 115 ALA C  1 116 SER N  -85.00 -155.00  104.76  -85.30  154.27 0.30  5 0 "[    .    1    .    2]" 
       180 . 1 115 ALA C 1 116 SER N  1 116 SER CA 1 116 SER C   45.00  -45.00 -114.20   63.41  -72.49    .  . 0 "[    .    1    .    2]" 
       181 . 1 115 ALA C 1 116 SER N  1 116 SER CA 1 116 SER C  175.00   75.00 -114.20   63.41  -72.49    .  . 0 "[    .    1    .    2]" 
       182 . 1 116 SER N 1 116 SER CA 1 116 SER C  1 117 VAL N   15.00 -155.00   94.79   15.11 -161.75    .  . 0 "[    .    1    .    2]" 
       183 . 1 116 SER C 1 117 VAL N  1 117 VAL CA 1 117 VAL C   45.00  -45.00 -100.63 -135.62   67.23    .  . 0 "[    .    1    .    2]" 
       184 . 1 116 SER C 1 117 VAL N  1 117 VAL CA 1 117 VAL C  175.00   75.00 -100.63 -135.62   67.23    .  . 0 "[    .    1    .    2]" 
       185 . 1 117 VAL N 1 117 VAL CA 1 117 VAL C  1 118 LEU N   25.00 -165.00  117.17   88.76  167.59    .  . 0 "[    .    1    .    2]" 
       186 . 1 117 VAL C 1 118 LEU N  1 118 LEU CA 1 118 LEU C   45.00  -45.00  -96.40 -127.58  -79.44    .  . 0 "[    .    1    .    2]" 
       187 . 1 117 VAL C 1 118 LEU N  1 118 LEU CA 1 118 LEU C -165.00   75.00  -96.40 -127.58  -79.44    .  . 0 "[    .    1    .    2]" 
       188 . 1 118 LEU N 1 118 LEU CA 1 118 LEU C  1 119 GLY N  -85.00   45.00  -45.83  -14.88  -28.43    .  . 0 "[    .    1    .    2]" 
       189 . 1 118 LEU C 1 119 GLY N  1 119 GLY CA 1 119 GLY C   45.00  -45.00   93.94   60.49 -100.84    .  . 0 "[    .    1    .    2]" 
       190 . 1 119 GLY C 1 120 ASP N  1 120 ASP CA 1 120 ASP C   45.00  -45.00  -93.65   60.45  -70.85    .  . 0 "[    .    1    .    2]" 
       191 . 1 119 GLY C 1 120 ASP N  1 120 ASP CA 1 120 ASP C  175.00   75.00  -93.65   60.45  -70.85 0.02  7 0 "[    .    1    .    2]" 
       192 . 1 120 ASP N 1 120 ASP CA 1 120 ASP C  1 121 THR N  -85.00 -155.00  131.63  -60.48  179.07    .  . 0 "[    .    1    .    2]" 
       193 . 1 120 ASP C 1 121 THR N  1 121 THR CA 1 121 THR C   45.00  -45.00  -98.16   49.19  -64.18    .  . 0 "[    .    1    .    2]" 
       194 . 1 120 ASP C 1 121 THR N  1 121 THR CA 1 121 THR C  175.00   65.00  -98.16   49.19  -64.18    .  . 0 "[    .    1    .    2]" 
       195 . 1 121 THR N 1 121 THR CA 1 121 THR C  1 122 LEU N   35.00 -165.00  112.38   77.93  140.36    .  . 0 "[    .    1    .    2]" 
    stop_

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