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
457194 2kha 16231 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2kha


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              106
    _TA_constraint_stats_list.Viol_count                    353
    _TA_constraint_stats_list.Viol_total                    4509.23
    _TA_constraint_stats_list.Viol_max                      3.79
    _TA_constraint_stats_list.Viol_rms                      0.38
    _TA_constraint_stats_list.Viol_average_all_restraints   0.11
    _TA_constraint_stats_list.Viol_average_violations_only  0.64
    _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  11 GLN C 1  12 TYR N  1  12 TYR CA 1  12 TYR C -115.00  -55.00  -78.98  -79.20  -85.81    .  . 0 "[    .    1    .    2]" 
         2 . 1  12 TYR C 1  13 VAL N  1  13 VAL CA 1  13 VAL C -141.00  -81.00 -116.65 -117.67 -118.99    .  . 0 "[    .    1    .    2]" 
         3 . 1  13 VAL C 1  14 VAL N  1  14 VAL CA 1  14 VAL C -127.00  -67.00  -69.19  -81.36  -66.08 0.92 16 0 "[    .    1    .    2]" 
         4 . 1  14 VAL C 1  15 PRO N  1  15 PRO CA 1  15 PRO C  -92.00  -32.00  -65.11  -67.18  -67.41    .  . 0 "[    .    1    .    2]" 
         5 . 1  17 ALA C 1  18 LYS N  1  18 LYS CA 1  18 LYS C -142.00  -82.00  -89.76  -84.23  -87.45 0.28  7 0 "[    .    1    .    2]" 
         6 . 1  20 GLU C 1  21 ALA N  1  21 ALA CA 1  21 ALA C -148.00  -88.00  -86.69  -86.86  -86.91 1.88 19 0 "[    .    1    .    2]" 
         7 . 1  21 ALA C 1  22 ILE N  1  22 ILE CA 1  22 ILE C -132.00  -72.00  -87.31 -112.66  -71.82 0.18 10 0 "[    .    1    .    2]" 
         8 . 1  22 ILE C 1  23 TYR N  1  23 TYR CA 1  23 TYR C -139.00  -79.00  -97.08  -98.26 -104.16 0.15 20 0 "[    .    1    .    2]" 
         9 . 1  26 GLY C 1  27 LEU N  1  27 LEU CA 1  27 LEU C -158.00  -98.00 -152.20 -150.73 -151.46 0.27  3 0 "[    .    1    .    2]" 
        10 . 1  27 LEU C 1  28 ARG N  1  28 ARG CA 1  28 ARG C -155.00  -95.00 -128.25 -144.71  -97.07    .  . 0 "[    .    1    .    2]" 
        11 . 1  28 ARG C 1  29 VAL N  1  29 VAL CA 1  29 VAL C -151.00  -91.00 -116.56 -121.74 -122.76    .  . 0 "[    .    1    .    2]" 
        12 . 1  29 VAL C 1  30 SER N  1  30 SER CA 1  30 SER C -155.00  -95.00 -150.97 -147.82 -150.01 0.13 19 0 "[    .    1    .    2]" 
        13 . 1  30 SER C 1  31 ILE N  1  31 ILE CA 1  31 ILE C -157.00  -97.00 -141.18 -139.95 -140.50    .  . 0 "[    .    1    .    2]" 
        14 . 1  38 LEU C 1  39 PHE N  1  39 PHE CA 1  39 PHE C -157.00  -97.00 -123.76 -120.60 -122.32    .  . 0 "[    .    1    .    2]" 
        15 . 1  39 PHE C 1  40 ALA N  1  40 ALA CA 1  40 ALA C -145.00  -85.00  -97.52 -111.05  -84.89 0.11  3 0 "[    .    1    .    2]" 
        16 . 1  40 ALA C 1  41 PHE N  1  41 PHE CA 1  41 PHE C -166.00 -106.00 -111.25 -116.95 -121.28 1.06  9 0 "[    .    1    .    2]" 
        17 . 1  43 GLY C 1  44 LYS N  1  44 LYS CA 1  44 LYS C -166.00 -106.00 -115.44 -125.45 -105.89 0.11 12 0 "[    .    1    .    2]" 
        18 . 1  44 LYS C 1  45 LEU N  1  45 LEU CA 1  45 LEU C -140.00  -80.00  -93.94  -98.09  -98.97 0.18  6 0 "[    .    1    .    2]" 
        19 . 1  53 GLU C 1  54 ALA N  1  54 ALA CA 1  54 ALA C  -90.00  -30.00  -53.45  -62.43  -44.84    .  . 0 "[    .    1    .    2]" 
        20 . 1  57 TRP C 1  58 ALA N  1  58 ALA CA 1  58 ALA C -117.00  -57.00 -118.23 -118.15 -118.22 1.88 20 0 "[    .    1    .    2]" 
        21 . 1  58 ALA C 1  59 ARG N  1  59 ARG CA 1  59 ARG C -149.00  -89.00 -137.71 -149.18  -96.41 0.18  8 0 "[    .    1    .    2]" 
        22 . 1  59 ARG C 1  60 ASP N  1  60 ASP CA 1  60 ASP C -126.00  -66.00  -95.37  -99.87 -105.74    .  . 0 "[    .    1    .    2]" 
        23 . 1  67 GLY C 1  68 ARG N  1  68 ARG CA 1  68 ARG C -156.00  -96.00 -157.37 -157.84 -156.66 1.84  5 0 "[    .    1    .    2]" 
        24 . 1  68 ARG C 1  69 TRP N  1  69 TRP CA 1  69 TRP C -133.00  -73.00  -82.86  -94.92  -76.30    .  . 0 "[    .    1    .    2]" 
        25 . 1  69 TRP C 1  70 THR N  1  70 THR CA 1  70 THR C -134.00  -74.00 -134.66 -134.43 -134.59 1.52  9 0 "[    .    1    .    2]" 
        26 . 1  70 THR C 1  71 PHE N  1  71 PHE CA 1  71 PHE C -143.00  -83.00 -111.15 -122.64  -95.88    .  . 0 "[    .    1    .    2]" 
        27 . 1  71 PHE C 1  72 ARG N  1  72 ARG CA 1  72 ARG C -152.00  -92.00 -106.06 -144.87  -91.93 0.07  1 0 "[    .    1    .    2]" 
        28 . 1  72 ARG C 1  73 ASP N  1  73 ASP CA 1  73 ASP C -138.00  -78.00 -136.47 -138.02 -138.03 0.13 19 0 "[    .    1    .    2]" 
        29 . 1  73 ASP C 1  74 ARG N  1  74 ARG CA 1  74 ARG C  -89.00  -29.00  -89.22  -89.37  -89.09 0.37  4 0 "[    .    1    .    2]" 
        30 . 1  76 ALA C 1  77 LYS N  1  77 LYS CA 1  77 LYS C -134.00  -74.00  -75.96  -87.24  -73.71 0.29 12 0 "[    .    1    .    2]" 
        31 . 1  77 LYS C 1  78 LEU N  1  78 LEU CA 1  78 LEU C -139.00  -79.00  -94.00 -122.01  -78.89 0.11 10 0 "[    .    1    .    2]" 
        32 . 1  78 LEU C 1  79 LYS N  1  79 LYS CA 1  79 LYS C -142.00  -82.00 -131.21 -125.55 -128.04 0.12 19 0 "[    .    1    .    2]" 
        33 . 1  82 ASP C 1  83 LYS N  1  83 LYS CA 1  83 LYS C -162.00 -102.00 -114.75 -114.13 -114.70    .  . 0 "[    .    1    .    2]" 
        34 . 1  83 LYS C 1  84 ILE N  1  84 ILE CA 1  84 ILE C -144.00  -84.00 -115.93 -127.85 -105.31    .  . 0 "[    .    1    .    2]" 
        35 . 1  84 ILE C 1  85 TYR N  1  85 TYR CA 1  85 TYR C -144.00  -84.00 -144.36 -144.64 -143.84 0.64  9 0 "[    .    1    .    2]" 
        36 . 1  85 TYR C 1  86 PHE N  1  86 PHE CA 1  86 PHE C -161.00 -101.00 -159.90 -161.57 -152.51 0.57  6 0 "[    .    1    .    2]" 
        37 . 1  86 PHE C 1  87 TRP N  1  87 TRP CA 1  87 TRP C -162.00 -102.00 -153.98 -152.83 -153.37    .  . 0 "[    .    1    .    2]" 
        38 . 1  87 TRP C 1  88 THR N  1  88 THR CA 1  88 THR C -160.00 -100.00 -102.39 -100.48 -106.82 0.64  4 0 "[    .    1    .    2]" 
        39 . 1  88 THR C 1  89 TYR N  1  89 TYR CA 1  89 TYR C -164.00 -104.00 -139.38 -150.01 -127.26    .  . 0 "[    .    1    .    2]" 
        40 . 1  89 TYR C 1  90 VAL N  1  90 VAL CA 1  90 VAL C -163.00 -103.00 -118.11 -144.72 -102.54 0.46 13 0 "[    .    1    .    2]" 
        41 . 1  90 VAL C 1  91 ILE N  1  91 ILE CA 1  91 ILE C -145.00  -85.00 -138.85 -136.91 -137.16 0.50  5 0 "[    .    1    .    2]" 
        42 . 1  92 LYS C 1  93 ASP N  1  93 ASP CA 1  93 ASP C   21.00   81.00   65.62   56.72   81.10 0.10 16 0 "[    .    1    .    2]" 
        43 . 1  96 GLY C 1  97 TYR N  1  97 TYR CA 1  97 TYR C -152.00  -92.00 -151.88 -152.54 -144.80 0.54 14 0 "[    .    1    .    2]" 
        44 . 1  97 TYR C 1  98 ARG N  1  98 ARG CA 1  98 ARG C -163.00 -103.00 -128.93 -144.18 -121.84    .  . 0 "[    .    1    .    2]" 
        45 . 1 102 GLY C 1 103 GLU N  1 103 GLU CA 1 103 GLU C -154.00  -94.00 -154.11 -154.65 -151.47 0.65 20 0 "[    .    1    .    2]" 
        46 . 1 103 GLU C 1 104 TRP N  1 104 TRP CA 1 104 TRP C -155.00  -95.00 -147.31 -149.18 -151.99 0.21 12 0 "[    .    1    .    2]" 
        47 . 1 104 TRP C 1 105 THR N  1 105 THR CA 1 105 THR C -151.00  -91.00 -108.95 -115.45 -105.01    .  . 0 "[    .    1    .    2]" 
        48 . 1 107 THR C 1 108 GLU N  1 108 GLU CA 1 108 GLU C -159.00  -99.00 -129.27 -125.30 -127.29    .  . 0 "[    .    1    .    2]" 
        49 . 1 108 GLU C 1 109 PHE N  1 109 PHE CA 1 109 PHE C -147.00  -87.00 -132.85 -122.15 -129.45    .  . 0 "[    .    1    .    2]" 
        50 . 1 109 PHE C 1 110 VAL N  1 110 VAL CA 1 110 VAL C -159.00  -99.00 -100.32 -118.67  -97.98 1.02 11 0 "[    .    1    .    2]" 
        51 . 1 111 ASN C 1 112 GLU N  1 112 GLU CA 1 112 GLU C  -88.00  -28.00  -55.51  -56.94  -54.24    .  . 0 "[    .    1    .    2]" 
        52 . 1 112 GLU C 1 113 ASP N  1 113 ASP CA 1 113 ASP C -117.00  -57.00  -71.41  -76.48  -66.47    .  . 0 "[    .    1    .    2]" 
        53 . 1 113 ASP C 1 114 GLY N  1 114 GLY CA 1 114 GLY C   57.00  117.00  117.71  117.57  117.87 0.87  8 0 "[    .    1    .    2]" 
        54 . 1  12 TYR N 1  12 TYR CA 1  12 TYR C  1  13 VAL N   79.00  179.00  173.63  175.61  175.12    .  . 0 "[    .    1    .    2]" 
        55 . 1  13 VAL N 1  13 VAL CA 1  13 VAL C  1  14 VAL N   79.00  179.00  161.27  157.86  179.36 0.36  9 0 "[    .    1    .    2]" 
        56 . 1  14 VAL N 1  14 VAL CA 1  14 VAL C  1  15 PRO N   78.00  178.00  135.60  138.77  138.51    .  . 0 "[    .    1    .    2]" 
        57 . 1  15 PRO N 1  15 PRO CA 1  15 PRO C  1  16 SER N   93.00 -167.00 -172.96 -169.09 -170.25 0.09 14 0 "[    .    1    .    2]" 
        58 . 1  18 LYS N 1  18 LYS CA 1  18 LYS C  1  19 LEU N   66.00  166.00  123.15  152.26  130.18    .  . 0 "[    .    1    .    2]" 
        59 . 1  21 ALA N 1  21 ALA CA 1  21 ALA C  1  22 ILE N   71.00  171.00  112.71  114.51  110.62    .  . 0 "[    .    1    .    2]" 
        60 . 1  22 ILE N 1  22 ILE CA 1  22 ILE C  1  23 TYR N   73.00  173.00  133.66  108.65  159.73    .  . 0 "[    .    1    .    2]" 
        61 . 1  23 TYR N 1  23 TYR CA 1  23 TYR C  1  24 PRO N   93.00 -167.00  144.09  140.82  150.78    .  . 0 "[    .    1    .    2]" 
        62 . 1  27 LEU N 1  27 LEU CA 1  27 LEU C  1  28 ARG N   81.00 -179.00  137.02  130.01  121.80    .  . 0 "[    .    1    .    2]" 
        63 . 1  28 ARG N 1  28 ARG CA 1  28 ARG C  1  29 VAL N   81.00 -179.00  113.16   96.34  134.91    .  . 0 "[    .    1    .    2]" 
        64 . 1  29 VAL N 1  29 VAL CA 1  29 VAL C  1  30 SER N   88.00 -172.00  153.80  142.20  161.50    .  . 0 "[    .    1    .    2]" 
        65 . 1  30 SER N 1  30 SER CA 1  30 SER C  1  31 ILE N  104.00 -156.00  146.15  148.82  147.07    .  . 0 "[    .    1    .    2]" 
        66 . 1  31 ILE N 1  31 ILE CA 1  31 ILE C  1  32 PRO N   96.00 -164.00  125.40  130.12  128.33    .  . 0 "[    .    1    .    2]" 
        67 . 1  39 PHE N 1  39 PHE CA 1  39 PHE C  1  40 ALA N   79.00  179.00   98.76  101.64   99.75    .  . 0 "[    .    1    .    2]" 
        68 . 1  40 ALA N 1  40 ALA CA 1  40 ALA C  1  41 PHE N   88.00 -172.00  123.23  114.78  135.63    .  . 0 "[    .    1    .    2]" 
        69 . 1  41 PHE N 1  41 PHE CA 1  41 PHE C  1  42 HIS N   93.00 -167.00  125.61  125.84  124.57    .  . 0 "[    .    1    .    2]" 
        70 . 1  44 LYS N 1  44 LYS CA 1  44 LYS C  1  45 LEU N   90.00 -170.00  143.15  149.18  148.92    .  . 0 "[    .    1    .    2]" 
        71 . 1  45 LEU N 1  45 LEU CA 1  45 LEU C  1  46 ASN N   83.00 -177.00  124.22  105.69  143.04    .  . 0 "[    .    1    .    2]" 
        72 . 1  54 ALA N 1  54 ALA CA 1  54 ALA C  1  55 GLY N  -79.00   21.00  -27.03  -20.31  -22.05    .  . 0 "[    .    1    .    2]" 
        73 . 1  58 ALA N 1  58 ALA CA 1  58 ALA C  1  59 ARG N   76.00  176.00   88.26   88.54   87.88    .  . 0 "[    .    1    .    2]" 
        74 . 1  59 ARG N 1  59 ARG CA 1  59 ARG C  1  60 ASP N   88.00 -172.00  127.89  114.30  143.85    .  . 0 "[    .    1    .    2]" 
        75 . 1  60 ASP N 1  60 ASP CA 1  60 ASP C  1  61 ILE N   75.00  175.00  120.96  118.62  111.65    .  . 0 "[    .    1    .    2]" 
        76 . 1  68 ARG N 1  68 ARG CA 1  68 ARG C  1  69 TRP N   97.00 -163.00  136.19  121.30  160.38    .  . 0 "[    .    1    .    2]" 
        77 . 1  69 TRP N 1  69 TRP CA 1  69 TRP C  1  70 THR N   83.00 -177.00  156.03  157.28  156.60    .  . 0 "[    .    1    .    2]" 
        78 . 1  70 THR N 1  70 THR CA 1  70 THR C  1  71 PHE N   82.00 -178.00  117.73  100.07  122.06    .  . 0 "[    .    1    .    2]" 
        79 . 1  71 PHE N 1  71 PHE CA 1  71 PHE C  1  72 ARG N   82.00 -178.00  101.52   82.00  154.02 0.00  6 0 "[    .    1    .    2]" 
        80 . 1  72 ARG N 1  72 ARG CA 1  72 ARG C  1  73 ASP N  103.00 -157.00  138.04  139.39  137.45    .  . 0 "[    .    1    .    2]" 
        81 . 1  73 ASP N 1  73 ASP CA 1  73 ASP C  1  74 ARG N   93.00 -167.00  105.62  105.37  104.34    .  . 0 "[    .    1    .    2]" 
        82 . 1  74 ARG N 1  74 ARG CA 1  74 ARG C  1  75 ASN N  -78.00   22.00   22.41   22.01   22.77 0.77 17 0 "[    .    1    .    2]" 
        83 . 1  77 LYS N 1  77 LYS CA 1  77 LYS C  1  78 LEU N   76.00  176.00   79.23   75.86   75.81 0.28 15 0 "[    .    1    .    2]" 
        84 . 1  78 LEU N 1  78 LEU CA 1  78 LEU C  1  79 LYS N   85.00 -175.00  148.08  115.48  169.90    .  . 0 "[    .    1    .    2]" 
        85 . 1  79 LYS N 1  79 LYS CA 1  79 LYS C  1  80 LEU N  111.00 -149.00  145.98  152.64  150.63    .  . 0 "[    .    1    .    2]" 
        86 . 1  83 LYS N 1  83 LYS CA 1  83 LYS C  1  84 ILE N   98.00 -162.00  158.58  148.89  172.50    .  . 0 "[    .    1    .    2]" 
        87 . 1  84 ILE N 1  84 ILE CA 1  84 ILE C  1  75 ASN N   72.00  172.00  174.96  174.93  174.84 3.79 10 0 "[    .    1    .    2]" 
        88 . 1  85 TYR N 1  85 TYR CA 1  85 TYR C  1  86 PHE N   78.00  178.00  126.34  124.92  122.34    .  . 0 "[    .    1    .    2]" 
        89 . 1  86 PHE N 1  86 PHE CA 1  86 PHE C  1  87 TRP N  104.00 -156.00 -175.52 -174.50 -174.90    .  . 0 "[    .    1    .    2]" 
        90 . 1  87 TRP N 1  87 TRP CA 1  87 TRP C  1  88 THR N   94.00 -166.00  131.82  133.06  132.35    .  . 0 "[    .    1    .    2]" 
        91 . 1  88 THR N 1  88 THR CA 1  88 THR C  1  89 TYR N  101.00 -159.00  157.77  160.97  156.98    .  . 0 "[    .    1    .    2]" 
        92 . 1  89 TYR N 1  89 TYR CA 1  89 TYR C  1  90 VAL N   97.00 -163.00  126.38  137.87  129.43    .  . 0 "[    .    1    .    2]" 
        93 . 1  90 VAL N 1  90 VAL CA 1  90 VAL C  1  91 ILE N  105.00 -155.00  164.17  160.25  169.60    .  . 0 "[    .    1    .    2]" 
        94 . 1  91 ILE N 1  91 ILE CA 1  91 ILE C  1  92 LYS N   85.00 -175.00  108.30  109.24  107.70    .  . 0 "[    .    1    .    2]" 
        95 . 1  93 ASP N 1  93 ASP CA 1  93 ASP C  1  94 GLY N   -5.00   95.00   63.08   46.02   77.60    .  . 0 "[    .    1    .    2]" 
        96 . 1  97 TYR N 1  97 TYR CA 1  97 TYR C  1  98 ARG N  106.00 -154.00  147.25  150.10  149.01    .  . 0 "[    .    1    .    2]" 
        97 . 1  98 ARG N 1  98 ARG CA 1  98 ARG C  1  99 GLN N  101.00 -159.00  145.62  140.11  152.40    .  . 0 "[    .    1    .    2]" 
        98 . 1 103 GLU N 1 103 GLU CA 1 103 GLU C  1 104 TRP N   91.00 -169.00  152.29  128.82  162.70    .  . 0 "[    .    1    .    2]" 
        99 . 1 104 TRP N 1 104 TRP CA 1 104 TRP C  1 105 THR N   75.00  175.00  165.92  165.69  165.45    .  . 0 "[    .    1    .    2]" 
       100 . 1 105 THR N 1 105 THR CA 1 105 THR C  1 106 VAL N   75.00  175.00  159.68  161.97  160.95    .  . 0 "[    .    1    .    2]" 
       101 . 1 108 GLU N 1 108 GLU CA 1 108 GLU C  1 109 PHE N  106.00 -154.00  154.11  137.20  172.78    .  . 0 "[    .    1    .    2]" 
       102 . 1 109 PHE N 1 109 PHE CA 1 109 PHE C  1 110 VAL N   99.00 -161.00  142.20  120.82  161.42    .  . 0 "[    .    1    .    2]" 
       103 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C  1 111 ASN N  104.00 -156.00  167.61  164.87  163.22    .  . 0 "[    .    1    .    2]" 
       104 . 1 112 GLU N 1 112 GLU CA 1 112 GLU C  1 113 ASP N  -77.00   23.00  -17.59  -16.94  -17.11    .  . 0 "[    .    1    .    2]" 
       105 . 1 113 ASP N 1 113 ASP CA 1 113 ASP C  1 114 GLY N  -50.00   50.00  -30.55  -31.93  -28.33    .  . 0 "[    .    1    .    2]" 
       106 . 1 114 GLY N 1 114 GLY CA 1 114 GLY C  1 115 THR N  -43.00   57.00   18.17   21.79   20.54    .  . 0 "[    .    1    .    2]" 
    stop_

save_



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