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
441546 2kb2 16037 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2kb2


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              168
    _TA_constraint_stats_list.Viol_count                    516
    _TA_constraint_stats_list.Viol_total                    9882.42
    _TA_constraint_stats_list.Viol_max                      2.91
    _TA_constraint_stats_list.Viol_rms                      0.43
    _TA_constraint_stats_list.Viol_average_all_restraints   0.15
    _TA_constraint_stats_list.Viol_average_violations_only  0.96
    _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   5 LEU C 1   6 THR N  1   6 THR CA 1   6 THR C -157.00  -85.00 -157.84 -157.95 -157.97 1.48 17 0 "[    .    1    .    2]" 
         2 . 1   6 THR N 1   6 THR CA 1   6 THR C  1   7 THR N  108.00  156.00  156.30  154.96  157.37 1.37 17 0 "[    .    1    .    2]" 
         3 . 1   6 THR C 1   7 THR N  1   7 THR CA 1   7 THR C -132.00  -92.00 -124.89 -125.27 -125.32    .  . 0 "[    .    1    .    2]" 
         4 . 1   7 THR C 1   8 LEU N  1   8 LEU CA 1   8 LEU C -160.00  -84.00  -92.34  -90.45  -92.06    .  . 0 "[    .    1    .    2]" 
         5 . 1   8 LEU N 1   8 LEU CA 1   8 LEU C  1   9 ILE N  118.00  154.00  130.94  122.54  138.38    .  . 0 "[    .    1    .    2]" 
         6 . 1   8 LEU C 1   9 ILE N  1   9 ILE CA 1   9 ILE C -146.00 -106.00 -129.54 -131.08 -133.01    .  . 0 "[    .    1    .    2]" 
         7 . 1   9 ILE N 1   9 ILE CA 1   9 ILE C  1  10 TYR N  114.00  150.00  143.22  141.42  139.90 2.48 16 0 "[    .    1    .    2]" 
         8 . 1   9 ILE C 1  10 TYR N  1  10 TYR CA 1  10 TYR C -158.00  -78.00 -148.29 -145.36 -145.99 0.23 13 0 "[    .    1    .    2]" 
         9 . 1  10 TYR N 1  10 TYR CA 1  10 TYR C  1  11 ARG N  122.00  170.00  168.25  168.76  167.72 1.42 10 0 "[    .    1    .    2]" 
        10 . 1  10 TYR C 1  11 ARG N  1  11 ARG CA 1  11 ARG C -161.00 -101.00 -144.12 -149.73 -119.31    .  . 0 "[    .    1    .    2]" 
        11 . 1  11 ARG N 1  11 ARG CA 1  11 ARG C  1  12 SER N  117.00  169.00  131.84  126.99  134.58    .  . 0 "[    .    1    .    2]" 
        12 . 1  11 ARG C 1  12 SER N  1  12 SER CA 1  12 SER C -163.00  -91.00 -123.62 -128.91 -116.44    .  . 0 "[    .    1    .    2]" 
        13 . 1  12 SER C 1  13 GLN N  1  13 GLN CA 1  13 GLN C  170.00  -82.00 -127.25 -126.08 -126.23    .  . 0 "[    .    1    .    2]" 
        14 . 1  14 VAL C 1  15 HIS N  1  15 HIS CA 1  15 HIS C -145.00  -57.00  -95.77 -100.77  -91.18    .  . 0 "[    .    1    .    2]" 
        15 . 1  15 HIS N 1  15 HIS CA 1  15 HIS C  1  16 PRO N   90.00  170.00   95.60   95.55   95.53    .  . 0 "[    .    1    .    2]" 
        16 . 1  19 PRO C 1  20 PRO N  1  20 PRO CA 1  20 PRO C  -87.00  -47.00  -53.78  -55.58  -57.61    .  . 0 "[    .    1    .    2]" 
        17 . 1  20 PRO N 1  20 PRO CA 1  20 PRO C  1  21 VAL N  128.00  168.00  162.98  157.96  169.08 1.08  1 0 "[    .    1    .    2]" 
        18 . 1  20 PRO C 1  21 VAL N  1  21 VAL CA 1  21 VAL C -137.00  -57.00  -91.42  -91.73  -92.35    .  . 0 "[    .    1    .    2]" 
        19 . 1  22 ASP C 1  23 LEU N  1  23 LEU CA 1  23 LEU C  -93.00  -31.00  -51.78  -53.36  -50.31    .  . 0 "[    .    1    .    2]" 
        20 . 1  23 LEU N 1  23 LEU CA 1  23 LEU C  1  24 ASP N  -56.00    6.00    2.51    2.66    2.43    .  . 0 "[    .    1    .    2]" 
        21 . 1  23 LEU C 1  24 ASP N  1  24 ASP CA 1  24 ASP C -101.00  -29.00 -102.36 -101.89 -102.54 1.96 17 0 "[    .    1    .    2]" 
        22 . 1  24 ASP N 1  24 ASP CA 1  24 ASP C  1  25 ALA N  -58.00  -14.00  -43.99  -45.20  -43.15    .  . 0 "[    .    1    .    2]" 
        23 . 1  24 ASP C 1  25 ALA N  1  25 ALA CA 1  25 ALA C  -84.00  -48.00  -84.98  -85.60  -84.39 1.60 15 0 "[    .    1    .    2]" 
        24 . 1  25 ALA N 1  25 ALA CA 1  25 ALA C  1  26 LEU N  -56.00  -20.00  -26.26  -29.15  -24.16    .  . 0 "[    .    1    .    2]" 
        25 . 1  25 ALA C 1  26 LEU N  1  26 LEU CA 1  26 LEU C  -84.00  -48.00  -67.60  -67.68  -68.32    .  . 0 "[    .    1    .    2]" 
        26 . 1  26 LEU N 1  26 LEU CA 1  26 LEU C  1  27 VAL N  -58.00  -22.00  -41.78  -42.88  -43.43    .  . 0 "[    .    1    .    2]" 
        27 . 1  26 LEU C 1  27 VAL N  1  27 VAL CA 1  27 VAL C  -85.00  -49.00  -85.00  -85.78  -82.58 0.78  7 0 "[    .    1    .    2]" 
        28 . 1  27 VAL N 1  27 VAL CA 1  27 VAL C  1  28 HIS N  -58.00  -22.00  -33.28  -41.48  -25.78    .  . 0 "[    .    1    .    2]" 
        29 . 1  27 VAL C 1  28 HIS N  1  28 HIS CA 1  28 HIS C  -82.00  -46.00  -54.49  -51.27  -53.14    .  . 0 "[    .    1    .    2]" 
        30 . 1  28 HIS N 1  28 HIS CA 1  28 HIS C  1  29 ARG N  -58.00  -22.00  -57.35  -58.87  -55.05 0.87  6 0 "[    .    1    .    2]" 
        31 . 1  28 HIS C 1  29 ARG N  1  29 ARG CA 1  29 ARG C  -80.00  -44.00  -60.03  -60.39  -60.94    .  . 0 "[    .    1    .    2]" 
        32 . 1  29 ARG N 1  29 ARG CA 1  29 ARG C  1  30 ALA N  -59.00  -23.00  -23.72  -29.65  -22.09 0.91  4 0 "[    .    1    .    2]" 
        33 . 1  29 ARG C 1  30 ALA N  1  30 ALA CA 1  30 ALA C  -79.00  -43.00  -77.48  -79.77  -72.46 0.77  3 0 "[    .    1    .    2]" 
        34 . 1  30 ALA N 1  30 ALA CA 1  30 ALA C  1  31 SER N  -80.00    8.00  -58.87  -64.48  -47.51    .  . 0 "[    .    1    .    2]" 
        35 . 1  30 ALA C 1  31 SER N  1  31 SER CA 1  31 SER C  -77.00  -41.00  -51.14  -52.72  -54.23    .  . 0 "[    .    1    .    2]" 
        36 . 1  31 SER N 1  31 SER CA 1  31 SER C  1  32 SER N  -61.00  -25.00  -32.79  -38.81  -42.76 0.60 14 0 "[    .    1    .    2]" 
        37 . 1  31 SER C 1  32 SER N  1  32 SER CA 1  32 SER C  -79.00  -43.00  -69.08  -81.85  -57.39 2.85 18 0 "[    .    1    .    2]" 
        38 . 1  32 SER N 1  32 SER CA 1  32 SER C  1  33 LYS N  -60.00  -24.00  -31.69  -35.56  -27.76    .  . 0 "[    .    1    .    2]" 
        39 . 1  32 SER C 1  33 LYS N  1  33 LYS CA 1  33 LYS C  -84.00  -48.00  -85.77  -85.92  -85.99 2.56 18 0 "[    .    1    .    2]" 
        40 . 1  33 LYS N 1  33 LYS CA 1  33 LYS C  1  34 ASN N  -58.00  -22.00  -44.46  -30.71  -38.66    .  . 0 "[    .    1    .    2]" 
        41 . 1  33 LYS C 1  34 ASN N  1  34 ASN CA 1  34 ASN C  -83.00  -47.00  -67.47  -78.88  -56.77    .  . 0 "[    .    1    .    2]" 
        42 . 1  34 ASN N 1  34 ASN CA 1  34 ASN C  1  35 LEU N  -76.00   16.00  -36.15  -34.51  -36.07    .  . 0 "[    .    1    .    2]" 
        43 . 1  35 LEU C 1  36 PRO N  1  36 PRO CA 1  36 PRO C  -78.00  -42.00  -67.15  -67.75  -68.04    .  . 0 "[    .    1    .    2]" 
        44 . 1  36 PRO N 1  36 PRO CA 1  36 PRO C  1  37 LEU N  -37.00   -1.00  -25.15  -24.30  -25.13    .  . 0 "[    .    1    .    2]" 
        45 . 1  36 PRO C 1  37 LEU N  1  37 LEU CA 1  37 LEU C -119.00  -71.00  -73.13  -77.79  -70.52 0.48 10 0 "[    .    1    .    2]" 
        46 . 1  37 LEU N 1  37 LEU CA 1  37 LEU C  1  38 GLY N  -36.00   36.00  -22.26  -27.58  -20.84    .  . 0 "[    .    1    .    2]" 
        47 . 1  38 GLY C 1  39 ILE N  1  39 ILE CA 1  39 ILE C -141.00  -85.00  -86.86  -86.91  -87.85 0.51 14 0 "[    .    1    .    2]" 
        48 . 1  39 ILE N 1  39 ILE CA 1  39 ILE C  1  40 THR N  112.00  164.00  147.91  137.04  157.24    .  . 0 "[    .    1    .    2]" 
        49 . 1  39 ILE C 1  40 THR N  1  40 THR CA 1  40 THR C -162.00 -102.00 -141.08 -149.77 -123.18    .  . 0 "[    .    1    .    2]" 
        50 . 1  40 THR N 1  40 THR CA 1  40 THR C  1  41 GLY N  110.00  158.00  155.04  158.84  158.51 1.15  8 0 "[    .    1    .    2]" 
        51 . 1  41 GLY C 1  42 ILE N  1  42 ILE CA 1  42 ILE C -151.00 -115.00 -152.38 -153.70 -151.28 2.70 19 0 "[    .    1    .    2]" 
        52 . 1  42 ILE N 1  42 ILE CA 1  42 ILE C  1  43 LEU N  114.00 -178.00  152.66  149.42  145.33    .  . 0 "[    .    1    .    2]" 
        53 . 1  42 ILE C 1  43 LEU N  1  43 LEU CA 1  43 LEU C -149.00  -93.00 -116.49 -121.16 -107.21    .  . 0 "[    .    1    .    2]" 
        54 . 1  43 LEU N 1  43 LEU CA 1  43 LEU C  1  44 LEU N   94.00  170.00  163.38  163.95  163.87    .  . 0 "[    .    1    .    2]" 
        55 . 1  43 LEU C 1  44 LEU N  1  44 LEU CA 1  44 LEU C -141.00  -93.00 -142.64 -142.82 -143.10 2.41 19 0 "[    .    1    .    2]" 
        56 . 1  44 LEU N 1  44 LEU CA 1  44 LEU C  1  45 PHE N  104.00  160.00  153.22  151.37  156.30    .  . 0 "[    .    1    .    2]" 
        57 . 1  44 LEU C 1  45 PHE N  1  45 PHE CA 1  45 PHE C -148.00 -108.00 -149.65 -149.73 -149.79 2.08  4 0 "[    .    1    .    2]" 
        58 . 1  45 PHE N 1  45 PHE CA 1  45 PHE C  1  46 ASN N  133.00  169.00  132.72  131.27  135.08 1.73 20 0 "[    .    1    .    2]" 
        59 . 1  48 LEU C 1  49 GLN N  1  49 GLN CA 1  49 GLN C -175.00  -67.00 -118.39 -122.28 -125.55    .  . 0 "[    .    1    .    2]" 
        60 . 1  49 GLN N 1  49 GLN CA 1  49 GLN C  1  50 PHE N  131.00  175.00  160.25  143.53  170.26    .  . 0 "[    .    1    .    2]" 
        61 . 1  49 GLN C 1  50 PHE N  1  50 PHE CA 1  50 PHE C -161.00  -85.00 -123.81 -126.47 -127.20    .  . 0 "[    .    1    .    2]" 
        62 . 1  50 PHE N 1  50 PHE CA 1  50 PHE C  1  51 PHE N  103.00 -177.00  110.57  104.19  121.76    .  . 0 "[    .    1    .    2]" 
        63 . 1  50 PHE C 1  51 PHE N  1  51 PHE CA 1  51 PHE C -137.00  -81.00 -100.49 -105.61 -113.87    .  . 0 "[    .    1    .    2]" 
        64 . 1  51 PHE N 1  51 PHE CA 1  51 PHE C  1  52 GLN N   97.00  145.00  128.95  128.32  125.57    .  . 0 "[    .    1    .    2]" 
        65 . 1  51 PHE C 1  52 GLN N  1  52 GLN CA 1  52 GLN C -149.00  -89.00 -129.93 -145.06 -122.15    .  . 0 "[    .    1    .    2]" 
        66 . 1  52 GLN N 1  52 GLN CA 1  52 GLN C  1  53 VAL N  106.00  162.00  123.80  111.92  137.02    .  . 0 "[    .    1    .    2]" 
        67 . 1  52 GLN C 1  53 VAL N  1  53 VAL CA 1  53 VAL C -160.00  -80.00  -95.74 -101.37 -109.55    .  . 0 "[    .    1    .    2]" 
        68 . 1  53 VAL N 1  53 VAL CA 1  53 VAL C  1  54 LEU N   96.00  172.00  104.65  101.04  100.67    .  . 0 "[    .    1    .    2]" 
        69 . 1  53 VAL C 1  54 LEU N  1  54 LEU CA 1  54 LEU C -148.00  -92.00 -106.51 -115.08  -99.73    .  . 0 "[    .    1    .    2]" 
        70 . 1  54 LEU N 1  54 LEU CA 1  54 LEU C  1  55 GLU N  129.00  165.00  138.18  134.47  133.10 0.33  1 0 "[    .    1    .    2]" 
        71 . 1  54 LEU C 1  55 GLU N  1  55 GLU CA 1  55 GLU C -155.00  -99.00 -131.18 -131.65 -133.37    .  . 0 "[    .    1    .    2]" 
        72 . 1  55 GLU N 1  55 GLU CA 1  55 GLU C  1  56 GLY N  116.00  180.00  148.47  128.49  115.04 2.34  9 0 "[    .    1    .    2]" 
        73 . 1  57 THR C 1  58 GLU N  1  58 GLU CA 1  58 GLU C  -76.00  -40.00  -51.57  -54.57  -48.53    .  . 0 "[    .    1    .    2]" 
        74 . 1  58 GLU N 1  58 GLU CA 1  58 GLU C  1  59 GLU N  -59.00  -23.00  -31.78  -36.42  -39.72    .  . 0 "[    .    1    .    2]" 
        75 . 1  58 GLU C 1  59 GLU N  1  59 GLU CA 1  59 GLU C  -82.00  -46.00  -67.19  -73.89  -54.68    .  . 0 "[    .    1    .    2]" 
        76 . 1  59 GLU N 1  59 GLU CA 1  59 GLU C  1  60 ALA N  -61.00  -25.00  -35.45  -38.22  -32.93    .  . 0 "[    .    1    .    2]" 
        77 . 1  59 GLU C 1  60 ALA N  1  60 ALA CA 1  60 ALA C  -84.00  -48.00  -77.98  -80.15  -81.75    .  . 0 "[    .    1    .    2]" 
        78 . 1  60 ALA N 1  60 ALA CA 1  60 ALA C  1  61 LEU N  -59.00  -23.00  -39.69  -41.32  -37.75    .  . 0 "[    .    1    .    2]" 
        79 . 1  60 ALA C 1  61 LEU N  1  61 LEU CA 1  61 LEU C  -85.00  -49.00  -62.51  -66.32  -58.14    .  . 0 "[    .    1    .    2]" 
        80 . 1  61 LEU N 1  61 LEU CA 1  61 LEU C  1  62 GLU N  -56.00  -20.00  -44.60  -55.19  -39.35    .  . 0 "[    .    1    .    2]" 
        81 . 1  61 LEU C 1  62 GLU N  1  62 GLU CA 1  62 GLU C  -79.00  -43.00  -58.80  -61.13  -62.67    .  . 0 "[    .    1    .    2]" 
        82 . 1  62 GLU N 1  62 GLU CA 1  62 GLU C  1  63 SER N  -58.00  -22.00  -58.93  -59.54  -58.05 1.54 18 0 "[    .    1    .    2]" 
        83 . 1  62 GLU C 1  63 SER N  1  63 SER CA 1  63 SER C  -81.00  -45.00  -56.15  -59.98  -50.17    .  . 0 "[    .    1    .    2]" 
        84 . 1  63 SER N 1  63 SER CA 1  63 SER C  1  64 LEU N  -58.00  -22.00  -47.49  -51.80  -44.08    .  . 0 "[    .    1    .    2]" 
        85 . 1  63 SER C 1  64 LEU N  1  64 LEU CA 1  64 LEU C  -82.00  -46.00  -60.44  -65.46  -57.11    .  . 0 "[    .    1    .    2]" 
        86 . 1  64 LEU N 1  64 LEU CA 1  64 LEU C  1  65 PHE N  -65.00  -15.00  -62.97  -64.34  -65.07 0.50  5 0 "[    .    1    .    2]" 
        87 . 1  64 LEU C 1  65 PHE N  1  65 PHE CA 1  65 PHE C  -81.00  -45.00  -49.65  -53.96  -47.65    .  . 0 "[    .    1    .    2]" 
        88 . 1  65 PHE N 1  65 PHE CA 1  65 PHE C  1  66 SER N  -63.00  -27.00  -30.82  -29.01  -29.54    .  . 0 "[    .    1    .    2]" 
        89 . 1  65 PHE C 1  66 SER N  1  66 SER CA 1  66 SER C  -81.00  -45.00  -74.98  -78.93  -71.43    .  . 0 "[    .    1    .    2]" 
        90 . 1  66 SER N 1  66 SER CA 1  66 SER C  1  67 GLU N  -55.00  -19.00  -29.11  -30.41  -30.68    .  . 0 "[    .    1    .    2]" 
        91 . 1  66 SER C 1  67 GLU N  1  67 GLU CA 1  67 GLU C  -83.00  -47.00  -72.02  -70.53  -70.70    .  . 0 "[    .    1    .    2]" 
        92 . 1  67 GLU N 1  67 GLU CA 1  67 GLU C  1  68 ILE N  -60.00  -24.00  -29.75  -32.62  -28.43    .  . 0 "[    .    1    .    2]" 
        93 . 1  67 GLU C 1  68 ILE N  1  68 ILE CA 1  68 ILE C  -84.00  -48.00  -64.34  -65.50  -66.34    .  . 0 "[    .    1    .    2]" 
        94 . 1  68 ILE N 1  68 ILE CA 1  68 ILE C  1  69 GLN N  -61.00  -25.00  -55.04  -59.88  -50.75    .  . 0 "[    .    1    .    2]" 
        95 . 1  68 ILE C 1  69 GLN N  1  69 GLN CA 1  69 GLN C  -83.00  -47.00  -62.92  -61.86  -63.05    .  . 0 "[    .    1    .    2]" 
        96 . 1  69 GLN N 1  69 GLN CA 1  69 GLN C  1  70 SER N  -59.00  -11.00  -10.39  -11.11  -10.01 0.99 16 0 "[    .    1    .    2]" 
        97 . 1  70 SER C 1  71 ASP N  1  71 ASP CA 1  71 ASP C -104.00  -48.00  -92.46  -98.87  -81.56    .  . 0 "[    .    1    .    2]" 
        98 . 1  71 ASP N 1  71 ASP CA 1  71 ASP C  1  72 PRO N  100.00  160.00  148.25  139.70  153.47    .  . 0 "[    .    1    .    2]" 
        99 . 1  76 ASP C 1  77 VAL N  1  77 VAL CA 1  77 VAL C -115.00  -55.00  -67.24  -70.78  -72.86    .  . 0 "[    .    1    .    2]" 
       100 . 1  77 VAL N 1  77 VAL CA 1  77 VAL C  1  78 VAL N  104.00  144.00  128.13  122.51  118.80    .  . 0 "[    .    1    .    2]" 
       101 . 1  77 VAL C 1  78 VAL N  1  78 VAL CA 1  78 VAL C -152.00  -84.00 -134.67 -147.13 -119.90    .  . 0 "[    .    1    .    2]" 
       102 . 1  78 VAL N 1  78 VAL CA 1  78 VAL C  1  79 GLU N  110.00  158.00  135.48  124.03  141.43    .  . 0 "[    .    1    .    2]" 
       103 . 1  78 VAL C 1  79 GLU N  1  79 GLU CA 1  79 GLU C -138.00  -54.00  -63.80  -67.38  -54.95    .  . 0 "[    .    1    .    2]" 
       104 . 1  79 GLU N 1  79 GLU CA 1  79 GLU C  1  80 LEU N  111.00  151.00  112.01  109.90  109.65 1.63  1 0 "[    .    1    .    2]" 
       105 . 1  80 LEU C 1  81 MET N  1  81 MET CA 1  81 MET C -174.00 -126.00 -150.90 -150.13 -151.40    .  . 0 "[    .    1    .    2]" 
       106 . 1  81 MET N 1  81 MET CA 1  81 MET C  1  82 ARG N  119.00  171.00  170.62  166.22  173.01 2.01 17 0 "[    .    1    .    2]" 
       107 . 1  82 ARG C 1  83 ASP N  1  83 ASP CA 1  83 ASP C -171.00  -91.00 -127.42 -136.17 -116.15    .  . 0 "[    .    1    .    2]" 
       108 . 1  83 ASP N 1  83 ASP CA 1  83 ASP C  1  84 TYR N  116.00 -172.00  147.52  143.90  156.81    .  . 0 "[    .    1    .    2]" 
       109 . 1  83 ASP C 1  84 TYR N  1  84 TYR CA 1  84 TYR C -151.00  -59.00  -64.12  -64.42  -65.59 0.02  3 0 "[    .    1    .    2]" 
       110 . 1  86 ALA C 1  87 TYR N  1  87 TYR CA 1  87 TYR C -165.00  -69.00 -154.86 -164.52 -145.28    .  . 0 "[    .    1    .    2]" 
       111 . 1  87 TYR N 1  87 TYR CA 1  87 TYR C  1  88 ARG N  120.00 -168.00  154.92  167.10  164.47    .  . 0 "[    .    1    .    2]" 
       112 . 1  87 TYR C 1  88 ARG N  1  88 ARG CA 1  88 ARG C -119.00  -47.00  -99.60 -118.65  -79.82    .  . 0 "[    .    1    .    2]" 
       113 . 1  88 ARG N 1  88 ARG CA 1  88 ARG C  1  89 ARG N  106.00  162.00  124.52  132.22  128.70 0.70  9 0 "[    .    1    .    2]" 
       114 . 1  95 MET C 1  96 ARG N  1  96 ARG CA 1  96 ARG C -153.00  -61.00 -153.65 -154.07 -154.13 1.23  7 0 "[    .    1    .    2]" 
       115 . 1  96 ARG N 1  96 ARG CA 1  96 ARG C  1  97 ILE N  107.00 -173.00  104.97  104.09  105.70 2.91  4 0 "[    .    1    .    2]" 
       116 . 1  97 ILE N 1  97 ILE CA 1  97 ILE C  1  98 LEU N  121.00  161.00  160.51  158.56  161.55 0.55 13 0 "[    .    1    .    2]" 
       117 . 1  98 LEU C 1  99 ASP N  1  99 ASP CA 1  99 ASP C -116.00  -60.00  -62.65  -64.40  -59.38 0.62  6 0 "[    .    1    .    2]" 
       118 . 1  99 ASP N 1  99 ASP CA 1  99 ASP C  1 100 LEU N   61.00  157.00   86.94   86.85   86.20    .  . 0 "[    .    1    .    2]" 
       119 . 1  99 ASP C 1 100 LEU N  1 100 LEU CA 1 100 LEU C  -75.00  -39.00  -57.27  -57.98  -58.26    .  . 0 "[    .    1    .    2]" 
       120 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C  1 101 ARG N  -57.00   -5.00  -22.37  -24.76  -19.99    .  . 0 "[    .    1    .    2]" 
       121 . 1 100 LEU C 1 101 ARG N  1 101 ARG CA 1 101 ARG C  -84.00  -48.00  -57.46  -57.33  -58.03    .  . 0 "[    .    1    .    2]" 
       122 . 1 101 ARG N 1 101 ARG CA 1 101 ARG C  1 102 LEU N  -60.00    4.00  -15.62  -16.07  -16.87    .  . 0 "[    .    1    .    2]" 
       123 . 1 102 LEU C 1 103 PHE N  1 103 PHE CA 1 103 PHE C -169.00  -69.00 -101.46 -104.27  -97.66    .  . 0 "[    .    1    .    2]" 
       124 . 1 104 GLU C 1 105 THR N  1 105 THR CA 1 105 THR C  -77.00  -41.00  -62.25  -61.15  -61.77    .  . 0 "[    .    1    .    2]" 
       125 . 1 105 THR N 1 105 THR CA 1 105 THR C  1 106 ASP N  -58.00  -22.00  -59.24  -59.53  -59.69 2.02 13 0 "[    .    1    .    2]" 
       126 . 1 106 ASP N 1 106 ASP CA 1 106 ASP C  1 107 GLY N  -58.00  -18.00  -24.83  -27.57  -22.76    .  . 0 "[    .    1    .    2]" 
       127 . 1 106 ASP C 1 107 GLY N  1 107 GLY CA 1 107 GLY C  -84.00  -48.00  -71.04  -74.44  -67.27    .  . 0 "[    .    1    .    2]" 
       128 . 1 107 GLY N 1 107 GLY CA 1 107 GLY C  1 108 ALA N  -68.00  -12.00  -51.72  -57.38  -64.26    .  . 0 "[    .    1    .    2]" 
       129 . 1 107 GLY C 1 108 ALA N  1 108 ALA CA 1 108 ALA C  -79.00  -43.00  -63.43  -69.57  -48.23    .  . 0 "[    .    1    .    2]" 
       130 . 1 108 ALA N 1 108 ALA CA 1 108 ALA C  1 109 LEU N  -59.00  -23.00  -47.62  -51.81  -41.37    .  . 0 "[    .    1    .    2]" 
       131 . 1 108 ALA C 1 109 LEU N  1 109 LEU CA 1 109 LEU C  -81.00  -45.00  -54.09  -53.33  -53.65    .  . 0 "[    .    1    .    2]" 
       132 . 1 109 LEU N 1 109 LEU CA 1 109 LEU C  1 110 GLU N  -61.00  -25.00  -43.46  -48.96  -36.14    .  . 0 "[    .    1    .    2]" 
       133 . 1 109 LEU C 1 110 GLU N  1 110 GLU CA 1 110 GLU C  -82.00  -46.00  -59.89  -59.72  -61.51    .  . 0 "[    .    1    .    2]" 
       134 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C  1 111 GLU N  -57.00  -21.00  -37.26  -35.39  -37.95    .  . 0 "[    .    1    .    2]" 
       135 . 1 110 GLU C 1 111 GLU N  1 111 GLU CA 1 111 GLU C  -82.00  -46.00  -52.57  -71.90  -45.72 0.28 13 0 "[    .    1    .    2]" 
       136 . 1 111 GLU N 1 111 GLU CA 1 111 GLU C  1 112 ILE N  -62.00  -26.00  -57.58  -59.42  -60.20    .  . 0 "[    .    1    .    2]" 
       137 . 1 111 GLU C 1 112 ILE N  1 112 ILE CA 1 112 ILE C  -92.00  -48.00  -46.53  -48.31  -45.33 2.67 13 0 "[    .    1    .    2]" 
       138 . 1 112 ILE N 1 112 ILE CA 1 112 ILE C  1 113 LEU N  -59.00  -23.00  -53.41  -55.49  -57.56 0.29  9 0 "[    .    1    .    2]" 
       139 . 1 112 ILE C 1 113 LEU N  1 113 LEU CA 1 113 LEU C  -81.00  -45.00  -56.74  -82.56  -46.90 1.56 19 0 "[    .    1    .    2]" 
       140 . 1 113 LEU N 1 113 LEU CA 1 113 LEU C  1 114 ARG N  -57.00  -21.00  -39.53  -48.70  -53.39    .  . 0 "[    .    1    .    2]" 
       141 . 1 113 LEU C 1 114 ARG N  1 114 ARG CA 1 114 ARG C  -85.00  -49.00  -56.90  -67.03  -47.44 1.56  6 0 "[    .    1    .    2]" 
       142 . 1 114 ARG N 1 114 ARG CA 1 114 ARG C  1 115 PHE N  -52.00  -16.00  -37.03  -33.64  -34.22    .  . 0 "[    .    1    .    2]" 
       143 . 1 114 ARG C 1 115 PHE N  1 115 PHE CA 1 115 PHE C -122.00  -74.00 -117.07 -123.16  -89.64 1.16 15 0 "[    .    1    .    2]" 
       144 . 1 122 GLU C 1 123 PRO N  1 123 PRO CA 1 123 PRO C  -78.00  -42.00  -64.07  -65.03  -65.35    .  . 0 "[    .    1    .    2]" 
       145 . 1 123 PRO N 1 123 PRO CA 1 123 PRO C  1 124 VAL N  -41.00   -5.00  -10.22  -31.14   -4.61 0.39  9 0 "[    .    1    .    2]" 
       146 . 1 126 ASP C 1 127 ARG N  1 127 ARG CA 1 127 ARG C  -82.00  -46.00  -49.59  -55.27  -45.84 0.16 19 0 "[    .    1    .    2]" 
       147 . 1 127 ARG N 1 127 ARG CA 1 127 ARG C  1 128 MET N  -59.00  -23.00  -37.92  -36.63  -38.93    .  . 0 "[    .    1    .    2]" 
       148 . 1 128 MET N 1 128 MET CA 1 128 MET C  1 129 PHE N  -60.00  -24.00  -46.14  -48.86  -52.11    .  . 0 "[    .    1    .    2]" 
       149 . 1 128 MET C 1 129 PHE N  1 129 PHE CA 1 129 PHE C  -81.00  -45.00  -64.02  -81.11  -55.23 0.11 18 0 "[    .    1    .    2]" 
       150 . 1 129 PHE N 1 129 PHE CA 1 129 PHE C  1 130 ARG N  -62.00  -26.00  -28.23  -28.74  -29.24 0.57 13 0 "[    .    1    .    2]" 
       151 . 1 129 PHE C 1 130 ARG N  1 130 ARG CA 1 130 ARG C  -83.00  -47.00  -55.98  -59.11  -53.03    .  . 0 "[    .    1    .    2]" 
       152 . 1 130 ARG N 1 130 ARG CA 1 130 ARG C  1 131 LEU N  -60.00  -24.00  -44.33  -46.59  -47.18    .  . 0 "[    .    1    .    2]" 
       153 . 1 130 ARG C 1 131 LEU N  1 131 LEU CA 1 131 LEU C  -82.00  -46.00  -79.20  -72.51  -77.55 0.80  6 0 "[    .    1    .    2]" 
       154 . 1 131 LEU N 1 131 LEU CA 1 131 LEU C  1 132 LEU N  -61.00  -25.00  -49.06  -49.27  -49.52    .  . 0 "[    .    1    .    2]" 
       155 . 1 131 LEU C 1 132 LEU N  1 132 LEU CA 1 132 LEU C  -79.00  -43.00  -45.65  -49.91  -42.87 0.13  8 0 "[    .    1    .    2]" 
       156 . 1 132 LEU N 1 132 LEU CA 1 132 LEU C  1 133 SER N  -58.00  -22.00  -57.20  -55.41  -57.35 1.45 16 0 "[    .    1    .    2]" 
       157 . 1 132 LEU C 1 133 SER N  1 133 SER CA 1 133 SER C  -80.00  -44.00  -71.98  -80.22  -67.65 0.22  4 0 "[    .    1    .    2]" 
       158 . 1 133 SER N 1 133 SER CA 1 133 SER C  1 134 ALA N  -57.00  -21.00  -20.82  -22.47  -20.07 0.93 15 0 "[    .    1    .    2]" 
       159 . 1 133 SER C 1 134 ALA N  1 134 ALA CA 1 134 ALA C  -88.00  -48.00  -74.42  -77.18  -72.77    .  . 0 "[    .    1    .    2]" 
       160 . 1 134 ALA N 1 134 ALA CA 1 134 ALA C  1 135 PHE N  -64.00  -12.00  -30.41  -30.00  -30.95    .  . 0 "[    .    1    .    2]" 
       161 . 1 134 ALA C 1 135 PHE N  1 135 PHE CA 1 135 PHE C  -84.00  -48.00  -83.34  -84.72  -80.45 0.72 15 0 "[    .    1    .    2]" 
       162 . 1 135 PHE N 1 135 PHE CA 1 135 PHE C  1 136 ILE N  -61.00  -25.00  -34.47  -34.32  -35.25    .  . 0 "[    .    1    .    2]" 
       163 . 1 135 PHE C 1 136 ILE N  1 136 ILE CA 1 136 ILE C  -81.00  -45.00  -69.41  -72.77  -63.93    .  . 0 "[    .    1    .    2]" 
       164 . 1 136 ILE N 1 136 ILE CA 1 136 ILE C  1 137 ALA N  -61.00  -25.00  -33.67  -36.26  -31.68    .  . 0 "[    .    1    .    2]" 
       165 . 1 136 ILE C 1 137 ALA N  1 137 ALA CA 1 137 ALA C  -86.00  -50.00  -87.11  -87.70  -84.99 1.70  2 0 "[    .    1    .    2]" 
       166 . 1 137 ALA N 1 137 ALA CA 1 137 ALA C  1 138 ASP N  -58.00   -6.00  -57.37  -58.51  -53.44 0.51  4 0 "[    .    1    .    2]" 
       167 . 1 137 ALA C 1 138 ASP N  1 138 ASP CA 1 138 ASP C -112.00  -68.00  -98.46  -95.52  -95.82    .  . 0 "[    .    1    .    2]" 
       168 . 1 138 ASP N 1 138 ASP CA 1 138 ASP C  1 139 GLY N  -40.00   20.00  -30.43  -30.27  -33.45 0.29 19 0 "[    .    1    .    2]" 
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