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
407313 1y5o 6225 cing 4-filtered-FRED Wattos check violation dihedral angle


data_1y5o


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              124
    _TA_constraint_stats_list.Viol_count                    365
    _TA_constraint_stats_list.Viol_total                    1797.69
    _TA_constraint_stats_list.Viol_max                      1.42
    _TA_constraint_stats_list.Viol_rms                      0.14
    _TA_constraint_stats_list.Viol_average_all_restraints   0.04
    _TA_constraint_stats_list.Viol_average_violations_only  0.25
    _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   6 ALA C 1   7 ALA N  1   7 ALA CA 1   7 ALA C -167.00 -107.00 -155.48 -156.77 -157.24    .  . 0 "[    .    1    .    2]" 
         2 . 1   7 ALA C 1   8 ILE N  1   8 ILE CA 1   8 ILE C -145.00  -97.00  -96.53  -96.53  -96.54 0.64 20 0 "[    .    1    .    2]" 
         3 . 1   8 ILE C 1   9 PHE N  1   9 PHE CA 1   9 PHE C -156.00  -54.00 -144.72 -145.55 -143.53    .  . 0 "[    .    1    .    2]" 
         4 . 1  12 VAL C 1  13 SER N  1  13 SER CA 1  13 SER C -180.00    0.00 -101.79 -101.98 -102.09    .  . 0 "[    .    1    .    2]" 
         5 . 1  14 GLY C 1  15 ILE N  1  15 ILE CA 1  15 ILE C -159.50  -90.50  -92.39  -94.91  -90.41 0.09 18 0 "[    .    1    .    2]" 
         6 . 1  15 ILE C 1  16 ILE N  1  16 ILE CA 1  16 ILE C -150.00 -102.00 -101.59 -101.78 -101.21 0.79 18 0 "[    .    1    .    2]" 
         7 . 1  16 ILE C 1  17 ALA N  1  17 ALA CA 1  17 ALA C -136.00  -88.00 -115.40 -116.31 -118.50    .  . 0 "[    .    1    .    2]" 
         8 . 1  17 ALA C 1  18 ILE N  1  18 ILE CA 1  18 ILE C -131.00  -77.00 -104.75 -109.66  -99.81    .  . 0 "[    .    1    .    2]" 
         9 . 1  18 ILE C 1  19 ASN N  1  19 ASN CA 1  19 ASN C -126.50  -81.50 -104.44 -110.35  -93.15    .  . 0 "[    .    1    .    2]" 
        10 . 1  19 ASN C 1  20 GLU N  1  20 GLU CA 1  20 GLU C -118.50  -73.50 -103.59  -94.06 -107.06    .  . 0 "[    .    1    .    2]" 
        11 . 1  24 PRO C 1  25 ALA N  1  25 ALA CA 1  25 ALA C -135.50  -54.50  -54.46  -56.71  -54.15 0.35  3 0 "[    .    1    .    2]" 
        12 . 1  25 ALA C 1  26 GLU N  1  26 GLU CA 1  26 GLU C -166.50  -79.50 -153.36 -157.40 -140.63    .  . 0 "[    .    1    .    2]" 
        13 . 1  26 GLU C 1  27 LEU N  1  27 LEU CA 1  27 LEU C -149.50  -92.50 -111.94 -122.78 -100.47    .  . 0 "[    .    1    .    2]" 
        14 . 1  27 LEU C 1  28 THR N  1  28 THR CA 1  28 THR C -137.00  -87.00  -88.45  -88.60  -89.21 0.08 16 0 "[    .    1    .    2]" 
        15 . 1  28 THR C 1  29 TRP N  1  29 TRP CA 1  29 TRP C -134.00  -94.00 -133.01 -133.10 -134.13 0.44 18 0 "[    .    1    .    2]" 
        16 . 1  29 TRP C 1  30 ARG N  1  30 ARG CA 1  30 ARG C -145.00  -85.00 -104.17 -105.27 -105.62    .  . 0 "[    .    1    .    2]" 
        17 . 1  30 ARG C 1  31 SER N  1  31 SER CA 1  31 SER C -103.50  -46.50  -60.45  -61.43  -61.43    .  . 0 "[    .    1    .    2]" 
        18 . 1  35 ASP C 1  36 LYS N  1  36 LYS CA 1  36 LYS C -172.00  -76.00 -123.79 -126.29 -126.59    .  . 0 "[    .    1    .    2]" 
        19 . 1  36 LYS C 1  37 VAL N  1  37 VAL CA 1  37 VAL C -152.00 -104.00 -127.25 -136.99 -123.83    .  . 0 "[    .    1    .    2]" 
        20 . 1  37 VAL C 1  38 HIS N  1  38 HIS CA 1  38 HIS C -163.00 -109.00 -109.01 -108.83 -108.84 0.21  6 0 "[    .    1    .    2]" 
        21 . 1  38 HIS C 1  39 THR N  1  39 THR CA 1  39 THR C -125.00  -85.00 -116.96 -119.84 -121.69    .  . 0 "[    .    1    .    2]" 
        22 . 1  39 THR C 1  40 VAL N  1  40 VAL CA 1  40 VAL C -147.00  -63.00 -116.03 -110.83 -113.05    .  . 0 "[    .    1    .    2]" 
        23 . 1  40 VAL C 1  41 VAL N  1  41 VAL CA 1  41 VAL C -104.00  -38.00  -92.49  -92.23  -92.44    .  . 0 "[    .    1    .    2]" 
        24 . 1  41 VAL C 1  42 LEU N  1  42 LEU CA 1  42 LEU C  -88.00  -48.00  -84.87  -88.15  -71.27 0.15  5 0 "[    .    1    .    2]" 
        25 . 1  46 ASP C 1  47 LYS N  1  47 LYS CA 1  47 LYS C  175.00  -95.00 -164.59 -163.31 -163.43    .  . 0 "[    .    1    .    2]" 
        26 . 1  47 LYS C 1  48 LEU N  1  48 LEU CA 1  48 LEU C -147.00  -81.00 -123.71 -142.49 -103.74    .  . 0 "[    .    1    .    2]" 
        27 . 1  48 LEU C 1  49 GLN N  1  49 GLN CA 1  49 GLN C -153.00  -93.00 -118.02 -130.79 -103.06    .  . 0 "[    .    1    .    2]" 
        28 . 1  49 GLN C 1  50 ALA N  1  50 ALA CA 1  50 ALA C -141.50  -90.50 -137.63 -141.58 -141.60 0.13  1 0 "[    .    1    .    2]" 
        29 . 1  50 ALA C 1  51 THR N  1  51 THR CA 1  51 THR C -139.50  -70.50  -70.68  -70.50  -70.55 0.19 18 0 "[    .    1    .    2]" 
        30 . 1  52 PRO C 1  53 ALA N  1  53 ALA CA 1  53 ALA C  -91.00  -51.00  -67.79  -75.09  -64.00    .  . 0 "[    .    1    .    2]" 
        31 . 1  53 ALA C 1  54 SER N  1  54 SER CA 1  54 SER C -130.00  -90.00  -89.77  -89.94  -89.63 0.37  1 0 "[    .    1    .    2]" 
        32 . 1  54 SER C 1  55 SER N  1  55 SER CA 1  55 SER C -107.00  -53.00 -106.64 -105.11 -106.32 0.14  5 0 "[    .    1    .    2]" 
        33 . 1  57 LYS C 1  58 MET N  1  58 MET CA 1  58 MET C -154.00  -64.00  -89.79 -101.37  -77.94    .  . 0 "[    .    1    .    2]" 
        34 . 1  58 MET C 1  59 MET N  1  59 MET CA 1  59 MET C -151.00  -91.00 -149.16 -151.14 -142.89 0.14 19 0 "[    .    1    .    2]" 
        35 . 1  59 MET C 1  60 LEU N  1  60 LEU CA 1  60 LEU C -166.50 -115.50 -115.28 -115.20 -115.29 0.43  9 0 "[    .    1    .    2]" 
        36 . 1  60 LEU C 1  61 ARG N  1  61 ARG CA 1  61 ARG C -143.00 -103.00 -107.90 -103.91 -104.84 0.07  2 0 "[    .    1    .    2]" 
        37 . 1  61 ARG C 1  62 LEU N  1  62 LEU CA 1  62 LEU C -130.50  -73.50 -118.04 -130.50 -101.76 0.00 12 0 "[    .    1    .    2]" 
        38 . 1  62 LEU C 1  63 ILE N  1  63 ILE CA 1  63 ILE C -131.50  -74.50  -94.43 -106.48  -74.45 0.05 19 0 "[    .    1    .    2]" 
        39 . 1  84 PRO C 1  85 GLN N  1  85 GLN CA 1  85 GLN C -123.00  -81.00  -94.99 -101.30 -108.78 0.09 15 0 "[    .    1    .    2]" 
        40 . 1  85 GLN C 1  86 ARG N  1  86 ARG CA 1  86 ARG C -133.00  -73.00 -119.43 -117.67 -118.79 0.00  7 0 "[    .    1    .    2]" 
        41 . 1  86 ARG C 1  87 HIS N  1  87 HIS CA 1  87 HIS C -152.00  -92.00 -112.02 -128.05  -99.60    .  . 0 "[    .    1    .    2]" 
        42 . 1  87 HIS C 1  88 MET N  1  88 MET CA 1  88 MET C -123.00  -75.00  -98.22 -104.27  -91.88    .  . 0 "[    .    1    .    2]" 
        43 . 1  88 MET C 1  89 PHE N  1  89 PHE CA 1  89 PHE C -157.00  -97.00 -111.49 -106.89 -110.64    .  . 0 "[    .    1    .    2]" 
        44 . 1  89 PHE C 1  90 SER N  1  90 SER CA 1  90 SER C -148.50  -85.50 -122.16 -113.66 -115.99    .  . 0 "[    .    1    .    2]" 
        45 . 1  90 SER C 1  91 PHE N  1  91 PHE CA 1  91 PHE C -148.50  -97.50 -101.32 -112.03  -97.55    .  . 0 "[    .    1    .    2]" 
        46 . 1  94 ARG C 1  95 THR N  1  95 THR CA 1  95 THR C  -86.00  -46.00  -68.02  -64.94  -65.76    .  . 0 "[    .    1    .    2]" 
        47 . 1  95 THR C 1  96 VAL N  1  96 VAL CA 1  96 VAL C  -88.00  -48.00  -69.84  -70.49  -70.57    .  . 0 "[    .    1    .    2]" 
        48 . 1  96 VAL C 1  97 MET N  1  97 MET CA 1  97 MET C  -85.00  -45.00  -75.23  -78.64  -72.31    .  . 0 "[    .    1    .    2]" 
        49 . 1  97 MET C 1  98 ASP N  1  98 ASP CA 1  98 ASP C  -88.00  -48.00  -77.64  -84.31  -72.29    .  . 0 "[    .    1    .    2]" 
        50 . 1  98 ASP C 1  99 ASN N  1  99 ASN CA 1  99 ASN C  -86.00  -46.00  -72.60  -74.65  -70.81    .  . 0 "[    .    1    .    2]" 
        51 . 1  99 ASN C 1 100 ILE N  1 100 ILE CA 1 100 ILE C  -86.00  -46.00  -85.79  -86.08  -86.13 0.24 17 0 "[    .    1    .    2]" 
        52 . 1 100 ILE C 1 101 LYS N  1 101 LYS CA 1 101 LYS C  -85.00  -45.00  -56.67  -51.36  -53.50    .  . 0 "[    .    1    .    2]" 
        53 . 1 101 LYS C 1 102 MET N  1 102 MET CA 1 102 MET C  -82.00  -42.00  -73.81  -82.10  -66.45 0.10  4 0 "[    .    1    .    2]" 
        54 . 1 102 MET C 1 103 THR N  1 103 THR CA 1 103 THR C  -92.50  -51.50  -68.41  -69.95  -70.91    .  . 0 "[    .    1    .    2]" 
        55 . 1 103 THR C 1 104 LEU N  1 104 LEU CA 1 104 LEU C  -83.00  -43.00  -68.52  -64.50  -65.22    .  . 0 "[    .    1    .    2]" 
        56 . 1 104 LEU C 1 105 GLN N  1 105 GLN CA 1 105 GLN C  -82.00  -42.00  -67.27  -71.09  -65.29    .  . 0 "[    .    1    .    2]" 
        57 . 1 105 GLN C 1 106 GLN N  1 106 GLN CA 1 106 GLN C  -83.00  -43.00  -65.24  -66.78  -63.37    .  . 0 "[    .    1    .    2]" 
        58 . 1 106 GLN C 1 107 ILE N  1 107 ILE CA 1 107 ILE C  -86.00  -46.00  -57.92  -59.26  -56.61    .  . 0 "[    .    1    .    2]" 
        59 . 1 107 ILE C 1 108 ILE N  1 108 ILE CA 1 108 ILE C  -83.00  -43.00  -52.40  -52.76  -53.01    .  . 0 "[    .    1    .    2]" 
        60 . 1 108 ILE C 1 109 SER N  1 109 SER CA 1 109 SER C  -85.00  -45.00  -55.17  -55.24  -55.58    .  . 0 "[    .    1    .    2]" 
        61 . 1   4 SER N 1   4 SER CA 1   4 SER C  1   5 GLY N   80.00  180.00  129.82  118.29  172.12    .  . 0 "[    .    1    .    2]" 
        62 . 1   5 GLY N 1   5 GLY CA 1   5 GLY C  1   6 ALA N   80.00  180.00  151.68  142.85  164.80    .  . 0 "[    .    1    .    2]" 
        63 . 1   6 ALA N 1   6 ALA CA 1   6 ALA C  1   7 ALA N   80.00  180.00  138.57  137.30  139.80    .  . 0 "[    .    1    .    2]" 
        64 . 1   7 ALA N 1   7 ALA CA 1   7 ALA C  1   8 ILE N  116.50  161.50  147.62  147.95  147.42    .  . 0 "[    .    1    .    2]" 
        65 . 1   8 ILE N 1   8 ILE CA 1   8 ILE C  1   9 PHE N  103.00  143.00  143.22  143.08  143.40 0.40 18 0 "[    .    1    .    2]" 
        66 . 1   9 PHE N 1   9 PHE CA 1   9 PHE C  1  10 GLU N  106.50  151.50  106.33  106.34  106.32 0.25  4 0 "[    .    1    .    2]" 
        67 . 1  12 VAL N 1  12 VAL CA 1  12 VAL C  1  13 SER N   80.00  180.00  138.86  138.26  137.97    .  . 0 "[    .    1    .    2]" 
        68 . 1  13 SER N 1  13 SER CA 1  13 SER C  1  14 GLY N   80.00  180.00  145.56  144.48  144.29    .  . 0 "[    .    1    .    2]" 
        69 . 1  14 GLY N 1  14 GLY CA 1  14 GLY C  1  15 ILE N   80.00  180.00  179.77  174.02 -179.85 0.15  6 0 "[    .    1    .    2]" 
        70 . 1  15 ILE N 1  15 ILE CA 1  15 ILE C  1  16 ILE N  116.50  161.50  127.57  125.51  129.93    .  . 0 "[    .    1    .    2]" 
        71 . 1  16 ILE N 1  16 ILE CA 1  16 ILE C  1  17 ALA N  113.00  153.00  120.01  116.24  123.28    .  . 0 "[    .    1    .    2]" 
        72 . 1  17 ALA N 1  17 ALA CA 1  17 ALA C  1  18 ILE N  102.50  153.50  142.81  141.71  143.59    .  . 0 "[    .    1    .    2]" 
        73 . 1  18 ILE N 1  18 ILE CA 1  18 ILE C  1  19 ASN N  104.00  144.00  113.64  108.30  119.72    .  . 0 "[    .    1    .    2]" 
        74 . 1  19 ASN N 1  19 ASN CA 1  19 ASN C  1  20 GLU N  110.00  164.00  109.69  109.73  109.71 0.53 17 0 "[    .    1    .    2]" 
        75 . 1  25 ALA N 1  25 ALA CA 1  25 ALA C  1  26 GLU N  112.00  172.00  170.20  172.05  172.04 0.23 18 0 "[    .    1    .    2]" 
        76 . 1  26 GLU N 1  26 GLU CA 1  26 GLU C  1  27 LEU N  121.00  161.00  154.44  155.78  154.04 0.11  6 0 "[    .    1    .    2]" 
        77 . 1  27 LEU N 1  27 LEU CA 1  27 LEU C  1  28 THR N   88.50  145.50  114.32  106.83  118.78    .  . 0 "[    .    1    .    2]" 
        78 . 1  28 THR N 1  28 THR CA 1  28 THR C  1  29 TRP N  107.00  147.00  146.89  146.27  145.49 0.32  2 0 "[    .    1    .    2]" 
        79 . 1  29 TRP N 1  29 TRP CA 1  29 TRP C  1  30 ARG N  110.00  158.00  110.23  109.87  112.01 0.13 18 0 "[    .    1    .    2]" 
        80 . 1  30 ARG N 1  30 ARG CA 1  30 ARG C  1  31 SER N   97.50  172.50  126.97  124.71  128.48    .  . 0 "[    .    1    .    2]" 
        81 . 1  31 SER N 1  31 SER CA 1  31 SER C  1  32 THR N  116.50  173.50  160.38  154.54  164.32    .  . 0 "[    .    1    .    2]" 
        82 . 1  36 LYS N 1  36 LYS CA 1  36 LYS C  1  37 VAL N  123.50  168.50  127.95  126.32  126.29    .  . 0 "[    .    1    .    2]" 
        83 . 1  37 VAL N 1  37 VAL CA 1  37 VAL C  1  38 HIS N  108.00  156.00  121.11  113.12  124.89    .  . 0 "[    .    1    .    2]" 
        84 . 1  38 HIS N 1  38 HIS CA 1  38 HIS C  1  39 THR N  101.00  141.00  142.26  142.18  142.14 1.42  7 0 "[    .    1    .    2]" 
        85 . 1  39 THR N 1  39 THR CA 1  39 THR C  1  40 VAL N  105.00  145.00  133.20  130.28  136.73    .  . 0 "[    .    1    .    2]" 
        86 . 1  40 VAL N 1  40 VAL CA 1  40 VAL C  1  41 VAL N  104.50  161.50  141.62  133.34  150.17    .  . 0 "[    .    1    .    2]" 
        87 . 1  41 VAL N 1  41 VAL CA 1  41 VAL C  1  42 LEU N  107.50  152.50  121.47  125.60  124.51    .  . 0 "[    .    1    .    2]" 
        88 . 1  42 LEU N 1  42 LEU CA 1  42 LEU C  1  43 SER N  -52.00  -12.00  -11.77  -11.74  -11.78 0.41 17 0 "[    .    1    .    2]" 
        89 . 1  47 LYS N 1  47 LYS CA 1  47 LYS C  1  48 LEU N  131.00  171.00  164.67  149.26  171.11 0.11  7 0 "[    .    1    .    2]" 
        90 . 1  48 LEU N 1  48 LEU CA 1  48 LEU C  1  49 GLN N  101.50  146.50  127.41  121.77  116.60    .  . 0 "[    .    1    .    2]" 
        91 . 1  49 GLN N 1  49 GLN CA 1  49 GLN C  1  50 ALA N  109.50  166.50  146.65  161.79  155.42    .  . 0 "[    .    1    .    2]" 
        92 . 1  50 ALA N 1  50 ALA CA 1  50 ALA C  1  51 THR N  107.50  164.50  158.53  160.67  158.95 0.12  4 0 "[    .    1    .    2]" 
        93 . 1  51 THR N 1  51 THR CA 1  51 THR C  1  52 PRO N   99.00  159.00  148.14  142.69  153.27    .  . 0 "[    .    1    .    2]" 
        94 . 1  53 ALA N 1  53 ALA CA 1  53 ALA C  1  54 SER N  -47.50   -2.50  -13.77  -12.09  -12.34    .  . 0 "[    .    1    .    2]" 
        95 . 1  54 SER N 1  54 SER CA 1  54 SER C  1  55 SER N  -18.00   30.00   -0.26   -1.09    0.67    .  . 0 "[    .    1    .    2]" 
        96 . 1  55 SER N 1  55 SER CA 1  55 SER C  1  56 GLU N   90.50  165.50  113.68  113.67  113.41    .  . 0 "[    .    1    .    2]" 
        97 . 1  58 MET N 1  58 MET CA 1  58 MET C  1  59 MET N  102.50  159.50  115.11  118.53  116.54    .  . 0 "[    .    1    .    2]" 
        98 . 1  59 MET N 1  59 MET CA 1  59 MET C  1  60 LEU N  128.00  170.00  138.98  127.93  150.45 0.07  2 0 "[    .    1    .    2]" 
        99 . 1  60 LEU N 1  60 LEU CA 1  60 LEU C  1  61 ARG N  110.50  173.50  123.56  113.10  137.76    .  . 0 "[    .    1    .    2]" 
       100 . 1  61 ARG N 1  61 ARG CA 1  61 ARG C  1  62 LEU N  101.00  161.00  135.28  139.08  138.11    .  . 0 "[    .    1    .    2]" 
       101 . 1  62 LEU N 1  62 LEU CA 1  62 LEU C  1  63 ILE N  109.00  157.00  127.89  117.15  132.51    .  . 0 "[    .    1    .    2]" 
       102 . 1  63 ILE N 1  63 ILE CA 1  63 ILE C  1  64 GLY N  113.00  153.00  130.21  123.80  119.12    .  . 0 "[    .    1    .    2]" 
       103 . 1  85 GLN N 1  85 GLN CA 1  85 GLN C  1  86 ARG N   83.00  167.00  130.77  149.84  142.26    .  . 0 "[    .    1    .    2]" 
       104 . 1  86 ARG N 1  86 ARG CA 1  86 ARG C  1  87 HIS N  115.50  160.50  139.33  134.80  149.11    .  . 0 "[    .    1    .    2]" 
       105 . 1  87 HIS N 1  87 HIS CA 1  87 HIS C  1  88 MET N  109.50  154.50  114.46  115.08  112.80 0.05 18 0 "[    .    1    .    2]" 
       106 . 1  88 MET N 1  88 MET CA 1  88 MET C  1  89 PHE N  111.00  151.00  120.37  111.04  129.27    .  . 0 "[    .    1    .    2]" 
       107 . 1  89 PHE N 1  89 PHE CA 1  89 PHE C  1  90 SER N  116.50  167.50  154.77  142.68  163.04    .  . 0 "[    .    1    .    2]" 
       108 . 1  90 SER N 1  90 SER CA 1  90 SER C  1  91 PHE N  112.00  152.00  122.42  125.72  123.22    .  . 0 "[    .    1    .    2]" 
       109 . 1  91 PHE N 1  91 PHE CA 1  91 PHE C  1  92 ASN N  127.00  167.00  140.94  136.42  135.09    .  . 0 "[    .    1    .    2]" 
       110 . 1  95 THR N 1  95 THR CA 1  95 THR C  1  96 VAL N  -60.00  -20.00  -41.79  -47.30  -34.66    .  . 0 "[    .    1    .    2]" 
       111 . 1  96 VAL N 1  96 VAL CA 1  96 VAL C  1  97 MET N  -63.50  -18.50  -34.02  -35.12  -37.48    .  . 0 "[    .    1    .    2]" 
       112 . 1  97 MET N 1  97 MET CA 1  97 MET C  1  98 ASP N  -56.00  -16.00  -32.64  -32.76  -33.08    .  . 0 "[    .    1    .    2]" 
       113 . 1  98 ASP N 1  98 ASP CA 1  98 ASP C  1  99 ASN N  -59.00  -19.00  -28.10  -27.66  -27.91    .  . 0 "[    .    1    .    2]" 
       114 . 1  99 ASN N 1  99 ASN CA 1  99 ASN C  1 100 ILE N  -64.00  -24.00  -31.84  -31.57  -32.13    .  . 0 "[    .    1    .    2]" 
       115 . 1 100 ILE N 1 100 ILE CA 1 100 ILE C  1 101 LYS N  -62.00  -22.00  -43.89  -41.65  -42.95    .  . 0 "[    .    1    .    2]" 
       116 . 1 101 LYS N 1 101 LYS CA 1 101 LYS C  1 102 MET N  -62.00  -22.00  -39.67  -43.06  -45.60    .  . 0 "[    .    1    .    2]" 
       117 . 1 102 MET N 1 102 MET CA 1 102 MET C  1 103 THR N  -60.00  -20.00  -41.43  -49.84  -30.75    .  . 0 "[    .    1    .    2]" 
       118 . 1 103 THR N 1 103 THR CA 1 103 THR C  1 104 LEU N  -59.00  -19.00  -37.18  -44.71  -24.34    .  . 0 "[    .    1    .    2]" 
       119 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C  1 105 GLN N  -62.00  -22.00  -33.07  -37.40  -29.50    .  . 0 "[    .    1    .    2]" 
       120 . 1 105 GLN N 1 105 GLN CA 1 105 GLN C  1 106 GLN N  -60.00  -20.00  -33.63  -35.78  -31.63    .  . 0 "[    .    1    .    2]" 
       121 . 1 106 GLN N 1 106 GLN CA 1 106 GLN C  1 107 ILE N  -64.00  -24.00  -40.80  -40.76  -41.12    .  . 0 "[    .    1    .    2]" 
       122 . 1 107 ILE N 1 107 ILE CA 1 107 ILE C  1 108 ILE N  -63.00  -23.00  -43.73  -42.95  -43.03    .  . 0 "[    .    1    .    2]" 
       123 . 1 108 ILE N 1 108 ILE CA 1 108 ILE C  1 109 SER N  -62.00  -22.00  -52.52  -52.81  -52.13    .  . 0 "[    .    1    .    2]" 
       124 . 1 109 SER N 1 109 SER CA 1 109 SER C  1 110 ARG N  -63.00  -23.00  -30.11  -35.84  -26.16    .  . 0 "[    .    1    .    2]" 
    stop_

save_



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