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
642257 6prj 30635 cing 4-filtered-FRED Wattos check violation dihedral angle


data_6prj


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              154
    _TA_constraint_stats_list.Viol_count                    500
    _TA_constraint_stats_list.Viol_total                    21017.47
    _TA_constraint_stats_list.Viol_max                      9.62
    _TA_constraint_stats_list.Viol_rms                      1.04
    _TA_constraint_stats_list.Viol_average_all_restraints   0.34
    _TA_constraint_stats_list.Viol_average_violations_only  2.10
    _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 24 GLN C  1 25 ASP N  1 25 ASP CA  1 25 ASP C   -149.50  -77.40  -78.08  -86.32  -74.99 2.41 16  0 "[    .    1    .    2]" 
         2 . 1 25 ASP N  1 25 ASP CA 1 25 ASP C   1 26 LEU N    115.20  174.60  145.70  121.00  162.51    .  .  0 "[    .    1    .    2]" 
         3 . 1 25 ASP C  1 26 LEU N  1 26 LEU CA  1 26 LEU C   -152.50 -112.50 -126.84 -130.91 -133.86 4.33  5  0 "[    .    1    .    2]" 
         4 . 1 26 LEU N  1 26 LEU CA 1 26 LEU C   1 27 TYR N    127.70  176.30  171.95  162.69  177.67 1.37  5  0 "[    .    1    .    2]" 
         5 . 1 26 LEU C  1 27 TYR N  1 27 TYR CA  1 27 TYR C   -147.50  -94.40 -136.13 -143.44 -126.17    .  .  0 "[    .    1    .    2]" 
         6 . 1 27 TYR N  1 27 TYR CA 1 27 TYR C   1 28 ALA N    123.00  163.00  128.24  121.02  141.58 1.98 13  0 "[    .    1    .    2]" 
         7 . 1 27 TYR C  1 28 ALA N  1 28 ALA CA  1 28 ALA C   -165.60 -125.60 -137.86 -129.65 -133.02 0.91  7  0 "[    .    1    .    2]" 
         8 . 1 28 ALA N  1 28 ALA CA 1 28 ALA C   1 29 THR N    130.20  170.20  141.05  127.50  171.98 2.70 19  0 "[    .    1    .    2]" 
         9 . 1 28 ALA C  1 29 THR N  1 29 THR CA  1 29 THR C   -134.80  -66.20  -91.57  -96.77 -115.31    .  .  0 "[    .    1    .    2]" 
        10 . 1 29 THR N  1 29 THR CA 1 29 THR C   1 30 LEU N    110.00  150.00  127.27  123.89  123.44    .  .  0 "[    .    1    .    2]" 
        11 . 1 29 THR C  1 30 LEU N  1 30 LEU CA  1 30 LEU C   -149.60 -109.60 -108.58 -117.45 -103.96 5.64 13  1 "[    .    1  + .    2]" 
        12 . 1 30 LEU N  1 30 LEU CA 1 30 LEU C   1 31 ASP N    113.50  153.50  109.91  107.42  111.39 6.08 10  1 "[    .    +    .    2]" 
        13 . 1 30 LEU C  1 31 ASP N  1 31 ASP CA  1 31 ASP C   -120.40  -63.80  -81.41  -81.21  -82.51    .  .  0 "[    .    1    .    2]" 
        14 . 1 31 ASP N  1 31 ASP CA 1 31 ASP C   1 32 VAL N    101.90  141.90  125.39  125.53  123.57    .  .  0 "[    .    1    .    2]" 
        15 . 1 31 ASP C  1 32 VAL N  1 32 VAL CA  1 32 VAL C   -142.20  -99.90 -142.00 -145.29 -132.18 3.09  3  0 "[    .    1    .    2]" 
        16 . 1 32 VAL N  1 32 VAL CA 1 32 VAL C   1 33 PRO N    103.90  156.20  129.04  123.32  133.58    .  .  0 "[    .    1    .    2]" 
        17 . 1 33 PRO N  1 33 PRO CA 1 33 PRO C   1 34 ALA N    127.20  167.20  157.94  153.35  162.00    .  .  0 "[    .    1    .    2]" 
        18 . 1 33 PRO C  1 34 ALA N  1 34 ALA CA  1 34 ALA C    -77.10  -37.10  -50.35  -55.75  -47.30    .  .  0 "[    .    1    .    2]" 
        19 . 1 34 ALA N  1 34 ALA CA 1 34 ALA C   1 35 PRO N    -62.50  -22.50  -51.70  -51.96  -52.91    .  .  0 "[    .    1    .    2]" 
        20 . 1 35 PRO N  1 35 PRO CA 1 35 PRO C   1 36 ILE N    -55.00  -15.00  -37.45  -43.45  -32.40    .  .  0 "[    .    1    .    2]" 
        21 . 1 36 ILE N  1 36 ILE CA 1 36 ILE C   1 37 ALA N    -60.10  -20.10  -33.29  -37.54  -28.25    .  .  0 "[    .    1    .    2]" 
        22 . 1 36 ILE C  1 37 ALA N  1 37 ALA CA  1 37 ALA C    -86.20  -46.20  -69.99  -71.66  -72.28    .  .  0 "[    .    1    .    2]" 
        23 . 1 37 ALA N  1 37 ALA CA 1 37 ALA C   1 38 VAL N    -59.60  -19.60  -40.24  -36.02  -38.09    .  .  0 "[    .    1    .    2]" 
        24 . 1 37 ALA C  1 38 VAL N  1 38 VAL CA  1 38 VAL C    -87.70  -47.70  -71.08  -80.27  -64.59    .  .  0 "[    .    1    .    2]" 
        25 . 1 38 VAL N  1 38 VAL CA 1 38 VAL C   1 39 VAL N    -55.60  -15.60  -52.96  -57.76  -43.02 2.16  2  0 "[    .    1    .    2]" 
        26 . 1 38 VAL C  1 39 VAL N  1 39 VAL CA  1 39 VAL C   -100.80  -60.80  -78.61  -82.89  -73.32    .  .  0 "[    .    1    .    2]" 
        27 . 1 39 VAL N  1 39 VAL CA 1 39 VAL C   1 40 GLY N    -40.80    7.80  -28.00  -17.26  -24.07    .  .  0 "[    .    1    .    2]" 
        28 . 1 41 GLY C  1 42 LYS N  1 42 LYS CA  1 42 LYS C   -136.70  -81.90 -137.40 -139.99 -132.86 3.29  8  0 "[    .    1    .    2]" 
        29 . 1 42 LYS N  1 42 LYS CA 1 42 LYS C   1 43 VAL N    120.60  161.30  151.08  155.46  155.28    .  .  0 "[    .    1    .    2]" 
        30 . 1 42 LYS C  1 43 VAL N  1 43 VAL CA  1 43 VAL C   -158.20 -118.20 -143.21 -146.04 -146.91    .  .  0 "[    .    1    .    2]" 
        31 . 1 43 VAL N  1 43 VAL CA 1 43 VAL C   1 44 ARG N    127.90  167.90  164.99  151.89  170.34 2.44  1  0 "[    .    1    .    2]" 
        32 . 1 43 VAL C  1 44 ARG N  1 44 ARG CA  1 44 ARG C   -103.90  -63.90  -98.40  -98.30  -98.94 1.17 13  0 "[    .    1    .    2]" 
        33 . 1 44 ARG N  1 44 ARG CA 1 44 ARG C   1 45 ALA N    108.10  150.70  117.31  110.57  128.65    .  .  0 "[    .    1    .    2]" 
        34 . 1 44 ARG C  1 45 ALA N  1 45 ALA CA  1 45 ALA C   -155.80 -103.80 -102.37 -100.74 -100.87 3.50 19  0 "[    .    1    .    2]" 
        35 . 1 45 ALA N  1 45 ALA CA 1 45 ALA C   1 46 MET N    113.60  164.10  125.40  139.20  133.55 1.38 18  0 "[    .    1    .    2]" 
        36 . 1 45 ALA C  1 46 MET N  1 46 MET CA  1 46 MET C   -106.10  -66.10  -89.05 -100.27  -76.22    .  .  0 "[    .    1    .    2]" 
        37 . 1 46 MET N  1 46 MET CA 1 46 MET C   1 47 THR N    106.20  153.30  121.30  108.78  137.28    .  .  0 "[    .    1    .    2]" 
        38 . 1 46 MET C  1 47 THR N  1 47 THR CA  1 47 THR C   -155.90 -112.20 -120.11 -115.60 -120.17 2.74  2  0 "[    .    1    .    2]" 
        39 . 1 47 THR N  1 47 THR CA 1 47 THR C   1 48 LEU N    148.30 -171.70 -174.71 -175.58 -175.80 0.56 18  0 "[    .    1    .    2]" 
        40 . 1 47 THR C  1 48 LEU N  1 48 LEU CA  1 48 LEU C    -82.50  -42.50  -62.18  -63.71  -65.22    .  .  0 "[    .    1    .    2]" 
        41 . 1 48 LEU N  1 48 LEU CA 1 48 LEU C   1 49 GLU N    -42.40   -2.10  -30.24  -22.76  -23.94    .  .  0 "[    .    1    .    2]" 
        42 . 1 48 LEU C  1 49 GLU N  1 49 GLU CA  1 49 GLU C   -119.80  -79.80  -94.05  -81.93  -86.45    .  .  0 "[    .    1    .    2]" 
        43 . 1 49 GLU N  1 49 GLU CA 1 49 GLU C   1 50 GLY N    -17.10   29.60    3.38  -22.89   23.20 5.79  2  1 "[ +  .    1    .    2]" 
        44 . 1 49 GLU C  1 50 GLY N  1 50 GLY CA  1 50 GLY C     64.40  154.80  104.61  113.61  101.67    .  .  0 "[    .    1    .    2]" 
        45 . 1 50 GLY N  1 50 GLY CA 1 50 GLY C   1 51 PRO N    150.00 -150.00 -161.38 -150.06 -151.44 0.10  6  0 "[    .    1    .    2]" 
        46 . 1 51 PRO N  1 51 PRO CA 1 51 PRO C   1 52 VAL N    121.80  161.80  143.76  121.04  159.91 0.76 18  0 "[    .    1    .    2]" 
        47 . 1 51 PRO C  1 52 VAL N  1 52 VAL CA  1 52 VAL C   -151.70 -111.70 -137.84 -151.58 -114.40    .  .  0 "[    .    1    .    2]" 
        48 . 1 52 VAL N  1 52 VAL CA 1 52 VAL C   1 53 GLU N    130.00  170.00  131.28  133.03  131.36 3.91 19  0 "[    .    1    .    2]" 
        49 . 1 52 VAL C  1 53 GLU N  1 53 GLU CA  1 53 GLU C   -112.80  -62.90  -79.51  -86.37  -69.73    .  .  0 "[    .    1    .    2]" 
        50 . 1 53 GLU N  1 53 GLU CA 1 53 GLU C   1 54 VAL N    106.20  151.60  102.44  104.16  103.43 6.17  9  3 "[    .   +*    .    -]" 
        51 . 1 53 GLU C  1 54 VAL N  1 54 VAL CA  1 54 VAL C   -145.40  -97.90 -104.33 -114.39  -97.39 0.51 19  0 "[    .    1    .    2]" 
        52 . 1 54 VAL N  1 54 VAL CA 1 54 VAL C   1 55 ALA N    103.90  153.50  130.10  126.07  123.08    .  .  0 "[    .    1    .    2]" 
        53 . 1 54 VAL C  1 55 ALA N  1 55 ALA CA  1 55 ALA C   -121.50  -65.00  -79.99  -88.85  -67.78    .  .  0 "[    .    1    .    2]" 
        54 . 1 55 ALA N  1 55 ALA CA 1 55 ALA C   1 56 VAL N    102.20  143.30  107.55  101.27  111.67 0.93 19  0 "[    .    1    .    2]" 
        55 . 1 55 ALA C  1 56 VAL N  1 56 VAL CA  1 56 VAL C   -127.70  -55.50  -54.70  -57.43  -52.69 2.81  9  0 "[    .    1    .    2]" 
        56 . 1 56 VAL N  1 56 VAL CA 1 56 VAL C   1 57 PRO N    109.20  149.20  134.68  128.76  139.47    .  .  0 "[    .    1    .    2]" 
        57 . 1 57 PRO N  1 57 PRO CA 1 57 PRO C   1 58 PRO N    129.60  169.60  151.79  143.50  160.71    .  .  0 "[    .    1    .    2]" 
        58 . 1 60 THR C  1 61 GLN N  1 61 GLN CA  1 61 GLN C   -151.50  -85.80 -112.38 -113.63 -114.65    .  .  0 "[    .    1    .    2]" 
        59 . 1 61 GLN N  1 61 GLN CA 1 61 GLN C   1 62 ALA N    129.70 -178.00  147.50  141.54  155.53    .  .  0 "[    .    1    .    2]" 
        60 . 1 61 GLN C  1 62 ALA N  1 62 ALA CA  1 62 ALA C    -77.60  -37.60  -58.65  -62.35  -54.99    .  .  0 "[    .    1    .    2]" 
        61 . 1 62 ALA N  1 62 ALA CA 1 62 ALA C   1 63 GLY N    115.50  155.50  123.28  123.93  122.63 1.21 16  0 "[    .    1    .    2]" 
        62 . 1 62 ALA C  1 63 GLY N  1 63 GLY CA  1 63 GLY C     73.20  113.20  109.96   94.11  115.84 2.64  1  0 "[    .    1    .    2]" 
        63 . 1 63 GLY N  1 63 GLY CA 1 63 GLY C   1 64 ARG N    -28.60   11.40   -3.63  -15.46   12.08 0.68 17  0 "[    .    1    .    2]" 
        64 . 1 63 GLY C  1 64 ARG N  1 64 ARG CA  1 64 ARG C    -91.40  -51.40  -68.39  -84.24  -59.07    .  .  0 "[    .    1    .    2]" 
        65 . 1 64 ARG N  1 64 ARG CA 1 64 ARG C   1 65 LYS N    119.70  159.70  148.05  148.50  147.44    .  .  0 "[    .    1    .    2]" 
        66 . 1 64 ARG C  1 65 LYS N  1 65 LYS CA  1 65 LYS C   -128.80  -83.00 -122.38 -131.42 -105.73 2.62 10  0 "[    .    1    .    2]" 
        67 . 1 65 LYS N  1 65 LYS CA 1 65 LYS C   1 66 LEU N     99.50  143.40  106.79  116.10  106.84 2.75 15  0 "[    .    1    .    2]" 
        68 . 1 65 LYS C  1 66 LEU N  1 66 LEU CA  1 66 LEU C   -124.70  -77.00  -87.86 -104.48  -76.28 0.72 14  0 "[    .    1    .    2]" 
        69 . 1 66 LEU N  1 66 LEU CA 1 66 LEU C   1 67 ARG N    101.20  151.70  146.50  132.75  154.31 2.61 10  0 "[    .    1    .    2]" 
        70 . 1 66 LEU C  1 67 ARG N  1 67 ARG CA  1 67 ARG C   -141.60  -71.00 -114.17 -120.78 -122.29    .  .  0 "[    .    1    .    2]" 
        71 . 1 67 ARG N  1 67 ARG CA 1 67 ARG C   1 68 LEU N    102.90  145.00  109.87  101.01  121.12 1.89  6  0 "[    .    1    .    2]" 
        72 . 1 67 ARG C  1 68 LEU N  1 68 LEU CA  1 68 LEU C   -120.00  -69.20  -95.99  -98.56  -99.60    .  .  0 "[    .    1    .    2]" 
        73 . 1 68 LEU N  1 68 LEU CA 1 68 LEU C   1 69 LYS N     90.10  140.00  105.75   94.84  117.71    .  .  0 "[    .    1    .    2]" 
        74 . 1 68 LEU C  1 69 LYS N  1 69 LYS CA  1 69 LYS C    -81.00  -40.70  -71.00  -70.72  -70.73    .  .  0 "[    .    1    .    2]" 
        75 . 1 69 LYS N  1 69 LYS CA 1 69 LYS C   1 70 GLY N    114.30  154.30  140.81  130.47  153.79    .  .  0 "[    .    1    .    2]" 
        76 . 1 69 LYS C  1 70 GLY N  1 70 GLY CA  1 70 GLY C     56.20  100.80   77.12   65.63   86.85    .  .  0 "[    .    1    .    2]" 
        77 . 1 70 GLY N  1 70 GLY CA 1 70 GLY C   1 71 LYS N    -16.10   32.80    7.05   10.35    3.36    .  .  0 "[    .    1    .    2]" 
        78 . 1 72 GLY C  1 73 PHE N  1 73 PHE CA  1 73 PHE C    -94.70  -51.20  -90.50  -95.17  -84.99 0.47  4  0 "[    .    1    .    2]" 
        79 . 1 73 PHE N  1 73 PHE CA 1 73 PHE C   1 74 PRO N    118.20  167.10  158.79  165.37  160.98 2.20 14  0 "[    .    1    .    2]" 
        80 . 1 74 PRO N  1 74 PRO CA 1 74 PRO C   1 75 GLY N    129.30  169.30  154.01  154.77  149.63 2.21  2  0 "[    .    1    .    2]" 
        81 . 1 76 PRO C  1 77 ALA N  1 77 ALA CA  1 77 ALA C   -119.10  -77.10  -92.93 -117.15  -80.24    .  .  0 "[    .    1    .    2]" 
        82 . 1 77 ALA N  1 77 ALA CA 1 77 ALA C   1 78 GLY N    -25.40   21.80   -4.45  -13.99  -14.45    .  .  0 "[    .    1    .    2]" 
        83 . 1 78 GLY C  1 79 ARG N  1 79 ARG CA  1 79 ARG C   -125.00  -43.30 -110.03 -126.65 -128.00 3.86  1  0 "[    .    1    .    2]" 
        84 . 1 79 ARG N  1 79 ARG CA 1 79 ARG C   1 80 GLY N    113.20  173.20  111.73  108.89  114.82 4.31  9  0 "[    .    1    .    2]" 
        85 . 1 79 ARG C  1 80 GLY N  1 80 GLY CA  1 80 GLY C   -178.70  -47.40  -78.68  -91.10  -69.30    .  .  0 "[    .    1    .    2]" 
        86 . 1 80 GLY N  1 80 GLY CA 1 80 GLY C   1 81 ASP N    126.60 -158.20  157.89  130.41  179.46    .  .  0 "[    .    1    .    2]" 
        87 . 1 80 GLY C  1 81 ASP N  1 81 ASP CA  1 81 ASP C   -170.40 -101.30 -119.67 -118.89 -124.65 1.09 12  0 "[    .    1    .    2]" 
        88 . 1 81 ASP N  1 81 ASP CA 1 81 ASP C   1 82 LEU N    129.10  169.10  150.19  127.78  171.52 2.42  5  0 "[    .    1    .    2]" 
        89 . 1 81 ASP C  1 82 LEU N  1 82 LEU CA  1 82 LEU C   -140.90 -100.80 -110.30  -99.54  -99.97 3.92  6  0 "[    .    1    .    2]" 
        90 . 1 82 LEU N  1 82 LEU CA 1 82 LEU C   1 83 TYR N    108.60  148.60  121.74  109.83  139.97    .  .  0 "[    .    1    .    2]" 
        91 . 1 82 LEU C  1 83 TYR N  1 83 TYR CA  1 83 TYR C   -131.30  -91.30  -91.72 -103.66  -88.21 3.09 16  0 "[    .    1    .    2]" 
        92 . 1 83 TYR N  1 83 TYR CA 1 83 TYR C   1 84 LEU N    109.70  151.20  113.76  112.19  110.62 1.62 20  0 "[    .    1    .    2]" 
        93 . 1 83 TYR C  1 84 LEU N  1 84 LEU CA  1 84 LEU C   -129.70  -89.70  -90.35  -87.57  -87.60 2.97 10  0 "[    .    1    .    2]" 
        94 . 1 84 LEU N  1 84 LEU CA 1 84 LEU C   1 85 GLU N    106.50  146.50  105.05  101.21  118.03 5.29 19  1 "[    .    1    .   +2]" 
        95 . 1 84 LEU C  1 85 GLU N  1 85 GLU CA  1 85 GLU C   -123.80  -80.20  -82.61  -81.33  -82.30 1.46  2  0 "[    .    1    .    2]" 
        96 . 1 85 GLU N  1 85 GLU CA 1 85 GLU C   1 86 VAL N     93.60  133.60   99.37   91.98  113.06 1.62 19  0 "[    .    1    .    2]" 
        97 . 1 85 GLU C  1 86 VAL N  1 86 VAL CA  1 86 VAL C   -109.20  -50.50  -68.11  -67.23  -68.43    .  .  0 "[    .    1    .    2]" 
        98 . 1 86 VAL N  1 86 VAL CA 1 86 VAL C   1 87 ARG N    106.10  146.10  134.29  125.88  143.10    .  .  0 "[    .    1    .    2]" 
        99 . 1 86 VAL C  1 87 ARG N  1 87 ARG CA  1 87 ARG C   -141.90  -91.80 -126.01 -131.85 -122.05    .  .  0 "[    .    1    .    2]" 
       100 . 1 87 ARG N  1 87 ARG CA 1 87 ARG C   1 88 ILE N     94.50  149.40  102.56   94.22  115.13 0.28  3  0 "[    .    1    .    2]" 
       101 . 1 87 ARG C  1 88 ILE N  1 88 ILE CA  1 88 ILE C   -117.60  -77.60  -79.65  -98.82  -76.40 1.20 11  0 "[    .    1    .    2]" 
       102 . 1 88 ILE N  1 88 ILE CA 1 88 ILE C   1 89 THR N    103.20  143.20  120.47  107.54  133.75    .  .  0 "[    .    1    .    2]" 
       103 . 1  2 GLN CA 1  2 GLN CB 1  2 GLN CG  1  2 GLN CD   160.00 -160.00  176.78  176.20  174.89    .  .  0 "[    .    1    .    2]" 
       104 . 1  5 LEU N  1  5 LEU CA 1  5 LEU CB  1  5 LEU CG   -80.40  -40.40  -77.11  -80.27  -80.66 1.79 13  0 "[    .    1    .    2]" 
       105 . 1  5 LEU CA 1  5 LEU CB 1  5 LEU CG  1  5 LEU CD1  155.70 -164.30  170.32  175.49  173.18    .  .  0 "[    .    1    .    2]" 
       106 . 1  6 PHE N  1  6 PHE CA 1  6 PHE CB  1  6 PHE CG   -80.40  -40.40  -49.22  -38.96  -41.13 1.44  2  0 "[    .    1    .    2]" 
       107 . 1  6 PHE CA 1  6 PHE CB 1  6 PHE CG  1  6 PHE CD1   80.40  120.00   83.08   91.24   88.07 3.01 12  0 "[    .    1    .    2]" 
       108 . 1  7 TYR N  1  7 TYR CA 1  7 TYR CB  1  7 TYR CG    50.50   90.50   50.92   51.03   50.94 2.32 19  0 "[    .    1    .    2]" 
       109 . 1 24 GLN N  1 24 GLN CA 1 24 GLN CB  1 24 GLN CG    40.00   80.00   66.36   57.63   73.02    .  .  0 "[    .    1    .    2]" 
       110 . 1 24 GLN CA 1 24 GLN CB 1 24 GLN CG  1 24 GLN CD   155.70 -164.30  165.07  168.38  166.52 0.22  8  0 "[    .    1    .    2]" 
       111 . 1 25 ASP N  1 25 ASP CA 1 25 ASP CB  1 25 ASP CG   -80.00  -40.00  -55.79  -58.55  -59.14    .  .  0 "[    .    1    .    2]" 
       112 . 1 25 ASP CA 1 25 ASP CB 1 25 ASP CG  1 25 ASP OD1  -80.00  -10.00  -69.11  -43.12  -50.10 3.82 17  0 "[    .    1    .    2]" 
       113 . 1 26 LEU N  1 26 LEU CA 1 26 LEU CB  1 26 LEU CG  -100.40  -60.40  -76.21  -73.83  -75.36    .  .  0 "[    .    1    .    2]" 
       114 . 1 26 LEU CA 1 26 LEU CB 1 26 LEU CG  1 26 LEU CD1  152.70 -167.30 -179.29  174.36 -173.76    .  .  0 "[    .    1    .    2]" 
       115 . 1 27 TYR N  1 27 TYR CA 1 27 TYR CB  1 27 TYR CG   -96.00  -46.00  -76.86  -96.94  -65.88 0.94 13  0 "[    .    1    .    2]" 
       116 . 1 30 LEU N  1 30 LEU CA 1 30 LEU CB  1 30 LEU CG  -178.40 -138.40 -163.39 -166.25 -160.55    .  .  0 "[    .    1    .    2]" 
       117 . 1 30 LEU CA 1 30 LEU CB 1 30 LEU CG  1 30 LEU CD1   53.00   93.00   59.13   54.07   64.14    .  .  0 "[    .    1    .    2]" 
       118 . 1 31 ASP N  1 31 ASP CA 1 31 ASP CB  1 31 ASP CG   160.00 -160.00 -178.28  172.53 -164.35    .  .  0 "[    .    1    .    2]" 
       119 . 1 31 ASP CA 1 31 ASP CB 1 31 ASP CG  1 31 ASP OD1   40.00  100.00   76.88   54.54   94.38    .  .  0 "[    .    1    .    2]" 
       120 . 1 36 ILE N  1 36 ILE CA 1 36 ILE CB  1 36 ILE CG1  -73.00  -33.00  -65.50  -70.68  -59.16    .  .  0 "[    .    1    .    2]" 
       121 . 1 36 ILE CA 1 36 ILE CB 1 36 ILE CG1 1 36 ILE CD1  159.90 -160.10 -175.36 -174.11 -174.75    .  .  0 "[    .    1    .    2]" 
       122 . 1 42 LYS N  1 42 LYS CA 1 42 LYS CB  1 42 LYS CG  -119.30  -79.30  -81.67  -92.12  -78.23 1.07 17  0 "[    .    1    .    2]" 
       123 . 1 42 LYS CA 1 42 LYS CB 1 42 LYS CG  1 42 LYS CD   162.30 -157.70  177.75  173.59 -175.15    .  .  0 "[    .    1    .    2]" 
       124 . 1 44 ARG CA 1 44 ARG CB 1 44 ARG CG  1 44 ARG CD   154.40 -165.60  179.67  168.21 -167.74    .  .  0 "[    .    1    .    2]" 
       125 . 1 48 LEU N  1 48 LEU CA 1 48 LEU CB  1 48 LEU CG   -82.70  -42.70  -63.40  -61.83  -63.37    .  .  0 "[    .    1    .    2]" 
       126 . 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG  1 48 LEU CD1  164.30 -155.70 -179.43  174.76 -174.42    .  .  0 "[    .    1    .    2]" 
       127 . 1 59 ARG N  1 59 ARG CA 1 59 ARG CB  1 59 ARG CG   -70.80  -30.80  -50.12  -54.08  -46.30    .  .  0 "[    .    1    .    2]" 
       128 . 1 59 ARG CA 1 59 ARG CB 1 59 ARG CG  1 59 ARG CD   160.30 -159.70 -178.29 -172.65 -175.07    .  .  0 "[    .    1    .    2]" 
       129 . 1 61 GLN N  1 61 GLN CA 1 61 GLN CB  1 61 GLN CG   -92.20  -52.20  -74.58  -70.33  -72.07    .  .  0 "[    .    1    .    2]" 
       130 . 1 61 GLN CA 1 61 GLN CB 1 61 GLN CG  1 61 GLN CD    44.00   84.00   70.63   76.03   73.63    .  .  0 "[    .    1    .    2]" 
       131 . 1 64 ARG N  1 64 ARG CA 1 64 ARG CB  1 64 ARG CG  -100.30  -60.30  -70.75  -65.05  -67.20    .  .  0 "[    .    1    .    2]" 
       132 . 1 64 ARG CA 1 64 ARG CB 1 64 ARG CG  1 64 ARG CD   178.90 -141.10 -163.67 -172.93 -149.29    .  .  0 "[    .    1    .    2]" 
       133 . 1 66 LEU N  1 66 LEU CA 1 66 LEU CB  1 66 LEU CG   -77.00  -37.00  -48.48  -49.31  -50.11    .  .  0 "[    .    1    .    2]" 
       134 . 1 66 LEU CA 1 66 LEU CB 1 66 LEU CG  1 66 LEU CD1  159.30 -160.70  175.12  168.95 -178.05    .  .  0 "[    .    1    .    2]" 
       135 . 1 67 ARG N  1 67 ARG CA 1 67 ARG CB  1 67 ARG CG  -179.00 -139.00 -173.58  179.07 -165.49 1.93  8  0 "[    .    1    .    2]" 
       136 . 1 67 ARG CA 1 67 ARG CB 1 67 ARG CG  1 67 ARG CD   162.60 -157.40  174.27  179.71  177.07    .  .  0 "[    .    1    .    2]" 
       137 . 1 68 LEU N  1 68 LEU CA 1 68 LEU CB  1 68 LEU CG   -73.00  -33.00  -57.13  -55.81  -56.95    .  .  0 "[    .    1    .    2]" 
       138 . 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG  1 68 LEU CD1  161.90 -158.10 -164.98 -172.35 -159.54    .  .  0 "[    .    1    .    2]" 
       139 . 1 69 LYS N  1 69 LYS CA 1 69 LYS CB  1 69 LYS CG   -94.60  -54.60  -71.51  -88.14  -65.67    .  .  0 "[    .    1    .    2]" 
       140 . 1 69 LYS CA 1 69 LYS CB 1 69 LYS CG  1 69 LYS CD  -170.80 -130.80 -138.72 -129.62 -131.45 3.97 10  0 "[    .    1    .    2]" 
       141 . 1 71 LYS N  1 71 LYS CA 1 71 LYS CB  1 71 LYS CG   -91.60  -51.60  -56.57  -48.03  -50.79 3.60  2  0 "[    .    1    .    2]" 
       142 . 1 71 LYS CA 1 71 LYS CB 1 71 LYS CG  1 71 LYS CD  -109.20  -69.20  -65.07  -64.24  -64.70 5.76  5  6 "[ * *+  - 1  * .   *2]" 
       143 . 1 79 ARG N  1 79 ARG CA 1 79 ARG CB  1 79 ARG CG  -153.60  -93.60 -160.07 -159.58 -160.23 9.62 18 17 "[** ******** *-.**+**]" 
       144 . 1 79 ARG CA 1 79 ARG CB 1 79 ARG CG  1 79 ARG CD   175.80 -144.20 -178.86  169.63 -169.41 6.17 18  1 "[    .    1    .  + 2]" 
       145 . 1 81 ASP N  1 81 ASP CA 1 81 ASP CB  1 81 ASP CG   -80.60  -40.60  -57.10  -69.68  -48.12    .  .  0 "[    .    1    .    2]" 
       146 . 1 81 ASP CA 1 81 ASP CB 1 81 ASP CG  1 81 ASP OD1  -80.60  -10.60  -64.70  -82.12  -82.14 3.90  5  0 "[    .    1    .    2]" 
       147 . 1 82 LEU N  1 82 LEU CA 1 82 LEU CB  1 82 LEU CG   171.00 -149.00  176.53  173.51 -179.15    .  .  0 "[    .    1    .    2]" 
       148 . 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG  1 82 LEU CD1   40.00   80.00   56.55   56.40   55.50    .  .  0 "[    .    1    .    2]" 
       149 . 1 84 LEU N  1 84 LEU CA 1 84 LEU CB  1 84 LEU CG  -114.90  -74.90  -70.38  -71.88  -68.88 6.02 14  7 "[    * ***1   +.  *-2]" 
       150 . 1 84 LEU CA 1 84 LEU CB 1 84 LEU CG  1 84 LEU CD1  130.90 -169.10  173.83  172.96  172.09    .  .  0 "[    .    1    .    2]" 
       151 . 1 87 ARG N  1 87 ARG CA 1 87 ARG CB  1 87 ARG CG   -69.60  -29.60  -60.28  -69.04  -54.14    .  .  0 "[    .    1    .    2]" 
       152 . 1 87 ARG CA 1 87 ARG CB 1 87 ARG CG  1 87 ARG CD   -75.10  -35.10  -55.69  -65.21  -44.38    .  .  0 "[    .    1    .    2]" 
       153 . 1 88 ILE N  1 88 ILE CA 1 88 ILE CB  1 88 ILE CG1  -90.20  -50.20  -64.12  -61.94  -62.67    .  .  0 "[    .    1    .    2]" 
       154 . 1 88 ILE CA 1 88 ILE CB 1 88 ILE CG1 1 88 ILE CD1  163.70 -156.30 -173.89 -177.85 -169.52    .  .  0 "[    .    1    .    2]" 
    stop_

save_



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Saturday, April 27, 2024 4:05:11 PM GMT (wattos1)