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
561574 2lut 18540 cing 4-filtered-FRED Wattos check violation dihedral angle


data_2lut


save_dihedral_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              108
    _TA_constraint_stats_list.Viol_count                    407
    _TA_constraint_stats_list.Viol_total                    2764.81
    _TA_constraint_stats_list.Viol_max                      4.10
    _TA_constraint_stats_list.Viol_rms                      0.55
    _TA_constraint_stats_list.Viol_average_all_restraints   0.26
    _TA_constraint_stats_list.Viol_average_violations_only  0.68
    _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 PHI 1  20 GLU C 1  21 TRP N  1  21 TRP CA 1  21 TRP C  -91.38  -62.64  -67.71  -62.55  -66.44 3.20  9 0 "[    .    1]" 
         2 PSI 1  21 TRP N 1  21 TRP CA 1  21 TRP C  1  22 LEU N  121.10  145.04  126.82  119.93  134.76 1.17  6 0 "[    .    1]" 
         3 PHI 1  21 TRP C 1  22 LEU N  1  22 LEU CA 1  22 LEU C -106.40  -87.28 -106.77 -106.95 -107.58 2.57  7 0 "[    .    1]" 
         4 PSI 1  22 LEU N 1  22 LEU CA 1  22 LEU C  1  23 TYR N  102.39  156.91  111.56  107.07  123.43    .  . 0 "[    .    1]" 
         5 PHI 1  22 LEU C 1  23 TYR N  1  23 TYR CA 1  23 TYR C -137.06 -101.24 -116.11 -132.21 -137.25 1.31  3 0 "[    .    1]" 
         6 PSI 1  23 TYR N 1  23 TYR CA 1  23 TYR C  1  24 GLY N  131.10  165.96  160.18  130.91  166.62 0.66  8 0 "[    .    1]" 
         7 PHI 1  24 GLY C 1  25 SER N  1  25 SER CA 1  25 SER C -123.60  -67.02  -75.66 -113.34  -66.00 1.02  4 0 "[    .    1]" 
         8 PSI 1  25 SER N 1  25 SER CA 1  25 SER C  1  26 CYS N  127.97  166.03  151.10  127.60  127.60 1.90 10 0 "[    .    1]" 
         9 PHI 1  25 SER C 1  26 CYS N  1  26 CYS CA 1  26 CYS C -161.57 -104.55 -106.32 -111.29 -112.07 4.10  4 0 "[    .    1]" 
        10 PSI 1  26 CYS N 1  26 CYS CA 1  26 CYS C  1  27 VAL N  126.35  153.11  133.99  138.06  136.54 0.45  7 0 "[    .    1]" 
        11 PHI 1  26 CYS C 1  27 VAL N  1  27 VAL CA 1  27 VAL C -108.51  -93.53 -106.78 -109.29  -98.11 0.78  4 0 "[    .    1]" 
        12 PSI 1  27 VAL N 1  27 VAL CA 1  27 VAL C  1  28 ALA N  103.84  129.26  121.94  113.18  129.66 0.40 10 0 "[    .    1]" 
        13 PHI 1  27 VAL C 1  28 ALA N  1  28 ALA CA 1  28 ALA C  -87.48  -64.74  -76.10  -87.57  -64.54 0.20  6 0 "[    .    1]" 
        14 PSI 1  28 ALA N 1  28 ALA CA 1  28 ALA C  1  29 ASN N  106.11  151.59  140.87  144.17  135.33 0.61 10 0 "[    .    1]" 
        15 PHI 1  32 ASP C 1  33 CYS N  1  33 CYS CA 1  33 CYS C -154.71 -130.93 -146.80 -140.85 -151.19 0.41  8 0 "[    .    1]" 
        16 PSI 1  33 CYS N 1  33 CYS CA 1  33 CYS C  1  34 GLY N  150.21  159.29  151.80  149.67  160.20 0.91  7 0 "[    .    1]" 
        17 PHI 1  34 GLY C 1  35 GLN N  1  35 GLN CA 1  35 GLN C  -92.14  -45.82  -57.78  -54.98  -61.29    .  . 0 "[    .    1]" 
        18 PSI 1  35 GLN N 1  35 GLN CA 1  35 GLN C  1  36 GLY N  117.05  155.93  122.89  132.23  121.18 0.48  9 0 "[    .    1]" 
        19 PHI 1  36 GLY C 1  37 MET N  1  37 MET CA 1  37 MET C -158.92 -104.92 -141.35 -159.08 -109.57 0.16  7 0 "[    .    1]" 
        20 PSI 1  37 MET N 1  37 MET CA 1  37 MET C  1  38 ARG N  138.52  173.64  165.33  174.01  169.84 0.37  2 0 "[    .    1]" 
        21 PHI 1  37 MET C 1  38 ARG N  1  38 ARG CA 1  38 ARG C -144.88 -123.56 -143.07 -140.72 -143.48 2.49  4 0 "[    .    1]" 
        22 PSI 1  38 ARG N 1  38 ARG CA 1  38 ARG C  1  39 GLU N  128.43  157.67  137.28  145.00  138.69 0.82  8 0 "[    .    1]" 
        23 PHI 1  38 ARG C 1  39 GLU N  1  39 GLU CA 1  39 GLU C -126.41  -92.79 -108.22 -119.65  -97.64    .  . 0 "[    .    1]" 
        24 PSI 1  39 GLU N 1  39 GLU CA 1  39 GLU C  1  40 GLY N  116.83  144.87  118.31  116.66  116.50 1.59  3 0 "[    .    1]" 
        25 PHI 1  40 GLY C 1  41 THR N  1  41 THR CA 1  41 THR C -121.27  -83.75 -120.49 -124.17 -102.25 2.90  8 0 "[    .    1]" 
        26 PSI 1  41 THR N 1  41 THR CA 1  41 THR C  1  42 CYS N  124.19  145.41  131.99  123.44  144.19 0.75  3 0 "[    .    1]" 
        27 PHI 1  41 THR C 1  42 CYS N  1  42 CYS CA 1  42 CYS C -139.90 -109.22 -131.29 -126.28 -131.73 0.20  7 0 "[    .    1]" 
        28 PSI 1  42 CYS N 1  42 CYS CA 1  42 CYS C  1  43 ASN N  112.51  154.99  111.92  110.93  114.23 1.58  8 0 "[    .    1]" 
        29 PHI 1  44 GLU C 1  45 GLN N  1  45 GLN CA 1  45 GLN C -133.72  -83.98 -132.66 -134.62 -121.95 0.90  6 0 "[    .    1]" 
        30 PSI 1  45 GLN N 1  45 GLN CA 1  45 GLN C  1  46 THR N  140.34  165.10  165.57  165.40  165.25 1.50  3 0 "[    .    1]" 
        31 PHI 1  45 GLN C 1  46 THR N  1  46 THR CA 1  46 THR C -146.09 -114.93 -124.00 -134.67 -114.93 0.00  1 0 "[    .    1]" 
        32 PSI 1  46 THR N 1  46 THR CA 1  46 THR C  1  47 ARG N  122.55  161.33  155.56  160.40  158.65 0.63  7 0 "[    .    1]" 
        33 PHI 1  46 THR C 1  47 ARG N  1  47 ARG CA 1  47 ARG C -146.81 -114.05 -144.91 -147.01 -147.13 0.99  6 0 "[    .    1]" 
        34 PSI 1  47 ARG N 1  47 ARG CA 1  47 ARG C  1  48 LYS N  127.41  165.37  158.61  160.57  160.26 4.05 10 0 "[    .    1]" 
        35 PHI 1  47 ARG C 1  48 LYS N  1  48 LYS CA 1  48 LYS C -126.55  -93.99 -119.72 -127.72 -103.37 1.17  7 0 "[    .    1]" 
        36 PSI 1  48 LYS N 1  48 LYS CA 1  48 LYS C  1  49 VAL N  128.92  149.16  134.63  141.42  139.19 1.64  4 0 "[    .    1]" 
        37 PHI 1  48 LYS C 1  49 VAL N  1  49 VAL CA 1  49 VAL C -152.31 -131.13 -148.09 -150.51 -150.54 0.18  4 0 "[    .    1]" 
        38 PSI 1  49 VAL N 1  49 VAL CA 1  49 VAL C  1  50 LYS N  144.42  166.98  144.23  143.28  146.87 1.14  7 0 "[    .    1]" 
        39 PHI 1  50 LYS C 1  51 CYS N  1  51 CYS CA 1  51 CYS C -140.82 -126.56 -137.21 -141.49 -126.49 0.67  2 0 "[    .    1]" 
        40 PSI 1  51 CYS N 1  51 CYS CA 1  51 CYS C  1  52 ARG N  146.02  171.68  168.08  172.08  172.00 0.58  7 0 "[    .    1]" 
        41 PHI 1  51 CYS C 1  52 ARG N  1  52 ARG CA 1  52 ARG C -144.71  -90.37 -112.80 -136.05 -100.77    .  . 0 "[    .    1]" 
        42 PSI 1  52 ARG N 1  52 ARG CA 1  52 ARG C  1  53 VAL N  117.15  142.87  136.74  141.87  134.78 2.46  7 0 "[    .    1]" 
        43 PHI 1  52 ARG C 1  53 VAL N  1  53 VAL CA 1  53 VAL C -125.01  -77.53 -110.51 -107.87 -110.09    .  . 0 "[    .    1]" 
        44 PSI 1  53 VAL N 1  53 VAL CA 1  53 VAL C  1  54 PRO N   62.12  177.16   83.49   90.81   78.68    .  . 0 "[    .    1]" 
        45 PHI 1  54 PRO C 1  55 CYS N  1  55 CYS CA 1  55 CYS C -134.64  -84.56  -83.71  -83.80  -83.88 1.50 10 0 "[    .    1]" 
        46 PSI 1  55 CYS N 1  55 CYS CA 1  55 CYS C  1  56 ASN N  119.43 -179.55  133.76  135.10  120.11 3.05  9 0 "[    .    1]" 
        47 PHI 1  64 ASP C 1  65 CYS N  1  65 CYS CA 1  65 CYS C -152.86 -111.28 -135.38 -150.70 -111.36    .  . 0 "[    .    1]" 
        48 PSI 1  65 CYS N 1  65 CYS CA 1  65 CYS C  1  66 LYS N  132.79  171.89  139.58  133.26  133.00 0.05 10 0 "[    .    1]" 
        49 PHI 1  65 CYS C 1  66 LYS N  1  66 LYS CA 1  66 LYS C -120.58  -78.42  -91.19  -97.03 -107.30 0.07  3 0 "[    .    1]" 
        50 PSI 1  66 LYS N 1  66 LYS CA 1  66 LYS C  1  67 TYR N  121.76  148.26  141.70  145.88  142.85 0.05  7 0 "[    .    1]" 
        51 PHI 1  66 LYS C 1  67 TYR N  1  67 TYR CA 1  67 TYR C -148.51  -90.83 -129.63 -148.54  -96.25 0.03  9 0 "[    .    1]" 
        52 PSI 1  67 TYR N 1  67 TYR CA 1  67 TYR C  1  68 LYS N  128.30  171.34  165.78  171.37  171.12 0.03  2 0 "[    .    1]" 
        53 PHI 1  67 TYR C 1  68 LYS N  1  68 LYS CA 1  68 LYS C -131.39  -88.01 -104.41 -118.28  -87.85 0.16  9 0 "[    .    1]" 
        54 PSI 1  68 LYS N 1  68 LYS CA 1  68 LYS C  1  69 PHE N   98.33  145.57   99.68   99.31   98.39 1.37  5 0 "[    .    1]" 
        55 PHI 1  68 LYS C 1  69 PHE N  1  69 PHE CA 1  69 PHE C -125.40  -89.78  -89.06  -89.20  -89.25 1.53  5 0 "[    .    1]" 
        56 PSI 1  69 PHE N 1  69 PHE CA 1  69 PHE C  1  70 GLY N  131.86  161.16  136.47  131.64  131.62 0.29  3 0 "[    .    1]" 
        57 PHI 1  73 GLY C 1  74 GLU N  1  74 GLU CA 1  74 GLU C -130.58  -79.68  -80.23  -79.34  -79.36 0.88  3 0 "[    .    1]" 
        58 PSI 1  74 GLU N 1  74 GLU CA 1  74 GLU C  1  75 CYS N  122.01  165.57  134.89  134.18  133.16    .  . 0 "[    .    1]" 
        59 PHI 1  74 GLU C 1  75 CYS N  1  75 CYS CA 1  75 CYS C -154.81  -83.31  -87.24 -125.07  -82.52 0.79  3 0 "[    .    1]" 
        60 PSI 1  75 CYS N 1  75 CYS CA 1  75 CYS C  1  76 ASP N  125.63  153.35  126.89  124.49  136.30 1.14  3 0 "[    .    1]" 
        61 PHI 1  75 CYS C 1  76 ASP N  1  76 ASP CA 1  76 ASP C  -99.93  -80.21  -98.39  -93.24  -97.69 1.00 10 0 "[    .    1]" 
        62 PSI 1  76 ASP N 1  76 ASP CA 1  76 ASP C  1  77 ALA N   98.86  134.58  107.97  103.95  102.62    .  . 0 "[    .    1]" 
        63 PHI 1  76 ASP C 1  77 ALA N  1  77 ALA CA 1  77 ALA C  -65.67  -53.91  -60.52  -64.94  -55.56    .  . 0 "[    .    1]" 
        64 PSI 1  77 ALA N 1  77 ALA CA 1  77 ALA C  1  78 ALA N  -45.90  -17.30  -18.86  -20.51  -22.03 0.42 10 0 "[    .    1]" 
        65 PHI 1  77 ALA C 1  78 ALA N  1  78 ALA CA 1  78 ALA C  -83.29  -68.05  -68.66  -72.95  -67.44 0.61  3 0 "[    .    1]" 
        66 PSI 1  78 ALA N 1  78 ALA CA 1  78 ALA C  1  79 THR N  -33.26   -8.64  -26.70  -33.13  -22.70    .  . 0 "[    .    1]" 
        67 PHI 1  80 SER C 1  81 THR N  1  81 THR CA 1  81 THR C -150.10 -113.22 -149.93 -149.02 -150.14 0.65  3 0 "[    .    1]" 
        68 PSI 1  81 THR N 1  81 THR CA 1  81 THR C  1  82 LYS N  140.28  177.40  144.51  139.62  162.99 0.66  8 0 "[    .    1]" 
        69 PHI 1  81 THR C 1  82 LYS N  1  82 LYS CA 1  82 LYS C -147.68 -108.70 -115.14 -108.59 -108.75 0.38  5 0 "[    .    1]" 
        70 PSI 1  82 LYS N 1  82 LYS CA 1  82 LYS C  1  83 SER N  135.59  157.87  155.20  150.00  158.21 0.34  1 0 "[    .    1]" 
        71 PHI 1  82 LYS C 1  83 SER N  1  83 SER CA 1  83 SER C -151.47 -106.19 -121.94 -125.33 -129.61    .  . 0 "[    .    1]" 
        72 PSI 1  83 SER N 1  83 SER CA 1  83 SER C  1  84 ARG N  126.79  155.07  149.00  145.12  156.12 1.05  8 0 "[    .    1]" 
        73 PHI 1  83 SER C 1  84 ARG N  1  84 ARG CA 1  84 ARG C -153.66 -109.96 -155.17 -156.22 -154.10 2.56  6 0 "[    .    1]" 
        74 PSI 1  84 ARG N 1  84 ARG CA 1  84 ARG C  1  85 THR N  121.28  172.04  150.40  122.69  173.20 1.16  9 0 "[    .    1]" 
        75 PHI 1  84 ARG C 1  85 THR N  1  85 THR CA 1  85 THR C -130.56  -94.20 -117.75 -125.80 -132.08 2.25  9 0 "[    .    1]" 
        76 PSI 1  85 THR N 1  85 THR CA 1  85 THR C  1  86 GLY N  124.53  140.45  127.34  123.12  140.73 1.41  3 0 "[    .    1]" 
        77 PHI 1  86 GLY C 1  87 THR N  1  87 THR CA 1  87 THR C -126.40  -86.74  -96.28  -91.19  -92.08 0.48  5 0 "[    .    1]" 
        78 PSI 1  87 THR N 1  87 THR CA 1  87 THR C  1  88 LEU N  116.33  151.47  138.55  144.77  136.01 0.36  2 0 "[    .    1]" 
        79 PHI 1  87 THR C 1  88 LEU N  1  88 LEU CA 1  88 LEU C  -84.40  -60.94  -70.75  -84.32  -60.74 0.20  4 0 "[    .    1]" 
        80 PSI 1  88 LEU N 1  88 LEU CA 1  88 LEU C  1  89 GLN N  119.98  145.48  135.30  135.45  121.47 0.07  4 0 "[    .    1]" 
        81 PHI 1  89 GLN C 1  90 LYS N  1  90 LYS CA 1  90 LYS C -144.60  -73.50 -132.56 -145.61  -73.48 1.01  5 0 "[    .    1]" 
        82 PSI 1  90 LYS N 1  90 LYS CA 1  90 LYS C  1  91 ALA N  123.77  159.09  151.27  125.35  159.57 0.48  5 0 "[    .    1]" 
        83 PHI 1  90 LYS C 1  91 ALA N  1  91 ALA CA 1  91 ALA C -143.79  -78.49 -108.39  -84.39  -93.40    .  . 0 "[    .    1]" 
        84 PSI 1  91 ALA N 1  91 ALA CA 1  91 ALA C  1  92 LEU N  116.27  163.95  121.14  116.17  135.65 0.10 10 0 "[    .    1]" 
        85 PHI 1  95 VAL C 1  96 GLU N  1  96 GLU CA 1  96 GLU C -102.07  -71.11  -86.05  -98.04  -71.12    .  . 0 "[    .    1]" 
        86 PSI 1  96 GLU N 1  96 GLU CA 1  96 GLU C  1  97 CYS N  113.37  144.77  125.92  135.63  118.21 0.11  8 0 "[    .    1]" 
        87 PHI 1  96 GLU C 1  97 CYS N  1  97 CYS CA 1  97 CYS C -153.45 -102.77 -120.43 -129.25 -149.74 0.02  4 0 "[    .    1]" 
        88 PSI 1  97 CYS N 1  97 CYS CA 1  97 CYS C  1  98 GLN N  143.84  164.26  152.45  158.22  149.88 0.09  4 0 "[    .    1]" 
        89 PHI 1  97 CYS C 1  98 GLN N  1  98 GLN CA 1  98 GLN C  -86.61  -65.21  -74.46  -70.23  -75.79 0.18  2 0 "[    .    1]" 
        90 PSI 1  98 GLN N 1  98 GLN CA 1  98 GLN C  1  99 GLN N  119.24  153.74  152.27  139.29  153.98 0.24  6 0 "[    .    1]" 
        91 PHI 1  99 GLN C 1 100 THR N  1 100 THR CA 1 100 THR C -148.23 -110.57 -140.81 -148.75 -116.73 0.52  2 0 "[    .    1]" 
        92 PSI 1 100 THR N 1 100 THR CA 1 100 THR C  1 101 VAL N  148.99  164.57  151.15  165.58  155.71 1.01  2 0 "[    .    1]" 
        93 PHI 1 100 THR C 1 101 VAL N  1 101 VAL CA 1 101 VAL C -158.98 -117.14 -145.52 -150.74 -137.08    .  . 0 "[    .    1]" 
        94 PSI 1 101 VAL N 1 101 VAL CA 1 101 VAL C  1 102 SER N  144.28  171.20  153.06  145.00  171.36 0.16  8 0 "[    .    1]" 
        95 PHI 1 101 VAL C 1 102 SER N  1 102 SER CA 1 102 SER C -124.67  -89.83 -102.40 -126.06  -91.67 1.39  7 0 "[    .    1]" 
        96 PSI 1 102 SER N 1 102 SER CA 1 102 SER C  1 103 VAL N  134.44  157.94  157.63  153.79  159.24 1.30  3 0 "[    .    1]" 
        97 PHI 1 102 SER C 1 103 VAL N  1 103 VAL CA 1 103 VAL C -136.65 -119.53 -136.75 -139.08 -132.54 2.43  5 0 "[    .    1]" 
        98 PSI 1 103 VAL N 1 103 VAL CA 1 103 VAL C  1 104 THR N  132.93  165.93  160.77  140.62  166.86 0.93  9 0 "[    .    1]" 
        99 PHI 1 103 VAL C 1 104 THR N  1 104 THR CA 1 104 THR C -138.50 -102.98 -138.89 -138.66 -138.71 2.40  8 0 "[    .    1]" 
       100 PSI 1 104 THR N 1 104 THR CA 1 104 THR C  1 105 LYS N  135.87  161.77  147.43  138.92  150.51    .  . 0 "[    .    1]" 
       101 PHI 1 104 THR C 1 105 LYS N  1 105 LYS CA 1 105 LYS C -149.42  -92.26 -148.57 -147.29 -148.87 1.41  4 0 "[    .    1]" 
       102 PSI 1 105 LYS N 1 105 LYS CA 1 105 LYS C  1 106 PRO N  107.13  151.17  144.62  145.55  141.06 1.39  4 0 "[    .    1]" 
       103 PHI 1 106 PRO C 1 107 CYS N  1 107 CYS CA 1 107 CYS C -145.51 -120.91 -128.67 -147.61 -120.32 2.10  4 0 "[    .    1]" 
       104 PSI 1 107 CYS N 1 107 CYS CA 1 107 CYS C  1 108 THR N  146.57  164.85  144.54  144.12  143.61 3.14  6 0 "[    .    1]" 
       105 PHI 1 107 CYS C 1 108 THR N  1 108 THR CA 1 108 THR C -134.61  -85.37 -136.15 -136.37 -137.17 2.97  6 0 "[    .    1]" 
       106 PSI 1 108 THR N 1 108 THR CA 1 108 THR C  1 109 THR N  121.61  151.79  141.36  121.50  152.14 0.35  6 0 "[    .    1]" 
       107 PHI 1 113 ASN C 1 114 LYS N  1 114 LYS CA 1 114 LYS C -104.57  -63.41  -91.49 -101.63  -70.63    .  . 0 "[    .    1]" 
       108 PSI 1 114 LYS N 1 114 LYS CA 1 114 LYS C  1 115 PRO N  110.49  167.39  158.17  160.71  160.70    .  . 0 "[    .    1]" 
    stop_

save_



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