NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype subsubtype
423354 2f3j cing 4-filtered-FRED Wattos check violation dihedral angle


data_2f3j


save_distance_constraint_statistics_1
    _TA_constraint_stats_list.Sf_category                   torsion_angle_constraint_statistics
    _TA_constraint_stats_list.Constraint_count              137
    _TA_constraint_stats_list.Viol_count                    289
    _TA_constraint_stats_list.Viol_total                    8082.68
    _TA_constraint_stats_list.Viol_max                      9.96
    _TA_constraint_stats_list.Viol_rms                      1.00
    _TA_constraint_stats_list.Viol_average_all_restraints   0.30
    _TA_constraint_stats_list.Viol_average_violations_only  2.00
    _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  88 GLY C 1  89 ALA N  1  89 ALA CA 1  89 ALA C -165.00 -105.00 -116.92 -136.60 -101.36 3.64  9 0 "[    .    1    ]" 
         2 . 1  89 ALA C 1  90 LYS N  1  90 LYS CA 1  90 LYS C -165.00 -105.00 -102.92 -102.51 -102.79 4.05  8 0 "[    .    1    ]" 
         3 . 1  90 LYS C 1  91 LEU N  1  91 LEU CA 1  91 LEU C -165.00 -105.00 -108.06 -123.50  -96.90 8.10  3 1 "[  + .    1    ]" 
         4 . 1  91 LEU C 1  92 LEU N  1  92 LEU CA 1  92 LEU C -165.00 -105.00 -112.27 -104.08 -104.77 2.65  8 0 "[    .    1    ]" 
         5 . 1  92 LEU C 1  93 VAL N  1  93 VAL CA 1  93 VAL C -165.00 -105.00 -122.41 -159.64  -99.85 5.15  7 1 "[    . +  1    ]" 
         6 . 1  93 VAL C 1  94 SER N  1  94 SER CA 1  94 SER C -165.00 -105.00 -141.80 -134.98 -144.43 0.02  7 0 "[    .    1    ]" 
         7 . 1 101 SER C 1 102 ASP N  1 102 ASP CA 1 102 ASP C  -95.00  -35.00  -55.78  -63.17  -46.73    .  . 0 "[    .    1    ]" 
         8 . 1 102 ASP C 1 103 ALA N  1 103 ALA CA 1 103 ALA C  -95.00  -35.00  -74.02  -96.36  -56.36 1.36  4 0 "[    .    1    ]" 
         9 . 1 103 ALA C 1 104 ASP N  1 104 ASP CA 1 104 ASP C  -95.00  -35.00  -64.52  -70.44  -57.98    .  . 0 "[    .    1    ]" 
        10 . 1 104 ASP C 1 105 ILE N  1 105 ILE CA 1 105 ILE C  -95.00  -35.00  -59.20  -63.55  -65.98    .  . 0 "[    .    1    ]" 
        11 . 1 105 ILE C 1 106 GLN N  1 106 GLN CA 1 106 GLN C  -95.00  -35.00  -65.81  -63.42  -66.36    .  . 0 "[    .    1    ]" 
        12 . 1 106 GLN C 1 107 GLU N  1 107 GLU CA 1 107 GLU C  -95.00  -35.00  -60.83  -58.36  -59.49    .  . 0 "[    .    1    ]" 
        13 . 1 107 GLU C 1 108 LEU N  1 108 LEU CA 1 108 LEU C  -95.00  -35.00  -64.20  -69.72  -57.65    .  . 0 "[    .    1    ]" 
        14 . 1 108 LEU C 1 109 PHE N  1 109 PHE CA 1 109 PHE C  -95.00  -35.00  -60.84  -61.40  -67.73    .  . 0 "[    .    1    ]" 
        15 . 1 109 PHE C 1 110 ALA N  1 110 ALA CA 1 110 ALA C  -95.00  -35.00  -70.30  -74.61  -59.08    .  . 0 "[    .    1    ]" 
        16 . 1 110 ALA C 1 111 GLU N  1 111 GLU CA 1 111 GLU C  -95.00  -35.00  -58.27  -79.04  -48.43    .  . 0 "[    .    1    ]" 
        17 . 1 111 GLU C 1 112 PHE N  1 112 PHE CA 1 112 PHE C  -95.00  -35.00  -69.53  -74.49  -84.93    .  . 0 "[    .    1    ]" 
        18 . 1 116 LYS C 1 117 LYS N  1 117 LYS CA 1 117 LYS C -165.00 -105.00 -142.78 -139.38 -144.49 5.77  3 1 "[  + .    1    ]" 
        19 . 1 117 LYS C 1 118 ALA N  1 118 ALA CA 1 118 ALA C -165.00 -105.00 -150.72 -166.73 -105.06 1.73 14 0 "[    .    1    ]" 
        20 . 1 118 ALA C 1 119 ALA N  1 119 ALA CA 1 119 ALA C -165.00 -105.00 -135.76 -165.20 -103.10 1.90  8 0 "[    .    1    ]" 
        21 . 1 119 ALA C 1 120 VAL N  1 120 VAL CA 1 120 VAL C -165.00 -105.00 -104.79 -148.70  -96.58 8.42  1 7 "[+  -* * ** *  ]" 
        22 . 1 120 VAL C 1 121 ASP N  1 121 ASP CA 1 121 ASP C -165.00 -105.00 -126.00 -126.83 -131.37 2.45  2 0 "[    .    1    ]" 
        23 . 1 131 THR C 1 132 ALA N  1 132 ALA CA 1 132 ALA C -165.00 -105.00 -151.93 -166.12 -109.96 1.12  4 0 "[    .    1    ]" 
        24 . 1 132 ALA C 1 133 ASP N  1 133 ASP CA 1 133 ASP C -165.00 -105.00 -119.78 -141.54 -103.97 1.03  7 0 "[    .    1    ]" 
        25 . 1 133 ASP C 1 134 VAL N  1 134 VAL CA 1 134 VAL C -165.00 -105.00 -110.20 -119.68 -103.24 1.76  1 0 "[    .    1    ]" 
        26 . 1 134 VAL C 1 135 HIS N  1 135 HIS CA 1 135 HIS C -165.00 -105.00 -129.02 -135.61 -123.19    .  . 0 "[    .    1    ]" 
        27 . 1 135 HIS C 1 136 PHE N  1 136 PHE CA 1 136 PHE C -165.00 -105.00 -111.51 -130.68 -102.25 2.75  5 0 "[    .    1    ]" 
        28 . 1 138 ARG C 1 139 ARG N  1 139 ARG CA 1 139 ARG C  -95.00  -35.00  -73.20  -78.36  -82.73    .  . 0 "[    .    1    ]" 
        29 . 1 139 ARG C 1 140 ALA N  1 140 ALA CA 1 140 ALA C  -95.00  -35.00  -63.93  -61.17  -62.56    .  . 0 "[    .    1    ]" 
        30 . 1 140 ALA C 1 141 ASP N  1 141 ASP CA 1 141 ASP C  -95.00  -35.00  -61.57  -81.41  -55.75    .  . 0 "[    .    1    ]" 
        31 . 1 141 ASP C 1 142 ALA N  1 142 ALA CA 1 142 ALA C  -95.00  -35.00  -80.09  -82.63  -77.00    .  . 0 "[    .    1    ]" 
        32 . 1 142 ALA C 1 143 LEU N  1 143 LEU CA 1 143 LEU C  -95.00  -35.00  -57.87  -59.13  -60.49    .  . 0 "[    .    1    ]" 
        33 . 1 143 LEU C 1 144 LYS N  1 144 LYS CA 1 144 LYS C  -95.00  -35.00  -64.21  -72.91  -59.71    .  . 0 "[    .    1    ]" 
        34 . 1 144 LYS C 1 145 ALA N  1 145 ALA CA 1 145 ALA C  -95.00  -35.00  -66.13  -71.53  -61.40    .  . 0 "[    .    1    ]" 
        35 . 1 145 ALA C 1 146 MET N  1 146 MET CA 1 146 MET C  -95.00  -35.00  -75.97  -78.08  -80.66    .  . 0 "[    .    1    ]" 
        36 . 1 146 MET C 1 147 LYS N  1 147 LYS CA 1 147 LYS C  -95.00  -35.00  -86.84  -92.87  -95.57 1.49  3 0 "[    .    1    ]" 
        37 . 1 147 LYS C 1 148 GLN N  1 148 GLN CA 1 148 GLN C  -95.00  -35.00  -86.19  -97.31  -62.09 2.31  3 0 "[    .    1    ]" 
        38 . 1 148 GLN C 1 149 TYR N  1 149 TYR CA 1 149 TYR C  -95.00  -35.00  -73.85  -77.11  -84.68    .  . 0 "[    .    1    ]" 
        39 . 1 159 MET C 1 160 ASP N  1 160 ASP CA 1 160 ASP C -165.00 -105.00 -106.02 -104.83 -106.19 3.90  9 0 "[    .    1    ]" 
        40 . 1 160 ASP C 1 161 ILE N  1 161 ILE CA 1 161 ILE C -165.00 -105.00 -139.53 -152.36 -161.66 0.93  3 0 "[    .    1    ]" 
        41 . 1 161 ILE C 1 162 GLN N  1 162 GLN CA 1 162 GLN C -165.00 -105.00 -125.03 -116.47 -120.92 1.51  3 0 "[    .    1    ]" 
        42 . 1 162 GLN C 1 163 LEU N  1 163 LEU CA 1 163 LEU C -165.00 -105.00 -117.09 -150.18 -102.63 2.37  1 0 "[    .    1    ]" 
        43 . 1 163 LEU C 1 164 VAL N  1 164 VAL CA 1 164 VAL C -165.00 -105.00 -114.18 -108.82 -122.25 2.24  6 0 "[    .    1    ]" 
        44 . 1  89 ALA N 1  89 ALA CA 1  89 ALA C  1  90 LYS N  105.00  165.00  114.83  104.65  121.73 0.35  9 0 "[    .    1    ]" 
        45 . 1  90 LYS N 1  90 LYS CA 1  90 LYS C  1  91 LEU N  105.00  165.00  119.14  105.03  128.30    .  . 0 "[    .    1    ]" 
        46 . 1  91 LEU N 1  91 LEU CA 1  91 LEU C  1  92 LEU N  105.00  165.00  128.81  119.39  164.01    .  . 0 "[    .    1    ]" 
        47 . 1  92 LEU N 1  92 LEU CA 1  92 LEU C  1  93 VAL N  105.00  165.00  127.30  150.72  131.06 0.10  5 0 "[    .    1    ]" 
        48 . 1  93 VAL N 1  93 VAL CA 1  93 VAL C  1  94 SER N  105.00  165.00  135.73  103.41  167.78 2.78  9 0 "[    .    1    ]" 
        49 . 1  94 SER N 1  94 SER CA 1  94 SER C  1  95 ASN N  105.00  165.00  125.24  156.44  123.07 3.15 12 0 "[    .    1    ]" 
        50 . 1 102 ASP N 1 102 ASP CA 1 102 ASP C  1 103 ALA N  -65.00   -5.00  -46.26  -46.66  -50.43    .  . 0 "[    .    1    ]" 
        51 . 1 103 ALA N 1 103 ALA CA 1 103 ALA C  1 104 ASP N  -65.00   -5.00  -25.68  -31.01  -33.75 0.59 13 0 "[    .    1    ]" 
        52 . 1 104 ASP N 1 104 ASP CA 1 104 ASP C  1 105 ILE N  -65.00   -5.00  -61.90  -68.04  -42.58 3.04  4 0 "[    .    1    ]" 
        53 . 1 105 ILE N 1 105 ILE CA 1 105 ILE C  1 106 GLN N  -65.00   -5.00  -31.71  -50.30  -20.23    .  . 0 "[    .    1    ]" 
        54 . 1 106 GLN N 1 106 GLN CA 1 106 GLN C  1 107 GLU N  -65.00   -5.00  -49.32  -56.07  -42.58    .  . 0 "[    .    1    ]" 
        55 . 1 107 GLU N 1 107 GLU CA 1 107 GLU C  1 108 LEU N  -65.00   -5.00  -36.94  -48.64  -28.73    .  . 0 "[    .    1    ]" 
        56 . 1 108 LEU N 1 108 LEU CA 1 108 LEU C  1 109 PHE N  -65.00   -5.00  -62.11  -58.15  -60.28 1.08  6 0 "[    .    1    ]" 
        57 . 1 109 PHE N 1 109 PHE CA 1 109 PHE C  1 110 ALA N  -65.00   -5.00  -22.51  -34.68  -15.11    .  . 0 "[    .    1    ]" 
        58 . 1 110 ALA N 1 110 ALA CA 1 110 ALA C  1 111 GLU N  -65.00   -5.00  -42.44  -48.54  -28.49    .  . 0 "[    .    1    ]" 
        59 . 1 111 GLU N 1 111 GLU CA 1 111 GLU C  1 112 PHE N  -65.00   -5.00  -38.72  -41.59  -34.90    .  . 0 "[    .    1    ]" 
        60 . 1 112 PHE N 1 112 PHE CA 1 112 PHE C  1 113 GLY N  -65.00   -5.00   -3.19   -1.34   -1.42 6.34  7 2 "[    . +- 1    ]" 
        61 . 1 117 LYS N 1 117 LYS CA 1 117 LYS C  1 118 ALA N  105.00  165.00  145.91  147.30  146.90 3.26  3 0 "[    .    1    ]" 
        62 . 1 118 ALA N 1 118 ALA CA 1 118 ALA C  1 119 ALA N  105.00  165.00  126.77  130.87  120.08 0.44 12 0 "[    .    1    ]" 
        63 . 1 119 ALA N 1 119 ALA CA 1 119 ALA C  1 120 VAL N  105.00  165.00  155.00  108.46  171.27 6.27  8 1 "[    .  + 1    ]" 
        64 . 1 120 VAL N 1 120 VAL CA 1 120 VAL C  1 121 ASP N  105.00  165.00  152.90  120.34  168.43 3.43  6 0 "[    .    1    ]" 
        65 . 1 121 ASP N 1 121 ASP CA 1 121 ASP C  1 122 TYR N  105.00  165.00  148.77  169.36  166.33 4.64  2 0 "[    .    1    ]" 
        66 . 1 131 THR N 1 131 THR CA 1 131 THR C  1 132 ALA N  105.00  165.00  147.67  148.22  142.48 0.72  9 0 "[    .    1    ]" 
        67 . 1 132 ALA N 1 132 ALA CA 1 132 ALA C  1 133 ASP N  105.00  165.00  155.58  164.91  163.55 2.57  4 0 "[    .    1    ]" 
        68 . 1 133 ASP N 1 133 ASP CA 1 133 ASP C  1 134 VAL N  105.00  165.00  108.95  104.17  114.14 0.83  8 0 "[    .    1    ]" 
        69 . 1 134 VAL N 1 134 VAL CA 1 134 VAL C  1 135 HIS N  105.00  165.00  145.72  138.10  128.51    .  . 0 "[    .    1    ]" 
        70 . 1 135 HIS N 1 135 HIS CA 1 135 HIS C  1 136 PHE N  105.00  165.00  124.76  127.80  126.70    .  . 0 "[    .    1    ]" 
        71 . 1 136 PHE N 1 136 PHE CA 1 136 PHE C  1 137 GLU N  105.00  165.00  156.82  148.75  164.62    .  . 0 "[    .    1    ]" 
        72 . 1 139 ARG N 1 139 ARG CA 1 139 ARG C  1 140 ALA N  -65.00   -5.00  -32.26  -35.53  -38.93    .  . 0 "[    .    1    ]" 
        73 . 1 140 ALA N 1 140 ALA CA 1 140 ALA C  1 141 ASP N  -65.00   -5.00  -31.62  -36.78  -43.25    .  . 0 "[    .    1    ]" 
        74 . 1 141 ASP N 1 141 ASP CA 1 141 ASP C  1 142 ALA N  -65.00   -5.00  -33.80  -41.14  -21.23    .  . 0 "[    .    1    ]" 
        75 . 1 142 ALA N 1 142 ALA CA 1 142 ALA C  1 143 LEU N  -65.00   -5.00  -38.58  -40.43  -40.65    .  . 0 "[    .    1    ]" 
        76 . 1 143 LEU N 1 143 LEU CA 1 143 LEU C  1 144 LYS N  -65.00   -5.00  -47.39  -53.51  -37.34    .  . 0 "[    .    1    ]" 
        77 . 1 144 LYS N 1 144 LYS CA 1 144 LYS C  1 145 ALA N  -65.00   -5.00  -39.66  -43.96  -34.64    .  . 0 "[    .    1    ]" 
        78 . 1 145 ALA N 1 145 ALA CA 1 145 ALA C  1 146 MET N  -65.00   -5.00  -37.39  -42.01  -46.19    .  . 0 "[    .    1    ]" 
        79 . 1 146 MET N 1 146 MET CA 1 146 MET C  1 147 LYS N  -65.00   -5.00  -21.69  -30.20  -11.40    .  . 0 "[    .    1    ]" 
        80 . 1 147 LYS N 1 147 LYS CA 1 147 LYS C  1 148 GLN N  -65.00   -5.00  -44.70  -47.33  -48.96    .  . 0 "[    .    1    ]" 
        81 . 1 148 GLN N 1 148 GLN CA 1 148 GLN C  1 149 TYR N  -65.00   -5.00  -60.46  -65.76  -51.45 0.76 11 0 "[    .    1    ]" 
        82 . 1 149 TYR N 1 149 TYR CA 1 149 TYR C  1 150 LYS N  -65.00   -5.00  -45.24  -62.50  -15.16    .  . 0 "[    .    1    ]" 
        83 . 1 160 ASP N 1 160 ASP CA 1 160 ASP C  1 161 ILE N  105.00  165.00  120.95  103.24  158.33 1.76  4 0 "[    .    1    ]" 
        84 . 1 161 ILE N 1 161 ILE CA 1 161 ILE C  1 162 GLN N  105.00  165.00  119.47  102.92  166.79 2.08 12 0 "[    .    1    ]" 
        85 . 1 162 GLN N 1 162 GLN CA 1 162 GLN C  1 163 LEU N  105.00  165.00  130.61  107.98  165.63 0.63  3 0 "[    .    1    ]" 
        86 . 1 163 LEU N 1 163 LEU CA 1 163 LEU C  1 164 VAL N  105.00  165.00  112.75  101.52  144.97 3.48 13 0 "[    .    1    ]" 
        87 . 1 164 VAL N 1 164 VAL CA 1 164 VAL C  1 165 ALA N  105.00  165.00  122.64  157.09  148.14 2.49 14 0 "[    .    1    ]" 
        88 . 1  22 SER C 1  23 LEU N  1  23 LEU CA 1  23 LEU C  -92.00  -40.00  -59.63  -68.32  -75.33    .  . 0 "[    .    1    ]" 
        89 . 1  23 LEU C 1  24 ASP N  1  24 ASP CA 1  24 ASP C  -87.00  -47.00  -61.47  -69.61  -53.46    .  . 0 "[    .    1    ]" 
        90 . 1  24 ASP C 1  25 ASP N  1  25 ASP CA 1  25 ASP C  -91.00  -43.00  -64.17  -72.94  -55.49    .  . 0 "[    .    1    ]" 
        91 . 1  25 ASP C 1  26 ILE N  1  26 ILE CA 1  26 ILE C  -79.00  -53.00  -62.64  -69.90  -56.29    .  . 0 "[    .    1    ]" 
        92 . 1  26 ILE C 1  27 ILE N  1  27 ILE CA 1  27 ILE C  -78.00  -50.00  -50.28  -48.61  -48.86 2.50 13 0 "[    .    1    ]" 
        93 . 1  27 ILE C 1  28 LYS N  1  28 LYS CA 1  28 LYS C  -86.00  -40.00  -59.04  -66.46  -68.95    .  . 0 "[    .    1    ]" 
        94 . 1  28 LYS C 1  29 LEU N  1  29 LEU CA 1  29 LEU C  -95.00  -41.00  -64.22  -73.20  -58.01    .  . 0 "[    .    1    ]" 
        95 . 1  30 ASN C 1  31 ARG N  1  31 ARG CA 1  31 ARG C  -88.00  -42.00  -72.34  -84.39  -62.87    .  . 0 "[    .    1    ]" 
        96 . 1  61 SER C 1  62 ARG N  1  62 ARG CA 1  62 ARG C -158.00  -32.00 -146.22 -157.99 -122.42    .  . 0 "[    .    1    ]" 
        97 . 1  62 ARG C 1  63 PRO N  1  63 PRO CA 1  63 PRO C  -89.00  -37.00  -62.75  -73.00  -42.02    .  . 0 "[    .    1    ]" 
        98 . 1  63 PRO C 1  64 LYS N  1  64 LYS CA 1  64 LYS C -122.00  -50.00 -102.72 -121.12  -64.21    .  . 0 "[    .    1    ]" 
        99 . 1  99 GLY C 1 100 VAL N  1 100 VAL CA 1 100 VAL C  -94.00  -48.00  -74.73  -60.29  -67.34 1.81  4 0 "[    .    1    ]" 
       100 . 1 100 VAL C 1 101 SER N  1 101 SER CA 1 101 SER C -138.00  -60.00  -85.32  -88.23  -98.09 6.37  3 1 "[  + .    1    ]" 
       101 . 1 113 GLY C 1 114 THR N  1 114 THR CA 1 114 THR C -141.00  -25.00 -106.76 -140.96  -57.35    .  . 0 "[    .    1    ]" 
       102 . 1 121 ASP C 1 122 TYR N  1 122 TYR CA 1 122 TYR C -155.00  -73.00 -123.85 -154.92  -67.17 5.83 13 1 "[    .    1  + ]" 
       103 . 1 122 TYR C 1 123 ASP N  1 123 ASP CA 1 123 ASP C -124.00  -50.00  -93.71 -108.36 -126.25 2.25  1 0 "[    .    1    ]" 
       104 . 1 123 ASP C 1 124 ARG N  1 124 ARG CA 1 124 ARG C  -65.00  -49.00  -58.90  -61.18  -63.24 3.68 14 0 "[    .    1    ]" 
       105 . 1 124 ARG C 1 125 SER N  1 125 SER CA 1 125 SER C -126.00  -62.00 -103.99  -95.42 -101.56 2.54 11 0 "[    .    1    ]" 
       106 . 1 129 LEU C 1 130 GLY N  1 130 GLY CA 1 130 GLY C   69.00  103.00   89.03   64.93  108.43 5.43  8 1 "[    .  + 1    ]" 
       107 . 1 136 PHE C 1 137 GLU N  1 137 GLU CA 1 137 GLU C  -78.00  -46.00  -78.74  -80.34  -81.53 3.53  1 0 "[    .    1    ]" 
       108 . 1 149 TYR C 1 150 LYS N  1 150 LYS CA 1 150 LYS C  -93.00  -31.00  -64.54  -67.10  -68.79    .  . 0 "[    .    1    ]" 
       109 . 1 153 PRO C 1 154 LEU N  1 154 LEU CA 1 154 LEU C -168.00  -68.00 -137.93 -127.64 -134.38    .  . 0 "[    .    1    ]" 
       110 . 1 156 GLY C 1 157 ARG N  1 157 ARG CA 1 157 ARG C -146.00  -54.00 -131.26 -137.35 -144.40 4.91  6 0 "[    .    1    ]" 
       111 . 1 157 ARG C 1 158 PRO N  1 158 PRO CA 1 158 PRO C  -80.00  -48.00  -64.87  -63.57  -66.75 6.22  6 1 "[    .+   1    ]" 
       112 . 1 169 ASP C 1 170 LEU N  1 170 LEU CA 1 170 LEU C -102.00  -36.00  -82.94  -61.19  -70.41 1.45  8 0 "[    .    1    ]" 
       113 . 1  15 MET N 1  15 MET CA 1  15 MET C  1  16 ALA N  -69.00   43.00  -32.94  -55.83   -0.07    .  . 0 "[    .    1    ]" 
       114 . 1  23 LEU N 1  23 LEU CA 1  23 LEU C  1  24 ASP N  -76.00   10.00  -41.40  -55.50  -28.49    .  . 0 "[    .    1    ]" 
       115 . 1  24 ASP N 1  24 ASP CA 1  24 ASP C  1  25 ASP N  -60.00  -18.00  -40.75  -39.22  -40.68    .  . 0 "[    .    1    ]" 
       116 . 1  25 ASP N 1  25 ASP CA 1  25 ASP C  1  26 ILE N  -63.00  -27.00  -40.35  -43.43  -45.46    .  . 0 "[    .    1    ]" 
       117 . 1  26 ILE N 1  26 ILE CA 1  26 ILE C  1  27 ILE N  -67.00    1.00  -48.62  -48.96  -49.37    .  . 0 "[    .    1    ]" 
       118 . 1  27 ILE N 1  27 ILE CA 1  27 ILE C  1  28 LYS N  -58.00  -20.00  -48.85  -56.27  -44.08    .  . 0 "[    .    1    ]" 
       119 . 1  28 LYS N 1  28 LYS CA 1  28 LYS C  1  29 LEU N  -58.00  -16.00  -51.20  -40.40  -47.21 0.95  7 0 "[    .    1    ]" 
       120 . 1  29 LEU N 1  29 LEU CA 1  29 LEU C  1  30 ASN N  -80.00   18.00  -35.86  -45.89  -46.12    .  . 0 "[    .    1    ]" 
       121 . 1  31 ARG N 1  31 ARG CA 1  31 ARG C  1  32 ASN N  -81.00   13.00  -32.14  -55.62  -21.03    .  . 0 "[    .    1    ]" 
       122 . 1  62 ARG N 1  62 ARG CA 1  62 ARG C  1  63 PRO N   95.00  169.00  139.92  124.34  160.57    .  . 0 "[    .    1    ]" 
       123 . 1  63 PRO N 1  63 PRO CA 1  63 PRO C  1  64 LYS N  114.00  166.00  134.62  144.43  142.31 1.02  8 0 "[    .    1    ]" 
       124 . 1  64 LYS N 1  64 LYS CA 1  64 LYS C  1  65 PRO N   98.00  180.00  121.22  100.27  100.24    .  . 0 "[    .    1    ]" 
       125 . 1 100 VAL N 1 100 VAL CA 1 100 VAL C  1 101 SER N  113.00  151.00  123.35  128.70  124.67 3.11 10 0 "[    .    1    ]" 
       126 . 1 101 SER N 1 101 SER CA 1 101 SER C  1 102 ASP N  147.00 -163.00  174.14  147.02 -167.65    .  . 0 "[    .    1    ]" 
       127 . 1 114 THR N 1 114 THR CA 1 114 THR C  1 115 LEU N  105.00  161.00  117.91  114.39  112.33 3.16  3 0 "[    .    1    ]" 
       128 . 1 122 TYR N 1 122 TYR CA 1 122 TYR C  1 123 ASP N  115.00  175.00  167.59  157.02  146.20 4.88 13 0 "[    .    1    ]" 
       129 . 1 123 ASP N 1 123 ASP CA 1 123 ASP C  1 124 ARG N  136.00 -168.00  166.52  151.67 -163.81 4.19  1 0 "[    .    1    ]" 
       130 . 1 124 ARG N 1 124 ARG CA 1 124 ARG C  1 125 SER N  -60.00   -6.00  -30.45  -48.36   -0.56 5.44  1 1 "[+   .    1    ]" 
       131 . 1 125 SER N 1 125 SER CA 1 125 SER C  1 126 GLY N  -33.00   31.00   -7.14  -33.87   17.66 0.87 11 0 "[    .    1    ]" 
       132 . 1 137 GLU N 1 137 GLU CA 1 137 GLU C  1 138 ARG N  -44.00    8.00  -17.71  -12.21  -14.34    .  . 0 "[    .    1    ]" 
       133 . 1 150 LYS N 1 150 LYS CA 1 150 LYS C  1 151 GLY N  116.00  154.00  119.27  113.84  139.54 2.16  5 0 "[    .    1    ]" 
       134 . 1 154 LEU N 1 154 LEU CA 1 154 LEU C  1 155 ASP N   93.00  159.00  100.90   98.41   92.37 9.96  6 3 "[    .+   1-  *]" 
       135 . 1 157 ARG N 1 157 ARG CA 1 157 ARG C  1 158 PRO N  110.00  154.00  139.79  102.12  154.99 7.88  6 3 "[    .+   1-  *]" 
       136 . 1 158 PRO N 1 158 PRO CA 1 158 PRO C  1 159 MET N  128.00  156.00  141.33  126.13  160.79 4.79 11 0 "[    .    1    ]" 
       137 . 1 170 LEU N 1 170 LEU CA 1 170 LEU C  1 171 GLU N  -86.00   32.00  -53.11  -86.97  -32.71 0.97  8 0 "[    .    1    ]" 
    stop_

save_



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