NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type subtype subsubtype
28531 3ci2 1870 cing recoord 1-original 7 unknown distance NOE simple


  20 HB#   21 HN    4.00  2.20  1.00     3.362  0.900                     
  20 HN    21 HN    3.00  1.20  0.30     2.812  0.371          .    .     
  21 HA    21 HB#   3.00  1.20  0.30     2.755  0.122                     
  21 HA    21 HG#   4.00  2.20  1.00     2.874  0.371                     
  21 HA    22 HN    2.40  0.60  0.30     2.340  0.208    ..               
  21 HA    23 HN    3.00  1.20  0.30     3.110  0.270  .        . :: .  + 
  21 HB#   21 HG#   4.00  2.20  1.00     2.611  0.062                     
  21 HB#   21 HN    2.40  0.60  0.30     2.643  0.115     .... . .  ... . 
  21 HD#   21 HE#   4.00  2.20  1.00     2.617  0.057                     
  21 HD#   24 HE1   4.00  2.20  1.00     4.197  0.504       .             
  21 HE#   21 HG#   4.00  2.20  1.00     2.907  0.237                     
  21 HE#   24 HA    4.00  2.20  1.00     3.893  0.649                     
  21 HE#   24 HD1   4.00  2.20  1.00     4.055  0.741     .    .          
  21 HE#   24 HE1   4.00  2.20  1.00     3.572  0.827      .       .      
  21 HN    23 HN    4.00  2.20  1.00     5.014  0.103 .:.. . .. . :. : . :
  22 HA    22 HB    2.40  0.60  0.30     2.561  0.049                     
  22 HA    22 HG2#  2.40  0.60  0.80     2.908  0.091                     
  22 HA    22 HN    3.00  1.20  0.30     3.019  0.021                     
  22 HA    23 HA    4.00  2.20  1.00     4.461  0.052                     
  22 HA    23 HN    3.00  1.20  0.30     3.028  0.163  .                  
  22 HA    24 HH2   3.00  1.20  0.30     3.019  0.269  .       .    .     
  22 HA    24 HZ3   3.00  1.20  0.30     3.096  0.207   .  . . .          
  22 HA    81 HA    4.00  2.20  1.00     4.561  0.193                     
  22 HA    82 HB    3.00  1.20  0.30     3.224  0.182     :.: ..  ... .. .
  22 HA    82 HG2#  3.00  1.20  0.80     2.470  0.315                     
  22 HA    82 HN    3.00  1.20  0.30     3.233  0.198 : . ... .. .... ..  
  22 HB    82 HB    3.00  1.20  0.30     2.655  0.328                     
  22 HB    82 HG1#  4.00  2.20  1.50     5.114  0.362  .   .      .  .. . 
  22 HB    82 HG2#  4.00  2.20  1.50     3.797  0.359                     
  22 HB    82 HN    3.00  1.20  0.30     2.959  0.181           .         
  22 HG2#  22 HN    3.00  1.20  0.80     3.231  0.224                     
  22 HG2#  23 HN    4.00  2.20  1.50     5.020  0.117                     
  22 HG2#  82 HB    4.00  2.20  1.50     3.634  0.290                     
  22 HG2#  82 HG1#  4.00  2.20  1.50     5.397  0.221   . ..  .. ... .. . 
  22 HG2#  82 HN    4.00  2.20  1.50     5.095  0.208        .            
  22 HN    23 HN    2.40  0.60  0.30     2.291  0.252 .  .                
  23 HA    23 HB1   3.00  1.20  0.30     2.457  0.107                     
  23 HA    23 HB2   3.00  1.20  0.30     2.447  0.072                     
  23 HA    23 HG#   4.00  2.20  1.00     3.993  0.103                     
  23 HA    23 HN    3.00  1.20  0.30     2.974  0.034                     
  23 HA    24 HE3   2.40  0.60  0.30     2.591  0.137                . . .
  23 HA    24 HN    2.40  0.60  0.30     2.247  0.095                     
  23 HA    24 HZ3   4.00  2.20  1.00     3.448  0.175                     
  23 HA    79 HG1#  4.00  2.20  1.50     4.388  0.465                     
  23 HA    81 HA    2.40  0.60  0.30     2.123  0.238           .         
  23 HA    82 HN    4.00  2.20  1.00     3.648  0.202                     
  23 HB1   23 HG#   4.00  2.20  1.00     2.629  0.098                     
  23 HB1   23 HN    3.00  1.20  0.30     3.204  0.156  . ..  . ..    . .  
  23 HB1   24 HE3   4.00  2.20  1.00     4.996  0.110 ..... . .  .........
  23 HB1   24 HN    4.00  2.20  1.00     4.013  0.159                     
  23 HB1   25 HD#   4.00  2.20  1.00     4.660  0.310 .           ..    . 
  23 HB2   23 HN    4.00  2.20  1.00     3.912  0.058                     
  23 HB2   24 HN    4.00  2.20  1.00     2.937  0.262                     
  23 HB2   81 HA    4.00  2.20  1.00     4.215  0.339                     
  23 HG#   23 HN    4.00  2.20  1.00     3.337  0.393                     
  23 HG#   79 HG1#  4.00  2.20  1.50     5.259  0.274        .   ..    .. 
  24 HA    24 HB1   3.00  1.20  0.30     2.566  0.091                     
  24 HA    24 HB2   4.00  2.20  1.00     3.071  0.030                     
  24 HA    24 HD1   3.00  1.20  0.30     3.003  0.075                     
  24 HA    24 HE3   4.00  2.20  1.00     4.039  0.099                     
  24 HA    24 HN    3.00  1.20  0.30     2.995  0.013                     
  24 HA    25 HB#   4.00  2.20  1.00     5.129  0.032 ::::.:|.:.:.::::::::
  24 HA    25 HD#   3.00  1.20  0.30     2.215  0.094                     
  24 HA    25 HG#   4.00  2.20  1.00     4.328  0.149                     
  24 HA    26 HN    3.00  1.20  0.30     3.258  0.087 .  ..  .   .. ..  . 
  24 HB1   24 HD1   2.40  0.60  0.30     2.182  0.066                     
  42 HB#   24 HE1   3.00  1.20  0.30     2.358  0.193                     
  24 HB1   24 HE3   4.00  2.20  1.00     3.952  0.112                     
  24 HB1   24 HN    4.00  2.20  1.00     3.778  0.075                     
  24 HB1   27 HB#   4.00  2.20  1.00     3.585  0.328                     
  24 HB1   27 HD*   3.00  1.20  0.80     2.583  0.096                     
  24 HB1   39 HG2#  4.00  2.20  1.50     5.663  0.047 |:::::::::::|:.:::|:
  24 HB2   24 HD1   3.00  1.20  0.30     3.465  0.030 :::::::|:::::::::|::
  24 HB2   24 HE1   4.00  2.20  1.00     5.011  0.013 ............ .. .. .
  24 HB2   24 HE3   3.00  1.20  0.30     2.617  0.195                     
  24 HB2   24 HN    4.00  2.20  1.00     2.738  0.164                     
  42 HB#   24 HZ2   4.00  2.20  1.00     2.504  0.200                     
  24 HB2   27 HB#   4.00  2.20  1.00     4.629  0.526 ::::.    :  .:    ::
  24 HB2   27 HD*   2.40  0.60  0.80     3.099  0.165    ...... ..    ... 
  24 HD1   25 HD#   4.00  2.20  1.00     5.062  0.042 .... ..:..::.. .....
  24 HD1   26 HN    4.00  2.20  1.00     4.700  0.194    .                
  24 HD1   27 HB#   4.00  2.20  1.00     4.647  0.486      .... ::  .:..  
  24 HD1   27 HD*   3.00  1.20  0.80     3.184  0.418       .    .        
  24 HD1   27 HG    3.00  1.20  0.30     3.095  0.322 .....    .  ..+   ..
  24 HD1   38 HG1#  3.00  1.20  0.80     3.128  0.249                     
  24 HD1   39 HD#   4.00  2.20  1.50     5.209  0.133                     
  24 HE1   38 HG1#  3.00  1.20  0.80     3.637  0.262  ..     ..   .  ..  
  24 HE1   39 HA    3.00  1.20  0.30     2.324  0.175                     
  24 HE1   39 HG2#  4.00  2.20  1.50     4.299  0.264                     
  24 HE1   42 HB#   2.40  0.60  0.30     2.358  0.193            ..       
  24 HE1   42 HN    4.00  2.20  1.00     3.975  0.264                     
  24 HE3   39 HD#   4.00  2.20  1.50     4.170  0.277                     
  24 HE3   39 HG2#  4.00  2.20  1.50     4.500  0.191                     
  24 HE3   66 HG1#  4.00  2.20  1.50     2.890  0.208                     
  24 HE3   66 HG2#  4.00  2.20  1.50     4.462  0.190                     
  24 HE3   79 HG1#  4.00  2.20  1.50     5.319  0.265 .   .  .  :.:     : 
  24 HE3   81 HA    3.00  1.20  0.30     2.702  0.313        .  :         
  24 HE3   82 HN    4.00  2.20  1.00     4.125  0.211                     
  24 HH2   39 HG2#  4.00  2.20  1.50     3.954  0.240                     
  24 HH2   66 HG1#  4.00  2.20  1.50     4.375  0.072                     
  24 HH2   66 HG2#  3.00  1.20  0.80     3.568  0.227            .  .:   .
  24 HH2   82 HG1#  4.00  2.20  1.50     4.891  0.231                     
  24 HH2   82 HG2#  2.40  0.60  0.80     2.395  0.141                     
  24 HN    79 HG1#  3.00  1.20  0.80     2.926  0.288                     
  24 HN    81 HA    4.00  2.20  1.00     3.482  0.342                     
  24 HZ2   39 HG2#  4.00  2.20  1.50     3.502  0.216                     
  24 HZ2   42 HA    4.00  2.20  1.00     4.781  0.219 .. .              : 
  24 HZ2   42 HB#   2.40  0.60  0.30     2.504  0.200      .       . .  ..
  24 HZ2   42 HN    4.00  2.20  1.00     4.535  0.223                     
  24 HZ2   43 HN    4.00  2.20  1.00     3.202  0.400                     
  24 HZ2   66 HG1#  4.00  2.20  1.50     5.581  0.075 .:.::..::. .: .:..|.
  24 HZ3   39 HG2#  4.00  2.20  1.50     4.402  0.266                     
  24 HZ3   66 HG1#  3.00  1.20  0.80     2.554  0.192                     
  24 HZ3   66 HG2#  3.00  1.20  0.80     3.179  0.243                .    
  24 HZ3   81 HA    3.00  1.20  0.30     2.775  0.243                     
  24 HZ3   82 HG1#  4.00  2.20  1.50     5.049  0.187                     
  24 HZ3   82 HG2#  2.40  0.60  0.80     2.191  0.075                     
  24 HZ3   82 HN    3.00  1.20  0.30     2.531  0.269                     
  25 HA    25 HB#   2.40  0.60  0.30     2.487  0.037                     
  25 HA    25 HD#   4.00  2.20  1.00     3.826  0.070                     
  25 HA    25 HG#   4.00  2.20  1.00     3.860  0.248                     
  25 HA    26 HN    4.00  2.20  1.00     3.493  0.055                     
  25 HA    27 HN    4.00  2.20  1.00     3.673  0.232                     
  25 HA    28 HG2#  2.40  0.60  0.80     2.417  0.151                     
  25 HA    28 HN    4.00  2.20  1.00     3.452  0.235                     
  25 HA    76 HG2#  4.00  2.20  1.50     5.577  0.037 .......:..::......:.
  25 HA    79 HG2#  2.40  0.60  0.80     2.525  0.170                     
  25 HB#   25 HD#   4.00  2.20  1.00     3.232  0.093                     
  25 HB#   25 HG#   3.00  1.20  0.30     2.554  0.024                     
  25 HB#   26 HN    4.00  2.20  1.00     3.696  0.340                     
  25 HB#   28 HG2#  4.00  2.20  1.50     4.484  0.188                     
  25 HB#   79 HG1#  3.00  1.20  0.80     3.129  0.366        .   .        
  25 HB#   79 HG2#  4.00  2.20  1.50     3.393  0.563                     
  25 HD#   25 HG#   4.00  2.20  1.00     2.555  0.023                     
  25 HD#   26 HN    4.00  2.20  1.00     2.964  0.179                     
  25 HD#   79 HG1#  4.00  2.20  1.50     3.484  0.294                     
  25 HD#   79 HG2#  4.00  2.20  1.50     5.396  0.187 :   .    .. ...   ..
  25 HG#   79 HG1#  4.00  2.20  1.50     4.485  0.712                     
  25 HG#   79 HG2#  4.00  2.20  1.50     5.467  0.190 ...  .. .   ...... .
  26 HA    26 HB#   3.00  1.20  0.30     2.574  0.094                     
  26 HA    26 HG#   4.00  2.20  1.00     3.418  0.506                     
  26 HA    26 HN    2.40  0.60  0.50     2.827  0.044          .       .  
  26 HB#   26 HG#   2.40  0.60  0.30     2.628  0.035                     
  26 HB#   26 HN    2.40  0.60  0.30     2.737  0.062  ..  ..:......:. : .
  26 HB#   27 HN    4.00  2.20  1.00     3.590  0.568                     
  26 HG#   26 HN    3.00  1.20  0.30     3.064  0.356 :  ::.   ..     . : 
  26 HG#   27 HN    4.00  2.20  1.00     3.915  1.009           .         
  26 HN    27 HN    2.40  0.60  0.30     2.668  0.115 ...  ...  . .. .  ..
  26 HN    28 HN    4.00  2.20  1.00     4.361  0.135                     
  26 HN    79 HG1#  4.00  2.20  1.50     5.315  0.186   ...         .     
  27 HA    27 HB#   2.40  0.60  0.30     2.563  0.132      ..        ...  
  27 HA    27 HN    2.40  0.60  0.50     2.921  0.022 ..........  .. .....
  27 HA    28 HN    4.00  2.20  1.00     3.280  0.231                     
  27 HB#   27 HD*   2.40  0.60  0.80     2.877  0.117                     
  27 HB#   27 HN    2.40  0.60  0.30     2.714  0.080 .::... ...  .:  . .:
  27 HB#   28 HN    4.00  2.20  1.00     3.940  0.522                     
  27 HD*   27 HG    2.40  0.60  0.80     2.583  0.064                     
  27 HD*   27 HN    4.00  2.20  1.50     4.015  0.418                     
  27 HD*   35 HA    2.40  0.60  0.80     2.553  0.144                     
  27 HD*   35 HB#   2.40  0.60  0.80     3.075  0.126  . .     .  .     . 
  27 HD*   35 HN    4.00  2.20  1.50     5.066  0.288               .     
  27 HD*   38 HG1#  3.00  1.20  0.80     3.275  0.190       .             
  27 HD*   38 HG2#  3.00  1.20  0.80     3.683  0.276 :....    . .::..  ..
  27 HD*   38 HN    4.00  2.20  1.50     5.028  0.183                     
  27 HD*   39 HD#   2.40  0.60  0.80     3.280  0.027 ...:.....:......:..:
  27 HD*   39 HG1#  4.00  2.20  1.50     2.736  0.076                     
  27 HD*   39 HN    4.00  2.20  1.50     3.992  0.213                     
  27 HG    27 HN    3.00  1.20  0.30     2.270  0.349               :     
  27 HN    28 HG2#  4.00  2.20  1.50     4.365  0.236                     
  27 HN    28 HN    2.40  0.60  0.30     2.582  0.156 ... .    .         .
  28 HA    28 HB    4.00  2.20  1.00     3.061  0.018                     
  28 HA    28 HG1#  4.00  2.20  1.50     2.995  0.123                     
  28 HA    28 HG2#  2.40  0.60  0.80     2.873  0.132                     
  28 HA    28 HN    2.40  0.60  0.50     2.876  0.046  ....   ..   .    ..
  28 HA    29 HA#   4.00  2.20  1.00     4.556  0.088                     
  28 HA    29 HN    2.40  0.60  0.30     2.275  0.152                     
  28 HA    30 HN    3.00  1.20  0.30     3.276  0.079  .   ... ....  ...  
  28 HA    76 HB    2.40  0.60  0.30     2.307  0.184                     
  28 HA    76 HG2#  2.40  0.60  0.80     2.680  0.236              .      
  28 HB    28 HN    2.40  0.60  0.30     2.459  0.165       .             
  28 HG1#  28 HN    4.00  2.20  1.50     4.539  0.059                     
  28 HG1#  29 HA#   4.00  2.20  1.50     4.328  0.249                     
  28 HG1#  29 HN    3.00  1.20  0.80     2.943  0.400                     
  28 HG1#  30 HN    4.00  2.20  1.50     5.244  0.208      .          .   
  28 HG2#  28 HN    2.40  0.60  0.80     2.671  0.269  .                  
  28 HG2#  29 HN    4.00  2.20  1.50     4.690  0.259                     
  28 HG2#  79 HA    2.40  0.60  0.80     2.785  0.356        |  ::        
  28 HG2#  79 HG1#  3.00  1.20  0.80     3.942  0.050 .::::::|:.:||:::::|:
  28 HG2#  79 HN    4.00  2.20  1.50     4.456  0.655                     
  28 HN    29 HN    4.00  2.20  1.00     4.635  0.107                     
  29 HA#   29 HN    3.00  1.20  0.30     2.596  0.047                     
  29 HA#   30 HN    3.00  1.20  0.30     3.221  0.083       .   .         
  29 HN    30 HN    2.40  0.60  0.30     2.539  0.235 .. .  .  ....      .
  29 HN    76 HB    4.00  2.20  1.00     2.639  0.214                     
  29 HN    76 HG2#  4.00  2.20  1.50     3.948  0.309                     
  30 HA    30 HB#   3.00  1.20  0.30     2.689  0.036                     
  30 HA    30 HD#   4.00  2.20  1.00     3.668  0.997                     
  30 HA    30 HG#   4.00  2.20  1.00     2.967  0.386                     
  30 HA    30 HN    2.40  0.60  0.50     2.967  0.009 ....................
  30 HA    31 HN    2.40  0.60  0.30     2.477  0.081                     
  30 HB#   30 HD#   4.00  2.20  1.00     2.952  0.294                     
  30 HB#   30 HE#   4.00  2.20  1.00     4.265  0.726                     
  30 HB#   30 HG#   4.00  2.20  1.00     2.640  0.073                     
  30 HB#   30 HN    3.00  1.20  0.30     2.747  0.113                     
  30 HB#   31 HN    2.40  0.60  0.30     2.655  0.109 . ...  ..  ...   . .
  30 HB#   76 HG1#  4.00  2.20  1.00     5.115  0.038 ...::.::..:::.::.:::
  30 HD#   30 HE#   4.00  2.20  1.00     2.557  0.029                     
  30 HD#   30 HN    4.00  2.20  1.00     4.242  0.693     .   .           
  30 HE#   30 HG#   3.00  1.20  0.30     2.989  0.161    .      .         
  30 HG#   30 HN    4.00  2.20  1.00     3.244  0.372                     
  30 HN    31 HN    4.00  2.20  1.00     4.546  0.046                     
  30 HN    76 HB    3.00  1.20  0.30     2.638  0.245                     
  30 HN    76 HG2#  4.00  2.20  1.50     5.090  0.238                     
  30 HN    76 HN    4.00  2.20  1.00     3.117  0.297                     
  31 HA    31 HB1   2.40  0.60  0.30     2.559  0.135      :    .  :      
  31 HA    31 HB2   2.40  0.60  0.30     2.624  0.135    .  . :  .. ..    
  31 HA    31 HN    3.00  1.20  0.30     3.008  0.024                     
  31 HA    32 HA    3.00  1.20  0.30     3.558  0.023 ||||||||||||||||||||
  31 HA    32 HB    3.00  1.20  0.30     3.492  0.040 |::|::::::::|:|||:||
  31 HA    32 HN    2.40  0.60  0.30     1.911  0.099                     
  31 HA    75 HA    2.40  0.60  0.30     2.095  0.284           :         
  31 HB1   31 HN    3.00  1.20  0.30     2.885  0.280         :           
  31 HB1   32 HN    3.00  1.20  0.30     3.266  0.179 .:.  : . :.  :  :...
  31 HB1   75 HA    4.00  2.20  1.00     3.649  0.511                     
  31 HB2   32 HN    2.40  0.60  0.30     2.381  0.189         .           
  31 HB2   75 HA    4.00  2.20  1.00     4.302  0.444                     
  31 HN    34 HN    4.00  2.20  1.00     4.481  0.250                     
  32 HA    32 HB    2.40  0.60  0.30     2.542  0.079            .        
  32 HA    32 HG*   4.00  2.20  1.50     3.156  0.146                     
  32 HA    32 HN    2.40  0.60  0.50     2.670  0.070                     
  32 HA    35 HB#   2.40  0.60  0.80     2.754  0.244         .           
  32 HA    35 HN    3.00  1.20  0.30     3.358  0.092 ..... .::..:.:...:..
  32 HA    36 HN    4.00  2.20  1.00     3.968  0.172                     
  32 HA    70 HG1#  4.00  2.20  1.50     3.947  0.217                     
  32 HA    76 HD#   2.40  0.60  0.80     3.184  0.196 ::.. ..... :. ..:. .
  32 HB    32 HG*   2.40  0.60  0.80     2.633  0.024                     
  32 HB    32 HN    2.40  0.60  0.30     1.905  0.100                     
  32 HG*   32 HN    3.00  1.20  0.80     3.298  0.307                     
  32 HG*   33 HA    4.00  2.20  1.50     4.252  0.197                     
  32 HG*   74 HB2   4.00  2.20  1.50     4.003  0.627                     
  32 HN    70 HG1#  4.00  2.20  1.50     4.161  0.324                     
  32 HN    70 HG2#  4.00  2.20  1.50     5.557  0.060 .. ...:..:......:.:.
  32 HN    75 HA    4.00  2.20  1.00     3.600  0.401                     
  32 HN    76 HD#   4.00  2.20  1.50     5.137  0.236      .          .   
  33 HA    33 HB#   3.00  1.20  0.30     2.734  0.128                     
  33 HA    33 HG#   4.00  2.20  1.00     3.424  0.364                     
  33 HA    33 HN    2.40  0.60  0.50     2.888  0.032  .   .... .. .      
  33 HA    34 HN    3.00  1.20  0.30     3.409  0.031 :::.:....::::::.:::.
  33 HA    36 HB#   3.00  1.20  0.30     2.877  0.353  .  .       ..      
  33 HA    36 HD#   3.00  1.20  0.30     2.709  0.335  .                  
  33 HA    36 HG#   4.00  2.20  1.00     3.872  0.498                     
  33 HA    36 HN    3.00  1.20  0.30     3.278  0.103  . ... ...  .. ..  .
  33 HA    37 HN    4.00  2.20  1.00     3.937  0.173                     
  33 HB#   33 HG#   2.40  0.60  0.30     2.605  0.040             .      .
  33 HB#   33 HN    3.00  1.20  0.30     2.652  0.129                     
  33 HG#   33 HN    3.00  1.20  0.30     2.824  0.303     . :      .      
  33 HN    34 HN    2.40  0.60  0.30     2.596  0.155 . ...    .    ..  . 
  34 HA    34 HB#   2.40  0.60  0.30     2.731  0.045 :.... .  ......:... 
  34 HA    34 HG#   3.00  1.20  0.30     2.872  0.218     .  .            
  34 HA    34 HN    2.40  0.60  0.50     2.879  0.040  . ... ..           
  34 HA    37 HB#   4.00  2.20  1.00     2.852  0.330                     
  34 HA    37 HD#   4.00  2.20  1.00     3.361  0.706                     
  34 HA    37 HN    4.00  2.20  1.00     3.620  0.275                     
  34 HA    38 HN    4.00  2.20  1.00     4.162  0.235                     
  34 HB#   34 HG#   3.00  1.20  0.30     2.643  0.059                     
  34 HB#   34 HN    3.00  1.20  0.30     2.597  0.162                     
  34 HB#   35 HN    3.00  1.20  0.30     2.621  0.124                     
  34 HG#   34 HN    4.00  2.20  1.00     3.711  0.863                     
  34 HG#   35 HN    4.00  2.20  1.00     4.526  0.338                     
  34 HG2   34 HN    4.00  2.20  1.00     3.848  0.730                     
  34 HN    35 HN    2.40  0.60  0.30     2.668  0.088 . .   .  ...  ..... 
  34 HN    36 HN    4.00  2.20  1.00     4.166  0.218                     
  34 HN    37 HN    4.00  2.20  1.00     4.724  0.204              .      
  35 HA    35 HN    2.40  0.60  0.50     2.803  0.039                     
  35 HA    36 HN    4.00  2.20  1.00     3.557  0.055                     
  35 HA    38 HB    3.00  1.20  0.30     2.870  0.176                     
  35 HA    38 HG2#  3.00  1.20  0.80     3.587  0.293  .   . .. ..  . ..  
  35 HA    38 HN    4.00  2.20  1.00     3.485  0.097                     
  35 HA    39 HD#   4.00  2.20  1.50     4.762  0.216                     
  35 HA    39 HN    4.00  2.20  1.00     3.780  0.175                     
  35 HB#   35 HN    2.40  0.60  0.80     2.655  0.069                     
  35 HB#   36 HN    3.00  1.20  0.80     2.800  0.161                     
  35 HB#   39 HD#   3.00  1.20  0.80     3.761  0.097  .. .  ..   . . ... 
  35 HB#   68 HD*   2.40  0.60  0.80     3.048  0.147 .  . . .            
  35 HB#   76 HD#   2.40  0.60  0.80     2.780  0.148                     
  35 HN    36 HN    3.00  1.20  0.30     2.960  0.159                     
  35 HN    37 HN    4.00  2.20  1.00     4.295  0.151                     
  36 HA    36 HB#   2.40  0.60  0.30     2.727  0.036 .. . ..  ...........
  36 HA    36 HD#   4.00  2.20  1.00     4.558  0.165                     
  36 HA    36 HG#   3.00  1.20  0.30     2.740  0.115                     
  36 HA    36 HN    2.40  0.60  0.50     2.781  0.035                     
  36 HA    37 HN    3.00  1.20  0.30     3.403  0.019 .:.:::::::.::....:.:
  36 HA    39 HB    3.00  1.20  0.30     2.534  0.188                     
  36 HA    39 HD#   3.00  1.20  0.80     3.563  0.297  .        . .   .  .
  36 HA    39 HG2#  4.00  2.20  1.50     4.615  0.259                     
  36 HA    39 HN    4.00  2.20  1.00     3.641  0.161                     
  36 HA    40 HD*   4.00  2.20  1.50     4.391  0.580                     
  36 HA    40 HN    4.00  2.20  1.00     3.627  0.144                     
  36 HA    48 HD#   2.40  0.60  0.80     2.709  0.268                .    
  36 HB#   36 HE#   4.00  2.20  1.00     3.839  0.875                     
  36 HB#   36 HN    3.00  1.20  0.30     2.597  0.200                     
  36 HB#   37 HA    4.00  2.20  1.00     4.150  0.215                     
  36 HB#   37 HN    2.40  0.60  0.30     2.504  0.093       .             
  36 HD#   36 HE#   4.00  2.20  1.00     2.599  0.058                     
  36 HD#   36 HG#   2.40  0.60  0.30     2.637  0.064 .         ..        
  36 HD#   36 HN    4.00  2.20  1.00     4.132  0.301                     
  36 HD#   48 HG2#  4.00  2.20  1.50     4.464  0.699           .         
  36 HE#   48 HG2#  4.00  2.20  1.50     4.314  0.883             .       
  36 HG#   36 HN    4.00  2.20  1.00     2.952  0.752                     
  36 HG#   37 HN    4.00  2.20  1.00     4.323  0.230                     
  36 HN    37 HA    4.00  2.20  1.00     5.203  0.027 :|::||||||:|:||:|||:
  36 HN    37 HN    2.40  0.60  0.30     2.637  0.060       .    .        
  36 HN    48 HG2#  4.00  2.20  1.50     5.055  0.229                     
  37 HA    37 HB#   2.40  0.60  0.30     2.691  0.056 ..  .  . ... .  .   
  37 HA    37 HD#   4.00  2.20  1.00     4.384  0.491                     
  37 HA    37 HG#   3.00  1.20  0.30     2.839  0.212              .      
  37 HA    37 HN    2.40  0.60  0.50     2.729  0.030                     
  37 HA    38 HN    4.00  2.20  1.00     3.442  0.046                     
  37 HA    39 HN    4.00  2.20  1.00     4.754  0.122                    .
  37 HA    40 HB2   3.00  1.20  0.30     3.027  0.197   .                .
  37 HA    40 HD*   4.00  2.20  1.50     4.146  0.570                    .
  37 HA    40 HN    4.00  2.20  1.00     3.991  0.181                     
  37 HB#   37 HN    2.40  0.60  0.30     2.510  0.156     .  .  .. .      
  37 HB#   38 HN    2.40  0.60  0.30     2.606  0.146  ...    ..  ..     .
  37 HD#   37 HE#   2.40  0.60  0.30     2.571  0.062                     
  37 HD#   37 HN    4.00  2.20  1.00     4.446  0.697       : .      . .  
  37 HE#   37 HG#   4.00  2.20  1.00     3.085  0.333                     
  37 HG#   37 HN    4.00  2.20  1.00     3.805  0.917                     
  37 HN    38 HG2#  4.00  2.20  1.50     5.314  0.108         .           
  37 HN    38 HN    2.40  0.60  0.30     2.787  0.024 ::....:..:....:.:::.
  37 HN    39 HN    4.00  2.20  1.00     4.311  0.092                     
  38 HA    38 HB    3.00  1.20  0.30     3.046  0.020                     
  38 HA    38 HG1#  3.00  1.20  0.80     2.925  0.058                     
  38 HA    38 HG2#  2.40  0.60  0.80     3.045  0.105                     
  38 HA    38 HN    2.40  0.60  0.50     2.906  0.027  ........    .. .. .
  38 HA    39 HN    4.00  2.20  1.00     3.460  0.037                     
  38 HA    41 HB#   4.00  2.20  1.00     2.984  0.380                     
  38 HA    41 HN    3.00  1.20  0.30     3.353  0.047 . :..........:......
  38 HB    38 HN    2.40  0.60  0.30     2.616  0.071 .     .      .      
  38 HB    39 HN    3.00  1.20  0.30     2.188  0.131                     
  38 HG1#  38 HN    4.00  2.20  1.50     4.668  0.050                     
  38 HG1#  39 HA    3.00  1.20  0.80     3.709  0.088    .   .      .  .  
  38 HG1#  39 HG1#  4.00  2.20  1.50     4.425  0.232                     
  38 HG1#  39 HN    3.00  1.20  0.80     3.777  0.056 ..   ....     .. .  
  38 HG1#  42 HB#   4.00  2.20  1.50     4.890  0.462            .  .     
  38 HG1#  42 HN    4.00  2.20  1.50     4.927  0.261                     
  38 HG2#  38 HN    2.40  0.60  0.80     2.717  0.100                     
  38 HG2#  39 HN    4.00  2.20  1.50     4.374  0.121                     
  38 HN    39 HN    2.40  0.60  0.30     2.711  0.044 .. ..... ..... .. . 
  39 HA    39 HB    4.00  2.20  1.00     3.053  0.013                     
  39 HA    39 HD#   4.00  2.20  1.50     4.431  0.081                     
  39 HA    39 HG1#  3.00  1.20  0.30     2.515  0.071                     
  39 HA    39 HG2#  2.40  0.60  0.80     2.863  0.099                     
  39 HA    39 HN    2.40  0.60  0.50     2.808  0.018                     
  39 HA    40 HN    4.00  2.20  1.00     3.504  0.047                     
  39 HA    42 HN    4.00  2.20  1.00     3.419  0.149                     
  39 HA    43 HN    4.00  2.20  1.00     3.857  0.194                     
  39 HB    39 HD#   3.00  1.20  0.80     2.957  0.069                     
  39 HB    39 HG1#  4.00  2.20  1.00     2.666  0.042                     
  39 HB    39 HN    2.40  0.60  0.30     2.422  0.064                     
  39 HB    40 HN    3.00  1.20  0.30     2.389  0.077                     
  39 HD#   39 HG1#  2.40  0.60  0.80     2.552  0.024                     
  39 HD#   39 HG2#  2.40  0.60  0.80     2.558  0.062                     
  39 HD#   39 HN    4.00  2.20  1.50     4.231  0.108                     
  39 HD#   48 HD#   2.40  0.60  0.80     3.055  0.238     . . ..    ... . 
  39 HD#   66 HG1#  3.00  1.20  0.80     2.635  0.117                     
  39 HD#   66 HG2#  2.40  0.60  0.80     3.458  0.038 ||+|||||||||||::|+||
  39 HG1#  39 HG2#  4.00  2.20  1.50     2.923  0.079                     
  39 HG1#  39 HN    3.00  1.20  0.30     2.259  0.078                     
  39 HG2#  39 HN    4.00  2.20  1.50     4.404  0.057                     
  39 HG2#  40 HA    4.00  2.20  1.50     4.156  0.152                     
  39 HG2#  40 HD*   4.00  2.20  1.50     5.296  0.476    ..:...  . .  ... 
  39 HG2#  40 HG    4.00  2.20  1.50     4.280  0.550                     
  39 HG2#  40 HN    3.00  1.20  0.80     3.874  0.053 :.:.. : .:..:::.. ..
  39 HG2#  42 HB#   4.00  2.20  1.50     4.759  0.249                     
  39 HG2#  43 HN    4.00  2.20  1.50     4.276  0.265                     
  39 HG2#  46 HB#   2.40  0.60  0.80     3.188  0.169 .:..... ..:  .. . :.
  39 HG2#  46 HN    4.00  2.20  1.50     5.416  0.160 .....   ..      . ..
  39 HG2#  48 HD#   2.40  0.60  0.80     2.460  0.072                     
  39 HG2#  48 HG1#  3.00  1.20  0.80     3.916  0.056 .:.:.:.::..|:.::.|.:
  39 HG2#  66 HG1#  2.40  0.60  0.80     3.381  0.059 |||||::.|||::||.::::
  39 HG2#  66 HG2#  2.40  0.60  0.80     2.389  0.034                     
  39 HN    40 HN    2.40  0.60  0.30     2.773  0.024 ...:...:............
  39 HN    41 HN    4.00  2.20  1.00     3.901  0.142                     
  40 HA    40 HB1   3.00  1.20  0.30     2.588  0.074                     
  40 HA    40 HB2   3.00  1.20  0.30     3.057  0.015                     
  40 HA    40 HD*   4.00  2.20  1.50     2.867  0.426                     
  40 HA    40 HG    3.00  1.20  0.30     2.789  0.429   .      .         .
  40 HA    40 HN    2.40  0.60  0.50     2.823  0.029                     
  40 HA    43 HN    3.00  1.20  0.30     3.291  0.091 . ....   .. ......  
  40 HA    46 HB#   4.00  2.20  1.50     3.535  0.416                     
  40 HB1   40 HD*   4.00  2.20  1.50     2.878  0.031                     
  40 HB1   40 HN    3.00  1.20  0.30     3.427  0.041 ::|::.:..::.::.::..:
  40 HB2   40 HD*   3.00  1.20  0.80     3.095  0.098                     
  40 HB2   40 HG    4.00  2.20  1.00     2.598  0.160                     
  40 HB2   40 HN    2.40  0.60  0.30     2.238  0.143                     
  40 HB2   41 HN    4.00  2.20  1.00     2.924  0.206                     
  40 HD*   40 HG    2.40  0.60  0.80     2.559  0.019                     
  40 HD*   40 HN    4.00  2.20  1.50     3.796  0.430                     
  40 HD*   46 HB#   4.00  2.20  1.50     3.448  0.631                .    
  40 HD*   48 HD#   3.00  1.20  0.80     3.756  0.201 ..  . .... .... ....
  40 HG    40 HN    2.40  0.60  0.30     2.326  0.270    : . .    :       
  40 HN    41 HN    2.40  0.60  0.30     2.715  0.073 . :.. . ..........  
  40 HN    42 HN    4.00  2.20  1.00     4.123  0.185                     
  41 HA    41 HB#   2.40  0.60  0.30     2.702  0.049 .... . . .. .  .. ..
  41 HA    41 HG#   4.00  2.20  1.00     2.957  0.267                     
  41 HA    41 HN    2.40  0.60  0.50     2.894  0.028   ..    .  ....  . .
  41 HA    42 HN    3.00  1.20  0.30     3.360  0.026 ......:.............
  41 HB#   41 HE2#  4.00  2.20  1.00     3.638  0.741                     
  41 HB#   41 HG#   4.00  2.20  1.00     2.645  0.050                     
  41 HB#   41 HN    2.40  0.60  0.50     2.606  0.156              .      
  41 HB#   42 HN    4.00  2.20  1.00     2.996  0.324                     
  41 HG#   41 HN    4.00  2.20  1.00     4.144  0.781                     
  41 HN    42 HN    2.40  0.60  0.30     2.473  0.141                     
  41 HN    43 HN    4.00  2.20  1.00     4.290  0.167                     
  42 HA    42 HB#   2.40  0.60  0.30     2.697  0.028 ..  ...  . .  ....  
  42 HA    42 HN    3.00  1.20  0.30     2.940  0.039                     
  42 HB#   42 HN    2.40  0.60  0.30     2.582  0.114     . .  .  .       
  42 HB#   43 HN    3.00  1.20  0.30     2.648  0.273                +    
  42 HN    43 HN    2.40  0.60  0.30     2.607  0.110 . .   .  .     .    
  43 HA    43 HB#   4.00  2.20  1.00     2.719  0.072                     
  43 HA    43 HD#   4.00  2.20  1.00     3.704  0.911                     
  43 HA    44 HD#   3.00  1.20  0.30     2.364  0.104                     
  43 HB#   43 HN    4.00  2.20  1.00     2.759  0.104                     
  43 HD#   43 HE#   4.00  2.20  1.00     2.579  0.053                     
  43 HE#   82 HG1#  3.00  1.20  0.80     3.244  0.521        ..   .  @   .
  43 HE#   82 HG2#  4.00  2.20  1.50     3.671  0.673                     
  43 HG#   43 HN    4.00  2.20  1.00     4.597  0.124                     
  43 HN    44 HD#   4.00  2.20  1.00     3.574  0.290                     
  44 HA    44 HB#   2.40  0.60  0.30     2.587  0.046                     
  44 HA    44 HD#   4.00  2.20  1.00     3.342  0.237                     
  44 HA    44 HG#   3.00  1.20  0.30     2.934  0.212                :.   
  44 HB#   44 HD#   4.00  2.20  1.00     3.596  0.154                     
  44 HB#   45 HN    4.00  2.20  1.00     2.814  0.206                     
  44 HD#   44 HG#   2.40  0.60  0.30     2.525  0.018                     
  44 HD#   45 HN    4.00  2.20  1.00     4.240  0.562                     
  45 HA    45 HB#   2.40  0.60  0.30     2.480  0.114                     
  45 HA    45 HG#   4.00  2.20  1.00     3.659  0.505                     
  45 HA    45 HN    2.40  0.60  0.50     2.885  0.031 . .  .   .  .  .. . 
  45 HA    46 HN    3.00  1.20  0.30     3.284  0.075 .  . ...   . . ... .
  45 HB#   45 HG#   2.40  0.60  0.30     2.580  0.076                     
  45 HB#   45 HN    2.40  0.60  0.30     2.795  0.044 :::.:...:::.:::.....
  45 HB#   46 HN    4.00  2.20  1.00     3.986  0.614                     
  45 HG#   45 HN    3.00  1.20  0.30     2.433  0.434      .            : 
  45 HN    46 HB#   4.00  2.20  1.50     5.115  0.259  .                  
  45 HN    46 HN    3.00  1.20  0.30     2.718  0.192                     
  46 HA    46 HN    2.40  0.60  0.50     2.786  0.063           .         
  46 HA    47 HN    2.40  0.60  0.50     2.299  0.122                     
  46 HB#   46 HN    2.40  0.60  0.80     2.623  0.073                     
  46 HB#   47 HN    4.00  2.20  1.50     4.363  0.139                     
  46 HB#   48 HD#   4.00  2.20  1.50     2.989  0.551                     
  46 HB#   48 HN    4.00  2.20  1.50     4.512  0.432             .  .    
  46 HN    47 HN    4.00  2.20  1.00     4.287  0.168                     
  47 HA    47 HB#   3.00  1.20  0.30     2.711  0.089                     
  47 HA    47 HN    3.00  1.20  0.30     2.945  0.024                     
  47 HA    48 HN    2.40  0.60  0.30     2.295  0.096                     
  47 HB#   47 HN    4.00  2.20  1.00     2.671  0.202                     
  47 HG#   47 HN    4.00  2.20  1.00     3.732  1.052                     
  47 HN    48 HN    4.00  2.20  1.00     3.788  0.283                     
  47 HN    65 HA    3.00  1.20  0.30     3.008  0.359  .   . .   :        
  47 HN    66 HN    4.00  2.20  1.00     4.597  0.443  . .. .             
  48 HA    48 HB    2.40  0.60  0.30     2.866  0.011 ::::::::::::::::::::
  48 HA    48 HG1#  4.00  2.20  1.00     2.619  0.134                     
  48 HA    48 HG2#  2.40  0.60  0.80     2.919  0.093                     
  48 HA    48 HN    3.00  1.20  0.30     2.894  0.035                     
  48 HA    49 HN    2.40  0.60  0.30     2.060  0.079                     
  48 HB    48 HD#   2.40  0.60  0.80     2.842  0.142                     
  48 HB    48 HG1#  4.00  2.20  1.00     2.743  0.076                     
  48 HB    48 HN    2.40  0.60  0.30     2.294  0.099                     
  48 HD#   48 HG1#  2.40  0.60  0.80     2.465  0.026                     
  48 HD#   66 HA    4.00  2.20  1.50     5.630  0.040 :::::::.:|::.:..:::.
  48 HG1#  48 HG2#  3.00  1.20  0.80     3.091  0.173                     
  48 HG1#  48 HN    4.00  2.20  1.00     2.693  0.374                     
  48 HG2#  48 HN    4.00  2.20  1.50     4.546  0.061                     
  48 HG2#  49 HN    3.00  1.20  0.80     2.893  0.305                     
  48 HG2#  50 HA    4.00  2.20  1.50     5.019  0.308              .      
  48 HG2#  50 HN    4.00  2.20  1.50     5.353  0.298  :...     .  .. ..  
  49 HA    49 HB    2.40  0.60  0.30     2.871  0.029 :::::::|::::::::::::
  49 HA    49 HD#   3.00  1.20  0.80     2.804  0.383                     
  49 HA    49 HG1#  4.00  2.20  1.00     2.954  0.356                     
  49 HA    49 HG2#  2.40  0.60  0.80     3.136  0.151  .:   : .. . .: . ..
  49 HA    49 HN    3.00  1.20  0.30     2.989  0.017                     
  49 HA    50 HG*   4.00  2.20  1.50     4.893  0.310                     
  49 HA    50 HN    2.40  0.60  0.30     2.295  0.164                    .
  49 HB    49 HD#   3.00  1.20  0.80     3.293  0.468 .  ..     . .  . . .
  49 HB    49 HG1#  4.00  2.20  1.00     2.601  0.138                     
  49 HB    49 HN    3.00  1.20  0.30     2.378  0.101                     
  49 HD#   49 HG1#  2.40  0.60  0.80     2.596  0.012                     
  49 HD#   49 HN    4.00  2.20  1.50     3.896  0.517                     
  49 HD#   50 HN    4.00  2.20  1.50     4.819  0.511        . .          
  49 HD#   65 HD#   4.00  2.20  1.50     4.415  0.809                     
  49 HG1#  49 HG2#  4.00  2.20  1.50     2.880  0.143                     
  49 HG1#  49 HN    4.00  2.20  1.00     3.913  0.711                     
  49 HN    67 HA    4.00  2.20  1.00     4.199  0.676  .            .  . .
  49 HN    68 HN    4.00  2.20  1.00     4.371  0.405             .       
  50 HA    50 HG*   2.40  0.60  0.80     3.152  0.083   . ..  . .. .  .  .
  50 HA    50 HN    3.00  1.20  0.30     2.957  0.019                     
  50 HA    51 HN    2.40  0.60  0.30     2.153  0.053                     
  50 HA    68 HN    4.00  2.20  1.00     4.136  0.798  .          . . .: .
  50 HB    50 HG*   2.40  0.60  0.80     2.606  0.014                     
  50 HB    50 HN    2.40  0.60  0.30     2.729  0.050 . . ... ..:.... . .:
  50 HB    51 HN    4.00  2.20  1.00     4.187  0.154                     
  50 HG*   50 HN    2.40  0.60  0.80     2.636  0.179                     
  51 HA    51 HB#   4.00  2.20  1.00     2.777  0.096                     
  51 HA    51 HD*   4.00  2.20  1.50     3.408  0.570                     
  51 HA    51 HN    3.00  1.20  0.30     2.976  0.011                     
  51 HA    52 HD#   2.40  0.60  0.30     2.322  0.083                     
  51 HB#   51 HD*   4.00  2.20  1.50     2.938  0.113                     
  51 HB#   51 HN    4.00  2.20  1.00     2.823  0.154                     
  51 HB#   69 HD#   4.00  2.20  1.00     3.955  0.334                     
  51 HB#   69 HE#   4.00  2.20  1.00     2.951  0.339                     
  51 HD*   51 HG    2.40  0.60  0.80     2.615  0.037                     
  51 HD*   51 HN    4.00  2.20  1.50     4.641  0.689                     
  51 HD*   52 HD#   4.00  2.20  1.50     4.434  0.771     .               
  51 HD*   55 HA    4.00  2.20  1.50     5.650  0.229 :|||:||:|: :::||:|||
  51 HD*   55 HB    4.00  2.20  1.50     3.646  0.682           +         
  51 HD*   57 HG1#  4.00  2.20  1.50     3.670  1.155  .  .    .        . 
  51 HD*   65 HD#   4.00  2.20  1.50     5.530  0.120 ..::..:.: ..   .... 
  51 HD*   67 HB#   4.00  2.20  1.50     4.970  1.017 .  .... :.. .   :  :
  51 HD*   67 HD#   4.00  2.20  1.50     3.817  1.215   .        . .   .  
  51 HD*   67 HE    4.00  2.20  1.50     4.516  1.192   .   :.      :. .  
  51 HD*   67 HG#   4.00  2.20  1.50     3.729  0.855                     
  51 HD*   67 HH*   4.00  2.20  1.50     4.761  0.914 ..    .       .: :  
  51 HD*   69 HD#   4.00  2.20  1.50     5.276  0.422   . . .   . ..  .   
  51 HD*   69 HE#   4.00  2.20  1.50     3.363  0.353                     
  51 HD*   69 HZ    4.00  2.20  1.50     2.619  0.347                     
  51 HN    70 HG1#  3.00  1.20  0.80     3.736  0.180 . .  .  ....  . ... 
  51 HN    70 HG2#  4.00  2.20  1.50     3.757  0.266                     
  52 HA    52 HB#   4.00  2.20  1.00     2.520  0.041                     
  52 HA    53 HN    2.40  0.60  0.30     2.183  0.082                     
  52 HA    70 HN    3.00  1.20  0.30     3.214  0.113 ..   . .   .   . .  
  52 HB#   52 HD#   4.00  2.20  1.00     3.391  0.092                     
  52 HB#   52 HG#   4.00  2.20  1.00     2.590  0.017                     
  52 HB#   53 HN    4.00  2.20  1.00     3.771  0.099                     
  52 HD#   52 HG#   3.00  1.20  0.30     2.565  0.016                     
  53 HA    53 HB    2.40  0.60  0.30     2.826  0.096 : ::::::::: :::::.::
  53 HA    53 HG*   3.00  1.20  0.80     2.612  0.149                     
  53 HA    53 HN    2.40  0.60  0.50     2.721  0.040                     
  53 HA    54 HA#   4.00  2.20  1.00     4.315  0.037                     
  53 HA    54 HN    2.40  0.60  0.30     1.853  0.055                     
  53 HA    69 HA    4.00  2.20  1.00     3.616  0.282                     
  53 HA    69 HB1   2.40  0.60  0.30     2.580  0.128        .   .   . :  
  53 HA    69 HB2   4.00  2.20  1.00     4.295  0.163                     
  53 HA    69 HD#   3.00  1.20  0.30     2.083  0.259                     
  53 HA    69 HE#   4.00  2.20  1.00     3.805  0.171                     
  53 HB    53 HG*   2.40  0.60  0.80     2.647  0.029                     
  53 HB    53 HN    2.40  0.60  0.30     2.284  0.144                     
  53 HG*   53 HN    3.00  1.20  0.80     3.107  0.263                     
  53 HG*   54 HN    2.40  0.60  0.80     3.247  0.097 . .:..:.... ..::....
  53 HG*   69 HB1   2.40  0.60  0.80     2.586  0.175                     
  53 HG*   69 HD#   3.00  1.20  0.80     3.919  0.046 . .::.:.:::|:::::.::
  53 HG*   71 HN    4.00  2.20  1.50     5.487  0.068  .....  .  ..... ...
  53 HG*   77 HB#   4.00  2.20  1.50     3.144  0.189                     
  53 HN    69 HA    4.00  2.20  1.00     3.930  0.306                     
  53 HN    69 HB1   4.00  2.20  1.00     4.396  0.194                     
  53 HN    69 HD#   4.00  2.20  1.00     3.660  0.298                     
  53 HN    69 HE#   4.00  2.20  1.00     5.019  0.086  :.:. ...  :.:.  :. 
  53 HN    70 HG2#  4.00  2.20  1.50     4.094  0.350                     
  53 HN    70 HN    4.00  2.20  1.00     3.189  0.214                     
  53 HN    77 HB#   4.00  2.20  1.50     4.990  0.210                     
  54 HA#   54 HN    4.00  2.20  1.00     2.741  0.036                     
  54 HA#   55 HN    4.00  2.20  1.00     3.161  0.168                     
  54 HN    55 HN    3.00  1.20  0.30     2.902  0.113                     
  54 HN    69 HB1   3.00  1.20  0.30     3.481  0.040 |:||::::::|:::|.|:::
  54 HN    69 HB2   4.00  2.20  1.00     4.970  0.138 . .: .... .. .. ..  
  54 HN    69 HD#   3.00  1.20  0.30     3.203  0.226 . . .. ... .:      .
  55 HA    55 HG2#  2.40  0.60  0.80     2.780  0.169                    .
  55 HA    55 HN    2.40  0.60  0.50     2.759  0.047                     
  55 HA    56 HN    2.40  0.60  0.30     2.393  0.156                     
  55 HB    55 HN    3.00  1.20  0.30     2.321  0.434           :    |    
  55 HB    69 HE#   4.00  2.20  1.00     2.283  0.667                     
  55 HG2#  55 HN    3.00  1.20  0.80     3.911  0.315 ||||||||:: |||| ::::
  55 HG2#  69 HE#   3.00  1.20  0.80     3.902  0.226 ::::|.|.:| .:::||| .
  55 HN    56 HN    4.00  2.20  1.00     4.354  0.318                     
  55 HN    69 HE#   4.00  2.20  1.00     3.081  0.691           .         
  56 HA    56 HB    3.00  1.20  0.30     3.030  0.020                     
  56 HA    56 HD#   4.00  2.20  1.50     2.804  0.707                     
  56 HA    56 HG1#  4.00  2.20  1.00     3.110  0.286                     
  56 HA    56 HG2#  4.00  2.20  1.50     2.974  0.189                     
  56 HA    56 HN    3.00  1.20  0.50     2.853  0.071                     
  56 HA    57 HN    2.40  0.60  0.30     2.025  0.218           :         
  56 HB    56 HG1#  4.00  2.20  1.00     2.514  0.126                     
  56 HB    56 HN    2.40  0.60  0.30     2.516  0.164       .         .   
  56 HB    57 HN    4.00  2.20  1.00     4.131  0.265                     
  56 HD#   56 HG1#  2.40  0.60  0.80     2.601  0.016                     
  56 HD#   56 HN    4.00  2.20  1.50     3.877  0.660                     
  56 HD#   57 HN    4.00  2.20  1.50     4.547  0.596   .         ..:     
  56 HG1#  56 HN    3.00  1.20  0.30     2.547  0.391           .  ..     
  56 HG1#  57 HN    4.00  2.20  1.00     4.906  0.318  : .....:  .   .:...
  56 HG2#  56 HN    4.00  2.20  1.50     4.571  0.132                     
  56 HG2#  57 HN    3.00  1.20  0.80     3.434  0.479  .   ..   ::        
  56 HN    57 HN    4.00  2.20  1.00     4.207  0.505                     
  57 HA    57 HB    2.40  0.60  0.30     2.640  0.148  .. :    :  ::   .: 
  57 HA    57 HG*   3.00  1.20  0.80     2.941  0.209                     
  57 HA    58 HN    3.00  1.20  0.30     3.020  0.469  :: :   .:  :: : :: 
  57 HB    57 HG*   2.40  0.60  0.80     2.583  0.047                     
  57 HB    57 HN    4.00  2.20  1.00     3.661  0.215                     
  57 HB    58 HN    2.40  0.60  0.30     2.132  0.307  ..                 
  57 HG*   57 HN    3.00  1.20  0.80     2.832  0.203                     
  57 HG1#  58 HN    4.00  2.20  1.50     4.375  0.261                     
  57 HG2#  58 HN    2.40  0.60  0.80     3.220  0.310 :  +:||| :::.:| | ..
  57 HG*   69 HZ    3.00  1.20  0.80     2.886  0.474                     
  57 HG2#  69 HD#   3.00  1.20  0.80     4.047  0.103 +:|+|||@:.+|::|++|:+
  57 HG2#  69 HE#   4.00  2.20  1.50     2.455  0.311                     
  57 HG2#  69 HZ    2.40  0.60  0.80     3.251  0.172 :. ::::..|.:....: :.
  58 HA    58 HB    2.40  0.60  0.30     2.793  0.054  ::::..::: :::::::::
  58 HA    58 HG2#  2.40  0.60  0.80     2.502  0.172                     
  58 HA    58 HN    3.00  1.20  0.30     2.855  0.050                     
  58 HA    59 HN    3.00  1.20  0.30     2.160  0.268                     
  58 HB    58 HN    2.40  0.60  0.30     2.926  0.054 +|:||:|:||+:||:::||:
  58 HG2#  58 HN    4.00  2.20  1.50     3.960  0.332                     
  58 HG2#  59 HN    3.00  1.20  0.80     3.693  0.418 .+. | . ::. :|.. :+ 
  59 HA    59 HB#   3.00  1.20  0.30     2.727  0.048                     
  59 HA    59 HG#   3.00  1.20  0.30     2.926  0.225                     
  59 HA    59 HN    2.40  0.60  0.50     2.958  0.028 ....:.............. 
  59 HA    60 HN    2.40  0.60  0.30     2.810  0.200 . |:|   +:+ :| +.+.:
  59 HB#   59 HG#   4.00  2.20  1.00     2.602  0.052                     
  59 HB#   59 HN    3.00  1.20  0.30     2.672  0.107                     
  59 HG#   59 HN    4.00  2.20  1.00     3.827  0.842                     
  60 HA    60 HB1   2.40  0.60  0.30     2.523  0.070                     
  60 HA    60 HB2   3.00  1.20  0.30     2.420  0.067                     
  60 HA    60 HG#   4.00  2.20  1.00     3.875  0.129                     
  60 HA    60 HN    2.40  0.60  0.50     2.884  0.036  ....   ..     . .  
  60 HA    61 HN    2.40  0.60  0.30     2.733  0.144  ....  ..:. :: : .:|
  60 HB1   60 HG#   2.40  0.60  0.30     2.626  0.099 .    ..    .. . ..  
  60 HB1   60 HN    2.40  0.60  0.30     2.416  0.177    .     .         .
  60 HB1   61 HN    4.00  2.20  1.00     3.705  0.240                     
  60 HB2   60 HG#   4.00  2.20  1.00     2.710  0.124                     
  60 HB2   60 HN    3.00  1.20  0.30     3.436  0.027 :::|:::::::::::::::.
  60 HB2   61 HN    3.00  1.20  0.30     2.371  0.376                    :
  60 HG#   60 HN    4.00  2.20  1.00     2.447  0.523                     
  60 HG#   61 HN    4.00  2.20  1.00     3.375  0.749                     
  61 HA    61 HB1   3.00  1.20  0.30     3.022  0.053                     
  61 HA    61 HB2   2.40  0.60  0.30     2.618  0.096      .     .    .  .
  61 HA    61 HD#   2.40  0.60  0.30     2.603  0.194    .... .  .    .:..
  61 HA    61 HE#   4.00  2.20  1.00     4.781  0.140                     
  61 HA    62 HN    2.40  0.60  0.30     2.314  0.175                     
  61 HB1   61 HD#   2.40  0.60  0.30     2.744  0.114 : . .:| .  :.. ::| :
  61 HB1   61 HE#   4.00  2.20  1.00     4.951  0.050           .   .     
  61 HB1   61 HN    3.00  1.20  0.30     2.947  0.216      .              
  61 HB2   61 HD#   2.40  0.60  0.30     2.699  0.090  ....  :... ....  . 
  61 HB2   61 HE#   4.00  2.20  1.00     4.937  0.040                 .   
  61 HB2   61 HN    3.00  1.20  0.30     2.859  0.232                     
  61 HD#   61 HN    4.00  2.20  1.00     4.831  0.094                .    
  61 HD#   62 HA    4.00  2.20  1.00     4.939  0.235 .|. .  ...: :...  : 
  61 HD#   62 HN    4.00  2.20  1.00     3.963  0.718               .     
  61 HD#   63 HA    4.00  2.20  1.00     4.011  0.594  .        .         
  61 HD#   63 HG1#  4.00  2.20  1.00     5.062  0.056 :....:........ ..:..
  61 HD#   63 HN    4.00  2.20  1.00     3.153  0.443                     
  61 HD#   83 HA#   3.00  1.20  0.30     3.187  0.291 .:  ... .::.  .. .. 
  61 HE#   63 HA    4.00  2.20  1.00     3.744  0.728                     
  61 HE#   63 HB    3.00  1.20  0.30     2.847  0.324   .|         .      
  61 HE#   63 HD#   3.00  1.20  0.80     2.925  0.518  :        .   .     
  61 HE#   63 HG1#  4.00  2.20  1.00     3.922  0.678    .                
  61 HE#   63 HG2#  4.00  2.20  1.50     5.054  0.666    . .          .. .
  61 HE#   63 HN    4.00  2.20  1.00     4.678  0.345   .        . . .    
  61 HE#   82 HG1#  4.00  2.20  1.50     4.340  0.954        :   .      . 
  61 HE#   83 HA#   4.00  2.20  1.00     3.788  0.787 .      .            
  61 HN    63 HN    4.00  2.20  1.00     5.087  0.067  ::::...:|:::.....::
  62 HA    62 HB#   4.00  2.20  1.00     2.778  0.141                     
  62 HA    62 HD#   3.00  1.20  0.30     2.772  0.411           +.:       
  62 HA    62 HG#   3.00  1.20  0.30     2.901  0.348 .. : .    .     .   
  62 HA    62 HN    3.00  1.20  0.30     2.973  0.030                     
  62 HA    63 HA    4.00  2.20  1.00     4.506  0.144                     
  62 HA    63 HB    4.00  2.20  1.00     4.564  0.225                     
  62 HA    63 HN    2.40  0.60  0.30     2.228  0.166                     
  62 HA    65 HN    4.00  2.20  1.00     4.655  0.302       ..  ..  .     
  62 HB#   62 HD#   4.00  2.20  1.00     3.205  0.394                     
  62 HB#   62 HE    4.00  2.20  1.00     3.621  1.010                     
  62 HB#   62 HG#   3.00  1.20  0.30     2.555  0.041                     
  62 HB#   62 HH*   4.00  2.20  1.00     4.584  0.623 .  ..     .  .   .  
  62 HB#   62 HN    4.00  2.20  1.00     2.692  0.265                     
  62 HD#   62 HE    2.40  0.60  0.30     2.685  0.086 .  : .. .. .   .: : 
  62 HD#   62 HG#   3.00  1.20  0.30     2.599  0.063                     
  62 HD#   62 HH*   3.00  1.20  0.30     3.082  0.262   . . .  .. ..      
  62 HD#   63 HN    4.00  2.20  1.00     4.661  0.296    .         . .  . 
  62 HE    62 HG#   4.00  2.20  1.00     3.079  0.455                     
  62 HE    62 HH*   3.00  1.20  0.30     2.740  0.152                     
  62 HE    62 HN    4.00  2.20  1.00     3.908  0.979        .         .  
  62 HG#   62 HH*   4.00  2.20  1.00     3.708  0.606                     
  62 HG#   62 HN    4.00  2.20  1.00     3.725  0.918                     
  62 HG#   63 HN    4.00  2.20  1.00     4.927  0.162 ..   .   ....  .. ..
  63 HA    63 HB    2.40  0.60  0.30     2.502  0.104                     
  63 HA    63 HD#   4.00  2.20  1.50     2.860  0.677                     
  63 HA    63 HG1#  3.00  1.20  0.30     3.278  0.266 : : :.:.:: :.: :....
  63 HA    63 HG2#  3.00  1.20  0.80     3.856  0.020 ... ................
  63 HA    63 HN    2.40  0.60  0.50     2.804  0.066    .           . .  
  63 HA    64 HN    3.00  1.20  0.30     3.228  0.199  .... .   .....    .
  63 HA    65 HB#   4.00  2.20  1.00     5.181  0.053 ::::|:||:|:::::+:::|
  63 HA    65 HN    4.00  2.20  1.00     3.125  0.121                     
  63 HA    82 HG1#  2.40  0.60  0.80     2.406  0.210                     
  63 HA    82 HG2#  4.00  2.20  1.50     5.466  0.124    : .. .. .:  . . .
  63 HA    83 HA#   3.00  1.20  0.30     3.133  0.278 .  :.    .   .:     
  63 HB    63 HD#   4.00  2.20  1.50     3.051  0.286                     
  63 HB    63 HG1#  3.00  1.20  0.30     2.585  0.079                     
  63 HB    63 HN    2.40  0.60  0.30     2.360  0.148                     
  63 HD#   63 HG1#  3.00  1.20  0.80     2.579  0.027                     
  63 HD#   63 HN    4.00  2.20  1.50     4.913  0.171                     
  63 HD#   64 HN    4.00  2.20  1.50     5.238  0.404      . .            
  63 HD#   65 HN    4.00  2.20  1.50     5.372  0.229  ..:.  .  .   :.    
  63 HG1#  63 HG2#  4.00  2.20  1.50     2.881  0.323                     
  63 HG1#  63 HN    4.00  2.20  1.00     4.441  0.078                     
  63 HG2#  63 HN    2.40  0.60  0.80     2.369  0.174                     
  63 HG2#  64 HN    3.00  1.20  0.80     3.087  0.444        .       :    
  64 HA    64 HB#   3.00  1.20  0.30     2.530  0.017                     
  64 HA    64 HN    2.40  0.60  0.50     2.893  0.044   .  ..... ... .. . 
  64 HA    65 HN    3.00  1.20  0.30     3.247  0.087 ..     . ..    .   .
  64 HB#   64 HN    3.00  1.20  0.30     2.860  0.134                     
  64 HN    65 HB#   4.00  2.20  1.00     4.157  0.289                     
  64 HN    65 HN    2.40  0.60  0.30     2.450  0.211 .            ..  .. 
  65 HA    65 HB#   4.00  2.20  1.00     2.581  0.120                     
  65 HA    65 HD#   4.00  2.20  1.00     4.574  0.521    .                
  65 HA    65 HG#   3.00  1.20  0.30     2.910  0.274            .        
  65 HA    65 HN    2.40  0.60  0.50     2.940  0.015 ....................
  65 HA    66 HB    4.00  2.20  1.00     4.933  0.131       ... .. .    ..
  65 HA    66 HN    3.00  1.20  0.30     2.318  0.090                     
  65 HB#   65 HD#   4.00  2.20  1.00     3.200  0.161                     
  65 HB#   65 HE    3.00  1.20  0.30     2.480  0.378                     
  65 HB#   65 HG#   4.00  2.20  1.00     2.698  0.040                     
  65 HB#   65 HN    3.00  1.20  0.30     2.534  0.158                     
  65 HD#   65 HE    3.00  1.20  0.30     2.719  0.081                     
  65 HD#   65 HG#   3.00  1.20  0.30     2.544  0.038                     
  65 HE    65 HG#   4.00  2.20  1.00     3.299  0.409                     
  65 HE    65 HH*   4.00  2.20  1.00     2.820  0.209                     
  65 HE    65 HN    4.00  2.20  1.00     4.486  0.398  ..       ..        
  65 HG#   65 HN    4.00  2.20  1.00     4.463  0.194                     
  65 HG#   66 HN    4.00  2.20  1.00     3.139  0.590                     
  66 HA    66 HB    4.00  2.20  1.00     3.024  0.041                     
  66 HA    66 HG1#  3.00  1.20  0.80     2.737  0.103                     
  66 HA    66 HG2#  2.40  0.60  0.80     2.848  0.181                    .
  66 HA    66 HN    3.00  1.20  0.30     2.972  0.033                     
  66 HA    67 HN    3.00  1.20  0.30     2.212  0.157                     
  66 HB    66 HN    2.40  0.60  0.30     2.743  0.025 ............ .......
  66 HG1#  66 HN    4.00  2.20  1.50     4.686  0.098                     
  66 HG1#  67 HN    4.00  2.20  1.50     3.569  0.585                     
  66 HG1#  81 HN    4.00  2.20  1.50     3.075  0.375                     
  66 HG1#  82 HA    4.00  2.20  1.50     3.238  0.245                     
  66 HG1#  82 HG1#  4.00  2.20  1.50     5.608  0.062 .:.:...:..|:|::...::
  66 HG1#  82 HG2#  3.00  1.20  0.80     3.864  0.049 :.........: ......|.
  66 HG1#  82 HN    4.00  2.20  1.50     3.699  0.303                     
  66 HG2#  66 HN    4.00  2.20  1.50     3.029  0.271                     
  66 HG2#  67 HN    4.00  2.20  1.50     4.852  0.273                    .
  66 HG2#  81 HA    4.00  2.20  1.50     5.169  0.361       .   .    .   .
  66 HG2#  81 HN    4.00  2.20  1.50     5.671  0.095 ::::|:::::+:@::::.+:
  66 HG2#  82 HA    2.40  0.60  0.80     2.953  0.369  ... .  ..   ....   
  66 HG2#  82 HG1#  4.00  2.20  1.50     4.060  0.266                     
  66 HG2#  82 HG2#  2.40  0.60  0.80     2.691  0.156                     
  66 HG2#  82 HN    4.00  2.20  1.50     4.587  0.449                     
  66 HG2#  83 HN    4.00  2.20  1.50     5.127  0.308 :  .   .         :  
  66 HN    67 HN    4.00  2.20  1.00     4.181  0.336                     
  67 HA    67 HB#   4.00  2.20  1.00     2.688  0.190                     
  67 HA    67 HD#   4.00  2.20  1.00     3.612  1.030            .        
  67 HA    67 HG#   3.00  1.20  0.30     3.055  0.354   |    |  :|.|      
  67 HA    67 HN    3.00  1.20  0.30     2.924  0.075                     
  67 HA    68 HN    2.40  0.60  0.30     2.160  0.133                     
  67 HB#   67 HD#   4.00  2.20  1.00     3.221  0.349                     
  67 HB#   67 HG#   4.00  2.20  1.00     2.549  0.072                     
  67 HB#   67 HH*   4.00  2.20  1.00     4.177  0.678             .    .  
  67 HB#   67 HN    4.00  2.20  1.00     2.635  0.262                     
  67 HB#   69 HD#   4.00  2.20  1.00     4.449  0.677 :. .       ... .    
  67 HD#   67 HE    4.00  2.20  1.00     2.769  0.065                     
  67 HD#   67 HG#   4.00  2.20  1.00     2.566  0.063                     
  67 HD#   67 HH*   4.00  2.20  1.00     3.140  0.221                     
  67 HD#   69 HZ    4.00  2.20  1.00     4.715  0.432   .    ::    . . |  
  67 HE    67 HG#   4.00  2.20  1.00     3.066  0.343                     
  67 HE    67 HH*   4.00  2.20  1.00     2.810  0.194                     
  67 HG#   67 HN    4.00  2.20  1.00     4.012  0.980                     
  67 HG#   68 HN    4.00  2.20  1.00     3.893  0.564                     
  67 HG#   69 HD#   3.00  1.20  0.30     3.107  0.304  .  . . .. . :    : 
  68 HA    68 HB#   4.00  2.20  1.00     2.741  0.106                     
  68 HA    68 HD*   2.40  0.60  0.80     2.965  0.208    ..       . .  .  
  68 HA    68 HG    4.00  2.20  1.00     2.843  0.418                     
  68 HA    68 HN    3.00  1.20  0.30     2.950  0.033                     
  68 HA    69 HN    2.40  0.60  0.30     2.301  0.135                     
  68 HB#   68 HN    3.00  1.20  0.30     2.631  0.174                     
  68 HD*   68 HN    4.00  2.20  1.50     4.167  0.612                     
  68 HG    68 HN    4.00  2.20  1.00     3.510  0.881                     
  68 HN    70 HG1#  4.00  2.20  1.50     5.546  0.103 :... .. .:..  ..::.:
  69 HA    69 HB1   3.00  1.20  0.30     2.780  0.036                     
  69 HA    69 HB2   3.00  1.20  0.30     3.114  0.033                     
  69 HA    69 HD#   3.00  1.20  0.30     2.424  0.173                     
  69 HA    69 HN    3.00  1.20  0.30     2.879  0.023                     
  69 HA    70 HG1#  4.00  2.20  1.50     4.226  0.163                     
  69 HA    70 HG2#  4.00  2.20  1.50     4.443  0.181                     
  69 HA    70 HN    2.40  0.60  0.30     1.817  0.039                     
  69 HB1   69 HD#   2.40  0.60  0.30     2.491  0.100                     
  69 HB1   69 HE#   4.00  2.20  1.00     4.665  0.051                     
  69 HB1   69 HN    4.00  2.20  1.00     3.596  0.074                     
  69 HB1   70 HN    4.00  2.20  1.00     3.915  0.110                     
  69 HB2   69 HD#   2.40  0.60  0.30     2.793  0.041 :|.:..::........::.:
  69 HB2   69 HE#   4.00  2.20  1.00     4.862  0.032                     
  69 HB2   69 HN    4.00  2.20  1.00     2.283  0.105                     
  69 HB2   70 HN    4.00  2.20  1.00     4.544  0.048                     
  69 HD#   69 HN    3.00  1.20  0.30     3.291  0.117 . ....... ..  ...  :
  69 HD#   70 HN    4.00  2.20  1.00     3.579  0.118                     
  69 HE#   69 HN    4.00  2.20  1.00     5.166  0.057 :|.:|::.:||.:::|:::|
  69 HE#   70 HN    4.00  2.20  1.00     5.198  0.039 ||:::::|:|:|:|||::||
  69 HN    70 HN    4.00  2.20  1.00     4.122  0.107                     
  70 HA    70 HB    2.40  0.60  0.30     2.399  0.027                     
  70 HA    70 HG1#  2.40  0.60  0.80     3.070  0.053              .      
  70 HA    70 HG2#  4.00  2.20  1.50     3.925  0.015                     
  70 HA    70 HN    3.00  1.20  0.30     3.036  0.016                     
  70 HA    71 HN    2.40  0.60  0.30     2.624  0.074 .  .          . .  .
  70 HA    74 HA    4.00  2.20  1.00     4.541  0.101                     
  70 HA    76 HA    2.40  0.60  0.30     2.283  0.108                     
  70 HA    76 HD#   4.00  2.20  1.50     5.534  0.030 . ..... .......... .
  70 HA    76 HG2#  4.00  2.20  1.50     4.646  0.115                     
  70 HA    77 HB#   2.40  0.60  0.80     3.022  0.142  .               .  
  70 HA    77 HN    2.40  0.60  0.30     2.363  0.125                     
  70 HB    70 HN    4.00  2.20  1.00     3.822  0.038                     
  70 HB    71 HN    2.40  0.60  0.30     2.416  0.119                     
  70 HB    74 HA    2.40  0.60  0.30     2.259  0.127                     
  70 HB    75 HN    4.00  2.20  1.00     3.114  0.148                     
  70 HG1#  70 HN    4.00  2.20  1.50     2.997  0.153                     
  70 HG1#  71 HN    4.00  2.20  1.50     4.704  0.109                     
  70 HG1#  74 HA    3.00  1.20  0.80     3.833  0.085 .. . :..... ..... :.
  70 HG1#  76 HA    3.00  1.20  0.80     3.653  0.137 .  .  .             
  70 HG1#  77 HN    4.00  2.20  1.50     4.909  0.109                     
  70 HG2#  70 HN    4.00  2.20  1.50     2.683  0.139                     
  70 HG2#  71 HN    4.00  2.20  1.50     3.688  0.169                     
  70 HG2#  74 HA    3.00  1.20  0.80     2.421  0.154                     
  71 HA    71 HB1   2.40  0.60  0.30     2.573  0.044                     
  71 HA    71 HB2   2.40  0.60  0.30     2.392  0.023                     
  71 HA    71 HN    2.40  0.60  0.50     2.963  0.009 ....................
  71 HA    72 HN    2.40  0.60  0.30     2.749  0.020 ....................
  71 HA    77 HB#   3.00  1.20  0.80     3.618  0.169   .  .  .    .    . 
  71 HB1   71 HN    4.00  2.20  1.00     2.520  0.087                     
  71 HB1   72 HN    2.40  0.60  0.30     3.006  0.021 +++|||+++|+|+|+|+|+|
  71 HB1   73 HN    4.00  2.20  1.00     3.985  0.057                     
  71 HB1   77 HB#   2.40  0.60  0.80     2.478  0.097                     
  71 HB2   71 HN    4.00  2.20  1.00     3.677  0.037                     
  71 HB2   72 HN    2.40  0.60  0.30     1.904  0.083                     
  71 HB2   73 HN    4.00  2.20  1.00     3.735  0.094                     
  71 HB2   77 HB#   3.00  1.20  0.80     3.857  0.034 ........:.........:.
  71 HN    72 HN    4.00  2.20  1.00     3.872  0.073                     
  71 HN    73 HN    4.00  2.20  1.00     3.661  0.127                     
  71 HN    74 HA    3.00  1.20  0.30     3.397  0.024 .:::.:.:...:...:.::.
  71 HN    74 HN    4.00  2.20  1.00     4.044  0.110                     
  71 HN    75 HN    2.40  0.60  0.30     2.551  0.079            .        
  71 HN    76 HA    4.00  2.20  1.00     4.051  0.138                     
  71 HN    77 HB#   3.00  1.20  0.80     3.306  0.212                     
  71 HN    77 HN    4.00  2.20  1.00     3.881  0.283                     
  72 HA    72 HB#   2.40  0.60  0.30     2.743  0.033 .. .:...............
  72 HA    72 HD#   4.00  2.20  1.00     3.758  0.958                     
  72 HA    72 HG#   4.00  2.20  1.00     3.010  0.213                     
  72 HA    72 HN    2.40  0.60  0.50     2.939  0.020 ....................
  72 HA    73 HN    2.40  0.60  0.30     2.953  0.059 |+||||:|:||+||++|+:|
  72 HB#   72 HG#   2.40  0.60  0.30     2.599  0.065                     
  72 HB#   72 HN    2.40  0.60  0.30     2.660  0.098  .   .. .. . . . ...
  72 HB#   73 HN    4.00  2.20  1.00     3.600  0.200                     
  72 HD#   72 HE#   2.40  0.60  0.30     2.599  0.046                     
  72 HG#   72 HN    4.00  2.20  1.00     3.620  0.872                     
  72 HN    73 HN    4.00  2.20  1.00     2.317  0.057                     
  73 HA    73 HB#   2.40  0.60  0.30     2.625  0.106   . .   ..  ..    ..
  73 HA    73 HD*   4.00  2.20  1.50     3.477  0.736                     
  73 HA    73 HN    3.00  1.20  0.30     2.986  0.010                     
  73 HB#   73 HG    2.40  0.60  0.30     2.640  0.056  .        ..   . .  
  73 HB#   73 HN    2.40  0.60  0.30     2.809  0.033 .:.:.:::..::..::::..
  73 HD*   73 HG    2.40  0.60  0.80     2.637  0.016                     
  73 HD*   73 HN    4.00  2.20  1.50     4.599  0.120                     
  73 HD*   75 HD2#  4.00  2.20  1.50     4.497  0.926                     
  73 HG    73 HN    2.40  0.60  0.30     2.792  0.034 :.:::.......::.::.:.
  73 HN    74 HN    2.40  0.60  0.30     2.534  0.157  .         .   . .  
  73 HN    75 HN    4.00  2.20  1.00     3.200  0.059                     
  74 HA    74 HB1   3.00  1.20  0.30     2.808  0.168                     
  74 HA    74 HB2   2.40  0.60  0.30     2.369  0.116         :           
  74 HA    74 HN    2.40  0.60  0.50     2.287  0.042                     
  74 HA    75 HN    3.00  1.20  0.30     2.883  0.113                     
  74 HB1   74 HN    4.00  2.20  1.00     2.682  0.199                     
  74 HB2   74 HN    3.00  1.20  0.30     3.413  0.063 ...:.:||:....:.::.|.
  75 HA    75 HB1   2.40  0.60  0.30     2.654  0.046  .    .   . .       
  75 HA    75 HB2   4.00  2.20  1.00     3.040  0.019                     
  75 HA    75 HN    3.00  1.20  0.30     2.965  0.014                     
  75 HA    76 HB    4.00  2.20  1.00     4.411  0.084                     
  75 HA    76 HD#   4.00  2.20  1.50     5.227  0.144                     
  75 HA    76 HG1#  4.00  2.20  1.00     3.416  0.118                     
  75 HA    76 HN    2.40  0.60  0.30     2.156  0.077                     
  75 HB1   75 HD2#  3.00  1.20  0.30     3.441  0.040 ::::::::.:::.:||:::.
  75 HB1   75 HN    4.00  2.20  1.00     3.613  0.044                     
  75 HB1   76 HN    3.00  1.20  0.30     3.063  0.183     .           ..  
  75 HB2   75 HD2#  3.00  1.20  0.30     2.840  0.271           ..  ..    
  75 HB2   75 HN    3.00  1.20  0.30     2.339  0.059                     
  75 HB2   76 HN    4.00  2.20  1.00     4.101  0.121                     
  75 HD2#  75 HN    4.00  2.20  1.00     3.548  0.203                     
  75 HN    76 HN    4.00  2.20  1.00     4.418  0.053                     
  76 HA    76 HB    4.00  2.20  1.00     2.960  0.012                     
  76 HA    76 HD#   3.00  1.20  0.80     3.981  0.050 :||::||:||:|:.::||.:
  76 HA    76 HG2#  2.40  0.60  0.80     2.756  0.103                     
  76 HA    76 HN    3.00  1.20  0.30     2.798  0.032                     
  76 HA    77 HB#   3.00  1.20  0.80     3.727  0.029                     
  76 HA    77 HN    2.40  0.60  0.30     1.752  0.026                     
  76 HA    78 HN    4.00  2.20  1.00     3.367  0.178                     
  76 HB    76 HD#   4.00  2.20  1.50     2.869  0.090                     
  76 HB    76 HG1#  4.00  2.20  1.00     2.662  0.070                     
  76 HB    76 HN    2.40  0.60  0.30     2.308  0.055                     
  76 HB    77 HN    4.00  2.20  1.00     4.159  0.029                     
  76 HD#   76 HG1#  2.40  0.60  0.80     2.429  0.021                     
  76 HD#   76 HG2#  2.40  0.60  0.80     3.046  0.090                     
  76 HD#   76 HN    3.00  1.20  0.80     3.885  0.065 . ..:.::....::::..::
  76 HD#   77 HN    4.00  2.20  1.50     5.511  0.057 :. .  .  . ....  ...
  76 HG1#  76 HG2#  4.00  2.20  1.50     3.227  0.142                     
  76 HG1#  76 HN    3.00  1.20  0.30     2.135  0.130                     
  76 HG1#  77 HB#   4.00  2.20  1.50     5.731  0.043 :||||:||:|:|+|:|:||:
  76 HG2#  76 HN    4.00  2.20  1.50     4.465  0.035                     
  76 HG2#  77 HN    3.00  1.20  0.80     3.285  0.240                     
  76 HG2#  78 HN    2.40  0.60  0.80     3.327  0.034 :.::::::::.:.:::::.:
  76 HN    77 HB#   4.00  2.20  1.50     5.579  0.046 .:...:..:.::. ..:..:
  76 HN    77 HN    4.00  2.20  1.00     4.095  0.176                     
  77 HA    77 HN    3.00  1.20  0.30     2.876  0.037                     
  77 HA    78 HN    3.00  1.20  0.30     3.420  0.023 ::::.::::::.:::::.::
  77 HB#   77 HN    2.40  0.60  0.80     2.197  0.059                     
  77 HB#   78 HN    2.40  0.60  0.80     2.841  0.132                     
  77 HN    78 HN    2.40  0.60  0.30     2.120  0.191                     
  78 HA    79 HN    2.40  0.60  0.30     2.482  0.185                     
  78 HB#   78 HN    4.00  2.20  1.00     2.712  0.083                     
  78 HG#   78 HN    4.00  2.20  1.00     4.259  0.547                     
  79 HA    79 HB    3.00  1.20  0.30     3.037  0.090                     
  79 HA    79 HG1#  2.40  0.60  0.80     2.926  0.164        :   :        
  79 HA    79 HG2#  2.40  0.60  0.80     2.579  0.156                     
  79 HA    79 HN    2.40  0.60  0.50     2.858  0.067 .    ..  .   ..  .  
  79 HA    80 HD#   3.00  1.20  0.30     2.277  0.545           + |     | 
  79 HB    79 HN    2.40  0.60  0.30     2.541  0.114                     
  79 HG1#  79 HN    4.00  2.20  1.50     4.575  0.170                     
  79 HG1#  80 HD#   2.40  0.60  0.80     2.817  0.268            ::     | 
  79 HG2#  79 HN    4.00  2.20  1.50     3.072  0.418                     
  79 HG2#  80 HD#   3.00  1.20  0.80     3.783  0.446 ::::::: :.: ::.::.|:
  80 HA    80 HB#   2.40  0.60  0.30     2.508  0.058                     
  80 HA    80 HG#   3.00  1.20  0.30     3.307  0.144 . .... |..|.  . .. .
  80 HA    81 HN    2.40  0.60  0.50     2.472  0.237           : .     : 
  81 HA    81 HB#   4.00  2.20  1.00     2.447  0.039                     
  81 HA    81 HD#   4.00  2.20  1.00     4.888  0.272      . ... . . ..   
  81 HA    81 HG#   3.00  1.20  0.30     3.491  0.067 |||::||.|||:||:||.|.
  81 HA    81 HN    3.00  1.20  0.30     2.899  0.067                     
  81 HA    82 HA    4.00  2.20  1.00     4.318  0.052                     
  81 HA    82 HG2#  4.00  2.20  1.50     4.353  0.268                     
  81 HA    82 HN    2.40  0.60  0.30     2.327  0.160                     
  81 HB#   81 HN    4.00  2.20  1.00     3.575  0.242                     
  81 HD#   81 HE    2.40  0.60  0.30     2.680  0.061 ...  ..     .  .  ..
  81 HD#   81 HG#   2.40  0.60  0.30     2.620  0.054       .             
  81 HG#   81 HN    4.00  2.20  1.00     2.905  0.519                     
  82 HA    82 HB    3.00  1.20  0.30     3.044  0.040                     
  82 HA    82 HG1#  2.40  0.60  0.80     2.641  0.109                     
  82 HA    82 HG2#  2.40  0.60  0.80     2.933  0.138                     
  82 HA    82 HN    3.00  1.20  0.30     2.917  0.040                     
  82 HA    83 HN    3.00  1.20  0.30     2.416  0.483        .   .        
  82 HB    82 HN    2.40  0.60  0.30     2.644  0.132  ... .. .   .  .... 
  82 HB    83 HA1   4.00  2.20  1.00     4.681  0.383    .  .   .  .     :
  82 HB    83 HN    4.00  2.20  1.00     3.443  0.877                     
  82 HG1#  82 HN    4.00  2.20  1.50     4.524  0.093                     
  82 HG1#  83 HA#   3.00  1.20  0.80     3.893  0.066 ...::..:. ::.:.|::.:
  82 HG1#  83 HN    3.00  1.20  0.80     2.859  0.449                     
  82 HG2#  82 HN    2.40  0.60  0.80     2.638  0.209                     
  82 HG2#  83 HN    4.00  2.20  1.50     4.598  0.344                     
  83 HA#   83 HN    3.00  1.20  0.30     2.657  0.075                     
  66 HA    83 HN    4.00  2.20  1.00     3.457  0.850            .     .  
  66 HA    82 HA    2.40  0.60  0.30     2.028  0.167                     
  49 HN    66 HN    4.00  2.20  1.00     4.161  0.602           ..        
  51 HN    70 HN    4.00  2.20  1.00     3.645  0.245                     
  47 HN    65 HA    4.00  2.20  1.00     3.008  0.359                     
  49 HN    67 HA    4.00  2.20  1.00     4.199  0.676  .            .  . .
  51 HN    69 HA    4.00  2.20  1.00     3.843  0.355                     




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