Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MREMD / ff_1l2y / outputs / 1L2Y_MREMD_GB022.stat

diff --git a/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB022.stat b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB022.stat
new file mode 100644 (file)
index 0000000..d52cc90
--- /dev/null
+++ b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB022.stat
@@ -0,0 +1,101 @@
+         0           0.00      34.684     113.174     147.858  12.87 0.000   NaN   NaN 4.850     314.670     360.000      15.552   22 
+     10000        2000.00      33.847       4.336      38.183   4.54 0.000 1.000 0.273 0.289     307.077     360.000       8.701   22 
+     20000        4000.00      34.108      16.528      50.636   4.56 0.000 1.000 0.364 0.770     309.445     360.000       8.662   22 
+     30000        6000.00      32.752       5.230      37.982   5.53 0.071 0.800 0.191 0.315     297.143     360.000       8.704   22 
+     40000        8000.00      35.475      16.498      51.973   7.54 0.071 0.000 0.182 0.304     321.852     360.000      11.148   22 
+     50000       10000.00      35.602      12.196      47.799   4.82 0.000 1.000 0.562 0.462     323.004     360.000       8.778   22 
+     60000       12000.00      29.750      -0.783      28.967   7.40 0.071 0.750 0.307 0.548     269.910     360.000       7.666   22 
+     70000       14000.00      50.831      -1.384      49.447   4.79 0.071 0.909 0.335 0.847     461.163     360.000       8.171   22 
+     80000       16000.00      27.800      16.314      44.114  10.58 0.000 1.000 0.159 0.360     252.218     360.000      13.628   22 
+     90000       18000.00      26.158      12.933      39.090   7.29 0.143 0.500 0.182 0.370     237.316     360.000       9.747   22 
+    100000       20000.00      35.146       5.110      40.256   6.09 0.214 0.250 0.182 0.216     318.861     360.000       9.481   22 
+    110000       22000.00      35.702       2.756      38.457   6.12 0.214 0.700 0.273 0.409     323.903     360.000       7.544   22 
+    120000       24000.00      32.859      -0.607      32.252   8.04 0.214 0.571 0.175 0.857     298.118     360.000      10.023   22 
+    130000       26000.00      48.747       1.621      50.368   6.42 0.143 0.500 0.205 0.516     442.260     360.000       9.807   22 
+    140000       28000.00      35.731       3.891      39.622   5.88 0.000 1.000 0.227 0.371     324.168     360.000       9.421   22 
+    150000       30000.00      47.043       1.592      48.635   6.87 0.143 0.778 0.177 1.154     426.797     360.000       8.104   22 
+    160000       32000.00      31.085      -9.288      21.796   6.49 0.071 0.900 0.314 0.403     282.015     360.000       6.967   22 
+    170000       34000.00      37.568      15.395      52.963   4.99 0.071 0.750 0.261 1.533     340.836     360.000       8.809   22 
+    180000       36000.00      39.974       7.271      47.245   7.43 0.000 1.000 0.318 0.586     362.662     360.000       9.200   22 
+    190000       38000.00      34.777      -4.437      30.340   6.58 0.071 0.833 0.189 0.291     315.516     360.000       8.124   22 
+    200000       40000.00      42.566       6.835      49.401   3.81 0.357 0.500 0.336 1.099     386.180     360.000       7.416   22 
+    210000       42000.00      31.685      15.099      46.784   6.86 0.000 1.000 0.500 0.430     287.458     360.000       7.245   22 
+    220000       44000.00      36.434      11.912      48.346   8.20 0.000 1.000 0.136 0.776     330.544     360.000      12.315   22 
+    230000       46000.00      35.055       2.226      37.281   4.83 0.143 0.750 0.227 0.823     318.040     360.000       8.002   22 
+    240000       48000.00      42.798      -6.537      36.261   4.83 0.214 0.786 0.377 0.359     388.282     360.000       7.046   22 
+    250000       50000.00      33.957      -4.315      29.642   5.27 0.214 0.700 0.355 0.243     308.077     360.000       7.090   22 
+    260000       52000.00      35.063       0.255      35.319   6.30 0.071 0.857 0.286 0.482     318.111     360.000       7.888   22 
+    270000       54000.00      37.206       5.920      43.125   6.35 0.143 0.750 0.250 0.758     337.550     360.000       7.765   22 
+    280000       56000.00      31.549       5.405      36.953   5.15 0.000 1.000 0.220 0.822     286.225     360.000       7.908   22 
+    290000       58000.00      32.828       2.287      35.114   6.87 0.143 0.778 0.278 0.563     297.829     360.000       7.623   22 
+    300000       60000.00      32.453       3.797      36.250   5.59 0.071 0.909 0.384 0.388     294.427     360.000       8.166   22 
+    310000       62000.00      35.465      15.794      51.258   5.57 0.000 1.000 0.379 0.934     321.753     360.000       8.434   22 
+    320000       64000.00      42.797       7.032      49.829   6.50 0.071 0.875 0.222 0.506     388.277     360.000       8.130   22 
+    330000       66000.00      43.618       4.576      48.193   6.42 0.071 0.833 0.197 0.505     395.721     360.000       9.538   22 
+    340000       68000.00      41.374       3.447      44.821  10.43 0.000 1.000 0.227 1.006     375.369     360.000      12.932   22 
+    350000       70000.00      42.019       6.546      48.564   5.34 0.071 0.667 0.273 0.600     381.214     360.000       8.915   22 
+    360000       72000.00      32.357       9.417      41.774   6.99 0.071 0.667 0.227 0.889     293.558     360.000       9.974   22 
+    370000       74000.00      40.621       7.600      48.221   3.90 0.071 0.800 0.218 1.455     368.532     360.000       8.001   22 
+    380000       76000.00      32.672      -2.662      30.010   5.56 0.000 1.000 0.351 0.457     296.421     360.000       8.496   22 
+    390000       78000.00      41.157       6.983      48.141   4.44 0.000 1.000 0.364 0.601     373.399     360.000       7.758   22 
+    400000       80000.00      38.858       2.594      41.453   7.31 0.143 0.667 0.152 0.791     352.544     360.000       8.634   22 
+    410000       82000.00      39.900       9.485      49.384   5.90 0.000 1.000 0.258 0.708     361.990     380.000       7.802   22 
+    420000       84000.00      34.184      -0.393      33.791   6.51 0.071 0.857 0.305 0.592     310.137     380.000       8.889   22 
+    430000       86000.00      40.509      11.943      52.452   7.39 0.143 0.750 0.330 0.696     367.521     380.000       8.189   22 
+    440000       88000.00      51.416      14.678      66.095   7.23 0.214 0.571 0.234 0.176     466.477     380.000       7.771   22 
+    450000       90000.00      37.007      11.764      48.771   5.34 0.143 0.667 0.341 0.896     335.747     380.000       8.352   22 
+    460000       92000.00      40.019       7.024      47.043   3.93 0.071 0.833 0.182 0.261     363.073     380.000       7.657   22 
+    470000       94000.00      28.986       8.961      37.947  11.84 0.000 1.000 0.159 0.759     262.976     380.000      14.703   22 
+    480000       96000.00      28.036      -1.553      26.483   3.97 0.286 0.667 0.288 0.474     254.361     380.000       6.848   22 
+    490000       98000.00      35.439       5.615      41.055   6.58 0.000 1.000 0.273 0.478     321.523     380.000       8.288   22 
+    500000      100000.00      41.694       5.388      47.083   5.73 0.071 0.857 0.331 0.760     378.274     380.000       7.799   22 
+    510000      102000.00      33.304      16.466      49.770   7.69 0.071 0.500 0.250 0.379     302.155     370.000      10.717   22 
+    520000      104000.00      39.032      12.208      51.241   6.49 0.071 0.667 0.333 0.605     354.120     370.000       8.803   22 
+    530000      106000.00      39.633       5.546      45.179   6.72 0.071 0.875 0.199 1.238     359.568     370.000       8.323   22 
+    540000      108000.00      36.896      13.649      50.545   5.51 0.000 1.000 0.250 1.140     334.736     370.000       8.304   22 
+    550000      110000.00      42.254       4.213      46.467   5.79 0.214 0.571 0.357 0.736     383.352     370.000       7.649   22 
+    560000      112000.00      40.758       3.589      44.347   4.39 0.071 0.875 0.352 0.450     369.777     370.000       7.792   22 
+    570000      114000.00      37.148       8.620      45.768   9.18 0.000 1.000 0.182 0.322     337.025     370.000      12.089   22 
+    580000      116000.00      37.502      10.522      48.025   6.77 0.143 0.333 0.303 0.143     340.242     370.000       8.198   22 
+    590000      118000.00      41.985       9.117      51.102   7.37 0.071 0.750 0.216 0.950     380.906     370.000      11.373   22 
+    600000      120000.00      36.144       6.285      42.429   5.40 0.214 0.500 0.197 0.317     327.922     370.000       8.833   22 
+    610000      122000.00      32.416      -1.200      31.215   6.62 0.143 0.750 0.182 0.215     294.093     350.000       8.747   22 
+    620000      124000.00      46.629      -2.753      43.876   5.49 0.071 0.800 0.427 0.268     423.038     350.000       7.691   22 
+    630000      126000.00      32.365      -1.663      30.703   6.04 0.071 0.889 0.460 0.452     293.636     350.000       7.946   22 
+    640000      128000.00      37.759       2.317      40.076   7.93 0.286 0.333 0.144 0.622     342.566     350.000      10.831   22 
+    650000      130000.00      37.888       0.818      38.706   4.67 0.143 0.714 0.279 0.572     343.737     350.000       8.063   22 
+    660000      132000.00      30.563       7.995      38.559   6.12 0.071 0.500 0.205 0.542     277.287     350.000       9.342   22 
+    670000      134000.00      37.702       7.964      45.665   4.90 0.000 1.000 0.432 0.715     342.049     350.000       8.543   22 
+    680000      136000.00      44.718     -10.618      34.100   5.62 0.143 0.800 0.323 0.396     405.703     350.000       7.318   22 
+    690000      138000.00      30.181       7.471      37.651   5.19 0.000 1.000 0.282 0.406     273.814     350.000       8.168   22 
+    700000      140000.00      33.655       4.640      38.295   6.21 0.000 1.000 0.280 0.352     305.333     350.000       8.430   22 
+    710000      142000.00      41.739       4.877      46.615   5.43 0.071 0.800 0.273 0.317     378.674     350.000       7.915   22 
+    720000      144000.00      43.262       5.991      49.254   5.83 0.071 0.833 0.205 1.144     392.499     350.000       8.924   22 
+    730000      146000.00      32.726      -0.033      32.693   4.41 0.286 0.667 0.277 0.402     296.910     350.000       6.724   22 
+    740000      148000.00      36.020      -2.637      33.383   7.11 0.143 0.750 0.284 1.046     326.793     350.000       7.427   22 
+    750000      150000.00      31.522     -11.443      20.078   5.24 0.286 0.692 0.353 0.963     285.981     350.000       7.177   22 
+    760000      152000.00      45.635      -6.474      39.160   5.40 0.071 0.889 0.369 0.396     414.021     350.000       7.259   22 
+    770000      154000.00      33.475      -4.195      29.281   4.50 0.214 0.667 0.303 0.545     303.706     350.000       7.779   22 
+    780000      156000.00      41.300       6.294      47.594   7.14 0.000 1.000 0.167 0.361     374.697     350.000      11.196   22 
+    790000      158000.00      29.905       5.784      35.688   7.17 0.071 0.833 0.386 0.454     271.309     350.000       8.107   22 
+    800000      160000.00      36.257      -2.219      34.038   6.47 0.071 0.889 0.343 0.625     328.947     350.000       7.238   22 
+    810000      162000.00      35.868       0.582      36.451   4.43 0.286 0.429 0.162 0.224     325.416     340.000       7.679   22 
+    820000      164000.00      24.313     -12.741      11.572   5.68 0.143 0.833 0.239 0.400     220.582     340.000       6.946   22 
+    830000      166000.00      38.822      -3.577      35.246   4.50 0.143 0.600 0.400 0.406     352.217     340.000       7.515   22 
+    840000      168000.00      30.115       9.362      39.477   6.82 0.143 0.714 0.175 0.715     273.219     340.000      10.993   22 
+    850000      170000.00      38.988     -10.022      28.966   5.80 0.143 0.867 0.309 0.181     353.716     340.000       6.870   22 
+    860000      172000.00      37.836       1.962      39.799   4.02 0.143 0.600 0.309 0.922     343.270     340.000       8.605   22 
+    870000      174000.00      42.308       7.925      50.233   6.60 0.071 0.500 0.182 0.673     383.844     340.000      10.283   22 
+    880000      176000.00      35.998      -7.885      28.113   4.58 0.143 0.800 0.318 0.696     326.597     340.000       6.840   22 
+    890000      178000.00      37.407      -0.264      37.143   6.09 0.214 0.400 0.227 0.981     339.377     340.000       9.793   22 
+    900000      180000.00      34.788      15.526      50.314   6.52 0.000   NaN   NaN 0.232     315.615     340.000       9.476   22 
+    910000      182000.00      44.178      25.428      69.605   8.09 0.000   NaN   NaN 0.144     400.802     400.000      11.043   22 
+    920000      184000.00      53.235       6.777      60.012   6.43 0.000 1.000 0.352 0.848     482.974     400.000       7.848   22 
+    930000      186000.00      38.252       8.008      46.260   5.52 0.000 1.000 0.500 1.053     347.038     400.000       8.175   22 
+    940000      188000.00      43.579      13.000      56.579   5.45 0.000 1.000 0.250 0.732     395.372     400.000       8.910   22 
+    950000      190000.00      46.845      13.980      60.825   6.29 0.000 1.000 0.682 0.920     425.000     400.000       9.665   22 
+    960000      192000.00      32.921      10.136      43.057   5.45 0.071 0.875 0.250 0.557     298.677     400.000       7.686   22 
+    970000      194000.00      41.071       8.061      49.132   5.93 0.000 1.000 0.303 0.379     372.613     400.000       8.624   22 
+    980000      196000.00      32.083      25.187      57.270   5.52 0.071 0.000 0.227 0.383     291.076     400.000       8.490   22 
+    990000      198000.00      39.771      19.525      59.296   3.64 0.071 0.750 0.455 0.947     360.822     400.000       8.446   22 
+   1000000      200000.00      46.974      14.708      61.681   7.37 0.143 0.333 0.182 0.368     426.171     400.000      10.798   22