cfd365fd1328c307ca2f6340e2be12a2bd52fa0d
[unres.git] / examples / unres / MD / ff_gab / ala10-cx_GB.stat
1          0           0.00      16.467       7.476      23.942       0.973     276.380     300.000       7.834    0 
2        100           9.10      16.328      -6.245      10.083       0.913     274.046     300.000       8.684    0 
3        200          18.15      17.606      -8.260       9.346       0.821     295.503     300.000       9.852    0 
4        300          26.60      17.633      -6.013      11.620       0.142     295.952     300.000      10.097    0 
5        400          35.80      17.943      -5.890      12.053       0.547     301.156     300.000       8.982    0 
6        500          41.98      17.384      -3.630      13.754       0.148     291.768     300.000       8.448    0 
7        600          51.58      16.187       0.569      16.756       0.677     271.688     300.000       8.613    0 
8        700          60.66      17.691      -1.921      15.770       0.842     296.932     300.000       8.910    0 
9        800          70.01      18.301      -5.865      12.435       0.260     307.162     300.000       8.917    0 
10        900          79.56      18.508      -1.201      17.307       0.632     310.645     300.000       9.128    0 
11       1000          84.98      18.836      -2.314      16.522       0.245     316.144     300.000       9.136    0 
12       1100          92.93      18.012      -6.747      11.265       0.190     302.321     300.000       8.645    0 
13       1200         101.65      17.092       2.645      19.737       0.478     286.872     300.000       8.006    0 
14       1300         107.20      17.207       1.125      18.333       0.826     288.813     300.000       8.018    0 
15       1400         115.95      18.648      -1.952      16.696       0.560     312.984     300.000       8.570    0 
16       1500         124.95      18.069      -5.726      12.344       0.688     303.281     300.000       8.805    0 
17       1600         134.15      18.394     -10.412       7.982       0.445     308.725     300.000       8.641    0 
18       1700         141.91      18.166      -3.630      14.535       0.090     304.894     300.000       8.413    0 
19       1800         150.16      19.083      -6.497      12.586       0.809     320.290     300.000       8.272    0 
20       1900         153.55      17.612      -4.945      12.667       0.131     295.609     300.000       8.493    0 
21       2000         162.95      17.590      -1.869      15.721       0.159     295.239     300.000       8.767    0 
22       2100         171.05      17.209      -4.409      12.800       0.139     288.838     300.000       8.718    0 
23       2200         179.70      17.507      -7.610       9.897       0.139     293.838     300.000       8.769    0 
24       2300         187.85      17.120      -0.502      16.618       0.805     287.345     300.000       8.905    0 
25       2400         196.75      18.459       1.456      19.915       0.944     309.821     300.000       8.602    0 
26       2500         206.05      17.708      -2.636      15.072       0.836     297.219     300.000       8.410    0 
27       2600         215.35      18.956      -5.931      13.025       0.549     318.155     300.000       8.925    0 
28       2700         224.00      18.119      -6.021      12.098       0.572     304.115     300.000       9.351    0 
29       2800         231.50      18.678       5.920      24.598       0.792     313.492     300.000       9.333    0 
30       2900         240.60      17.320      -7.378       9.942       0.671     290.707     300.000       8.713    0 
31       3000         249.95      16.503      -1.872      14.631       0.784     276.984     300.000       8.098    0 
32       3100         255.97      17.818       4.567      22.385       0.002     299.060     300.000       8.132    0 
33       3200         263.92      18.398      -0.332      18.065       0.065     308.791     300.000       8.193    0 
34       3300         268.34      17.860       0.247      18.107       0.000     299.766     300.000       8.187    0 
35       3400         274.73      16.831       4.505      21.336       0.980     282.495     300.000       8.188    0 
36       3500         281.48      18.149      -1.105      17.044       0.163     304.618     300.000       8.418    0 
37       3600         289.33      19.066      -3.115      15.951       0.952     320.001     300.000       8.999    0 
38       3700         296.88      17.911      -8.099       9.812       0.528     300.623     300.000       9.419    0 
39       3800         306.33      18.439      -5.739      12.700       0.147     309.490     300.000       9.724    0 
40       3900         311.62      17.844      -2.005      15.838       0.001     299.489     300.000       9.417    0 
41       4000         319.36      17.788      -5.589      12.198       0.203     298.552     300.000       8.808    0 
42       4100         324.15      18.296      -0.895      17.401       0.652     307.084     300.000       8.896    0 
43       4200         329.04      17.523      -9.432       8.091       0.192     294.109     300.000       9.160    0 
44       4300         338.04      17.089      -0.430      16.659       0.935     286.826     300.000       9.730    0 
45       4400         347.09      17.437     -12.280       5.157       0.463     292.670     300.000       9.568    0 
46       4500         355.30      17.828      -6.993      10.835       0.951     299.234     300.000       9.095    0 
47       4600         365.10      17.447       0.593      18.040       0.264     292.827     300.000       8.617    0 
48       4700         374.40      17.248      -0.425      16.823       0.568     289.501     300.000       7.937    0 
49       4800         383.65      18.354      -0.773      17.581       0.620     308.061     300.000       7.793    0 
50       4900         390.77      18.793      -0.973      17.820       0.927     315.424     300.000       7.717    0 
51       5000         399.02      18.096      -1.591      16.505       0.722     303.729     300.000       7.397    0 
52       5100         408.72      17.308       1.699      19.008       0.680     290.509     300.000       7.222    0 
53       5200         415.89      17.852       5.048      22.901       0.003     299.639     300.000       7.369    0 
54       5300         424.20      17.934       0.214      18.147       0.130     301.004     300.000       7.566    0 
55       5400         432.65      18.692      -8.277      10.415       0.613     313.728     300.000       7.941    0 
56       5500         437.18      17.852      -7.456      10.396       0.020     299.631     300.000       8.147    0 
57       5600         445.70      17.562      -4.347      13.215       0.486     294.762     300.000       8.254    0 
58       5700         454.90      17.618       1.864      19.482       0.146     295.699     300.000       8.213    0 
59       5800         462.75      17.470      -4.524      12.946       0.807     293.219     300.000       7.987    0 
60       5900         471.70      17.535      -2.686      14.848       0.180     294.302     300.000       7.699    0 
61       6000         476.15      17.393      -1.046      16.347       0.138     291.925     300.000       7.754    0 
62       6100         482.98      18.158       6.699      24.856       0.122     304.763     300.000       7.391    0 
63       6200         489.35      17.753      -2.463      15.290       0.224     297.970     300.000       7.555    0 
64       6300         495.52      17.873       4.396      22.269       0.000     299.981     300.000       7.701    0 
65       6400         496.99      18.261       2.555      20.816       0.889     306.491     300.000       7.655    0 
66       6500         505.31      19.109      -3.507      15.602       0.559     320.730     300.000       7.549    0 
67       6600         511.86      19.921      -2.615      17.306       0.831     334.362     300.000       7.473    0 
68       6700         516.50      17.836       1.609      19.445       0.009     299.365     300.000       7.515    0 
69       6800         525.13      17.551      -5.494      12.058       0.813     294.583     300.000       7.319    0 
70       6900         534.48      16.969      -3.074      13.895       0.850     284.805     300.000       7.009    0 
71       7000         540.87      16.846      -3.773      13.073       0.141     282.746     300.000       6.951    0 
72       7100         547.49      18.501      -4.184      14.317       0.132     310.525     300.000       6.688    0 
73       7200         554.64      17.291      -1.757      15.535       0.877     290.215     300.000       6.455    0 
74       7300         561.99      16.237      -3.244      12.993       0.979     272.518     300.000       6.148    0 
75       7400         569.18      17.372       3.789      21.160       0.150     291.570     300.000       6.037    0 
76       7500         576.36      17.692      -1.857      15.835       0.916     296.950     300.000       5.832    0 
77       7600         580.20      17.908       3.568      21.476       0.045     300.575     300.000       5.672    0 
78       7700         586.58      17.253      -1.713      15.541       0.645     289.584     300.000       5.324    0 
79       7800         595.28      18.636      -4.664      13.972       0.768     312.794     300.000       5.042    0 
80       7900         602.66      17.616      -5.709      11.906       0.735     295.667     300.000       4.857    0 
81       8000         612.06      17.814      -4.197      13.617       0.153     298.996     300.000       5.023    0 
82       8100         619.07      17.423      -8.016       9.407       0.207     292.435     300.000       4.999    0 
83       8200         626.27      18.598      -4.785      13.813       0.453     312.145     300.000       4.862    0 
84       8300         634.62      17.465      -9.443       8.022       0.139     293.132     300.000       5.005    0 
85       8400         643.17      17.222      -4.356      12.866       0.719     289.049     300.000       5.086    0 
86       8500         652.47      18.706      -6.319      12.388       0.500     313.972     300.000       5.489    0 
87       8600         658.22      17.874      -8.851       9.023       0.000     299.999     300.000       5.720    0 
88       8700         666.44      20.872       5.048      25.920       0.446     350.319     300.000       5.880    0 
89       8800         674.14      18.412      -7.266      11.146       0.495     309.036     300.000       6.265    0 
90       8900         682.42      17.086      -5.330      11.755       0.852     286.772     300.000       6.611    0 
91       9000         687.98      18.421     -12.007       6.414       0.809     309.182     300.000       6.336    0 
92       9100         695.08      18.351      -1.368      16.983       0.176     307.998     300.000       6.306    0 
93       9200         700.84      18.777      -3.479      15.297       0.125     315.151     300.000       6.316    0 
94       9300         708.56      17.878      -5.025      12.854       0.000     300.075     300.000       6.027    0 
95       9400         713.22      17.006      -7.676       9.330       0.706     285.435     300.000       5.765    0 
96       9500         722.77      19.028     -10.245       8.783       0.655     319.362     300.000       5.419    0 
97       9600         729.81      17.878      -0.689      17.190       0.000     300.069     300.000       5.101    0 
98       9700         736.47      18.024     -11.583       6.441       0.441     302.514     300.000       5.360    0 
99       9800         744.92      18.233      -7.035      11.198       0.133     306.022     300.000       5.671    0 
100       9900         753.67      18.163     -12.974       5.189       0.826     304.847     300.000       5.703    0 
101      10000         762.87      16.707      -9.525       7.182       0.708     280.411     300.000       5.685    0