Merge branch 'devel' into feature-ga

[unres.git] / examples / unres / MD / ff_gab / ala10-cx_MD.ang

diff --git a/examples/unres/MD/ff_gab/ala10-cx_MD.ang b/examples/unres/MD/ff_gab/ala10-cx_MD.ang
new file mode 100644 (file)
index 0000000..f688f0d
--- /dev/null
+++ b/examples/unres/MD/ff_gab/ala10-cx_MD.ang
@@ -0,0 +1,110 @@
+         1 0.84978127E+02   -0.23142E+01    0.00000E+00   300.00000
+ALA    149.777  -116.250
+ALA    115.006   159.994
+ALA    136.663  -165.949
+ALA    144.549  -160.838
+ALA    145.726   172.354
+ALA    130.111  -167.542
+ALA     91.980   133.026
+ALA     92.759    89.936
+ALA    115.225   115.286
+ALA    104.503
+         2 0.16295000E+03   -0.18690E+01    0.00000E+00   300.00000
+ALA    100.883  -152.419
+ALA    114.047    95.450
+ALA    146.102  -137.939
+ALA    112.985   179.337
+ALA    141.104  -156.278
+ALA    140.256  -168.236
+ALA    102.050   162.119
+ALA     91.158   120.771
+ALA     89.182   139.040
+ALA     89.606
+         3 0.24995000E+03   -0.18720E+01    0.00000E+00   300.00000
+ALA    104.388   158.274
+ALA     97.919    67.644
+ALA    110.100  -163.300
+ALA    108.685   166.084
+ALA    117.521   107.838
+ALA    112.365   -86.773
+ALA    131.325  -173.788
+ALA    105.013   140.652
+ALA    121.982  -171.326
+ALA    125.653
+         4 0.31935858E+03   -0.55894E+01    0.00000E+00   300.00000
+ALA    112.920  -140.590
+ALA    100.328   166.852
+ALA    111.144   106.514
+ALA     97.985   178.549
+ALA    120.699  -152.026
+ALA    124.816  -175.948
+ALA    116.714  -156.814
+ALA    107.321   173.196
+ALA    114.722   163.522
+ALA    129.215
+         5 0.39901797E+03   -0.15912E+01    0.00000E+00   300.00000
+ALA    121.180   -97.270
+ALA    127.421  -167.342
+ALA     90.137   126.194
+ALA    126.532  -125.402
+ALA    112.021   170.716
+ALA     86.923    75.196
+ALA    106.730  -121.619
+ALA    112.789  -148.902
+ALA     95.490    94.846
+ALA    127.742
+         6 0.47615079E+03   -0.10461E+01    0.00000E+00   300.00000
+ALA    131.206  -167.357
+ALA    132.852  -159.425
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+ALA     92.453    74.728
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+         7 0.54086719E+03   -0.37729E+01    0.00000E+00   300.00000
+ALA    133.879   156.151
+ALA    111.476  -163.488
+ALA    109.341   174.653
+ALA     95.391    65.313
+ALA     90.352    52.539
+ALA     92.439   174.814
+ALA    126.855  -110.258
+ALA    117.771  -175.801
+ALA    120.593  -153.930
+ALA    107.506
+         8 0.61206250E+03   -0.41971E+01    0.00000E+00   300.00000
+ALA    117.391   169.055
+ALA     84.971    83.016
+ALA     99.076    51.890
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+ALA     90.578   102.030
+ALA     88.648   -58.570
+ALA    103.319   -57.841
+ALA     98.287   172.865
+ALA    106.026    97.126
+ALA     88.519
+         9 0.68797656E+03   -0.12007E+02    0.00000E+00   300.00000
+ALA    120.646   179.395
+ALA     88.205   125.417
+ALA     88.009    65.849
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+ALA     91.198    63.709
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+ALA     93.782   -98.046
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+ALA    120.187  -102.464
+ALA    108.963