1. New organization of examples for 4P,GAB,E0LL2Y force field,

[unres.git] / examples / unres / CSA / 4P / CSA / output / 1l2y_csa@024.pdb

diff --git a/examples/unres/CSA/4P/CSA/output/1l2y_csa@024.pdb b/examples/unres/CSA/4P/CSA/output/1l2y_csa@024.pdb
new file mode 100644 (file)
index 0000000..6f8a1bf
--- /dev/null
+++ b/examples/unres/CSA/4P/CSA/output/1l2y_csa@024.pdb
@@ -0,0 +1,61 @@
+REMARK GM 24 e   2133915 m   8192                         ENERGY    -1.81572E+02
+HELIX    1 H1  LEU      2  GLY     10  1                                       8
+ATOM      1  CA  ASN     1       3.800   0.000   0.000          0.000
+ATOM      2  CB  ASN     1       5.362   0.488   0.398          0.000
+ATOM      3  CA  LEU     2       4.042  -3.792   0.000          0.000
+ATOM      4  CB  LEU     2       3.838  -5.700   0.280          0.000
+ATOM      5  CA  TYR     3       1.609  -4.079  -2.904          0.000
+ATOM      6  CB  TYR     3       0.837  -1.718  -2.939          0.000
+ATOM      7  CA  ILE     4       4.264  -3.128  -5.451          0.000
+ATOM      8  CB  ILE     4       4.481  -1.461  -6.023          0.000
+ATOM      9  CA  GLN     5       6.815  -5.452  -3.860          0.000
+ATOM     10  CB  GLN     5       7.373  -3.898  -2.346          0.000
+ATOM     11  CA  TRP     6       4.179  -8.157  -3.442          0.000
+ATOM     12  CB  TRP     6       2.966 -10.248  -2.470          0.000
+ATOM     13  CA  LEU     7       2.850  -7.565  -6.952          0.000
+ATOM     14  CB  LEU     7       1.181  -6.974  -6.161          0.000
+ATOM     15  CA  LYS     8       6.372  -7.421  -8.370          0.000
+ATOM     16  CB  LYS     8       6.907  -4.946  -8.574          0.000
+ATOM     17  CA  ASP     9       7.379 -10.662  -6.660          0.000
+ATOM     18  CB  ASP     9       6.749 -10.798  -5.078          0.000
+ATOM     19  CA  GLY    10       4.916 -12.726  -8.689          0.000
+ATOM     20  CA  GLY    11       1.191 -12.400  -8.013          0.000
+ATOM     21  CA  PRO    12      -0.461 -12.746  -4.609          0.000
+ATOM     22  CB  PRO    12      -0.970 -11.503  -4.540          0.000
+ATOM     23  CA  SER    13       0.517 -16.404  -4.290          0.000
+ATOM     24  CB  SER    13       0.593 -16.997  -5.273          0.000
+ATOM     25  CA  SER    14       4.216 -15.622  -3.906          0.000
+ATOM     26  CB  SER    14       4.340 -14.479  -3.942          0.000
+ATOM     27  CA  GLY    15       6.183 -16.215  -0.709          0.000
+ATOM     28  CA  ARG    16       5.171 -12.927   0.906          0.000
+ATOM     29  CB  ARG    16       6.207 -10.422  -0.424          0.000
+ATOM     30  CA  PRO    17       1.797 -12.010   2.394          0.000
+ATOM     31  CB  PRO    17       2.557 -11.050   2.949          0.000
+ATOM     32  CA  PRO    18      -1.098 -11.287   0.041          0.000
+ATOM     33  CB  PRO    18      -1.707 -12.201   0.817          0.000
+ATOM     34  CA  PRO    19      -2.207  -7.672  -0.339          0.000
+ATOM     35  CB  PRO    19      -1.052  -7.516  -1.010          0.000
+ATOM     36  CA  SER    20      -5.888  -8.551   0.008          0.000
+ATOM     37  CB  SER    20      -6.209  -9.522  -0.519          0.000
+TER
+CONECT    1    3    2
+CONECT    3    5    4
+CONECT    5    7    6
+CONECT    7    9    8
+CONECT    9   11   10
+CONECT   11   13   12
+CONECT   13   15   14
+CONECT   15   17   16
+CONECT   17   19   18
+CONECT   19   20
+CONECT   20   21
+CONECT   21   23   22
+CONECT   23   25   24
+CONECT   25   27   26
+CONECT   27   28
+CONECT   28   30   29
+CONECT   30   32   31
+CONECT   32   34   33
+CONECT   34   36   35
+CONECT   36   37
+ENDMDL