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

[unres.git] / examples / unres / CSA / 4P / CSA / output / 1l2y_csa@028.pdb

diff --git a/examples/unres/CSA/4P/CSA/output/1l2y_csa@028.pdb b/examples/unres/CSA/4P/CSA/output/1l2y_csa@028.pdb
new file mode 100644 (file)
index 0000000..57d874d
--- /dev/null
+++ b/examples/unres/CSA/4P/CSA/output/1l2y_csa@028.pdb
@@ -0,0 +1,61 @@
+REMARK GM 28 e   2579214 m   9990                         ENERGY    -1.86452E+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       4.370   0.262   1.563          0.000
+ATOM      3  CA  LEU     2       4.041  -3.792   0.000          0.000
+ATOM      4  CB  LEU     2       3.762  -5.665   0.417          0.000
+ATOM      5  CA  TYR     3       1.481  -4.088  -2.793          0.000
+ATOM      6  CB  TYR     3       0.532  -1.792  -2.821          0.000
+ATOM      7  CA  ILE     4       4.006  -3.092  -5.451          0.000
+ATOM      8  CB  ILE     4       4.136  -1.428  -6.058          0.000
+ATOM      9  CA  GLN     5       6.652  -5.408  -4.011          0.000
+ATOM     10  CB  GLN     5       7.371  -4.127  -2.320          0.000
+ATOM     11  CA  TRP     6       4.068  -8.140  -3.465          0.000
+ATOM     12  CB  TRP     6       3.339 -10.295  -2.195          0.000
+ATOM     13  CA  LEU     7       2.529  -7.542  -6.887          0.000
+ATOM     14  CB  LEU     7       0.960  -6.565  -6.301          0.000
+ATOM     15  CA  LYS     8       5.961  -7.435  -8.515          0.000
+ATOM     16  CB  LYS     8       6.769  -5.032  -8.350          0.000
+ATOM     17  CA  ASP     9       6.942 -10.790  -7.025          0.000
+ATOM     18  CB  ASP     9       7.071 -10.360  -5.376          0.000
+ATOM     19  CA  GLY    10       4.885 -12.763  -9.538          0.000
+ATOM     20  CA  GLY    11       1.493 -14.475  -9.500          0.000
+ATOM     21  CA  PRO    12       2.478 -16.932  -6.773          0.000
+ATOM     22  CB  PRO    12       3.601 -17.178  -7.472          0.000
+ATOM     23  CA  SER    13       3.484 -14.089  -4.461          0.000
+ATOM     24  CB  SER    13       4.006 -13.214  -4.994          0.000
+ATOM     25  CA  SER    14       0.019 -12.549  -4.708          0.000
+ATOM     26  CB  SER    14       0.522 -11.572  -5.047          0.000
+ATOM     27  CA  GLY    15      -1.726 -15.840  -3.959          0.000
+ATOM     28  CA  ARG    16       0.463 -16.712  -0.977          0.000
+ATOM     29  CB  ARG    16       3.337 -16.119  -1.690          0.000
+ATOM     30  CA  PRO    17       0.493 -14.777   2.293          0.000
+ATOM     31  CB  PRO    17       0.930 -15.984   2.692          0.000
+ATOM     32  CA  PRO    18       1.972 -11.277   2.260          0.000
+ATOM     33  CB  PRO    18       0.855 -10.977   2.946          0.000
+ATOM     34  CA  PRO    19       5.408 -10.786   3.807          0.000
+ATOM     35  CB  PRO    19       5.722 -10.543   2.522          0.000
+ATOM     36  CA  SER    20       4.329  -7.667   5.691          0.000
+ATOM     37  CB  SER    20       3.696  -6.928   5.078          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