Merge branch 'bartek' of mmka.chem.univ.gda.pl:unres into bartek

[unres.git] / examples / unres / CSA / 4P / CSA / output / 1l2y_csa@017.pdb

diff --git a/examples/unres/CSA/4P/CSA/output/1l2y_csa@017.pdb b/examples/unres/CSA/4P/CSA/output/1l2y_csa@017.pdb
new file mode 100644 (file)
index 0000000..658846e
--- /dev/null
+++ b/examples/unres/CSA/4P/CSA/output/1l2y_csa@017.pdb
@@ -0,0 +1,62 @@
+REMARK GM 17 e    453103 m   1675                         ENERGY    -1.73128E+02
+SHEET    1 B1  2 ASN     1  TYR     3  0
+SHEET    2 B1  2 TRP     6  LYS     8 -1  N  LYS     8   O  ASN     1
+ATOM      1  CA  ASN     1       3.800   0.000   0.000          0.000
+ATOM      2  CB  ASN     1       4.243   1.461   0.712          0.000
+ATOM      3  CA  LEU     2       4.040  -3.792   0.000          0.000
+ATOM      4  CB  LEU     2       3.516  -5.515   0.720          0.000
+ATOM      5  CA  TYR     3       5.109  -5.320  -3.311          0.000
+ATOM      6  CB  TYR     3       7.520  -5.160  -3.886          0.000
+ATOM      7  CA  ILE     4       5.857  -8.684  -1.709          0.000
+ATOM      8  CB  ILE     4       7.510  -9.117  -1.226          0.000
+ATOM      9  CA  GLN     5       2.213  -9.761  -1.720          0.000
+ATOM     10  CB  GLN     5       0.250  -8.859  -1.128          0.000
+ATOM     11  CA  TRP     6       1.333  -7.232  -4.415          0.000
+ATOM     12  CB  TRP     6       3.599  -7.612  -5.643          0.000
+ATOM     13  CA  LEU     7      -0.166  -4.751  -1.958          0.000
+ATOM     14  CB  LEU     7      -0.846  -4.021  -0.295          0.000
+ATOM     15  CA  LYS     8       1.005  -1.793  -4.035          0.000
+ATOM     16  CB  LYS     8       3.487  -1.617  -3.520          0.000
+ATOM     17  CA  ASP     9      -1.161  -2.755  -7.006          0.000
+ATOM     18  CB  ASP     9      -1.581  -4.315  -6.448          0.000
+ATOM     19  CA  GLY    10      -4.156  -0.840  -5.664          0.000
+ATOM     20  CA  GLY    11      -5.585  -3.808  -3.769          0.000
+ATOM     21  CA  PRO    12      -3.820  -6.855  -2.342          0.000
+ATOM     22  CB  PRO    12      -4.935  -6.857  -1.589          0.000
+ATOM     23  CA  SER    13      -2.067  -9.109  -4.849          0.000
+ATOM     24  CB  SER    13      -1.523  -8.815  -5.818          0.000
+ATOM     25  CA  SER    14      -0.235 -12.371  -4.184          0.000
+ATOM     26  CB  SER    14      -0.940 -13.278  -4.142          0.000
+ATOM     27  CA  GLY    15       2.197 -13.846  -6.704          0.000
+ATOM     28  CA  ARG    16       1.152 -15.380 -10.019          0.000
+ATOM     29  CB  ARG    16       1.325 -18.363 -10.463          0.000
+ATOM     30  CA  PRO    17      -2.243 -16.882 -10.833          0.000
+ATOM     31  CB  PRO    17      -1.956 -16.274 -11.997          0.000
+ATOM     32  CA  PRO    18      -2.874 -20.478  -9.779          0.000
+ATOM     33  CB  PRO    18      -3.975 -19.937  -9.227          0.000
+ATOM     34  CA  PRO    19      -2.977 -23.130 -12.498          0.000
+ATOM     35  CB  PRO    19      -1.822 -23.574 -11.971          0.000
+ATOM     36  CA  SER    20      -6.082 -24.776 -11.052          0.000
+ATOM     37  CB  SER    20      -6.112 -24.850  -9.905          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