restructured examples

[unres.git] / examples / unres / CSA / 4P / outputs / 1l2y_csa@019.pdb

diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@019.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@019.pdb
new file mode 100644 (file)
index 0000000..120bb4c
--- /dev/null
+++ b/examples/unres/CSA/4P/outputs/1l2y_csa@019.pdb
@@ -0,0 +1,62 @@
+REMARK GM 19 e    602498 m   2226                         ENERGY    -1.76354E+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   1.470   0.691          0.000
+ATOM      3  CA  LEU     2       4.040  -3.792   0.000          0.000
+ATOM      4  CB  LEU     2       4.244  -5.684   0.377          0.000
+ATOM      5  CA  TYR     3       1.494  -4.124  -2.801          0.000
+ATOM      6  CB  TYR     3       1.991  -3.310  -5.095          0.000
+ATOM      7  CA  ILE     4       2.763  -7.547  -3.858          0.000
+ATOM      8  CB  ILE     4       3.997  -7.782  -5.114          0.000
+ATOM      9  CA  GLN     5       0.634  -9.348  -1.278          0.000
+ATOM     10  CB  GLN     5       0.888  -9.053   0.928          0.000
+ATOM     11  CA  TRP     6      -1.174  -6.118  -0.419          0.000
+ATOM     12  CB  TRP     6      -1.847  -5.570  -2.875          0.000
+ATOM     13  CA  LEU     7       0.558  -4.646   2.626          0.000
+ATOM     14  CB  LEU     7       1.744  -4.411   4.142          0.000
+ATOM     15  CA  LYS     8      -1.115  -1.272   2.117          0.000
+ATOM     16  CB  LYS     8       0.212  -0.889  -0.016          0.000
+ATOM     17  CA  ASP     9      -4.470  -2.466   3.442          0.000
+ATOM     18  CB  ASP     9      -4.218  -4.153   3.550          0.000
+ATOM     19  CA  GLY    10      -3.424  -1.987   7.064          0.000
+ATOM     20  CA  GLY    11      -2.330  -5.598   7.521          0.000
+ATOM     21  CA  PRO    12      -1.199  -7.980   4.785          0.000
+ATOM     22  CB  PRO    12      -0.849  -8.690   5.873          0.000
+ATOM     23  CA  SER    13      -3.543  -8.352   1.817          0.000
+ATOM     24  CB  SER    13      -4.015  -7.538   1.156          0.000
+ATOM     25  CA  SER    14      -3.449 -10.969  -0.937          0.000
+ATOM     26  CB  SER    14      -4.055 -11.911  -0.676          0.000
+ATOM     27  CA  GLY    15      -5.044 -10.374  -4.334          0.000
+ATOM     28  CA  ARG    16      -8.789 -10.305  -4.974          0.000
+ATOM     29  CB  ARG    16     -10.139 -12.540  -6.492          0.000
+ATOM     30  CA  PRO    17     -11.465 -12.014  -2.886          0.000
+ATOM     31  CB  PRO    17     -12.089 -10.864  -3.197          0.000
+ATOM     32  CA  PRO    18     -12.140 -15.692  -3.559          0.000
+ATOM     33  CB  PRO    18     -11.968 -15.785  -2.229          0.000
+ATOM     34  CA  PRO    19     -15.378 -16.606  -5.325          0.000
+ATOM     35  CB  PRO    19     -14.599 -16.946  -6.367          0.000
+ATOM     36  CA  SER    20     -16.110 -19.464  -2.930          0.000
+ATOM     37  CB  SER    20     -15.199 -20.094  -2.621          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