Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / CSA / GAB / global / restrained / outputs / 1l2y_csa@024.pdb

diff --git a/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@024.pdb b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@024.pdb
new file mode 100644 (file)
index 0000000..be79890
--- /dev/null
+++ b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@024.pdb
@@ -0,0 +1,61 @@
+REMARK GM 24 e   1035770 m   3218                         ENERGY    -8.75655E+01
+HELIX    1 H1  ILE      4  GLY     10  1                                       6
+ATOM      1  CA  ASN     1       3.800   0.000   0.000          0.000
+ATOM      2  CB  ASN     1       5.241   0.835   0.247          0.000
+ATOM      3  CA  LEU     2       5.632  -3.329   0.000          0.000
+ATOM      4  CB  LEU     2       6.173  -4.807  -1.132          0.000
+ATOM      5  CA  TYR     3       8.223  -4.134   2.660          0.000
+ATOM      6  CB  TYR     3       7.521  -4.703   4.974          0.000
+ATOM      7  CA  ILE     4       9.784  -7.598   2.564          0.000
+ATOM      8  CB  ILE     4       9.942  -7.909   0.823          0.000
+ATOM      9  CA  GLN     5      12.435  -6.495   5.054          0.000
+ATOM     10  CB  GLN     5      12.434  -4.486   4.061          0.000
+ATOM     11  CA  TRP     6       9.833  -6.579   7.822          0.000
+ATOM     12  CB  TRP     6       9.191  -7.196  10.270          0.000
+ATOM     13  CA  LEU     7       8.852 -10.101   6.787          0.000
+ATOM     14  CB  LEU     7       7.043  -9.538   6.377          0.000
+ATOM     15  CA  LYS     8      12.455 -11.244   7.180          0.000
+ATOM     16  CB  LYS     8      12.825 -11.386   4.670          0.000
+ATOM     17  CA  ASP     9      12.969  -9.064  10.250          0.000
+ATOM     18  CB  ASP     9      13.273  -7.533   9.553          0.000
+ATOM     19  CA  GLY    10      10.399 -11.021  12.251          0.000
+ATOM     20  CA  GLY    11       6.739 -10.797  11.255          0.000
+ATOM     21  CA  PRO    12       5.087  -7.386  10.982          0.000
+ATOM     22  CB  PRO    12       4.272  -8.028  10.127          0.000
+ATOM     23  CA  SER    13       5.754  -5.143  13.976          0.000
+ATOM     24  CB  SER    13       6.487  -5.532  14.772          0.000
+ATOM     25  CA  SER    14       8.155  -2.931  12.032          0.000
+ATOM     26  CB  SER    14       8.195  -3.373  10.971          0.000
+ATOM     27  CA  GLY    15       7.740   0.638  10.794          0.000
+ATOM     28  CA  ARG    16       7.005  -0.335   7.195          0.000
+ATOM     29  CB  ARG    16       9.339  -2.249   7.272          0.000
+ATOM     30  CA  PRO    17       3.859  -1.985   5.844          0.000
+ATOM     31  CB  PRO    17       4.365  -1.786   4.613          0.000
+ATOM     32  CA  PRO    18       3.449  -5.759   6.018          0.000
+ATOM     33  CB  PRO    18       2.494  -5.419   6.902          0.000
+ATOM     34  CA  PRO    19       3.020  -7.659   2.755          0.000
+ATOM     35  CB  PRO    19       4.324  -7.409   2.542          0.000
+ATOM     36  CA  SER    20       1.582 -10.715   4.497          0.000
+ATOM     37  CB  SER    20       1.839 -10.752   5.617          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