Author: bugman
Date: Thu Jul 15 15:29:46 2010
New Revision: 11303
URL: http://svn.gna.org/viewcvs/relax?rev=11303&view=rev
Log:
Added a severely truncated PDB file for PCS back-calculation with ubiquitin.
Added:
1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb
Added: 1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb
URL:
http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb?rev=11303&view=auto
==============================================================================
--- 1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb (added)
+++ 1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb Thu Jul 15
15:29:46 2010
@@ -1,0 +1,91 @@
+MODEL 1
+ATOM 20 N GLN 2 4.569 14.695 -13.410 0.00 100.00
+ATOM 29 H GLN 2 5.487 14.393 -13.250 0.00 100.00
+ATOM 37 N ILE 3 1.652 12.891 -12.450 0.00 100.00
+ATOM 45 H ILE 3 1.142 13.104 -13.257 0.00 100.00
+ATOM 56 N PHE 4 -0.423 10.296 -10.960 0.00 100.00
+ATOM 67 H PHE 4 -0.240 10.425 -10.012 0.00 100.00
+TER
+ENDMDL
+MODEL 2
+ATOM 20 N GLN 2 4.788 15.474 -11.785 0.00 100.00
+ATOM 29 H GLN 2 5.690 15.149 -11.587 0.00 100.00
+ATOM 37 N ILE 3 1.849 13.484 -11.554 0.00 100.00
+ATOM 45 H ILE 3 1.404 13.884 -12.326 0.00 100.00
+ATOM 56 N PHE 4 -0.286 10.610 -10.861 0.00 100.00
+ATOM 67 H PHE 4 -0.202 10.548 -9.892 0.00 100.00
+TER
+ENDMDL
+MODEL 3
+ATOM 20 N GLN 2 4.672 14.558 -12.766 0.00 100.00
+ATOM 29 H GLN 2 5.579 14.260 -12.544 0.00 100.00
+ATOM 37 N ILE 3 1.712 12.766 -11.946 0.00 100.00
+ATOM 45 H ILE 3 1.236 12.983 -12.771 0.00 100.00
+ATOM 56 N PHE 4 -0.447 10.216 -10.466 0.00 100.00
+ATOM 67 H PHE 4 -0.311 10.390 -9.518 0.00 100.00
+TER
+ENDMDL
+MODEL 4
+ATOM 20 N GLN 2 4.849 14.581 -12.444 0.00 100.00
+ATOM 29 H GLN 2 5.753 14.326 -12.166 0.00 100.00
+ATOM 37 N ILE 3 1.904 12.786 -11.571 0.00 100.00
+ATOM 45 H ILE 3 1.450 12.934 -12.424 0.00 100.00
+ATOM 56 N PHE 4 -0.239 10.291 -10.006 0.00 100.00
+ATOM 67 H PHE 4 -0.143 10.533 -9.067 0.00 100.00
+TER
+ENDMDL
+MODEL 5
+ATOM 20 N GLN 2 4.815 15.258 -12.159 0.00 100.00
+ATOM 29 H GLN 2 5.722 14.938 -11.968 0.00 100.00
+ATOM 37 N ILE 3 1.887 13.268 -11.738 0.00 100.00
+ATOM 45 H ILE 3 1.419 13.620 -12.523 0.00 100.00
+ATOM 56 N PHE 4 -0.212 10.435 -10.802 0.00 100.00
+ATOM 67 H PHE 4 -0.111 10.448 -9.833 0.00 100.00
+TER
+ENDMDL
+MODEL 6
+ATOM 20 N GLN 2 4.619 15.643 -12.842 0.00 100.00
+ATOM 29 H GLN 2 5.536 15.339 -12.683 0.00 100.00
+ATOM 37 N ILE 3 1.736 13.612 -12.360 0.00 100.00
+ATOM 45 H ILE 3 1.237 13.976 -13.118 0.00 100.00
+ATOM 56 N PHE 4 -0.302 10.742 -11.403 0.00 100.00
+ATOM 67 H PHE 4 -0.159 10.732 -10.438 0.00 100.00
+TER
+ENDMDL
+MODEL 7
+ATOM 20 N GLN 2 5.031 14.869 -11.160 0.00 100.00
+ATOM 29 H GLN 2 5.906 14.561 -10.844 0.00 100.00
+ATOM 37 N ILE 3 2.030 12.986 -10.891 0.00 100.00
+ATOM 45 H ILE 3 1.660 13.278 -11.748 0.00 100.00
+ATOM 56 N PHE 4 -0.249 10.292 -9.959 0.00 100.00
+ATOM 67 H PHE 4 -0.243 10.374 -8.988 0.00 100.00
+TER
+ENDMDL
+MODEL 8
+ATOM 20 N GLN 2 4.993 14.280 -10.842 0.00 100.00
+ATOM 29 H GLN 2 5.840 13.951 -10.475 0.00 100.00
+ATOM 37 N ILE 3 1.890 12.564 -10.508 0.00 100.00
+ATOM 45 H ILE 3 1.549 12.812 -11.390 0.00 100.00
+ATOM 56 N PHE 4 -0.548 10.073 -9.408 0.00 100.00
+ATOM 67 H PHE 4 -0.558 10.246 -8.450 0.00 100.00
+TER
+ENDMDL
+MODEL 9
+ATOM 20 N GLN 2 4.673 16.419 -11.643 0.00 100.00
+ATOM 29 H GLN 2 5.593 16.163 -11.426 0.00 100.00
+ATOM 37 N ILE 3 1.899 14.193 -11.489 0.00 100.00
+ATOM 45 H ILE 3 1.436 14.573 -12.262 0.00 100.00
+ATOM 56 N PHE 4 -0.029 11.157 -10.869 0.00 100.00
+ATOM 67 H PHE 4 0.041 11.094 -9.900 0.00 100.00
+TER
+ENDMDL
+MODEL 10
+ATOM 20 N GLN 2 4.889 14.987 -11.256 0.00 100.00
+ATOM 29 H GLN 2 5.772 14.668 -10.977 0.00 100.00
+ATOM 37 N ILE 3 1.901 13.068 -10.945 0.00 100.00
+ATOM 45 H ILE 3 1.497 13.382 -11.779 0.00 100.00
+ATOM 56 N PHE 4 -0.318 10.332 -9.984 0.00 100.00
+ATOM 67 H PHE 4 -0.283 10.410 -9.013 0.00 100.00
+TER
+ENDMDL
+END
r11303 - /1.3/test_suite/shared_data/structures/trunc_ubi_pcs.pdb