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energy match prerelease from old unres
[unres4.git]
/
PARAM
/
bond_AM1_ext.parm
diff --git
a/PARAM/bond_AM1_ext.parm
b/PARAM/bond_AM1_ext.parm
index
965ac1f
..
333a43f
100644
(file)
--- a/
PARAM/bond_AM1_ext.parm
+++ b/
PARAM/bond_AM1_ext.parm
@@
-1,4
+1,4
@@
-1 3.800 2.900 41.7 0.000 43.0 14.33 2.5 ! peptide group
+1 3.800 41.7 0.000 43.0 14.33 2.5 ! peptide group
1 1.396 243.1 0.000 59.0 19.67 5.0 ! Cys
2 2.103 71.3 0.850 2.500 128.0 0.033 88.0 29.33 6.2 ! Met
1 2.997 124.6 0.000 104.0 34.67 6.8 ! Phe