update

[unres.git] / PARAM / bond_AM1_ext.parm

diff --git a/PARAM/bond_AM1_ext.parm b/PARAM/bond_AM1_ext.parm
index 7e5e837..0f7bb5e 100644 (file)
--- a/PARAM/bond_AM1_ext.parm
+++ b/PARAM/bond_AM1_ext.parm
@@ -19,7 +19,7 @@
 3 2.644  48.8  1.707 3.433  34.8 .00123 4.080 899.9  1.175 114.0  38.00  6.8  ! Arg
 3 2.379  99.0  1.974 2.704 157.5  0.546 3.073 164.7  0.055  86.0  28.67  6.3  ! Lys
 1 1.422 605.2  0.000                                        71.0  23.67  5.6  ! Pro
-2 2.103  71.3  0.850 2.500 128.0  0.033                    135.0  45.00  6.2  ! SeMet   # adapted from Met
-2 3.368 123.1  0.000 3.686 129.1 .00049                    149.0  49.76  7.2  ! Dap(Bz) # adapted from Trp
-1 0.778 353.0  0.000                                        42.0  14.00  4.7  ! Aib     # adapted from Ala
-1 1.210 353.0  0.000                                        42.0  14.00  5.6  ! Abu     # Adapted from Ala
+2 2.142  71.3  0.850 2.500 128.0  0.033                    135.0  45.00  6.2  ! SeMet
+1 3.799 124.6  0.000                                       149.0  49.67  7.2  ! Dap(Bz)
+1 0.743 353.00 0.000                                        42.0  14.00  4.7  ! Aib
+1 1.210 353.00 0.000                                        42.0  14.00  5.6  ! Abu