From: Rossen Apostolov <rossen@kth.se>
Date: Mon, 26 May 2014 13:52:05 +0000 (+0200)
Subject: Mapped HIS1 to HSD in charmm27.
X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=commitdiff_plain;h=84d764865094a81b3398fbfbb62e119859b1b656;p=alexxy%2Fgromacs.git

Mapped HIS1 to HSD in charmm27.

Fixes #1133.

Change-Id: I6c289af9b58c8e7cd66f36982bf118505aa38f7d
---

diff --git a/share/top/charmm27.ff/aminoacids.r2b b/share/top/charmm27.ff/aminoacids.r2b
index 41bcbab9f1..f3e88d2682 100644
--- a/share/top/charmm27.ff/aminoacids.r2b
+++ b/share/top/charmm27.ff/aminoacids.r2b
@@ -1,6 +1,7 @@
 ; rtp residue to rtp building block table
 ;GMX   Force-field
 HISD	HSD
+HIS1	HSD
 HISE	HSE
 HISH	HSP
 LYSN	LSN