X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2Frmscalc.f;h=eecf900dbd35ad90358027d261b76cc6e0fe685d;hb=0bc26432861b8aa8fb7cb98becda4da4f0ae8b48;hp=826167fce33a2292a2646a0ae5de26b9197c1ec0;hpb=478a9d9a1c99eb3f4bc4ca676ff3162bdd01d633;p=unres.git diff --git a/source/wham/src-M/rmscalc.f b/source/wham/src-M/rmscalc.f index 826167f..eecf900 100644 --- a/source/wham/src-M/rmscalc.f +++ b/source/wham/src-M/rmscalc.f @@ -161,7 +161,7 @@ c------------------------------------------------------------------------- do kkk=1,nperm nnsup=0 do i=1,nres - if (itype(i).ne.21) then + if (itype(i).ne.ntyp1) then nnsup=nnsup+1 do j=1,3 cc(j,nnsup)=c(j,i)