AMBER is located in /usr/groupS How to Protonate crystal structures: protonate -d data-file-name -i input-pdb-file -o output-pdb-file for example: /usr/groupS/Amber6/amber6/exe/protonate -d /usr/groupS/Amber6/amber6/dat/PROTON_INFO.Brook -i /chem/lawrence/RNA_PDB/ur0015.pdb -o /chem/lawrence/RNA_PDB/ur0015-H.pdb