Chi angles for PHE78 from a 10ns sim from Homeira Amirkhani and David Mobley, of apo human IL-2 (PDB 1M47) for code validation Hand calculation for PHE78: For 15 degree bins, tot entropy = 4.219228 For 18 degree bins, tot entropy = 3.897372 For 20 degree bins, tot entropy = 3.713323 For the Excel Files, goto worksheet "TotEnt" for these values