firststep 0
numsteps  1000

exclude scaled1-4

seed 1234

posfile bpti.pdb
psffile bpti.psf
parfile bpti.par
temperature 0

outputfreq 1
#allenergiesfile bpti.out.energy

boundaryConditions periodic
cellBasisVector1     63.0 0.0 0.0
cellBasisVector2     0.0 50.0 0.0
cellBasisVector3     0.0 0.0 50.0
cellOrigin           0.0 0.0 0.0

cellManager Cubic
cellsize 5.0

Integrator {
  level 0 Leapfrog {
        timestep 1
    force time Improper 
    force time Dihedral 
    force time Bond 
    force time Angle 
    force time LennardJones
	-switchingFunction C2 
	-algorithm NonbondedCutoff
	-switchon 1.0
        -cutoff 10.0
    force time Coulomb 
	-switchingFunction Shift 
	-algorithm NonbondedCutoff
	-switchon 1.0
        -cutoff 10.0

  }
}