# input
structure	        hisH_solv.psf
coordinates             hisH_solv.pdb        
paraTypeCharmm          on
parameters              par_all27_prot_na_lipids_full.inp

numsteps                10000
minimization            on  

# force field parameters
exclude			scaled1-4
1-4scaling		1.0
cutoff			14.0
switching		On
switchdist		12.0
pairlistdist		16.0

# integrator params
timestep		1.0
nonbondedFreq           2
fullElectFrequency      4
stepspercycle		20

# Periodic boundary condition
cellBasisVector1        65.83 0      0
cellBasisVector2        0     69.52  0
cellBasisVector3        0     0      52.35
cellorigin              -19.47  -0.78  -17.47
wrapWater               on
wrapAll                 on
wrapNearest             on

# output
outputname	        hisH_solv_min_long.pdb
dcdfile                 hisH_solv_min_long.dcd

binaryoutput            no
outputEnergies          100
dcdfreq                 100 




