eq3 temp = 300, k = 10
&cntrl
 nstlim = 10000, dt = 0.002,
 ntx = 7, irest = 1,
 ntpr = 500, ntwr = 500, ntwx =500, 
 tempi = 300., temp0 = 300.,
 ntt = 1,
 ntb = 2, ntp = 1,
 ntc = 2, ntf = 2,
 ntr = 1,
 restraint_wt = 10.0, restraintmask = "@CA"
&end