Thermolysin: initial minimisation solvent 
 &cntrl
  imin   = 1,
  maxcyc = 5000,
  ncyc   = 2000,
  ntb    = 1,
  ntr    = 1,
  cut    = 9,
  ifqnt  =1
 /
 &qmmm
  iqmatoms=2106,2107,2108,2109,2110,2111,2112,2113,2114,2115,2116,2171,2172,2173,2174,2175,2176,2177,2178,2179,2180,2181,2330,2331,2332,2333,2334,2335,
           2336,2337,2338,2339,2340,2341,2342,2343,2344,2458,2459,2460,2461,2462,2463,2464,2465,2466,2502,2503,2504,2505,2506,4709,4710,4711,4712,4713,
           4714,4715,
  qmtheory=1,
  qm_ewald=1,qm_pme=1
 /
Hold the Thermolysin fixed
500.0
RES 1 323
END
END