Starting mmtbx.development.electrons
on Sun May 19 12:44:31 2024 by afonine
===============================================================================

Processing files:
-------------------------------------------------------------------------------

  Found model, 8ve0_43160.pdb

Processing PHIL parameters:
-------------------------------------------------------------------------------

  No PHIL parameters found

Final processed PHIL parameters:
-------------------------------------------------------------------------------
  data_manager {
    model {
      file = "8ve0_43160.pdb"
    }
    default_model = "8ve0_43160.pdb"
  }


Starting job
===============================================================================
Distribution time : 8s
================================================================================
elec. dist.
  "ATOM      1  N   LYS A   9 .*.     N  "  :  -1e
  "ATOM      9  NZ  LYS A   9 .*.     N  "  :  -1e
  "ATOM    110  NZ  LYS A  15 .*.     N  "  :  -1e
  "ATOM    166  OD2 ASP A  18 .*.     O  "  :   1e
  "ATOM    204  NE  ARG A  21 .*.     N  "  :  -1e
  "ATOM    398  NE  ARG A  34 .*.     N  "  :  -1e
  "ATOM    423  NZ  LYS A  35 .*.     N  "  :  -1e
  "ATOM    464  OD2 ASP A  38 .*.     O  "  :   1e
  "ATOM    476  OD2 ASP A  39 .*.     O  "  :   1e
  "ATOM    527  OE2 GLU A  42 .*.     O  "  :   1e
  "ATOM    604  NZ  LYS A  48 .*.     N  "  :  -1e
  "ATOM    651  OE2 GLU A  51 .*.     O  "  :   1e
  "ATOM    684  OE2 GLU A  54 .*.     O  "  :   1e
  "ATOM    789  OE2 GLU A  61 .*.     O  "  :   1e
  "ATOM    804  OE2 GLU A  62 .*.     O  "  :   1e
  "ATOM    819  OE2 GLU A  63 .*.     O  "  :   1e
  "ATOM    870  OE2 GLU A  66 .*.     O  "  :   1e
  "ATOM    932  NZ  LYS A  70 .*.     N  "  :  -1e
  "ATOM    970  OE2 GLU A  72 .*.     O  "  :   1e
  "ATOM   1003  OD2 ASP A  74 .*.     O  "  :   1e
  "ATOM   1030  NZ  LYS A  76 .*.     N  "  :  -1e
  "ATOM   1108  NZ  LYS A  80 .*.     N  "  :  -1e
  "ATOM   1247  OE2 GLU A  89 .*.     O  "  :   1e
  "ATOM   1289  OE2 GLU A  92 .*.     O  "  :   1e
  "ATOM   1393  OD2 ASP A  99 .*.     O  "  :   1e
  "ATOM   1437  NE  ARG A 103 .*.     N  "  :  -1e
  "ATOM   1461  NE  ARG A 104 .*.     N  "  :  -1e
  "ATOM   1784  OXT PRO A 125 .*.     O  "  :   1e

Validation report

  Unlikely charge for LYS of -1
    " LYS A   9 "


===============================================================================
Job complete
usr+sys time: 11.06 seconds
wall clock time: 11.07 seconds