

   NSTEP       ENERGY          RMS            GMAX         NAME    NUMBER
  83046      -4.7830E+01     5.4421E+00     2.9103E+01     N3         16

 BOND    =        2.4984  ANGLE   =       45.3851  DIHED      =        4.0000
 VDWAALS =        0.3367  EEL     =       36.3807  EPB        =      -30.9332
 1-4 VDW =        1.3434  1-4 EEL =     -110.3981  RESTRAINT  =        0.0042
 ESURF   =        3.5525
 ECAVITY =        3.5525  EDISPER =        0.0000
 EAMBER  =      -47.8346
 NMR restraints: Bond =    0.000   Angle =     0.000   Torsion =     0.004
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