=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 0 rings

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
3ipnD1 GLY   3 HA2    0.00  -0.02   0.02  -0.51   4.01     3.50
3ipnD1 GLY   3 HA3    0.00  -0.00   0.02  -0.51   4.01     3.52
3ipnD1 GLY   6 HA2    0.00  -0.02   0.08  -0.51   4.01     3.55
3ipnD1 GLY   6 HA3    0.00  -0.00   0.06  -0.51   4.01     3.55
3ipnD1 GLY   9 HA2    0.00  -0.02   0.08  -0.51   4.01     3.56
3ipnD1 GLY   9 HA3    0.00   0.00   0.06  -0.51   4.01     3.56
3ipnD1 GLY  12 HA2    0.00  -0.02   0.08  -0.51   4.01     3.56
3ipnD1 GLY  12 HA3    0.00  -0.00   0.06  -0.51   4.01     3.56
3ipnD1 GLY  15 HA2    0.00  -0.02   0.07  -0.51   4.01     3.56
3ipnD1 GLY  15 HA3    0.00  -0.00   0.06  -0.51   4.01     3.56
3ipnD1 GLY  18 HA2    0.00  -0.00   0.05  -0.51   4.01     3.55
3ipnD1 GLY  18 HA3    0.00  -0.00   0.03  -0.51   4.01     3.53