=============================================================================
          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
=============================================================================
1hsbC1 ALA   1 HA     0.00  -0.11   0.20  -0.75   4.34     3.68
1hsbC1 ALA   1 HB3    0.00  -0.01   0.04  -0.04   1.41     1.40
1hsbC1 VAL   2 H      0.00   0.02   0.08  -0.55   8.24     7.79
1hsbC1 VAL   2 HA     0.00   0.06   0.54  -0.75   4.13     3.98
1hsbC1 VAL   2 HB     0.00   0.03   0.04  -0.04   2.12     2.15
1hsbC1 VAL   2 HG13   0.00  -0.01   0.05  -0.04   0.97     0.97
1hsbC1 VAL   2 HG23   0.00  -0.00  -0.00  -0.04   0.95     0.90
1hsbC1 ALA   3 H      0.00   0.06   0.07  -0.55   8.40     7.98
1hsbC1 ALA   3 HA     0.00   0.16   0.24  -0.75   4.34     3.98
1hsbC1 ALA   3 HB3    0.00   0.01   0.08  -0.04   1.41     1.46