=============================================================================
          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
=============================================================================
1cybA1 VAL   5 H      0.00   0.16   0.03  -0.55   8.24     7.87
1cybA1 VAL   5 HA     0.00   0.01   0.04  -0.75   4.13     3.42
1cybA1 VAL   5 HB     0.00  -0.01   0.03  -0.04   2.12     2.09
1cybA1 VAL   5 HG13   0.00   0.00  -0.01  -0.04   0.97     0.92
1cybA1 VAL   5 HG23   0.00  -0.00   0.01  -0.04   0.95     0.92
1cybA1 ALA   7 H      0.00   0.04   0.00  -0.55   8.40     7.89
1cybA1 ALA   7 HA     0.00   0.01   0.02  -0.75   4.34     3.61
1cybA1 ALA   7 HB3    0.00  -0.00   0.04  -0.04   1.41     1.41