=============================================================================
          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
=============================================================================
3fv3J1 VAL 502 HA     0.00  -0.06   0.18  -0.75   4.13     3.50
3fv3J1 VAL 502 HB     0.00  -0.03   0.01  -0.04   2.12     2.06
3fv3J1 VAL 502 HG13   0.00  -0.00   0.03  -0.04   0.97     0.95
3fv3J1 VAL 502 HG23   0.00  -0.01  -0.07  -0.04   0.95     0.83
3fv3J1 VAL 503 H      0.00   0.19   0.02  -0.55   8.24     7.91
3fv3J1 VAL 503 HA     0.00   0.22   0.47  -0.75   4.13     4.07
3fv3J1 VAL 503 HB     0.00  -0.04   0.05  -0.04   2.12     2.10
3fv3J1 VAL 503 HG13   0.00   0.01   0.02  -0.04   0.97     0.95
3fv3J1 VAL 503 HG23   0.00   0.01  -0.17  -0.04   0.95     0.74
3fv3J1 ALA 505 HA     0.00   0.02   0.15  -0.75   4.34     3.75
3fv3J1 ALA 505 HB3    0.00  -0.00   0.03  -0.04   1.41     1.40