=============================================================================
          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
=============================================================================
1btwH1 ALA 733 H      0.00   0.19   0.10  -0.55   8.40     8.15
1btwH1 ALA 733 HA     0.00  -0.17   0.21  -0.75   4.34     3.63
1btwH1 ALA 733 HB3    0.00   0.01   0.01  -0.04   1.41     1.39
1btwH1 VAL 734 H      0.00   0.10   0.00  -0.55   8.24     7.79
1btwH1 VAL 734 HA     0.00   0.12   0.30  -0.75   4.13     3.80
1btwH1 VAL 734 HB     0.00  -0.02   0.11  -0.04   2.12     2.17
1btwH1 VAL 734 HG13   0.00   0.01   0.03  -0.04   0.97     0.97
1btwH1 VAL 734 HG23   0.00   0.02   0.03  -0.04   0.95     0.95