=============================================================================
          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
=============================================================================
1a16L1 PRO   1 HA     0.00  -0.13   0.21  -0.51   4.44     4.01
1a16L1 PRO   1 HB2    0.00   0.03  -0.08  -0.04   2.28     2.19
1a16L1 PRO   1 HB3    0.00  -0.05   0.02  -0.04   2.02     1.95
1a16L1 PRO   1 HG2    0.00   0.01   0.02  -0.04   2.03     2.01
1a16L1 PRO   1 HG3    0.00  -0.01   0.03  -0.04   2.03     2.01
1a16L1 PRO   1 HD2    0.00   0.01   0.05  -0.04   3.68     3.69
1a16L1 PRO   1 HD3    0.00  -0.00   0.03  -0.04   3.65     3.64
1a16L1 LEU   2 H      0.00   0.07   0.00  -0.55   8.37     7.90
1a16L1 LEU   2 HA     0.00   0.25   0.66  -0.75   4.35     4.51
1a16L1 LEU   2 HB2    0.00   0.03  -0.08  -0.04   1.64     1.54
1a16L1 LEU   2 HB3    0.00  -0.01   0.05  -0.04   1.64     1.65
1a16L1 LEU   2 HG     0.00  -0.00   0.04  -0.04   1.64     1.64
1a16L1 LEU   2 HD13   0.00   0.01   0.02  -0.04   0.93     0.93
1a16L1 LEU   2 HD23   0.00  -0.00   0.00  -0.04   0.89     0.85