=============================================================================
          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
=============================================================================
2wa9H1 LEU   1 HA     0.00  -0.12   0.20  -0.75   4.35     3.68
2wa9H1 LEU   1 HB2    0.00   0.04   0.00  -0.04   1.64     1.64
2wa9H1 LEU   1 HB3    0.00  -0.04   0.06  -0.04   1.64     1.62
2wa9H1 LEU   1 HG     0.00  -0.01   0.04  -0.04   1.64     1.63
2wa9H1 LEU   1 HD13   0.00  -0.01   0.01  -0.04   0.93     0.90
2wa9H1 LEU   1 HD23   0.00  -0.01   0.04  -0.04   0.89     0.87
2wa9H1 LEU   2 H      0.00   0.00   0.06  -0.55   8.37     7.89
2wa9H1 LEU   2 HA     0.00   0.14   0.60  -0.75   4.35     4.33
2wa9H1 LEU   2 HB2    0.00  -0.02   0.07  -0.04   1.64     1.65
2wa9H1 LEU   2 HB3    0.00  -0.09   0.09  -0.04   1.64     1.60
2wa9H1 LEU   2 HG     0.00   0.01   0.03  -0.04   1.64     1.64
2wa9H1 LEU   2 HD13   0.00   0.00   0.01  -0.04   0.93     0.90
2wa9H1 LEU   2 HD23   0.00   0.01   0.05  -0.04   0.89     0.91
2wa9H1 THR   3 H      0.00   0.15   0.04  -0.55   8.28     7.93
2wa9H1 THR   3 HA     0.00   0.27   0.67  -0.75   4.39     4.58
2wa9H1 THR   3 HB     0.00   0.10  -0.05  -0.04   4.32     4.33
2wa9H1 THR   3 HG23   0.00   0.01  -0.07  -0.04   1.22     1.12