=============================================================================
          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
=============================================================================
1yguD1 PRO 2002 HA     0.00  -0.05   0.16  -0.51   4.44     4.04
1yguD1 PRO 2002 HB2    0.00  -0.00  -0.08  -0.04   2.28     2.15
1yguD1 PRO 2002 HB3    0.00  -0.02   0.08  -0.04   2.02     2.04
1yguD1 PRO 2002 HG2    0.00  -0.01   0.01  -0.04   2.03     1.99
1yguD1 PRO 2002 HG3    0.00  -0.01   0.04  -0.04   2.03     2.02
1yguD1 PRO 2002 HD2    0.00  -0.01   0.03  -0.04   3.68     3.66
1yguD1 PRO 2002 HD3    0.00  -0.02   0.04  -0.04   3.65     3.63
1yguD1 THR 2003 H      0.00   0.21   0.05  -0.55   8.28     7.99
1yguD1 THR 2003 HA     0.00   0.24   0.71  -0.75   4.39     4.58
1yguD1 THR 2003 HB     0.00  -0.05  -0.07  -0.04   4.32     4.16
1yguD1 THR 2003 HG23   0.00   0.02  -0.47  -0.04   1.22     0.73
1yguD1 SER 2005 HA     0.00   0.00   0.07  -0.75   4.49     3.81
1yguD1 SER 2005 HB2    0.00   0.00   0.00  -0.04   3.95     3.92
1yguD1 SER 2005 HB3    0.00  -0.01  -0.13  -0.04   3.93     3.75