=============================================================================
          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
=============================================================================
3hu6D1 GLU  97 HA     0.00  -0.12   0.22  -0.75   4.29     3.64
3hu6D1 VAL  98 H      0.00   0.03   0.09  -0.55   8.24     7.82
3hu6D1 VAL  98 HA     0.00   0.07   0.52  -0.75   4.13     3.97
3hu6D1 VAL  98 HB     0.00  -0.03   0.11  -0.04   2.12     2.16
3hu6D1 VAL  98 HG13   0.00  -0.00  -0.06  -0.04   0.97     0.86
3hu6D1 VAL  98 HG23   0.00  -0.00   0.05  -0.04   0.95     0.96
3hu6D1 THR  99 H      0.00   0.24   0.27  -0.55   8.28     8.24
3hu6D1 THR  99 HA     0.00   0.10   0.58  -0.75   4.39     4.32
3hu6D1 THR  99 HB     0.00   0.02   0.14  -0.04   4.32     4.44
3hu6D1 THR  99 HG23   0.00   0.03  -0.11  -0.04   1.22     1.10
3hu6D1 SER 100 H      0.00   0.23   0.17  -0.55   8.46     8.31
3hu6D1 SER 100 HA     0.00   0.19   0.83  -0.75   4.49     4.75
3hu6D1 SER 100 HB2    0.00   0.07  -0.11  -0.04   3.95     3.87
3hu6D1 SER 100 HB3    0.00   0.10  -0.00  -0.04   3.93     3.98
3hu6D1 THR 101 H      0.00  -0.14   0.23  -0.55   8.28     7.81
3hu6D1 THR 101 HA     0.00   0.23   0.83  -0.75   4.39     4.69
3hu6D1 THR 101 HB     0.00   0.01   0.11  -0.04   4.32     4.40
3hu6D1 THR 101 HG23   0.00   0.00  -0.17  -0.04   1.22     1.01
3hu6D1 THR 102 H      0.00  -0.28   0.12  -0.55   8.28     7.57
3hu6D1 THR 102 HA     0.00   0.22   0.50  -0.75   4.39     4.36