=============================================================================
          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
=============================================================================
3driB1 ALA   1 HA     0.00   0.00   0.14  -0.75   4.34     3.73
3driB1 ALA   1 HB3    0.00  -0.01   0.02  -0.04   1.41     1.38
3driB1 ALA   2 H      0.00   0.11   0.13  -0.55   8.40     8.09
3driB1 ALA   2 HA     0.00   0.15   0.84  -0.75   4.34     4.58
3driB1 ALA   2 HB3    0.00  -0.02   0.08  -0.04   1.41     1.42
3driB1 SER   3 H      0.00   0.06   0.14  -0.55   8.46     8.11
3driB1 SER   3 HA     0.00   0.15   0.63  -0.75   4.49     4.51
3driB1 SER   3 HB2    0.00  -0.00   0.03  -0.04   3.95     3.94
3driB1 SER   3 HB3    0.00   0.03   0.03  -0.04   3.93     3.94
3driB1 ALA   4 H      0.00   0.19   0.14  -0.55   8.40     8.19
3driB1 ALA   4 HA     0.00   0.15   0.86  -0.75   4.34     4.59
3driB1 ALA   4 HB3    0.00   0.03  -0.05  -0.04   1.41     1.35
3driB1 SER   5 H      0.00   0.14   0.10  -0.55   8.46     8.16
3driB1 SER   5 HA     0.00  -0.01   0.56  -0.75   4.49     4.29
3driB1 SER   5 HB2    0.00   0.02   0.12  -0.04   3.95     4.05
3driB1 SER   5 HB3    0.00   0.01   0.01  -0.04   3.93     3.92
3driB1 ALA   6 H      0.00   0.07   0.10  -0.55   8.40     8.03
3driB1 ALA   6 HA     0.00   0.04   0.07  -0.75   4.34     3.69
3driB1 ALA   6 HB3    0.00   0.10   0.12  -0.04   1.41     1.59