=============================================================================
          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
=============================================================================
1vdnB1 ALA   2 HA     0.00  -0.02   0.11  -0.75   4.34     3.68
1vdnB1 ALA   2 HB3    0.00  -0.03  -0.00  -0.04   1.41     1.34
1vdnB1 ALA   3 H      0.00   0.21   0.08  -0.55   8.40     8.14
1vdnB1 ALA   3 HA     0.00  -0.01   0.56  -0.75   4.34     4.13
1vdnB1 ALA   3 HB3    0.00  -0.02   0.05  -0.04   1.41     1.40
1vdnB1 PRO   4 HA     0.00  -0.08   0.41  -0.51   4.44     4.26
1vdnB1 PRO   4 HB2    0.00   0.11  -0.03  -0.04   2.28     2.32
1vdnB1 PRO   4 HB3    0.00  -0.01   0.09  -0.04   2.02     2.05
1vdnB1 PRO   4 HG2    0.00   0.04   0.09  -0.04   2.03     2.12
1vdnB1 PRO   4 HG3    0.00   0.00   0.08  -0.04   2.03     2.07
1vdnB1 PRO   4 HD2    0.00   0.13   0.24  -0.04   3.68     4.01
1vdnB1 PRO   4 HD3    0.00   0.05   0.24  -0.04   3.65     3.90
1vdnB1 ALA   5 H      0.00   0.04   0.08  -0.55   8.40     7.97
1vdnB1 ALA   5 HA     0.00   0.26   0.31  -0.75   4.34     4.15
1vdnB1 ALA   5 HB3    0.00   0.01   0.09  -0.04   1.41     1.46