=============================================================================
          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
=============================================================================
3meaB1 ALA   1 HA     0.00  -0.07   0.17  -0.75   4.34     3.68
3meaB1 ALA   1 HB3    0.00  -0.01  -0.04  -0.04   1.41     1.32
3meaB1 ARG   2 H      0.00   0.12   0.07  -0.55   8.46     8.10
3meaB1 ARG   2 HA     0.00   0.13   0.85  -0.75   4.34     4.57
3meaB1 ARG   2 HB2    0.00  -0.00   0.05  -0.04   1.90     1.90
3meaB1 ARG   2 HB3    0.00  -0.04   0.17  -0.04   1.80     1.89
3meaB1 ARG   2 HG2    0.00   0.14  -0.15  -0.04   1.67     1.62
3meaB1 ARG   2 HG3    0.00  -0.01   0.02  -0.04   1.67     1.65
3meaB1 ARG   2 HD2    0.00  -0.02   0.00  -0.04   3.22     3.16
3meaB1 ARG   2 HD3    0.00  -0.03  -0.01  -0.04   3.22     3.15
3meaB1 THR   3 H      0.00   0.16  -0.01  -0.55   8.28     7.89
3meaB1 THR   3 HA     0.00   0.21   0.55  -0.75   4.39     4.40
3meaB1 THR   3 HB     0.00   0.01   0.04  -0.04   4.32     4.33
3meaB1 THR   3 HG23   0.00   0.03  -0.11  -0.04   1.22     1.09