=============================================================================
          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
=============================================================================
2dxpB1 ALA 170 HA     0.00  -0.02   0.04  -0.75   4.34     3.61
2dxpB1 ALA 170 HB3    0.00  -0.00   0.03  -0.04   1.41     1.40
2dxpB1 ARG 172 HA     0.00  -0.01   0.04  -0.75   4.34     3.62
2dxpB1 ARG 172 HB2    0.00  -0.01   0.03  -0.04   1.90     1.87
2dxpB1 ARG 172 HB3    0.00  -0.00   0.02  -0.04   1.80     1.77
2dxpB1 ARG 172 HG2    0.00   0.04   0.16  -0.04   1.67     1.83
2dxpB1 ARG 172 HG3    0.00  -0.01   0.05  -0.04   1.67     1.67
2dxpB1 ARG 172 HD2    0.00  -0.01   0.01  -0.04   3.22     3.18
2dxpB1 ARG 172 HD3    0.00   0.02   0.02  -0.04   3.22     3.22