=============================================================================
          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
=============================================================================
2b2wD1 ALA   1 HA     0.00  -0.09   0.19  -0.75   4.34     3.69
2b2wD1 ALA   1 HB3    0.00  -0.02   0.02  -0.04   1.41     1.37
2b2wD1 ARG   2 H      0.00   0.03   0.10  -0.55   8.46     8.03
2b2wD1 ARG   2 HA     0.00   0.09   0.32  -0.75   4.34     3.99
2b2wD1 ARG   2 HB2    0.00  -0.06   0.11  -0.04   1.90     1.91
2b2wD1 ARG   2 HB3    0.00   0.09  -0.01  -0.04   1.80     1.84
2b2wD1 ARG   2 HG2    0.00   0.04   0.03  -0.04   1.67     1.70
2b2wD1 ARG   2 HG3    0.00  -0.04   0.02  -0.04   1.67     1.62
2b2wD1 ARG   2 HD2    0.00   0.03   0.01  -0.04   3.22     3.21
2b2wD1 ARG   2 HD3    0.00  -0.02   0.01  -0.04   3.22     3.17
2b2wD1 THR   3 H      0.00   0.28   0.11  -0.55   8.28     8.12
2b2wD1 THR   3 HA     0.00   0.18   0.67  -0.75   4.39     4.49
2b2wD1 THR   3 HB     0.00  -0.02   0.10  -0.04   4.32     4.37
2b2wD1 THR   3 HG23   0.00   0.03  -0.18  -0.04   1.22     1.03
2b2wD1 GLN   5 HA     0.00  -0.02   0.02  -0.75   4.36     3.61
2b2wD1 GLN   5 HB2    0.00   0.00   0.13  -0.04   2.15     2.24
2b2wD1 GLN   5 HB3    0.00  -0.01   0.02  -0.04   2.02     1.99
2b2wD1 GLN   5 HG2    0.00  -0.02  -0.18  -0.04   2.40     2.15
2b2wD1 GLN   5 HG3    0.00   0.12  -0.24  -0.04   2.39     2.23
2b2wD1 GLN   5 HE21   0.00  -0.01   0.00  -0.04   6.97     6.92
2b2wD1 GLN   5 HE22   0.00   0.02   0.02  -0.04   7.69     7.70