=============================================================================
          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
=============================================================================
2w6uC1 SER   3 HA     0.00  -0.04   0.14  -0.75   4.49     3.84
2w6uC1 SER   3 HB2    0.00   0.01   0.08  -0.04   3.95     4.00
2w6uC1 SER   3 HB3    0.00  -0.01   0.06  -0.04   3.93     3.94
2w6uC1 ALA   4 H      0.00   0.05   0.02  -0.55   8.40     7.93
2w6uC1 ALA   4 HA     0.00   0.12  -0.45  -0.75   4.34     3.26
2w6uC1 ALA   4 HB3    0.00   0.03   0.04  -0.04   1.41     1.44
2w6uC1 ASP   7 HA     0.00   0.02  -0.53  -0.75   4.63     3.37
2w6uC1 ASP   7 HB2    0.00   0.07  -0.06  -0.04   2.71     2.68
2w6uC1 ASP   7 HB3    0.00  -0.07  -0.17  -0.04   2.70     2.43
2w6uC1 SER   9 HA     0.00  -0.02   0.07  -0.75   4.49     3.78
2w6uC1 SER   9 HB2    0.00  -0.00  -0.04  -0.04   3.95     3.87
2w6uC1 SER   9 HB3    0.00  -0.04  -0.80  -0.04   3.93     3.05