=============================================================================
          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
=============================================================================
2ap2E1 SER 123 HA     0.00  -0.17   0.00  -0.75   4.49     3.57
2ap2E1 SER 123 HB2    0.00  -0.12   0.00  -0.04   3.95     3.79
2ap2E1 SER 123 HB3    0.00   0.04   0.00  -0.04   3.93     3.93