=============================================================================
          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
=============================================================================
1bx9B1 GLU 101 HA     0.00   0.00   0.02  -0.75   4.29     3.56
1bx9B1 GLU 101 HB2    0.00   0.02   0.06  -0.04   2.09     2.13
1bx9B1 GLU 101 HB3    0.00  -0.02   0.06  -0.04   1.99     1.99
1bx9B1 GLU 101 HG2    0.00  -0.03   0.17  -0.04   2.34     2.43
1bx9B1 GLU 101 HG3    0.00   0.01   0.40  -0.04   2.34     2.71
1bx9B1 GLY 103 HA2    0.00  -0.01   0.03  -0.51   4.01     3.52
1bx9B1 GLY 103 HA3    0.00   0.01   0.04  -0.51   4.01     3.54