=============================================================================
          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
=============================================================================
1is0C1 GLU 253 HA     0.00  -0.08   0.20  -0.75   4.29     3.66
1is0C1 GLU 253 HB2    0.00  -0.03  -0.07  -0.04   2.09     1.96
1is0C1 GLU 253 HB3    0.00   0.04  -0.02  -0.04   1.99     1.97
1is0C1 GLU 253 HG2    0.00  -0.01   0.03  -0.04   2.34     2.32
1is0C1 GLU 253 HG3    0.00  -0.01   0.00  -0.04   2.34     2.29
1is0C1 GLU 254 H      0.00   0.14   0.13  -0.55   8.60     8.32
1is0C1 GLU 254 HA     0.00   0.19   0.86  -0.75   4.29     4.58
1is0C1 GLU 254 HB2    0.00  -0.04   0.08  -0.04   2.09     2.09
1is0C1 GLU 254 HB3    0.00   0.03  -0.01  -0.04   1.99     1.96
1is0C1 GLU 254 HG2    0.00   0.03   0.02  -0.04   2.34     2.35
1is0C1 GLU 254 HG3    0.00   0.02  -0.20  -0.04   2.34     2.12
1is0C1 ILE 255 H      0.00   0.24   0.04  -0.55   8.25     7.98
1is0C1 ILE 255 HA     0.00   0.25   0.72  -0.75   4.18     4.39
1is0C1 ILE 255 HB     0.00   0.00   0.07  -0.04   1.89     1.92
1is0C1 ILE 255 HG12   0.00   0.05  -0.13  -0.04   1.49     1.37
1is0C1 ILE 255 HG13   0.00  -0.00  -0.21  -0.04   1.21     0.95
1is0C1 ILE 255 HG23   0.00   0.01   0.03  -0.04   0.93     0.93
1is0C1 ILE 255 HD13   0.00   0.00  -0.03  -0.04   0.88     0.81