=============================================================================
          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
=============================================================================
1xb0I1 ALA 901 HA     0.00  -0.05   0.15  -0.75   4.34     3.68
1xb0I1 ALA 901 HB3    0.00  -0.03   0.02  -0.04   1.41     1.36
1xb0I1 VAL 902 H      0.00   0.16   0.11  -0.55   8.24     7.96
1xb0I1 VAL 902 HA     0.00   0.21   0.87  -0.75   4.13     4.45
1xb0I1 VAL 902 HB     0.00  -0.08  -0.01  -0.04   2.12     1.99
1xb0I1 VAL 902 HG13   0.00   0.06  -0.04  -0.04   0.97     0.94
1xb0I1 VAL 902 HG23   0.00  -0.01  -0.19  -0.04   0.95     0.71
1xb0I1 PRO 903 HA     0.00   0.04   0.49  -0.51   4.44     4.46
1xb0I1 PRO 903 HB2    0.00   0.03  -0.01  -0.04   2.28     2.26
1xb0I1 PRO 903 HB3    0.00   0.03   0.10  -0.04   2.02     2.11
1xb0I1 PRO 903 HG2    0.00   0.01   0.08  -0.04   2.03     2.08
1xb0I1 PRO 903 HG3    0.00   0.04   0.07  -0.04   2.03     2.11
1xb0I1 PRO 903 HD2    0.00   0.11   0.25  -0.04   3.68     4.00
1xb0I1 PRO 903 HD3    0.00   0.15   0.13  -0.04   3.65     3.89
1xb0I1 ILE 904 H      0.00   0.13   0.09  -0.55   8.25     7.92
1xb0I1 ILE 904 HA     0.00   0.20   0.39  -0.75   4.18     4.02
1xb0I1 ILE 904 HB     0.00  -0.01   0.10  -0.04   1.89     1.94
1xb0I1 ILE 904 HG12   0.00   0.06  -0.01  -0.04   1.49     1.50
1xb0I1 ILE 904 HG13   0.00  -0.03   0.08  -0.04   1.21     1.22
1xb0I1 ILE 904 HG23   0.00   0.01   0.04  -0.04   0.93     0.94
1xb0I1 ILE 904 HD13   0.00  -0.00   0.02  -0.04   0.88     0.86