=============================================================================
          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
=============================================================================
1fyrI1 VAL   1 HA     0.00   0.00   0.20  -0.75   4.13     3.58
1fyrI1 VAL   1 HB     0.00  -0.04   0.02  -0.04   2.12     2.07
1fyrI1 VAL   1 HG13   0.00   0.00  -0.08  -0.04   0.97     0.85
1fyrI1 VAL   1 HG23   0.00   0.00   0.03  -0.04   0.95     0.94
1fyrI1 ASN   2 H      0.00   0.19   0.05  -0.55   8.53     8.22
1fyrI1 ASN   2 HA     0.00   0.20   0.79  -0.75   4.76     5.00
1fyrI1 ASN   2 HB2    0.00  -0.01   0.17  -0.04   2.88     3.00
1fyrI1 ASN   2 HB3    0.00  -0.01   0.02  -0.04   2.79     2.76
1fyrI1 ASN   2 HD21   0.00  -0.01  -0.02  -0.04   7.03     6.96
1fyrI1 ASN   2 HD22   0.00  -0.01   0.03  -0.04   7.74     7.71
1fyrI1 VAL   3 H      0.00   0.27  -0.36  -0.55   8.24     7.59
1fyrI1 VAL   3 HA     0.00   0.27   0.76  -0.75   4.13     4.41
1fyrI1 VAL   3 HB     0.00   0.02  -0.00  -0.04   2.12     2.09
1fyrI1 VAL   3 HG13   0.00   0.00   0.02  -0.04   0.97     0.96
1fyrI1 VAL   3 HG23   0.00  -0.01  -0.20  -0.04   0.95     0.70