=============================================================================
          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
=============================================================================
1gvkA1 ASN   5 H      0.00   0.13   0.04  -0.55   8.53     8.16
1gvkA1 ASN   5 HA     0.00  -0.03   0.21  -0.75   4.76     4.19
1gvkA1 ASN   5 HB2    0.00  -0.05   0.05  -0.04   2.88     2.84
1gvkA1 ASN   5 HB3    0.00   0.03  -0.10  -0.04   2.79     2.68
1gvkA1 ASN   5 HD21   0.00   0.00   0.04  -0.04   7.03     7.03
1gvkA1 ASN   5 HD22   0.00  -0.03   0.01  -0.04   7.74     7.68
1gvkA1 PRO   6 HA     0.00   0.00   0.41  -0.51   4.44     4.35
1gvkA1 PRO   6 HB2    0.00   0.03   0.02  -0.04   2.28     2.29
1gvkA1 PRO   6 HB3    0.00   0.01   0.08  -0.04   2.02     2.06
1gvkA1 PRO   6 HG2    0.00   0.04   0.07  -0.04   2.03     2.10
1gvkA1 PRO   6 HG3    0.00   0.04   0.07  -0.04   2.03     2.09
1gvkA1 PRO   6 HD2    0.00   0.10   0.16  -0.04   3.68     3.90
1gvkA1 PRO   6 HD3    0.00   0.12   0.16  -0.04   3.65     3.89
1gvkA1 ILE   7 H      0.00   0.07   0.11  -0.55   8.25     7.88
1gvkA1 ILE   7 HA     0.00   0.24   0.65  -0.75   4.18     4.32
1gvkA1 ILE   7 HB     0.00  -0.00   0.07  -0.04   1.89     1.91
1gvkA1 ILE   7 HG12   0.00   0.07   0.03  -0.04   1.49     1.55
1gvkA1 ILE   7 HG13   0.00  -0.03   0.09  -0.04   1.21     1.22
1gvkA1 ILE   7 HG23   0.00   0.06  -0.13  -0.04   0.93     0.82
1gvkA1 ILE   7 HD13   0.00  -0.00   0.02  -0.04   0.88     0.85