=============================================================================
          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
=============================================================================
1tnoN1 THR   6 HA     0.00  -0.03   0.20  -0.75   4.39     3.80
1tnoN1 THR   6 HB     0.00  -0.06   0.01  -0.04   4.32     4.23
1tnoN1 THR   6 HG23   0.00  -0.01  -0.07  -0.04   1.22     1.10
1tnoN1 LYS   7 H      0.00   0.19   0.13  -0.55   8.42     8.19
1tnoN1 LYS   7 HA     0.00   0.20   0.81  -0.75   4.32     4.58
1tnoN1 LYS   7 HB2    0.00  -0.10   0.06  -0.04   1.87     1.79
1tnoN1 LYS   7 HB3    0.00   0.07  -0.10  -0.04   1.79     1.72
1tnoN1 LYS   7 HG2    0.00   0.00  -0.04  -0.04   1.46     1.39
1tnoN1 LYS   7 HG3    0.00  -0.04  -0.15  -0.04   1.46     1.24
1tnoN1 LYS   7 HD2    0.00  -0.02  -0.07  -0.04   1.69     1.56
1tnoN1 LYS   7 HD3    0.00   0.03  -0.07  -0.04   1.68     1.60
1tnoN1 LYS   7 HE2    0.00  -0.01  -0.04  -0.04   2.99     2.90
1tnoN1 LYS   7 HE3    0.00   0.02  -0.04  -0.04   2.99     2.93
1tnoN1 CYS   8 H      0.00   0.18   0.07  -0.55   8.50     8.20
1tnoN1 CYS   8 HA     0.00   0.21   0.94  -0.75   4.58     4.97
1tnoN1 CYS   8 HB2    0.00  -0.02   0.14  -0.04   2.97     3.04
1tnoN1 CYS   8 HB3    0.00   0.01  -0.03  -0.04   2.97     2.91
1tnoN1 VAL   9 H      0.00   0.25   0.03  -0.55   8.24     7.96
1tnoN1 VAL   9 HA     0.00   0.07   0.69  -0.75   4.13     4.14
1tnoN1 VAL   9 HB     0.00   0.06   0.17  -0.04   2.12     2.31
1tnoN1 VAL   9 HG13   0.00  -0.02  -0.06  -0.04   0.97     0.85
1tnoN1 VAL   9 HG23   0.00   0.02  -0.04  -0.04   0.95     0.89
1tnoN1 ILE  10 H      0.00   0.19   0.16  -0.55   8.25     8.05
1tnoN1 ILE  10 HA     0.00   0.25   0.83  -0.75   4.18     4.51
1tnoN1 ILE  10 HB     0.00   0.02   0.14  -0.04   1.89     2.01
1tnoN1 ILE  10 HG12   0.00   0.00   0.08  -0.04   1.49     1.53
1tnoN1 ILE  10 HG13   0.00   0.00  -0.18  -0.04   1.21     1.00
1tnoN1 ILE  10 HG23   0.00   0.04  -0.15  -0.04   0.93     0.78
1tnoN1 ILE  10 HD13   0.00   0.00   0.00  -0.04   0.88     0.84
1tnoN1 MET  11 H      0.00  -0.02  -0.23  -0.55   8.47     7.67
1tnoN1 MET  11 HA     0.00   0.21   0.38  -0.75   4.52     4.35
1tnoN1 MET  11 HB2    0.00  -0.05  -0.08  -0.04   2.15     1.97
1tnoN1 MET  11 HB3    0.00   0.02   0.04  -0.04   2.03     2.05
1tnoN1 MET  11 HG2    0.00   0.02   0.09  -0.04   2.63     2.69
1tnoN1 MET  11 HG3    0.00   0.19  -0.31  -0.04   2.56     2.39
1tnoN1 MET  11 HE3    0.00  -0.01  -0.07  -0.04   2.10     1.99