=============================================================================
          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
=============================================================================
1hhzA1 LYS  12 H      0.00   0.10   0.10  -0.55   8.42     8.07
1hhzA1 LYS  12 HA     0.00   0.12   0.48  -0.75   4.32     4.16
1hhzA1 LYS  12 HB2    0.00  -0.01   0.10  -0.04   1.87     1.92
1hhzA1 LYS  12 HB3    0.00   0.03   0.06  -0.04   1.79     1.84
1hhzA1 ALA  13 H      0.00   0.29   0.28  -0.55   8.40     8.43
1hhzA1 ALA  13 HA     0.00   0.14   0.72  -0.75   4.34     4.45
1hhzA1 ALA  13 HB3    0.00   0.01  -0.06  -0.04   1.41     1.32
1hhzA1 ALA  14 H      0.00   0.30   0.05  -0.55   8.40     8.20
1hhzA1 ALA  14 HA     0.00   0.21   0.65  -0.75   4.34     4.44
1hhzA1 ALA  14 HB3    0.00   0.04  -0.10  -0.04   1.41     1.32