=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 1 rings
        ring        int.           center             anis.    iso.
       TYR  2     0.840    -0.642  21.155 114.009  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1mhwG1 CYS  42 HA     0.03  -0.01   0.09  -0.75   4.58     3.94
1mhwG1 CYS  42 HB2    0.03  -0.02   0.01  -0.04   2.97     2.94
1mhwG1 CYS  42 HB3    0.04   0.10   0.06  -0.04   2.97     3.13
1mhwG1 TYR  44 HA     0.00   0.01   0.05  -0.75   4.56     3.86
1mhwG1 TYR  44 HB2    0.00   0.00   0.03  -0.04   3.06     3.05
1mhwG1 TYR  44 HB3    0.00   0.00   0.04  -0.04   2.98     2.98
1mhwG1 TYR  44 HD2    0.00   0.00   0.01  -0.04   7.15     7.12
1mhwG1 TYR  44 HE2    0.00  -0.00   0.00  -0.04   6.85     6.81