=============================================================================
          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.
       PHE  3     1.000     4.605 -10.636   8.142  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2g30S1 ALA   6 HA     0.02  -0.12   0.18  -0.75   4.34     3.66
2g30S1 ALA   6 HB3    0.00  -0.00   0.07  -0.04   1.41     1.44
2g30S1 ALA   7 H      0.01   0.04   0.10  -0.55   8.40     8.00
2g30S1 ALA   7 HA    -0.18   0.16  -0.06  -0.75   4.34     3.50
2g30S1 ALA   7 HB3   -0.34   0.01   0.02  -0.04   1.41     1.06
2g30S1 PHE   8 H      0.10   0.01  -0.07  -0.55   8.34     7.82
2g30S1 PHE   8 HA     0.00   0.27   0.72  -0.75   4.62     4.85
2g30S1 PHE   8 HB2    0.00  -0.02   0.03  -0.04   3.15     3.12
2g30S1 PHE   8 HB3    0.00   0.03   0.05  -0.04   3.06     3.10
2g30S1 PHE   8 HD2    0.00  -0.02  -0.03  -0.04   7.28     7.18
2g30S1 PHE   8 HE2    0.00  -0.00  -0.03  -0.04   7.38     7.30
2g30S1 PHE   8 HZ     0.00  -0.00  -0.03  -0.04   7.32     7.24