=============================================================================
          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   -26.826  36.201  26.746  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2azbI1 ALA 201 HA    -0.36  -0.15   0.24  -0.75   4.34     3.31
2azbI1 ALA 201 HB3   -0.30  -0.01  -0.01  -0.04   1.41     1.05
2azbI1 VAL 202 H     -0.47   0.16   0.02  -0.55   8.24     7.41
2azbI1 VAL 202 HA    -0.20   0.12   0.71  -0.75   4.13     4.02
2azbI1 VAL 202 HB    -0.15  -0.02   0.13  -0.04   2.12     2.05
2azbI1 VAL 202 HG13  -0.06  -0.00  -0.06  -0.04   0.97     0.80
2azbI1 VAL 202 HG23  -0.10   0.02  -0.15  -0.04   0.95     0.68
2azbI1 PHE 203 H     -0.11   0.39  -0.03  -0.55   8.34     8.04
2azbI1 PHE 203 HA     0.00   0.16   0.46  -0.75   4.62     4.49
2azbI1 PHE 203 HB2    0.00   0.02   0.02  -0.04   3.15     3.15
2azbI1 PHE 203 HB3    0.00   0.03   0.06  -0.04   3.06     3.10
2azbI1 PHE 203 HD2    0.00   0.03  -0.05  -0.04   7.28     7.21
2azbI1 PHE 203 HE2    0.00   0.02  -0.06  -0.04   7.38     7.29
2azbI1 PHE 203 HZ     0.00   0.01  -0.05  -0.04   7.32     7.24