=============================================================================
          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    14.089  59.865  39.727  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2az9I1 ALA 201 HA    -0.62  -0.20   0.22  -0.75   4.34     2.99
2az9I1 ALA 201 HB3   -0.42  -0.01   0.02  -0.04   1.41     0.97
2az9I1 VAL 202 H     -0.54   0.17  -0.01  -0.55   8.24     7.31
2az9I1 VAL 202 HA    -0.19   0.09   0.64  -0.75   4.13     3.92
2az9I1 VAL 202 HB    -0.14  -0.02   0.13  -0.04   2.12     2.06
2az9I1 VAL 202 HG13  -0.05  -0.01  -0.02  -0.04   0.97     0.85
2az9I1 VAL 202 HG23  -0.11   0.02  -0.15  -0.04   0.95     0.67
2az9I1 PHE 203 H     -0.10   0.41  -0.07  -0.55   8.34     8.02
2az9I1 PHE 203 HA     0.00   0.14   0.43  -0.75   4.62     4.43
2az9I1 PHE 203 HB2    0.00   0.01   0.03  -0.04   3.15     3.14
2az9I1 PHE 203 HB3    0.00   0.06   0.05  -0.04   3.06     3.12
2az9I1 PHE 203 HD2    0.00   0.04  -0.09  -0.04   7.28     7.19
2az9I1 PHE 203 HE2    0.00   0.02  -0.05  -0.04   7.38     7.30
2az9I1 PHE 203 HZ     0.00   0.02  -0.04  -0.04   7.32     7.26