=============================================================================
          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  2     1.000    42.783  11.221  14.800  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1r1lD1 LEU  11 HA     0.21  -0.15   0.21  -0.75   4.35     3.87
1r1lD1 LEU  11 HB2    0.05   0.01  -0.08  -0.04   1.64     1.58
1r1lD1 LEU  11 HB3    0.05  -0.03   0.04  -0.04   1.64     1.67
1r1lD1 LEU  11 HG    -0.02  -0.01   0.04  -0.04   1.64     1.61
1r1lD1 LEU  11 HD13  -0.04   0.01   0.00  -0.04   0.93     0.86
1r1lD1 LEU  11 HD23   0.01  -0.00  -0.00  -0.04   0.89     0.85
1r1lD1 PHE  12 H      0.55   0.04   0.00  -0.55   8.34     8.38
1r1lD1 PHE  12 HA     0.00   0.23   0.62  -0.75   4.62     4.72
1r1lD1 PHE  12 HB2    0.00  -0.01   0.07  -0.04   3.15     3.17
1r1lD1 PHE  12 HB3    0.00   0.02   0.05  -0.04   3.06     3.09
1r1lD1 PHE  12 HD2    0.00  -0.05   0.00  -0.04   7.28     7.19
1r1lD1 PHE  12 HE2    0.00   0.01  -0.03  -0.04   7.38     7.31
1r1lD1 PHE  12 HZ     0.00  -0.01  -0.03  -0.04   7.32     7.24