=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 14 rings
        ring        int.           center             anis.    iso.
       TYR 15     0.840    20.959   7.960  51.212  -99.200  -91.000
       HIS 21     0.900    23.115   7.794  57.967  -99.200  -91.000
       PHE 31     1.000    10.729  17.779  60.237  -99.200  -91.000
       TYR 32     0.840    11.898  15.461  64.406  -99.200  -91.000
       PHE 44     1.000    -0.456  18.008  66.575  -99.200  -91.000
       PHE 45     1.000     6.234  16.027  67.043  -99.200  -91.000
       PHE 60     1.000     8.784   6.846  56.342  -99.200  -91.000
       PHE 61     1.000    13.611  13.257  54.596  -99.200  -91.000
       TYR 71     0.840    10.153   3.014  59.593  -99.200  -91.000
       HIS 80     0.900     2.517   9.784  61.760  -99.200  -91.000
       HIS 88     0.900    -3.134  24.836  60.302  -99.200  -91.000
       HIS 89     0.900    -2.839  20.275  63.268  -99.200  -91.000
       PHE 90     1.000     1.648  15.883  55.239  -99.200  -91.000
       HIS 96     0.900     8.223  24.529  61.004  -99.200  -91.000