=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 20 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840    58.125   6.733  -6.076  -99.200  -91.000
       PHE  4     1.000    64.695   5.025 -11.587  -99.200  -91.000
       HIS  7     0.900    63.735  12.895 -17.904  -99.200  -91.000
       TYR  8     0.840    51.155  14.034 -13.649  -99.200  -91.000
       TYR 13     0.840    43.883   1.579 -17.092  -99.200  -91.000
       PHE 24     1.000    34.451   6.973 -24.212  -99.200  -91.000
       HIS 31     0.900    43.713  12.587 -30.581  -99.200  -91.000
       PHE 42     1.000    43.734  13.537 -24.079  -99.200  -91.000
       PHE 54     1.000    36.014   2.618 -26.073  -99.200  -91.000
       TYR 57     0.840    50.502   6.763 -22.936  -99.200  -91.000
       TYR 60     0.840    48.605  16.902 -20.645  -99.200  -91.000
       HIS 69     0.900    42.721  17.131 -20.581  -99.200  -91.000
       HIS 74     0.900    40.267  20.407 -24.782  -99.200  -91.000
       TYR 75     0.840    38.174  16.846 -17.790  -99.200  -91.000
       TRP 78     1.040    35.426  13.034 -23.323  -99.200  -91.000
      TRP6 78     1.020    36.182  12.196 -21.238  -99.200  -91.000
       TRP 85     1.040    26.574   8.517 -23.478  -99.200  -91.000
      TRP6 85     1.020    27.818   9.798 -25.013  -99.200  -91.000
       TYR 94     0.840    51.771   4.041 -14.819  -99.200  -91.000
       TYR 98     0.840    65.179   5.893 -20.475  -99.200  -91.000