=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 18 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    25.005 -16.274 -13.292  -99.200  -91.000
       PHE  6     1.000     9.495 -14.412  -8.597  -99.200  -91.000
       PHE 28     1.000    14.773 -16.488  -7.450  -99.200  -91.000
       TYR 42     0.840    13.859 -16.968   5.602  -99.200  -91.000
       PHE 62     1.000     6.314 -18.333   5.340  -99.200  -91.000
       PHE 63     1.000     2.168 -21.203   5.241  -99.200  -91.000
       PHE 75     1.000     2.243 -16.839   1.159  -99.200  -91.000
       TYR 76     0.840    -1.762 -22.692   6.524  -99.200  -91.000
       PHE 79     1.000     2.549 -25.061   2.329  -99.200  -91.000
       PHE 92     1.000     0.414 -15.839  -3.591  -99.200  -91.000
       TYR 94     0.840    -0.255 -12.312   1.333  -99.200  -91.000
       PHE 96     1.000     5.878 -11.710   2.376  -99.200  -91.000
       TYR 98     0.840     4.185 -11.139  13.347  -99.200  -91.000
       HIS 108     0.900     6.805 -19.710  -9.273  -99.200  -91.000
       TYR 118     0.840     4.484 -28.980  -1.255  -99.200  -91.000
       TRP 119     1.040    11.745 -25.278  -4.393  -99.200  -91.000
      TRP6 119     1.020    13.706 -24.813  -3.171  -99.200  -91.000
       PHE 121     1.000    11.298 -20.645  -5.887  -99.200  -91.000