=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 36 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    54.482 -13.516  57.755  -99.200  -91.000
       PHE  9     1.000    43.674  -6.084  54.221  -99.200  -91.000
       PHE 11     1.000    41.700  -0.283  52.247  -99.200  -91.000
       HIS 19     0.900    48.742   3.667  55.708  -99.200  -91.000
       PHE 33     1.000    54.474  -6.345  37.740  -99.200  -91.000
       PHE 37     1.000    44.106  -5.424  42.367  -99.200  -91.000
       TYR 40     0.840    30.794  -3.986  45.175  -99.200  -91.000
       TYR 47     0.840    39.113   3.583  42.394  -99.200  -91.000
       PHE 50     1.000    50.538  -3.878  44.511  -99.200  -91.000
       TYR 52     0.840    57.209  -2.579  44.100  -99.200  -91.000
       TYR 64     0.840    45.703   6.963  39.842  -99.200  -91.000
       TYR 71     0.840    40.481  -1.330  35.318  -99.200  -91.000
       TYR 74     0.840    51.061   5.834  36.620  -99.200  -91.000
       HIS 78     0.900    59.246   5.866  31.296  -99.200  -91.000
       PHE 88     1.000    30.252   3.887  39.310  -99.200  -91.000
       HIS 93     0.900    40.512 -11.791  39.398  -99.200  -91.000
       TRP 98     1.040    56.499  -4.151  32.342  -99.200  -91.000
      TRP6 98     1.020    58.619  -4.327  33.383  -99.200  -91.000
       PHE 107     1.000    46.038  -2.850  33.630  -99.200  -91.000
       TRP 108     1.040    45.011 -11.093  30.994  -99.200  -91.000
      TRP6 108     1.020    44.091 -12.760  29.583  -99.200  -91.000
       TYR 123     0.840    62.820   0.507  35.460  -99.200  -91.000
       PHE 124     1.000    66.478  -6.522  35.254  -99.200  -91.000
       TYR 140     0.840    61.053   3.014  51.051  -99.200  -91.000
       PHE 144     1.000    49.858   7.043  52.596  -99.200  -91.000
       PHE 150     1.000    39.524   0.315  46.792  -99.200  -91.000
       TYR 158     0.840    46.058 -15.157  45.567  -99.200  -91.000
       TRP 160     1.040    51.482 -15.995  41.085  -99.200  -91.000
      TRP6 160     1.020    49.415 -14.872  40.889  -99.200  -91.000
       TYR 173     0.840    36.626 -13.833  36.277  -99.200  -91.000
       TRP 185     1.040    43.021 -12.587  50.466  -99.200  -91.000
      TRP6 185     1.020    43.520 -10.292  50.735  -99.200  -91.000
       TYR 190     0.840    46.893  -8.147  57.668  -99.200  -91.000
       TYR 195     0.840    36.466   2.939  60.039  -99.200  -91.000
       TRP 203     1.040    32.495  -7.750  47.538  -99.200  -91.000
      TRP6 203     1.020    34.353  -7.903  46.083  -99.200  -91.000