=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       TYR  9     0.840     6.648   1.476  -1.059  -99.200  -91.000
       HIS 11     0.900     1.876   2.397  -5.584  -99.200  -91.000
       PHE 17     1.000    -4.137  -3.220  -0.259  -99.200  -91.000
       TYR 42     0.840     8.324   3.751  -8.672  -99.200  -91.000
       PHE 46     1.000    18.346   1.148  -7.468  -99.200  -91.000
       PHE 65     1.000    29.651  -2.058 -19.848  -99.200  -91.000
       TYR 67     0.840    25.690  -4.198 -15.599  -99.200  -91.000
       HIS 72     0.900    33.047 -12.011 -10.643  -99.200  -91.000
       TYR 75     0.840    31.260  -7.843  -4.334  -99.200  -91.000
       PHE 99     1.000    13.083  -8.511  -3.005  -99.200  -91.000
       PHE 101     1.000     6.677  -7.489  -6.562  -99.200  -91.000
       TYR 104     0.840     3.758  -1.419 -12.533  -99.200  -91.000
       TRP 105     1.040     3.136  -5.018 -18.832  -99.200  -91.000
      TRP6 105     1.020     1.125  -5.707 -19.920  -99.200  -91.000
       PHE 106     1.000     0.779 -13.135 -16.137  -99.200  -91.000
       TRP 115     1.040    17.352  -3.032  -4.888  -99.200  -91.000
      TRP6 115     1.020    17.526  -5.274  -4.105  -99.200  -91.000
       PHE 124     1.000    25.705  -8.476  -2.286  -99.200  -91.000
       PHE 126     1.000    25.469 -14.304 -10.139  -99.200  -91.000
       PHE 131     1.000    24.888 -21.730 -10.946  -99.200  -91.000
       TYR 132     0.840    19.192 -22.455  -9.308  -99.200  -91.000
       TYR 155     0.840    -3.083 -13.425 -11.530  -99.200  -91.000
       TYR 166     0.840     0.813 -22.200 -14.066  -99.200  -91.000
       PHE 167     1.000     2.324 -13.878 -10.506  -99.200  -91.000
       TRP 169     1.040    10.756 -21.097 -13.156  -99.200  -91.000
      TRP6 169     1.020    11.389 -22.897 -11.776  -99.200  -91.000
       HIS 173     0.900    14.397 -22.594  -9.295  -99.200  -91.000
       HIS 177     0.900    16.667 -22.546  -4.814  -99.200  -91.000
       PHE 178     1.000    21.893 -18.184 -10.431  -99.200  -91.000
       PHE 181     1.000    17.738 -13.370  -0.717  -99.200  -91.000
       PHE 190     1.000    -4.595 -13.408  -5.605  -99.200  -91.000
       TRP 207     1.040     2.177  -7.266   4.833  -99.200  -91.000
      TRP6 207     1.020     3.649  -9.079   4.452  -99.200  -91.000
       TRP 215     1.040    11.046 -12.707  12.736  -99.200  -91.000
      TRP6 215     1.020    12.760 -12.369  11.128  -99.200  -91.000
       HIS 225     0.900     5.544 -31.551  -6.816  -99.200  -91.000
       TRP 226     1.040     5.419 -24.219  -3.466  -99.200  -91.000
      TRP6 226     1.020     5.074 -22.032  -4.343  -99.200  -91.000
       HIS 227     0.900     8.053 -21.865  -8.130  -99.200  -91.000
       PHE 228     1.000     6.621 -23.749 -13.431  -99.200  -91.000