=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 34 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840    -2.351  66.420  28.426  -99.200  -91.000
       PHE  7     1.000     2.986  67.055  31.918  -99.200  -91.000
       HIS  8     0.900     4.334  71.614  22.646  -99.200  -91.000
       PHE 18     1.000    -2.764  62.529  23.532  -99.200  -91.000
       TYR 29     0.840     8.284  63.471  32.143  -99.200  -91.000
       TYR 49     0.840    -4.299  52.599  44.762  -99.200  -91.000
       HIS 51     0.900     2.996  52.587  36.011  -99.200  -91.000
       HIS 57     0.900    14.154  46.008  37.868  -99.200  -91.000
       HIS 59     0.900    16.101  45.752  32.598  -99.200  -91.000
       TYR 63     0.840     3.257  57.100  39.442  -99.200  -91.000
       PHE 64     1.000     9.209  60.399  35.708  -99.200  -91.000
       TRP 67     1.040    -3.352  65.397  36.172  -99.200  -91.000
      TRP6 67     1.020    -1.300  64.764  35.175  -99.200  -91.000
       HIS 72     0.900   -10.726  62.692  29.328  -99.200  -91.000
       TYR 79     0.840     8.976  59.031  24.053  -99.200  -91.000
       TYR 93     0.840     5.583  38.140   9.764  -99.200  -91.000
       TYR 98     0.840    12.497  36.445  11.254  -99.200  -91.000
       PHE 99     1.000    14.280  41.360  19.161  -99.200  -91.000
       TYR 117     0.840    10.992  46.524  41.246  -99.200  -91.000
       HIS 119     0.900     6.489  37.302  38.850  -99.200  -91.000
       HIS 125     0.900     2.419  43.238  33.058  -99.200  -91.000
       PHE 134     1.000     5.475  50.422  26.104  -99.200  -91.000
       PHE 140     1.000    14.630  44.465  24.529  -99.200  -91.000
       HIS 147     0.900    -4.948  43.309  31.768  -99.200  -91.000
       PHE 163     1.000     1.599  37.228  23.607  -99.200  -91.000
       TYR 173     0.840    -7.795  33.051  39.242  -99.200  -91.000
       HIS 175     0.900     0.999  26.734  41.582  -99.200  -91.000
       PHE 182     1.000     1.626  29.753  28.328  -99.200  -91.000
       TRP 204     1.040    -5.202  29.936  23.306  -99.200  -91.000
      TRP6 204     1.020    -5.758  28.771  25.296  -99.200  -91.000
       HIS 205     0.900    -7.896  24.423  23.619  -99.200  -91.000
       PHE 223     1.000    16.890  31.348  24.124  -99.200  -91.000
       HIS 232     0.900     5.617  20.752  32.101  -99.200  -91.000
       HIS 247     0.900    18.351  27.956  32.657  -99.200  -91.000