=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900     3.836  21.647  27.757  -99.200  -91.000
       TYR  7     0.840    15.460  12.821  22.364  -99.200  -91.000
       PHE  8     1.000    16.454  12.446  30.783  -99.200  -91.000
       TYR  9     0.840    22.397  10.125  23.888  -99.200  -91.000
       PHE 22     1.000    23.674   5.314  23.363  -99.200  -91.000
       TYR 27     0.840    11.343  10.149  30.525  -99.200  -91.000
       PHE 33     1.000     9.627  11.575  22.758  -99.200  -91.000
       PHE 36     1.000    19.490   2.081  19.906  -99.200  -91.000
       TRP 51     1.040     2.101  11.544  22.819  -99.200  -91.000
      TRP6 51     1.020     4.309  12.258  22.346  -99.200  -91.000
       TYR 59     0.840    10.329  10.324  14.836  -99.200  -91.000
       TRP 60     1.040     8.892   5.340  13.924  -99.200  -91.000
      TRP6 60     1.020     9.269   5.753  16.229  -99.200  -91.000
       TYR 74     0.840    27.655   9.772  24.562  -99.200  -91.000
       TYR 84     0.840    40.241  12.786  27.461  -99.200  -91.000
       TYR 85     0.840    38.293  11.537  34.513  -99.200  -91.000
       HIS 93     0.900    35.521   3.183  34.907  -99.200  -91.000
       TYR 99     0.840    20.374  15.591  22.800  -99.200  -91.000
       TYR 113     0.840    18.147  22.408  30.375  -99.200  -91.000
       TYR 118     0.840    34.374   8.288  33.465  -99.200  -91.000
       TYR 123     0.840    34.112  14.545  30.721  -99.200  -91.000
       TRP 133     1.040    31.521  23.780  25.114  -99.200  -91.000
      TRP6 133     1.020    29.760  22.220  24.862  -99.200  -91.000
       TRP 147     1.040    33.006  18.214  22.449  -99.200  -91.000
      TRP6 147     1.020    31.444  17.739  24.184  -99.200  -91.000
       TYR 159     0.840    18.348  18.998  18.879  -99.200  -91.000
       TYR 171     0.840     7.984  14.802  19.119  -99.200  -91.000
       HIS 188     0.900    -6.080   9.345  51.585  -99.200  -91.000
       HIS 191     0.900    -5.886   9.867  64.387  -99.200  -91.000
       HIS 192     0.900    -3.136   4.732  60.049  -99.200  -91.000
       HIS 197     0.900    -0.614   9.941  76.521  -99.200  -91.000
       TRP 204     1.040    -1.732   8.667  52.178  -99.200  -91.000
      TRP6 204     1.020    -0.352   7.204  50.929  -99.200  -91.000
       PHE 208     1.000     1.248  13.849  42.355  -99.200  -91.000
       TYR 209     0.840     1.754  14.161  33.114  -99.200  -91.000
       TRP 217     1.040     1.769  16.994  57.410  -99.200  -91.000
      TRP6 217     1.020    -0.498  17.052  58.078  -99.200  -91.000
       PHE 241     1.000     4.967  10.966  37.822  -99.200  -91.000
       TRP 244     1.040     3.661   8.286  52.024  -99.200  -91.000
      TRP6 244     1.020     5.102   8.577  53.867  -99.200  -91.000
       TYR 257     0.840     0.696  19.071  64.126  -99.200  -91.000
       HIS 260     0.900    -1.282  24.784  54.330  -99.200  -91.000
       HIS 263     0.900    -0.469  18.613  40.037  -99.200  -91.000
       TRP 274     1.040    -8.084  13.034  62.277  -99.200  -91.000
      TRP6 274     1.020    -8.704  11.143  60.999  -99.200  -91.000