=============================================================================
          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  2     0.900    33.013  -9.959   4.764  -99.200  -91.000
       HIS  4     0.900    32.983  -7.800  11.557  -99.200  -91.000
       HIS 20     0.900    12.001   9.109  15.960  -99.200  -91.000
       PHE 57     1.000    15.615  28.419  46.235  -99.200  -91.000
       TYR 58     0.840    19.895  29.298  38.014  -99.200  -91.000
       PHE 79     1.000    29.112  20.204  35.532  -99.200  -91.000
       HIS 80     0.900    29.455  13.098  38.008  -99.200  -91.000
       TYR 84     0.840    25.384  11.391  40.522  -99.200  -91.000
       PHE 93     1.000    17.518  18.747  41.950  -99.200  -91.000
       TYR 137     0.840    27.488  10.283  34.047  -99.200  -91.000
       PHE 144     1.000    19.400  14.346  26.512  -99.200  -91.000
       TRP 147     1.040    32.819  15.719  22.340  -99.200  -91.000
      TRP6 147     1.020    34.068  14.251  23.707  -99.200  -91.000
       HIS 156     0.900    45.325  32.250   6.091  -99.200  -91.000
       TYR 173     0.840    29.496  12.162  22.430  -99.200  -91.000
       HIS 196     0.900    31.484  34.802  10.525  -99.200  -91.000
       TYR 203     0.840    32.704  27.470   0.769  -99.200  -91.000
       TYR 213     0.840    25.239  14.128   9.909  -99.200  -91.000
       HIS 219     0.900    35.202   6.727  13.971  -99.200  -91.000
       HIS 220     0.900    31.529   0.775  10.452  -99.200  -91.000
       TYR 222     0.840    19.987   2.915  14.575  -99.200  -91.000
       HIS 237     0.900    27.849  37.855  18.050  -99.200  -91.000
       TYR 243     0.840    23.596  39.489   5.988  -99.200  -91.000
       HIS 245     0.900    14.962  38.179  12.775  -99.200  -91.000
       PHE 269     1.000    18.696  25.080  13.944  -99.200  -91.000
       TRP 295     1.040    17.289  16.574   8.446  -99.200  -91.000
      TRP6 295     1.020    16.914  18.756   7.608  -99.200  -91.000
       PHE 299     1.000    12.906  24.873  22.687  -99.200  -91.000
       TYR 301     0.840    16.855  28.452  21.808  -99.200  -91.000
       TRP 313     1.040    16.905  34.038  43.001  -99.200  -91.000
      TRP6 313     1.020    18.658  32.449  42.938  -99.200  -91.000
       TYR 327     0.840    11.930  27.247  32.661  -99.200  -91.000
       TYR 342     0.840     7.171  33.610  19.521  -99.200  -91.000
       PHE 357     1.000    24.855  48.509  27.553  -99.200  -91.000
       HIS 361     0.900    31.495  50.933  41.456  -99.200  -91.000
       TYR 363     0.840    19.769  52.930  44.316  -99.200  -91.000