=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 35 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    24.313   3.668  33.479  -99.200  -91.000
       HIS  4     0.900    30.921   4.305  35.634  -99.200  -91.000
       HIS 20     0.900    30.602  15.765  60.278  -99.200  -91.000
       PHE 57     1.000    59.556  35.444  67.291  -99.200  -91.000
       TYR 58     0.840    52.337  37.095  62.381  -99.200  -91.000
       PHE 79     1.000    53.078  30.295  50.647  -99.200  -91.000
       HIS 80     0.900    55.351  23.997  49.603  -99.200  -91.000
       TYR 84     0.840    56.692  20.639  53.454  -99.200  -91.000
       PHE 93     1.000    56.102  26.748  62.686  -99.200  -91.000
       TYR 137     0.840    50.943  20.707  49.670  -99.200  -91.000
       PHE 144     1.000    41.953  22.731  56.935  -99.200  -91.000
       TRP 147     1.040    40.848  27.107  43.815  -99.200  -91.000
      TRP6 147     1.020    42.435  25.989  42.464  -99.200  -91.000
       HIS 156     0.900    28.199  46.413  32.145  -99.200  -91.000
       TYR 173     0.840    40.101  23.192  46.135  -99.200  -91.000
       HIS 196     0.900    27.922  45.651  46.429  -99.200  -91.000
       TYR 203     0.840    19.365  38.445  41.788  -99.200  -91.000
       TYR 213     0.840    27.224  24.005  47.579  -99.200  -91.000
       HIS 219     0.900    33.560  19.251  37.650  -99.200  -91.000
       HIS 220     0.900    30.346  12.515  38.707  -99.200  -91.000
       TYR 222     0.840    31.103  12.069  51.284  -99.200  -91.000
       HIS 237     0.900    34.450  47.181  52.257  -99.200  -91.000
       TYR 243     0.840    21.565  47.554  54.517  -99.200  -91.000
       HIS 245     0.900    26.664  44.516  63.996  -99.200  -91.000
       PHE 269     1.000    29.182  32.718  57.356  -99.200  -91.000
       TRP 295     1.040    24.121  24.141  55.807  -99.200  -91.000
      TRP6 295     1.020    22.996  26.202  56.114  -99.200  -91.000
       PHE 299     1.000    36.619  31.150  64.508  -99.200  -91.000
       TYR 301     0.840    36.222  35.511  61.210  -99.200  -91.000
       TRP 313     1.040    56.371  39.946  66.447  -99.200  -91.000
      TRP6 313     1.020    56.537  39.560  64.119  -99.200  -91.000
       TYR 327     0.840    45.641  33.157  67.598  -99.200  -91.000
       TYR 342     0.840    32.321  38.798  71.129  -99.200  -91.000
       HIS 347     0.900     7.389  35.887  54.910  -99.200  -91.000
       TYR 349     0.840    16.141  40.190  55.399  -99.200  -91.000