=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 49 rings
        ring        int.           center             anis.    iso.
       PHE 10     1.000    43.492  32.291  22.878  -99.200  -91.000
       HIS 11     0.900    44.974  42.183  19.657  -99.200  -91.000
       PHE 20     1.000    37.234  50.763  11.152  -99.200  -91.000
       TYR 27     0.840    37.796  34.203  18.333  -99.200  -91.000
       TRP 39     1.040    36.656  28.320  22.452  -99.200  -91.000
      TRP6 39     1.020    38.673  29.531  22.179  -99.200  -91.000
       TRP 45     1.040    32.205  48.925  12.010  -99.200  -91.000
      TRP6 45     1.020    32.521  46.973  10.707  -99.200  -91.000
       HIS 47     0.900    39.142  54.332  18.248  -99.200  -91.000
       TYR 49     0.840    28.254  51.044  15.419  -99.200  -91.000
       HIS 53     0.900    38.563  51.364  24.730  -99.200  -91.000
       HIS 67     0.900    35.313  40.324  41.585  -99.200  -91.000
       HIS 78     0.900    25.434  33.697  41.196  -99.200  -91.000
       HIS 90     0.900    32.979  49.662  31.776  -99.200  -91.000
       TYR 92     0.840    33.491  47.940  26.128  -99.200  -91.000
       TRP 102     1.040    23.509  32.217  26.955  -99.200  -91.000
      TRP6 102     1.020    21.413  31.122  26.825  -99.200  -91.000
       TRP 114     1.040    19.197  25.602  16.705  -99.200  -91.000
      TRP6 114     1.020    17.409  24.048  16.867  -99.200  -91.000
       TYR 151     0.840    23.913  39.659   0.430  -99.200  -91.000
       HIS 154     0.900    19.191  44.324  -1.569  -99.200  -91.000
       HIS 181     0.900    15.576  41.531  -4.406  -99.200  -91.000
       PHE 185     1.000    16.066  54.187   1.663  -99.200  -91.000
       TRP 191     1.040    19.532  62.530   7.729  -99.200  -91.000
      TRP6 191     1.020    17.702  61.231   6.975  -99.200  -91.000
       TRP 208     1.040    11.611  48.252   8.317  -99.200  -91.000
      TRP6 208     1.020    10.983  48.659  10.558  -99.200  -91.000
       HIS 221     0.900    10.533  66.866  17.446  -99.200  -91.000
       HIS 237     0.900    24.035  52.700  24.649  -99.200  -91.000
       PHE 239     1.000    13.474  44.906  29.625  -99.200  -91.000
       HIS 242     0.900    16.402  47.599  24.200  -99.200  -91.000
       TRP 246     1.040     5.610  49.332  24.604  -99.200  -91.000
      TRP6 246     1.020     4.694  49.742  26.748  -99.200  -91.000
       PHE 273     1.000     9.397  45.557  25.985  -99.200  -91.000
       TRP 279     1.040     9.199  47.341  19.340  -99.200  -91.000
      TRP6 279     1.020    10.674  47.537  21.178  -99.200  -91.000
       HIS 282     0.900    16.934  44.279  10.290  -99.200  -91.000
       HIS 298     0.900    23.121  28.599  17.685  -99.200  -91.000
       TRP 312     1.040    26.220  43.335   8.254  -99.200  -91.000
      TRP6 312     1.020    27.837  43.703   9.943  -99.200  -91.000
       HIS 315     0.900    30.838  35.228   8.521  -99.200  -91.000
       HIS 317     0.900    30.808  44.089   5.346  -99.200  -91.000
       TYR 359     0.840    42.964  37.437  33.448  -99.200  -91.000
       HIS 363     0.900    47.774  24.177  47.493  -99.200  -91.000
       HIS 364     0.900    43.723  29.475  50.085  -99.200  -91.000
       HIS 365     0.900    49.531  24.988  53.141  -99.200  -91.000
       HIS 366     0.900    52.601  28.727  43.955  -99.200  -91.000
       HIS 367     0.900    57.907  31.429  49.193  -99.200  -91.000
       HIS 368     0.900    55.279  34.172  43.138  -99.200  -91.000