=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 29 rings
        ring        int.           center             anis.    iso.
       HIS 20     0.900    51.808  26.268  51.679  -99.200  -91.000
       TYR 29     0.840    38.377  18.315  46.316  -99.200  -91.000
       TYR 36     0.840    31.198  18.565  61.829  -99.200  -91.000
       HIS 44     0.900    43.212  30.544  74.215  -99.200  -91.000
       PHE 45     1.000    35.319  27.826  71.355  -99.200  -91.000
       HIS 64     0.900    40.073  25.564  77.117  -99.200  -91.000
       TYR 68     0.840    34.067  25.759  76.564  -99.200  -91.000
       PHE 77     1.000    27.835  18.243  71.681  -99.200  -91.000
       PHE 78     1.000    32.103  17.027  77.766  -99.200  -91.000
       HIS 86     0.900    38.308  18.011  93.700  -99.200  -91.000
       PHE 88     1.000    44.191  26.763  97.787  -99.200  -91.000
       TYR 97     0.840    56.171  17.141  92.511  -99.200  -91.000
       HIS 105     0.900    37.615  30.220  82.739  -99.200  -91.000
       TYR 108     0.840    40.132  33.240  83.982  -99.200  -91.000
       HIS 127     0.900    47.930  30.294  71.296  -99.200  -91.000
       PHE 133     1.000    35.999  40.115  73.345  -99.200  -91.000
       TYR 134     0.840    42.551  32.943  76.917  -99.200  -91.000
       PHE 138     1.000    52.579  33.989  82.073  -99.200  -91.000
       TYR 158     0.840    55.074  23.133  78.568  -99.200  -91.000
       HIS 161     0.900    60.892  11.834  80.285  -99.200  -91.000
       HIS 165     0.900    56.281   6.925  87.200  -99.200  -91.000
       PHE 175     1.000    44.692  16.714  94.211  -99.200  -91.000
       HIS 219     0.900    51.660  17.701  67.141  -99.200  -91.000
       TYR 221     0.840    55.211  10.324  73.353  -99.200  -91.000
       TRP 247     1.040    48.706   8.102  55.014  -99.200  -91.000
      TRP6 247     1.020    46.891   7.803  53.530  -99.200  -91.000
       TYR 259     0.840    52.514  13.879  49.883  -99.200  -91.000
       TYR 262     0.840    39.235  10.334  52.015  -99.200  -91.000
       PHE 263     1.000    38.949  14.311  49.100  -99.200  -91.000