=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 26 rings
        ring        int.           center             anis.    iso.
       TYR  5     0.840    64.625  13.413  29.210  -99.200  -91.000
       HIS 11     0.900    70.844  35.898  24.619  -99.200  -91.000
       TYR 14     0.840    75.316  30.389  22.836  -99.200  -91.000
       TYR 24     0.840    74.441  16.683  28.155  -99.200  -91.000
       HIS 29     0.900    74.670  28.396  11.792  -99.200  -91.000
       TYR 37     0.840    78.927  16.087   6.741  -99.200  -91.000
       TYR 39     0.840    68.300  15.253   3.513  -99.200  -91.000
       PHE 40     1.000    71.644  18.771   1.969  -99.200  -91.000
       PHE 60     1.000    77.004  27.579 -14.769  -99.200  -91.000
       HIS 61     0.900    78.661  31.226 -22.301  -99.200  -91.000
       TYR 62     0.840    82.671  26.731 -16.936  -99.200  -91.000
       HIS 73     0.900    88.628  17.035 -12.028  -99.200  -91.000
       PHE 83     1.000    73.177  15.028 -12.475  -99.200  -91.000
       PHE 87     1.000    73.666  25.532 -25.668  -99.200  -91.000
       TYR 92     0.840    81.108  21.952 -20.553  -99.200  -91.000
       HIS 97     0.900    67.974  20.718  -9.232  -99.200  -91.000
       TRP 100     1.040    69.135  14.121  -3.344  -99.200  -91.000
      TRP6 100     1.020    71.341  14.958  -3.341  -99.200  -91.000
       PHE 101     1.000    72.182  19.418  -5.880  -99.200  -91.000
       HIS 141     0.900    64.920  34.225  20.522  -99.200  -91.000
       PHE 161     1.000    78.780  13.794  22.322  -99.200  -91.000
       HIS 165     0.900    82.487  23.996   8.465  -99.200  -91.000
       HIS 172     0.900    77.915  16.631  30.438  -99.200  -91.000
       HIS 173     0.900    79.843  23.551  31.989  -99.200  -91.000
       TYR 176     0.840    82.873  15.777  41.315  -99.200  -91.000
       PHE 182     1.000    76.565  26.965  41.215  -99.200  -91.000