=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 46 rings
        ring        int.           center             anis.    iso.
       PHE  2     1.000    40.853  72.189  35.946  -99.200  -91.000
       TYR  4     0.840    33.842  68.125  27.734  -99.200  -91.000
       HIS 11     0.900    36.471  72.225  20.279  -99.200  -91.000
       PHE 18     1.000    39.213  76.217   8.495  -99.200  -91.000
       HIS 21     0.900    41.199  81.042   5.347  -99.200  -91.000
       TYR 29     0.840    38.991  81.593  -6.217  -99.200  -91.000
       HIS 31     0.900    33.223  87.699  -7.468  -99.200  -91.000
       HIS 34     0.900    25.641  87.436 -12.814  -99.200  -91.000
       TYR 61     0.840    37.719  86.594 -21.606  -99.200  -91.000
       TYR 75     0.840    35.441  73.248 -16.214  -99.200  -91.000
       PHE 80     1.000    23.739  69.757 -27.751  -99.200  -91.000
       TRP 89     1.040    44.487  76.812 -24.305  -99.200  -91.000
      TRP6 89     1.020    45.995  76.584 -26.124  -99.200  -91.000
       PHE 95     1.000    39.253  70.226 -16.455  -99.200  -91.000
       PHE 100     1.000    34.030  67.516 -17.373  -99.200  -91.000
       TRP 102     1.040    30.040  62.960 -15.921  -99.200  -91.000
      TRP6 102     1.020    31.241  62.971 -13.857  -99.200  -91.000
       TYR 105     0.840    30.632  70.954 -12.554  -99.200  -91.000
       PHE 106     1.000    25.836  70.787 -18.700  -99.200  -91.000
       TYR 107     0.840    19.894  67.386 -13.327  -99.200  -91.000
       TYR 117     0.840    29.035  68.124  -7.010  -99.200  -91.000
       PHE 118     1.000    31.194  68.986  -1.149  -99.200  -91.000
       TYR 129     0.840    32.571  75.045  -3.071  -99.200  -91.000
       TYR 130     0.840    34.591  71.035  -9.671  -99.200  -91.000
       TYR 131     0.840    31.598  79.211  -5.935  -99.200  -91.000
       TYR 133     0.840    25.002  83.131 -13.426  -99.200  -91.000
       TYR 137     0.840    23.289  86.964 -27.829  -99.200  -91.000
       TRP 157     1.040    43.127  73.461  11.851  -99.200  -91.000
      TRP6 157     1.020    41.052  74.141  12.710  -99.200  -91.000
       TYR 163     0.840    44.788  66.694  15.010  -99.200  -91.000
       PHE 164     1.000    39.976  71.633   8.187  -99.200  -91.000
       HIS 170     0.900    25.767  59.395   1.891  -99.200  -91.000
       PHE 174     1.000    35.890  68.005  -1.166  -99.200  -91.000
       TRP 180     1.040    42.079  61.105  10.124  -99.200  -91.000
      TRP6 180     1.020    41.789  62.770  11.775  -99.200  -91.000
       PHE 182     1.000    39.177  62.073  -1.583  -99.200  -91.000
       HIS 183     0.900    40.191  57.043   4.958  -99.200  -91.000
       TYR 202     0.840    33.476  62.436  -2.083  -99.200  -91.000
       TRP 212     1.040    36.884  58.742  15.916  -99.200  -91.000
      TRP6 212     1.020    37.998  60.030  14.264  -99.200  -91.000
       TRP 223     1.040    32.955  62.692  16.394  -99.200  -91.000
      TRP6 223     1.020    34.046  63.310  14.370  -99.200  -91.000
       HIS 229     0.900    39.669  49.700  17.711  -99.200  -91.000
       TRP 230     1.040    43.643  48.541  17.225  -99.200  -91.000
      TRP6 230     1.020    45.448  50.008  16.808  -99.200  -91.000
       TYR 235     0.840    40.550  63.033  18.275  -99.200  -91.000