=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       TRP  5     1.040    37.949   3.513 -13.333  -99.200  -91.000
      TRP6  5     1.020    37.000   1.376 -12.965  -99.200  -91.000
       TRP 14     1.040    35.173   8.062   0.834  -99.200  -91.000
      TRP6 14     1.020    33.237   9.103  -0.039  -99.200  -91.000
       PHE 19     1.000    54.599  10.088   2.801  -99.200  -91.000
       TRP 37     1.040    37.689  10.185  16.231  -99.200  -91.000
      TRP6 37     1.020    39.216   8.869  17.464  -99.200  -91.000
       HIS 43     0.900    47.082  -5.368   6.938  -99.200  -91.000
       TYR 47     0.840    52.748  -9.443  10.193  -99.200  -91.000
       TRP 49     1.040    56.826  -9.228   7.672  -99.200  -91.000
      TRP6 49     1.020    55.166  -8.598   6.093  -99.200  -91.000
       PHE 53     1.000    54.940   1.945  11.002  -99.200  -91.000
       HIS 65     0.900    43.741  12.526  -9.368  -99.200  -91.000
       TYR 70     0.840    52.782  20.679  -0.651  -99.200  -91.000
       TYR 84     0.840    43.038   5.695  20.737  -99.200  -91.000
       HIS 86     0.900    39.095  -5.309  18.488  -99.200  -91.000
       TYR 89     0.840    46.335  -6.908  13.985  -99.200  -91.000
       TRP 91     1.040    49.907  -9.888  16.029  -99.200  -91.000
      TRP6 91     1.020    51.777 -11.316  16.124  -99.200  -91.000
       PHE 110     1.000    34.528  17.596   7.067  -99.200  -91.000
       TYR 113     0.840    39.399  19.162  -4.844  -99.200  -91.000
       HIS 115     0.900    31.360  16.068   2.693  -99.200  -91.000
       TYR 133     0.840    22.764  -6.140  -3.377  -99.200  -91.000
       TRP 140     1.040    47.262   7.307  -4.420  -99.200  -91.000
      TRP6 140     1.020    46.049   8.045  -2.520  -99.200  -91.000
       TRP 147     1.040    59.490  -9.517  -8.222  -99.200  -91.000
      TRP6 147     1.020    61.122  -7.914  -7.649  -99.200  -91.000
       PHE 182     1.000    32.985  -7.017   3.184  -99.200  -91.000
       PHE 186     1.000    34.497  -8.493 -11.026  -99.200  -91.000
       PHE 205     1.000    33.532  -3.588  -0.940  -99.200  -91.000
       PHE 211     1.000    17.497   1.666   0.774  -99.200  -91.000
       TRP 215     1.040    29.279   7.619  -2.583  -99.200  -91.000
      TRP6 215     1.020    29.931   5.857  -4.019  -99.200  -91.000
       TYR 216     0.840    25.340   4.608   4.455  -99.200  -91.000
       TYR 233     0.840    36.274 -15.593  -4.337  -99.200  -91.000
       PHE 235     1.000    39.190 -13.772   2.479  -99.200  -91.000
       TYR 236     0.840    37.675  -5.931   0.481  -99.200  -91.000
       HIS 238     0.900    30.257  -6.885   8.222  -99.200  -91.000
       PHE 240     1.000    25.902  -2.923  12.063  -99.200  -91.000
       TRP 245     1.040    37.761  -1.373  19.137  -99.200  -91.000
      TRP6 245     1.020    38.750  -0.288  17.278  -99.200  -91.000
       PHE 253     1.000    41.428   5.923  25.291  -99.200  -91.000