=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 44 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900    48.056 -25.270  12.442  -99.200  -91.000
       HIS 12     0.900    23.301 -27.034  29.386  -99.200  -91.000
       PHE 14     1.000    22.030 -22.020  20.566  -99.200  -91.000
       PHE 16     1.000    23.656 -29.459  25.806  -99.200  -91.000
       PHE 47     1.000    44.189 -25.286  24.234  -99.200  -91.000
       HIS 51     0.900    47.441 -29.792  20.576  -99.200  -91.000
       PHE 61     1.000    43.396 -26.467  34.745  -99.200  -91.000
       TYR 66     0.840    27.248 -32.783  25.021  -99.200  -91.000
       TYR 68     0.840    22.536 -24.402  16.267  -99.200  -91.000
       PHE 82     1.000    38.619 -23.514  11.546  -99.200  -91.000
       PHE 84     1.000    38.078 -27.213  16.512  -99.200  -91.000
       TYR 87     0.840    40.195 -20.035  25.658  -99.200  -91.000
       TYR 94     0.840    26.949 -15.425  26.476  -99.200  -91.000
       TRP 97     1.040    33.743   0.307  28.960  -99.200  -91.000
      TRP6 97     1.020    35.900   0.034  28.027  -99.200  -91.000
       HIS 101     0.900    38.613  -5.161  32.169  -99.200  -91.000
       TRP 102     1.040    35.068  -3.916  25.132  -99.200  -91.000
      TRP6 102     1.020    32.722  -4.106  24.906  -99.200  -91.000
       PHE 121     1.000    30.341 -12.953  21.522  -99.200  -91.000
       PHE 133     1.000    29.530  -9.979  17.324  -99.200  -91.000
       PHE 137     1.000    25.504 -19.219  15.538  -99.200  -91.000
       PHE 138     1.000    18.674 -20.042  17.159  -99.200  -91.000
       HIS 157     0.900     8.423  -0.521  26.375  -99.200  -91.000
       HIS 162     0.900     9.740   0.063  32.235  -99.200  -91.000
       HIS 163     0.900     6.709   3.892  37.142  -99.200  -91.000
       PHE 168     1.000     8.283  -8.033  39.562  -99.200  -91.000
       PHE 170     1.000    12.645  -6.342  37.409  -99.200  -91.000
       TYR 181     0.840    16.560  -3.717  25.440  -99.200  -91.000
       PHE 186     1.000    13.353   0.013  28.812  -99.200  -91.000
       HIS 190     0.900    22.166  -2.014  34.938  -99.200  -91.000
       TYR 192     0.840    13.665  -3.213  41.903  -99.200  -91.000
       TYR 196     0.840    16.406  -8.289  43.392  -99.200  -91.000
       TYR 207     0.840    19.609 -17.612  42.382  -99.200  -91.000
       PHE 218     1.000    17.469 -15.606  34.115  -99.200  -91.000
       TYR 227     0.840    17.751 -27.164  26.043  -99.200  -91.000
       PHE 244     1.000    12.427  -7.837  26.240  -99.200  -91.000
       TYR 249     0.840    22.109 -16.643  20.190  -99.200  -91.000
       TYR 270     0.840    28.288 -24.431   6.944  -99.200  -91.000
       HIS 273     0.900    23.227 -25.024  -0.128  -99.200  -91.000
       PHE 275     1.000    25.225 -28.228   9.508  -99.200  -91.000
       HIS 280     0.900    15.126 -25.206  16.217  -99.200  -91.000
       TRP 283     1.040    22.802 -30.000  18.514  -99.200  -91.000
      TRP6 283     1.020    23.809 -31.507  20.063  -99.200  -91.000
       TYR 284     0.840    16.511 -24.855  20.660  -99.200  -91.000