=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 33 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900     3.439  12.268 -11.075  -99.200  -91.000
       TYR  6     0.840     1.591   9.725  -2.021  -99.200  -91.000
       TRP  7     1.040     9.008  16.815   1.179  -99.200  -91.000
      TRP6  7     1.020    10.622  15.538   2.353  -99.200  -91.000
       PHE 14     1.000    19.348  20.395   8.890  -99.200  -91.000
       PHE 21     1.000    10.870  13.188  18.196  -99.200  -91.000
       PHE 25     1.000     6.099  11.040  14.809  -99.200  -91.000
       PHE 37     1.000    13.847   6.242   4.585  -99.200  -91.000
       PHE 55     1.000     7.507   2.901  14.232  -99.200  -91.000
       HIS 61     0.900    19.003   6.692  -3.758  -99.200  -91.000
       HIS 73     0.900    -1.367   7.370  -0.638  -99.200  -91.000
       HIS 85     0.900    20.036  17.908   5.993  -99.200  -91.000
       HIS 92     0.900    26.167  16.505  15.944  -99.200  -91.000
       PHE 106     1.000    17.426  -2.617  10.970  -99.200  -91.000
       PHE 107     1.000    21.428  -5.869   6.037  -99.200  -91.000
       TRP 111     1.040    31.682   3.527   2.711  -99.200  -91.000
      TRP6 111     1.020    31.968   4.389   0.523  -99.200  -91.000
       HIS 112     0.900    32.199  -4.713   0.458  -99.200  -91.000
       HIS 116     0.900    36.714   3.971  -0.730  -99.200  -91.000
       PHE 126     1.000    25.969   7.381  13.424  -99.200  -91.000
       PHE 140     1.000    23.487   2.599  16.764  -99.200  -91.000
       HIS 141     0.900    18.488  -4.428  15.244  -99.200  -91.000
       TRP 146     1.040    32.802  -6.273   4.431  -99.200  -91.000
      TRP6 146     1.020    33.144  -7.726   2.591  -99.200  -91.000
       TYR 149     0.840    30.167  -0.950   8.783  -99.200  -91.000
       HIS 152     0.900    35.011   0.314  12.781  -99.200  -91.000
       TYR 163     0.840    25.741   2.950  22.683  -99.200  -91.000
       TYR 172     0.840    29.040 -10.268  15.979  -99.200  -91.000
       PHE 184     1.000    19.943 -12.276  -2.763  -99.200  -91.000
       HIS 187     0.900    21.779 -15.185   9.526  -99.200  -91.000
       TRP 190     1.040    28.403 -11.309  11.801  -99.200  -91.000
      TRP6 190     1.020    28.772 -11.728   9.500  -99.200  -91.000
       PHE 194     1.000    26.853  -3.071  21.841  -99.200  -91.000