=============================================================================
          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.
       HIS  1     0.900    15.167  -2.549   6.321  -99.200  -91.000
       HIS  2     0.900     8.076  -0.849   5.438  -99.200  -91.000
       TRP  3     1.040     4.796   0.709  11.730  -99.200  -91.000
      TRP6  3     1.020     2.818  -0.576  11.889  -99.200  -91.000
       TYR  5     0.840     0.999  -5.998  12.335  -99.200  -91.000
       HIS  8     0.900    14.157 -10.958   9.985  -99.200  -91.000
       HIS 13     0.900    12.754  -6.897  15.548  -99.200  -91.000
       TRP 14     1.040     5.984  -2.926  15.934  -99.200  -91.000
      TRP6 14     1.020     3.698  -3.298  16.406  -99.200  -91.000
       HIS 15     0.900    12.481  -2.532  22.102  -99.200  -91.000
       PHE 18     1.000     7.156   3.846  15.974  -99.200  -91.000
       HIS 34     0.900   -13.706 -16.037  35.845  -99.200  -91.000
       TYR 38     0.840   -22.600  -2.890  37.182  -99.200  -91.000
       TYR 49     0.840   -20.977   3.968  14.579  -99.200  -91.000
       HIS 62     0.900     1.735  -1.117   8.590  -99.200  -91.000
       PHE 64     1.000   -10.250  -4.238   5.192  -99.200  -91.000
       PHE 68     1.000   -17.215   5.343   8.226  -99.200  -91.000
       TYR 86     0.840   -14.208  10.333  23.054  -99.200  -91.000
       PHE 91     1.000   -15.341  -0.120   8.834  -99.200  -91.000
       HIS 92     0.900    -8.022  -0.310  12.419  -99.200  -91.000
       PHE 93     1.000   -13.129  -5.609   9.818  -99.200  -91.000
       HIS 94     0.900    -5.534  -4.643  14.332  -99.200  -91.000
       TRP 95     1.040    -6.735 -10.540   8.198  -99.200  -91.000
      TRP6 95     1.020    -6.939  -8.243   7.669  -99.200  -91.000
       HIS 105     0.900    -8.287  -5.008  23.173  -99.200  -91.000
       TYR 112     0.840   -13.639 -13.932  20.630  -99.200  -91.000
       HIS 117     0.900    -8.889  -2.658  17.018  -99.200  -91.000
       HIS 120     0.900   -15.786   5.694  17.431  -99.200  -91.000
       TRP 121     1.040   -11.855  12.816  15.273  -99.200  -91.000
      TRP6 121     1.020   -12.416  15.097  15.538  -99.200  -91.000
       TYR 125     0.840    -8.836  16.863  23.716  -99.200  -91.000
       PHE 128     1.000    -6.503  10.312  14.722  -99.200  -91.000
       PHE 144     1.000   -12.808  -9.679  21.490  -99.200  -91.000
       PHE 173     1.000   -16.626   0.167   1.199  -99.200  -91.000
       PHE 176     1.000   -19.775  -0.903   5.408  -99.200  -91.000
       TYR 188     0.840   -19.203  -0.498  27.910  -99.200  -91.000
       TRP 189     1.040   -15.277  -7.273  29.879  -99.200  -91.000
      TRP6 189     1.020   -15.579  -8.859  28.150  -99.200  -91.000
       TYR 191     0.840    -7.823  -1.725  27.933  -99.200  -91.000
       TRP 206     1.040    -8.054   0.325  23.505  -99.200  -91.000
      TRP6 206     1.020    -8.560  -0.583  21.384  -99.200  -91.000
       PHE 223     1.000   -11.768  -9.209   6.583  -99.200  -91.000
       PHE 228     1.000     1.038  -7.894   6.255  -99.200  -91.000
       TRP 242     1.040    -2.495 -11.666  15.345  -99.200  -91.000
      TRP6 242     1.020    -1.600 -12.632  17.317  -99.200  -91.000
       PHE 257     1.000   -20.540  -7.835  31.054  -99.200  -91.000