=============================================================================
          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    14.037  -2.793  10.348  -99.200  -91.000
       HIS  2     0.900     7.164  -1.561   6.955  -99.200  -91.000
       TRP  3     1.040     5.013   0.305  11.911  -99.200  -91.000
      TRP6  3     1.020     3.039  -0.987  12.036  -99.200  -91.000
       TYR  5     0.840     1.179  -6.533  12.449  -99.200  -91.000
       HIS  8     0.900    14.187 -11.340   9.723  -99.200  -91.000
       HIS 13     0.900    12.967  -7.385  15.910  -99.200  -91.000
       TRP 14     1.040     6.121  -3.460  16.201  -99.200  -91.000
      TRP6 14     1.020     3.827  -3.773  16.592  -99.200  -91.000
       HIS 15     0.900    12.511  -3.131  22.382  -99.200  -91.000
       PHE 18     1.000     7.174   3.494  16.404  -99.200  -91.000
       HIS 34     0.900   -13.905 -16.862  36.167  -99.200  -91.000
       TYR 38     0.840   -22.568  -4.474  37.718  -99.200  -91.000
       TYR 49     0.840   -21.635   3.751  14.758  -99.200  -91.000
       HIS 62     0.900    -1.016  -0.632   9.551  -99.200  -91.000
       PHE 64     1.000   -10.259  -4.750   5.338  -99.200  -91.000
       PHE 68     1.000   -17.542   5.068   8.395  -99.200  -91.000
       TYR 86     0.840   -14.563   9.958  23.183  -99.200  -91.000
       PHE 91     1.000   -15.562  -0.574   9.074  -99.200  -91.000
       HIS 92     0.900    -8.103  -0.533  12.724  -99.200  -91.000
       PHE 93     1.000   -13.225  -6.032   9.946  -99.200  -91.000
       HIS 94     0.900    -5.520  -4.967  14.525  -99.200  -91.000
       TRP 95     1.040    -6.687 -10.826   8.320  -99.200  -91.000
      TRP6 95     1.020    -6.822  -8.556   7.751  -99.200  -91.000
       HIS 105     0.900    -8.431  -5.706  23.446  -99.200  -91.000
       TYR 112     0.840   -13.941 -14.758  20.589  -99.200  -91.000
       HIS 117     0.900    -8.959  -3.031  17.211  -99.200  -91.000
       HIS 120     0.900   -16.314   5.212  17.703  -99.200  -91.000
       TRP 121     1.040   -11.988  12.371  15.639  -99.200  -91.000
      TRP6 121     1.020   -12.327  14.688  15.971  -99.200  -91.000
       TYR 125     0.840    -8.864  16.392  23.888  -99.200  -91.000
       PHE 128     1.000    -6.949   9.825  14.686  -99.200  -91.000
       PHE 144     1.000   -13.111 -10.298  21.632  -99.200  -91.000
       PHE 173     1.000   -17.005  -0.039   1.449  -99.200  -91.000
       PHE 176     1.000   -20.233  -1.215   5.617  -99.200  -91.000
       TYR 188     0.840   -19.661  -0.901  28.402  -99.200  -91.000
       TRP 189     1.040   -15.516  -7.802  30.162  -99.200  -91.000
      TRP6 189     1.020   -15.799  -9.311  28.356  -99.200  -91.000
       TYR 191     0.840    -7.923  -2.380  28.177  -99.200  -91.000
       TRP 206     1.040    -8.257  -0.335  23.858  -99.200  -91.000
      TRP6 206     1.020    -8.710  -1.204  21.718  -99.200  -91.000
       PHE 223     1.000   -11.808  -9.663   6.864  -99.200  -91.000
       PHE 228     1.000     1.267  -8.197   6.316  -99.200  -91.000
       TRP 242     1.040    -2.516 -12.228  15.439  -99.200  -91.000
      TRP6 242     1.020    -1.370 -13.172  17.298  -99.200  -91.000
       PHE 257     1.000   -20.600  -8.575  31.148  -99.200  -91.000