=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       HIS 12     0.900    47.249 -27.875  -3.220  -99.200  -91.000
       TRP 14     1.040    50.771 -22.882  -1.639  -99.200  -91.000
      TRP6 14     1.020    52.288 -23.163  -3.431  -99.200  -91.000
       TYR 19     0.840    44.934 -28.391  13.679  -99.200  -91.000
       PHE 24     1.000    41.550 -26.913   9.778  -99.200  -91.000
       HIS 31     0.900    59.723 -13.755   5.604  -99.200  -91.000
       TRP 34     1.040    55.773 -12.605   9.272  -99.200  -91.000
      TRP6 34     1.020    54.293 -11.488  10.727  -99.200  -91.000
       HIS 40     0.900    35.953 -15.734   7.947  -99.200  -91.000
       PHE 42     1.000    43.426 -16.295  13.731  -99.200  -91.000
       HIS 44     0.900    37.395 -16.863  17.488  -99.200  -91.000
       HIS 57     0.900    48.030 -35.720   1.478  -99.200  -91.000
       PHE 58     1.000    47.192 -38.784   4.769  -99.200  -91.000
       PHE 59     1.000    40.999 -31.497  10.432  -99.200  -91.000
       PHE 69     1.000    56.845 -23.720  12.540  -99.200  -91.000
       TYR 74     0.840    45.147 -13.407  17.174  -99.200  -91.000
       TYR 77     0.840    43.480  -3.780   5.973  -99.200  -91.000
       TYR 80     0.840    37.338  -8.376  10.000  -99.200  -91.000
       PHE 83     1.000    29.999  -3.074  15.200  -99.200  -91.000
       HIS 88     0.900    38.833  -3.299   4.214  -99.200  -91.000
       PHE 108     1.000    56.497 -34.057   1.122  -99.200  -91.000
       PHE 121     1.000    47.133 -13.966 -11.634  -99.200  -91.000
       HIS 125     0.900    45.142 -17.175 -14.895  -99.200  -91.000
       TRP 132     1.040    43.227 -31.109   5.054  -99.200  -91.000
      TRP6 132     1.020    44.687 -29.261   5.213  -99.200  -91.000
       HIS 134     0.900    31.390 -29.305   6.753  -99.200  -91.000
       TYR 142     0.840    36.914 -29.872  10.522  -99.200  -91.000
       HIS 157     0.900    28.252  -6.568 -15.464  -99.200  -91.000
       TYR 165     0.840    28.023 -13.985  -3.918  -99.200  -91.000
       TYR 178     0.840    33.747 -24.242 -12.597  -99.200  -91.000
       PHE 179     1.000    28.228 -17.192 -12.218  -99.200  -91.000
       TYR 203     0.840    53.171 -14.618  -8.416  -99.200  -91.000
       TYR 205     0.840    43.963 -12.334  -8.414  -99.200  -91.000
       TRP 210     1.040    31.918 -12.960   1.328  -99.200  -91.000
      TRP6 210     1.020    29.837 -12.555   0.311  -99.200  -91.000
       HIS 218     0.900    21.249 -19.107 -10.901  -99.200  -91.000
       TYR 223     0.840    37.440 -17.852  -3.379  -99.200  -91.000
       TYR 229     0.840    43.381  -6.142   1.925  -99.200  -91.000
       TRP 232     1.040    47.944  -3.468   6.474  -99.200  -91.000
      TRP6 232     1.020    47.882  -5.580   7.538  -99.200  -91.000