=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 45 rings
        ring        int.           center             anis.    iso.
       TYR  4     0.840    72.727  90.898  41.840  -99.200  -91.000
       TYR  7     0.840    65.570  87.078  39.115  -99.200  -91.000
       HIS 18     0.900    83.123  89.163  23.618  -99.200  -91.000
       HIS 24     0.900    89.828 104.028  28.866  -99.200  -91.000
       PHE 29     1.000    80.551 102.554  18.955  -99.200  -91.000
       HIS 33     0.900    75.893 101.682  19.994  -99.200  -91.000
       TRP 39     1.040    67.410 101.679  30.595  -99.200  -91.000
      TRP6 39     1.020    65.959 101.217  32.418  -99.200  -91.000
       HIS 45     0.900    57.028  92.908  29.696  -99.200  -91.000
       PHE 63     1.000    45.028 107.032  31.161  -99.200  -91.000
       TRP 80     1.040    71.311 110.210  23.362  -99.200  -91.000
      TRP6 80     1.020    72.453 108.910  21.746  -99.200  -91.000
       TYR 91     0.840    83.534 106.626  15.831  -99.200  -91.000
       TYR 97     0.840    91.397  98.550  15.155  -99.200  -91.000
       PHE 104     1.000    69.370 102.945   8.137  -99.200  -91.000
       TYR 107     0.840    65.957  92.338  17.471  -99.200  -91.000
       TYR 109     0.840    64.815 103.742  16.613  -99.200  -91.000
       PHE 114     1.000    58.072  99.048  11.528  -99.200  -91.000
       HIS 127     0.900    65.710  94.544  11.179  -99.200  -91.000
       HIS 129     0.900    71.247  90.353   8.931  -99.200  -91.000
       HIS 133     0.900    67.625  89.596  15.028  -99.200  -91.000
       HIS 142     0.900    51.958  92.577   7.432  -99.200  -91.000
       TYR 147     0.840    47.362 108.758  16.721  -99.200  -91.000
       PHE 159     1.000    34.872 111.014  21.108  -99.200  -91.000
       TRP 170     1.040    45.777  97.406  10.653  -99.200  -91.000
      TRP6 170     1.020    44.701  99.409  11.293  -99.200  -91.000
       TYR 176     0.840    44.496 116.151   9.526  -99.200  -91.000
       TRP 184     1.040    43.127 112.857  18.761  -99.200  -91.000
      TRP6 184     1.020    43.273 111.693  20.831  -99.200  -91.000
       TYR 188     0.840    43.911 117.869  23.780  -99.200  -91.000
       HIS 194     0.900    34.572 114.088  25.697  -99.200  -91.000
       TRP 195     1.040    41.206 113.953  33.566  -99.200  -91.000
      TRP6 195     1.020    41.245 116.298  33.842  -99.200  -91.000
       TYR 198     0.840    42.977 117.514  29.079  -99.200  -91.000
       PHE 204     1.000    48.436 107.718  21.875  -99.200  -91.000
       PHE 211     1.000    61.286 107.504  19.068  -99.200  -91.000
       TRP 214     1.040    67.068 108.012  21.965  -99.200  -91.000
      TRP6 214     1.020    67.542 107.257  19.764  -99.200  -91.000
       PHE 216     1.000    68.496 118.865  18.717  -99.200  -91.000
       HIS 218     0.900    71.449 108.369  17.078  -99.200  -91.000
       PHE 228     1.000    75.014 117.722   8.134  -99.200  -91.000
       TYR 240     0.840    68.111 107.528   8.229  -99.200  -91.000
       PHE 250     1.000    51.809 109.255  18.818  -99.200  -91.000
       TRP 254     1.040    52.737 116.524  17.690  -99.200  -91.000
      TRP6 254     1.020    54.061 117.758  19.215  -99.200  -91.000