=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 48 rings
        ring        int.           center             anis.    iso.
       TYR 12     0.840    31.366  66.561   4.105  -99.200  -91.000
       PHE 31     1.000    42.890  89.281  11.075  -99.200  -91.000
       TYR 35     0.840    38.012  86.892   7.128  -99.200  -91.000
       HIS 36     0.900    40.639  85.061   3.017  -99.200  -91.000
       HIS 41     0.900    39.862  74.096   6.241  -99.200  -91.000
       PHE 45     1.000    39.467  72.642  16.664  -99.200  -91.000
       PHE 63     1.000    39.521  87.018  13.472  -99.200  -91.000
       HIS 67     0.900    27.164  89.906  22.911  -99.200  -91.000
       HIS 69     0.900    26.717  85.529  27.871  -99.200  -91.000
       TYR 72     0.840    28.274  82.034  29.895  -99.200  -91.000
       HIS 74     0.900    34.777  91.469  33.494  -99.200  -91.000
       HIS 87     0.900    33.744  75.812  40.232  -99.200  -91.000
       TRP 97     1.040    24.556  68.878  19.573  -99.200  -91.000
      TRP6 97     1.020    26.715  68.959  18.608  -99.200  -91.000
       HIS 98     0.900    26.239  76.107  22.977  -99.200  -91.000
       PHE 103     1.000    21.618  85.748  24.087  -99.200  -91.000
       TRP 127     1.040    33.079  74.403  17.067  -99.200  -91.000
      TRP6 127     1.020    34.736  73.792  18.640  -99.200  -91.000
       TYR 134     0.840    20.738  74.481   2.323  -99.200  -91.000
       PHE 141     1.000    12.514  67.834   5.496  -99.200  -91.000
       HIS 152     0.900    17.634  81.526  17.000  -99.200  -91.000
       PHE 154     1.000    19.585  85.370  28.699  -99.200  -91.000
       PHE 158     1.000    22.760  81.950  29.191  -99.200  -91.000
       TYR 161     0.840    16.009  75.548  35.952  -99.200  -91.000
       TYR 163     0.840    22.205  82.017  35.213  -99.200  -91.000
       HIS 170     0.900    16.299  86.104  40.629  -99.200  -91.000
       TRP 173     1.040    17.786  84.863  34.118  -99.200  -91.000
      TRP6 173     1.020    15.512  85.452  34.404  -99.200  -91.000
       HIS 185     0.900    18.537  85.838  14.613  -99.200  -91.000
       HIS 191     0.900    29.772  83.015   5.819  -99.200  -91.000
       PHE 200     1.000    21.898  81.609  12.583  -99.200  -91.000
       PHE 205     1.000    21.289  80.738  23.174  -99.200  -91.000
       PHE 223     1.000    15.422  66.206   9.511  -99.200  -91.000
       PHE 225     1.000    16.209  71.881  18.119  -99.200  -91.000
       HIS 227     0.900    20.258  66.848   8.779  -99.200  -91.000
       PHE 233     1.000    25.365  66.496   8.569  -99.200  -91.000
       TRP 237     1.040    40.828  70.782  20.009  -99.200  -91.000
      TRP6 237     1.020    42.346  70.305  18.266  -99.200  -91.000
       TRP 239     1.040    38.750  71.668  24.503  -99.200  -91.000
      TRP6 239     1.020    39.135  73.637  23.250  -99.200  -91.000
       TRP 247     1.040    32.766  79.061  17.117  -99.200  -91.000
      TRP6 247     1.020    33.831  78.950  19.225  -99.200  -91.000
       HIS 254     0.900    30.122  76.335  20.686  -99.200  -91.000
       TYR 255     0.840    26.929  68.058  23.640  -99.200  -91.000
       TYR 260     0.840    34.471  69.548  32.784  -99.200  -91.000
       HIS 268     0.900    40.739  83.286  30.412  -99.200  -91.000
       PHE 278     1.000    22.181  88.006   4.038  -99.200  -91.000
       TYR 279     0.840    17.001  81.679   1.800  -99.200  -91.000