=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 38 rings
        ring        int.           center             anis.    iso.
       HIS  8     0.900    45.960  15.001  31.067  -99.200  -91.000
       PHE 13     1.000    50.432  18.744  41.302  -99.200  -91.000
       PHE 16     1.000    54.008  22.143  45.840  -99.200  -91.000
       TYR 22     0.840    57.253  14.043  51.138  -99.200  -91.000
       PHE 24     1.000    53.055  14.183  48.454  -99.200  -91.000
       TYR 29     0.840    48.094   8.808  49.771  -99.200  -91.000
       PHE 34     1.000    49.021  21.385  45.668  -99.200  -91.000
       HIS 36     0.900    37.550  24.697  44.752  -99.200  -91.000
       TYR 39     0.840    41.335  19.694  38.066  -99.200  -91.000
       HIS 40     0.900    35.104  19.932  34.911  -99.200  -91.000
       TYR 41     0.840    38.810  19.499  33.097  -99.200  -91.000
       TYR 47     0.840    40.823  22.027  49.018  -99.200  -91.000
       PHE 52     1.000    38.518  16.874  60.699  -99.200  -91.000
       TYR 60     0.840    51.983  18.239  68.327  -99.200  -91.000
       HIS 65     0.900    58.762  27.623  66.576  -99.200  -91.000
       TYR 67     0.840    54.889  24.295  76.602  -99.200  -91.000
       HIS 73     0.900    56.399  34.155  72.960  -99.200  -91.000
       PHE 91     1.000    47.722  27.701  58.653  -99.200  -91.000
       TYR 98     0.840    57.818  29.092  51.159  -99.200  -91.000
       TYR 100     0.840    51.785  25.101  49.219  -99.200  -91.000
       HIS 101     0.900    50.866  31.154  43.120  -99.200  -91.000
       TYR 103     0.840    53.383  23.739  41.144  -99.200  -91.000
       PHE 104     1.000    43.024  25.817  43.978  -99.200  -91.000
       PHE 112     1.000    42.905  28.873  39.095  -99.200  -91.000
       HIS 113     0.900    40.621  39.139  38.301  -99.200  -91.000
       PHE 118     1.000    46.605  36.305  49.466  -99.200  -91.000
       PHE 121     1.000    48.340  43.126  49.846  -99.200  -91.000
       PHE 139     1.000    51.357  26.531  54.573  -99.200  -91.000
       TYR 147     0.840    49.601  12.203  60.047  -99.200  -91.000
       TRP 156     1.040    58.215  21.582  62.785  -99.200  -91.000
      TRP6 156     1.020    56.680  23.263  62.166  -99.200  -91.000
       TYR 159     0.840    53.435  22.344  55.345  -99.200  -91.000
       TYR 160     0.840    62.251  25.037  61.666  -99.200  -91.000
       PHE 168     1.000    52.522  37.172  62.261  -99.200  -91.000
       PHE 189     1.000    61.513  38.177  89.380  -99.200  -91.000
       TYR 196     0.840    46.797  43.758 105.703  -99.200  -91.000
       PHE 212     1.000    62.849  48.703  90.404  -99.200  -91.000
       TYR 219     0.840    55.478  33.226  93.350  -99.200  -91.000