=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 31 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    38.639  42.150  64.469  -99.200  -91.000
       PHE  6     1.000    33.409  50.773  63.936  -99.200  -91.000
       PHE 12     1.000    43.129  57.871  61.843  -99.200  -91.000
       TRP 20     1.040    31.140  46.932  45.586  -99.200  -91.000
      TRP6 20     1.020    30.436  48.894  44.444  -99.200  -91.000
       TYR 26     0.840    39.534  26.726  45.495  -99.200  -91.000
       TYR 39     0.840    39.978  30.084  49.036  -99.200  -91.000
       TYR 60     0.840    40.910  55.724  55.242  -99.200  -91.000
       HIS 80     0.900    52.718  53.356  32.561  -99.200  -91.000
       HIS 83     0.900    47.867  57.846  42.560  -99.200  -91.000
       PHE 85     1.000    40.549  57.023  34.207  -99.200  -91.000
       TYR 112     0.840    48.334  61.312  27.772  -99.200  -91.000
       TYR 125     0.840    56.282  68.995  33.572  -99.200  -91.000
       PHE 131     1.000    57.515  55.435  38.921  -99.200  -91.000
       TYR 136     0.840    59.285  69.185  36.761  -99.200  -91.000
       TYR 152     0.840    45.508  66.285  50.166  -99.200  -91.000
       TYR 167     0.840    44.433  47.577  49.548  -99.200  -91.000
       PHE 182     1.000    42.174  33.753  52.576  -99.200  -91.000
       PHE 219     1.000    63.930  43.378  47.064  -99.200  -91.000
       TYR 249     0.840    59.497  36.158  48.808  -99.200  -91.000
       TYR 251     0.840    58.935  35.879  41.779  -99.200  -91.000
       PHE 253     1.000    59.134  37.939  35.009  -99.200  -91.000
       TYR 256     0.840    56.243  50.626  36.751  -99.200  -91.000
       TYR 282     0.840    51.709  48.337  39.108  -99.200  -91.000
       PHE 287     1.000    47.614  34.103  39.774  -99.200  -91.000
       TYR 288     0.840    56.913  33.759  36.586  -99.200  -91.000
       PHE 305     1.000    46.988  38.192  42.675  -99.200  -91.000
       HIS 307     0.900    42.640  41.713  39.297  -99.200  -91.000
       PHE 315     1.000    40.992  46.713  26.962  -99.200  -91.000
       HIS 316     0.900    49.452  52.166  27.463  -99.200  -91.000
       TYR 317     0.840    52.296  49.289  28.247  -99.200  -91.000