=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 23 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    -0.416  27.509  64.557  -99.200  -91.000
       PHE  2     1.000    -0.365  27.785  70.228  -99.200  -91.000
       TYR  9     0.840     9.456  32.402  77.379  -99.200  -91.000
       TYR 16     0.840    20.707  17.310  80.480  -99.200  -91.000
       HIS 22     0.900    26.766  16.232  74.743  -99.200  -91.000
       PHE 23     1.000    24.143  21.425  81.104  -99.200  -91.000
       HIS 42     0.900    31.389  31.445  75.995  -99.200  -91.000
       PHE 45     1.000    22.149  29.543  75.044  -99.200  -91.000
       TYR 56     0.840    13.010  36.910  68.675  -99.200  -91.000
       TYR 65     0.840    18.861  37.960  69.734  -99.200  -91.000
       TYR 75     0.840    23.286  31.748  61.439  -99.200  -91.000
       PHE 86     1.000    15.306  28.628  66.507  -99.200  -91.000
       HIS 94     0.900     9.741  16.129  81.959  -99.200  -91.000
       TYR 95     0.840    12.316  14.990  77.923  -99.200  -91.000
       TYR 98     0.840    13.273  25.503  72.581  -99.200  -91.000
       HIS 103     0.900    14.274  27.012  56.745  -99.200  -91.000
       TRP 108     1.040    14.558  21.217  58.084  -99.200  -91.000
      TRP6 108     1.020    15.788  22.733  56.738  -99.200  -91.000
       PHE 109     1.000    11.172  18.736  65.457  -99.200  -91.000
       HIS 125     0.900    13.043  11.510  62.637  -99.200  -91.000
       TYR 126     0.840     6.738  16.677  65.542  -99.200  -91.000
       TRP 133     1.040    16.654  20.997  72.861  -99.200  -91.000
      TRP6 133     1.020    18.974  21.273  73.217  -99.200  -91.000