=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 21 rings
        ring        int.           center             anis.    iso.
       HIS 19     0.900    48.628  64.676  22.261  -99.200  -91.000
       PHE 21     1.000    44.776  56.710  29.877  -99.200  -91.000
       PHE 26     1.000    49.403  70.605  28.792  -99.200  -91.000
       TYR 30     0.840    44.563  75.000  20.031  -99.200  -91.000
       PHE 35     1.000    37.406  61.006  12.953  -99.200  -91.000
       TYR 38     0.840    45.387  58.836  20.131  -99.200  -91.000
       PHE 42     1.000    42.978  51.510  32.752  -99.200  -91.000
       TRP 54     1.040    37.514  56.164  18.505  -99.200  -91.000
      TRP6 54     1.020    37.263  55.859  16.184  -99.200  -91.000
       TYR 61     0.840    33.569  77.429  10.268  -99.200  -91.000
       TYR 62     0.840    37.052  70.674  10.908  -99.200  -91.000
       TYR 70     0.840    29.563  61.569  18.033  -99.200  -91.000
       PHE 80     1.000    32.790  71.842  32.577  -99.200  -91.000
       TRP 95     1.040    29.792  70.227  23.161  -99.200  -91.000
      TRP6 95     1.020    30.565  69.602  21.029  -99.200  -91.000
       PHE 102     1.000    25.011  62.030  15.099  -99.200  -91.000
       HIS 130     0.900    34.345  89.416  29.859  -99.200  -91.000
       TYR 137     0.840    33.791  68.739  42.037  -99.200  -91.000
       TYR 152     0.840    31.885  67.966  37.472  -99.200  -91.000
       PHE 168     1.000    41.253  59.043  29.288  -99.200  -91.000
       HIS 169     0.900    39.461  53.719  38.321  -99.200  -91.000