=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 36 rings
        ring        int.           center             anis.    iso.
       TYR  3     0.840    24.253   4.424 -15.669  -99.200  -91.000
       PHE  4     1.000    27.151   4.844  -5.001  -99.200  -91.000
       PHE 10     1.000    23.070  -1.405   5.563  -99.200  -91.000
       PHE 20     1.000    39.543  -4.317  21.096  -99.200  -91.000
       HIS 27     0.900    36.147 -19.521  27.175  -99.200  -91.000
       PHE 28     1.000    27.354 -17.854  21.991  -99.200  -91.000
       TYR 33     0.840    37.461 -17.191  29.727  -99.200  -91.000
       TRP 36     1.040    31.632 -14.297  27.203  -99.200  -91.000
      TRP6 36     1.020    29.681 -13.933  25.938  -99.200  -91.000
       TRP 40     1.040    26.721  -9.446  23.258  -99.200  -91.000
      TRP6 40     1.020    27.595  -8.956  21.125  -99.200  -91.000
       TRP 45     1.040    23.281   0.851  20.574  -99.200  -91.000
      TRP6 45     1.020    22.020   1.275  18.640  -99.200  -91.000
       TYR 51     0.840    11.495  -1.788  13.396  -99.200  -91.000
       HIS 72     0.900    16.631   3.945   6.057  -99.200  -91.000
       PHE 74     1.000    13.644  -5.984   9.586  -99.200  -91.000
       HIS 80     0.900    20.434  -9.057   6.852  -99.200  -91.000
       PHE 85     1.000    25.344 -20.453  10.493  -99.200  -91.000
       TRP 92     1.040    20.993 -14.836  15.509  -99.200  -91.000
      TRP6 92     1.020    22.243 -15.557  13.655  -99.200  -91.000
       PHE 98     1.000    20.480 -12.380  10.471  -99.200  -91.000
       HIS 99     0.900    12.385 -11.873  10.013  -99.200  -91.000
       TYR 103     0.840    23.345 -14.701  -0.429  -99.200  -91.000
       HIS 107     0.900    38.142 -21.063   4.567  -99.200  -91.000
       TRP 113     1.040    19.367 -24.315   9.308  -99.200  -91.000
      TRP6 113     1.020    20.113 -23.047  11.163  -99.200  -91.000
       PHE 121     1.000    21.109 -18.078   8.652  -99.200  -91.000
       TYR 122     0.840    20.532 -19.221  -0.150  -99.200  -91.000
       PHE 123     1.000    25.548 -22.443   5.782  -99.200  -91.000
       TYR 156     0.840    32.140  -8.202   1.591  -99.200  -91.000
       PHE 174     1.000    33.628  -4.684  24.327  -99.200  -91.000
       PHE 181     1.000    37.651   1.071  11.597  -99.200  -91.000
       HIS 185     0.900    44.950  -4.829   1.086  -99.200  -91.000
       PHE 191     1.000    34.504   4.523   4.827  -99.200  -91.000
       HIS 204     0.900    23.149   5.731  17.757  -99.200  -91.000
       TYR 207     0.840    32.576   7.877  10.162  -99.200  -91.000