=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 34 rings
        ring        int.           center             anis.    iso.
       TYR  6     0.840     3.268  32.631  11.454  -99.200  -91.000
       HIS 25     0.900     2.731  68.030  16.716  -99.200  -91.000
       PHE 48     1.000     9.246  30.312  14.063  -99.200  -91.000
       HIS 52     0.900    10.798  26.976  13.826  -99.200  -91.000
       PHE 54     1.000     4.201  27.669  10.870  -99.200  -91.000
       PHE 57     1.000     4.427  37.090   8.265  -99.200  -91.000
       HIS 62     0.900    -0.767  49.719  10.885  -99.200  -91.000
       PHE 66     1.000     0.633  56.602  10.497  -99.200  -91.000
       HIS 69     0.900    -2.090  60.952   5.579  -99.200  -91.000
       PHE 72     1.000     6.355  57.118   4.597  -99.200  -91.000
       TYR 74     0.840    10.928  57.807   4.845  -99.200  -91.000
       TRP 76     1.040     6.345  53.862   0.278  -99.200  -91.000
      TRP6 76     1.020     6.430  51.627  -0.528  -99.200  -91.000
       TYR 80     0.840    12.151  51.805   3.955  -99.200  -91.000
       PHE 94     1.000    14.826  31.329   4.056  -99.200  -91.000
       HIS 101     0.900    -7.971  40.475   4.764  -99.200  -91.000
       TYR 105     0.840    -8.736  51.491   6.786  -99.200  -91.000
       TYR 125     0.840     1.811  50.234   2.165  -99.200  -91.000
       HIS 143     0.900   -13.676  40.744   4.470  -99.200  -91.000
       TYR 148     0.840   -21.460  51.727   2.146  -99.200  -91.000
       PHE 158     1.000   -14.850  45.406  -4.400  -99.200  -91.000
       TYR 171     0.840     1.074  41.813  -6.876  -99.200  -91.000
       TRP 181     1.040   -20.516  41.968   0.272  -99.200  -91.000
      TRP6 181     1.020   -21.775  42.627  -1.614  -99.200  -91.000
       HIS 203     0.900   -14.755  35.997   7.357  -99.200  -91.000
       HIS 204     0.900   -19.661  28.243   3.246  -99.200  -91.000
       PHE 221     1.000    -9.560  24.954  -3.205  -99.200  -91.000
       TRP 224     1.040    -7.527  30.612  -5.953  -99.200  -91.000
      TRP6 224     1.020    -6.206  32.295  -4.965  -99.200  -91.000
       HIS 231     0.900    -7.658  34.303   4.310  -99.200  -91.000
       HIS 244     0.900   -10.116  35.332  13.060  -99.200  -91.000
       PHE 246     1.000    -3.466  31.423  22.074  -99.200  -91.000
       TRP 253     1.040    -5.816  20.705  10.978  -99.200  -91.000
      TRP6 253     1.020    -5.339  21.897   8.978  -99.200  -91.000