=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 47 rings
        ring        int.           center             anis.    iso.
       TYR 14     0.840    -3.769   7.258 -50.801  -99.200  -91.000
       TYR 21     0.840     1.277  13.624 -39.608  -99.200  -91.000
       HIS 24     0.900     9.845  11.355 -38.486  -99.200  -91.000
       HIS 25     0.900     2.008   9.803 -39.498  -99.200  -91.000
       TYR 28     0.840     5.248   7.419 -36.363  -99.200  -91.000
       PHE 29     1.000     1.009   5.132 -43.033  -99.200  -91.000
       TYR 35     0.840    -1.532  -3.284 -31.839  -99.200  -91.000
       PHE 59     1.000    12.959 -10.895 -38.834  -99.200  -91.000
       PHE 79     1.000    -4.404   1.446 -49.517  -99.200  -91.000
       TRP 88     1.040     3.719  -9.373 -41.596  -99.200  -91.000
      TRP6 88     1.020     4.681  -7.541 -42.741  -99.200  -91.000
       TRP 90     1.040    -6.237  -8.672 -46.562  -99.200  -91.000
      TRP6 90     1.020    -5.607  -9.693 -48.607  -99.200  -91.000
       TYR 104     0.840     9.139  -2.614 -52.538  -99.200  -91.000
       TRP 109     1.040    15.088 -15.437 -43.802  -99.200  -91.000
      TRP6 109     1.020    14.873 -13.084 -43.645  -99.200  -91.000
       TRP 115     1.040    10.165 -15.152 -53.494  -99.200  -91.000
      TRP6 115     1.020    10.769 -16.872 -55.017  -99.200  -91.000
       HIS 121     0.900    12.041   4.370 -59.759  -99.200  -91.000
       HIS 123     0.900     4.565   0.514 -59.779  -99.200  -91.000
       HIS 148     0.900    16.768  -1.398 -46.854  -99.200  -91.000
       PHE 149     1.000    10.181   2.394 -45.782  -99.200  -91.000
       PHE 156     1.000     7.683  11.057 -48.227  -99.200  -91.000
       PHE 161     1.000    12.897   7.895 -41.576  -99.200  -91.000
       PHE 184     1.000    15.434   3.211 -33.107  -99.200  -91.000
       TRP 195     1.040    11.923  -0.105 -24.975  -99.200  -91.000
      TRP6 195     1.020    12.799   0.626 -27.040  -99.200  -91.000
       HIS 196     0.900     9.430  -9.681 -22.574  -99.200  -91.000
       TRP 204     1.040     4.568   3.593 -21.461  -99.200  -91.000
      TRP6 204     1.020     2.870   4.105 -23.032  -99.200  -91.000
       HIS 206     0.900     8.116   1.582 -11.939  -99.200  -91.000
       HIS 216     0.900    -0.971   3.669  -6.607  -99.200  -91.000
       PHE 222     1.000    -9.443  -2.202 -12.929  -99.200  -91.000
       PHE 224     1.000   -12.818  -4.949 -19.150  -99.200  -91.000
       TRP 226     1.040   -18.821  -5.875 -23.804  -99.200  -91.000
      TRP6 226     1.020   -19.156  -4.249 -25.502  -99.200  -91.000
       TRP 237     1.040    -4.571   8.973  -8.315  -99.200  -91.000
      TRP6 237     1.020    -5.774   6.980  -8.662  -99.200  -91.000
       PHE 248     1.000    -1.734   4.739 -26.530  -99.200  -91.000
       HIS 257     0.900    -8.300  11.221 -23.535  -99.200  -91.000
       HIS 260     0.900   -10.668   4.852 -25.724  -99.200  -91.000
       PHE 283     1.000   -15.438  11.754  -4.434  -99.200  -91.000
       TRP 285     1.040   -10.651  12.665 -15.217  -99.200  -91.000
      TRP6 285     1.020   -10.448  10.539 -14.208  -99.200  -91.000
       PHE 307     1.000   -11.223   5.504 -34.394  -99.200  -91.000
       PHE 332     1.000   -11.465   1.901 -11.053  -99.200  -91.000
       HIS 339     0.900    -4.603   1.601  -4.209  -99.200  -91.000