=============================================================================
          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  2     0.840    42.045  29.036 -17.877  -99.200  -91.000
       TYR  3     0.840    38.601  23.519 -21.938  -99.200  -91.000
       HIS  4     0.900    32.035  28.423 -21.953  -99.200  -91.000
       HIS  5     0.900    38.205  33.996 -19.343  -99.200  -91.000
       HIS  6     0.900    42.968  29.902 -22.907  -99.200  -91.000
       HIS  7     0.900    36.636  26.549 -27.203  -99.200  -91.000
       HIS  8     0.900    33.878  34.601 -25.335  -99.200  -91.000
       HIS  9     0.900    38.793  36.566 -23.395  -99.200  -91.000
       PHE 13     1.000    31.654  16.736  -3.946  -99.200  -91.000
       TYR 14     0.840    36.767  16.372  -5.553  -99.200  -91.000
       TRP 35     1.040    13.973  21.373  10.297  -99.200  -91.000
      TRP6 35     1.020    12.636  20.120   8.824  -99.200  -91.000
       TRP 52     1.040    -8.624   2.853   1.880  -99.200  -91.000
      TRP6 52     1.020   -10.448   2.376   3.291  -99.200  -91.000
       PHE 60     1.000    -6.871   1.634  -4.640  -99.200  -91.000
       PHE 62     1.000    -9.054   5.384  -1.153  -99.200  -91.000
       TYR 68     0.840    -0.725  18.448  11.226  -99.200  -91.000
       TYR 70     0.840     4.082  16.005  17.382  -99.200  -91.000
       TYR 79     0.840    -5.943  11.322  10.639  -99.200  -91.000
       HIS 80     0.900   -13.021  16.220  11.228  -99.200  -91.000
       HIS 95     0.900    -6.597   3.090   9.660  -99.200  -91.000
       PHE 107     1.000     7.401  25.501  -8.760  -99.200  -91.000
       TYR 120     0.840    12.583  19.581  -0.310  -99.200  -91.000
       PHE 126     1.000     7.221   6.410   6.978  -99.200  -91.000
       PHE 149     1.000   -11.157  27.062  12.508  -99.200  -91.000
       TYR 172     0.840    -9.887   7.624  11.256  -99.200  -91.000
       TRP 179     1.040    10.324  11.929  13.622  -99.200  -91.000
      TRP6 179     1.020     9.006  13.219  15.092  -99.200  -91.000
       TRP 185     1.040    13.014  27.941   2.565  -99.200  -91.000
      TRP6 185     1.020    10.812  27.199   2.428  -99.200  -91.000
       TRP 195     1.040    22.688  28.647 -21.243  -99.200  -91.000
      TRP6 195     1.020    23.039  27.444 -23.228  -99.200  -91.000
       TRP 202     1.040    14.177  34.079 -15.945  -99.200  -91.000
      TRP6 202     1.020    12.226  32.790 -15.775  -99.200  -91.000