=============================================================================
          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.
       HIS 16     0.900    -0.875 -12.723  81.093  -99.200  -91.000
       TYR 21     0.840     1.607 -26.556  76.340  -99.200  -91.000
       PHE 24     1.000     7.343 -27.512  79.501  -99.200  -91.000
       PHE 28     1.000    11.673 -20.804  72.049  -99.200  -91.000
       HIS 34     0.900    18.009 -14.871  77.492  -99.200  -91.000
       TYR 48     0.840    -0.809 -23.363  71.981  -99.200  -91.000
       HIS 49     0.900    -4.870 -14.368  71.465  -99.200  -91.000
       HIS 51     0.900    -7.915 -13.577  68.134  -99.200  -91.000
       TYR 57     0.840     7.133  -7.946  72.162  -99.200  -91.000
       TRP 67     1.040     8.462  -2.394  85.579  -99.200  -91.000
      TRP6 67     1.020    10.362  -2.850  84.262  -99.200  -91.000
       TYR 71     0.840     8.497 -14.498  94.246  -99.200  -91.000
       PHE 80     1.000    11.796  -8.326  77.238  -99.200  -91.000
       TYR 93     0.840    14.989  -4.348  66.047  -99.200  -91.000
       PHE 116     1.000    -2.093 -30.484  77.951  -99.200  -91.000
       TYR 120     0.840    -6.406 -21.403  66.049  -99.200  -91.000
       PHE 134     1.000     5.643 -20.054  91.398  -99.200  -91.000
       HIS 156     0.900    -0.096 -11.978  99.063  -99.200  -91.000
       PHE 166     1.000     6.289 -25.722 103.283  -99.200  -91.000
       TRP 167     1.040    -1.282 -24.322 110.276  -99.200  -91.000
      TRP6 167     1.020    -3.595 -24.562 109.845  -99.200  -91.000
       HIS 172     0.900    -6.215 -34.093 106.802  -99.200  -91.000
       PHE 192     1.000     2.320  -3.968  97.278  -99.200  -91.000
       TYR 208     0.840    -3.851 -11.153 103.571  -99.200  -91.000
       TYR 240     0.840     2.135  -4.316  92.153  -99.200  -91.000
       HIS 244     0.900     9.842   4.381  88.534  -99.200  -91.000
       PHE 247     1.000     5.782  10.576  92.298  -99.200  -91.000
       TYR 296     0.840     3.805  10.528 102.709  -99.200  -91.000
       HIS 298     0.900    -3.077  17.869  97.751  -99.200  -91.000
       PHE 305     1.000    -3.126  -4.264  96.023  -99.200  -91.000
       TYR 328     0.840   -11.636 -23.014  96.339  -99.200  -91.000
       TYR 329     0.840    -0.640 -23.765  95.135  -99.200  -91.000
       HIS 332     0.900    -3.792 -27.228  90.011  -99.200  -91.000
       TYR 343     0.840     2.167 -40.291  82.240  -99.200  -91.000
       HIS 353     0.900     1.788 -57.195  78.940  -99.200  -91.000
       HIS 454     0.900    13.991 -21.485  91.841  -99.200  -91.000