=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       TRP 12     1.040    43.186 -24.543  78.182  -99.200  -91.000
      TRP6 12     1.020    43.511 -25.654  80.250  -99.200  -91.000
       TRP 14     1.040    36.812 -26.496  78.709  -99.200  -91.000
      TRP6 14     1.020    38.029 -28.442  79.283  -99.200  -91.000
       TYR 24     0.840    35.805  -6.435  65.293  -99.200  -91.000
       TRP 25     1.040    29.719 -11.498  63.180  -99.200  -91.000
      TRP6 25     1.020    27.678 -11.457  64.377  -99.200  -91.000
       HIS 27     0.900    36.220 -12.685  73.752  -99.200  -91.000
       PHE 28     1.000    29.220 -10.637  74.239  -99.200  -91.000
       HIS 35     0.900    23.830 -31.015  75.558  -99.200  -91.000
       TRP 38     1.040    21.625 -26.769  76.324  -99.200  -91.000
      TRP6 38     1.020    20.199 -24.938  76.781  -99.200  -91.000
       HIS 44     0.900    29.963 -10.163  84.053  -99.200  -91.000
       HIS 64     0.900    47.090 -17.830  67.073  -99.200  -91.000
       TYR 66     0.840    38.427 -10.946  67.016  -99.200  -91.000
       TYR 67     0.840    44.467 -17.334  60.664  -99.200  -91.000
       HIS 80     0.900    19.594 -17.885  88.969  -99.200  -91.000
       PHE 83     1.000    23.934 -10.586  86.912  -99.200  -91.000
       TYR 84     0.840    19.838  -4.832  89.834  -99.200  -91.000
       HIS 108     0.900    36.733 -32.760  74.407  -99.200  -91.000
       PHE 119     1.000    36.074 -27.746  92.232  -99.200  -91.000
       TRP 126     1.040    46.498 -24.164  84.355  -99.200  -91.000
      TRP6 126     1.020    46.923 -26.100  85.628  -99.200  -91.000
       TRP 130     1.040    41.096 -15.724  72.859  -99.200  -91.000
      TRP6 130     1.020    39.340 -17.297  73.048  -99.200  -91.000
       PHE 141     1.000    43.607  -9.803  68.646  -99.200  -91.000
       HIS 154     0.900    37.451 -19.374 106.179  -99.200  -91.000
       TYR 160     0.840    37.266  -9.224  97.239  -99.200  -91.000
       HIS 161     0.900    34.644  -7.850 104.839  -99.200  -91.000
       TYR 165     0.840    36.448   4.200 104.303  -99.200  -91.000
       TRP 203     1.040    41.567 -31.000  82.473  -99.200  -91.000
      TRP6 203     1.020    42.806 -29.498  83.816  -99.200  -91.000
       TRP 211     1.040    36.025  -8.123  90.776  -99.200  -91.000
      TRP6 211     1.020    35.385  -6.153  89.644  -99.200  -91.000
       TYR 224     0.840    37.457 -17.434  88.689  -99.200  -91.000
       TYR 229     0.840    24.187 -21.383  95.795  -99.200  -91.000
       TYR 230     0.840    23.694 -20.192  91.085  -99.200  -91.000
       TRP 233     1.040    18.783 -21.395  86.544  -99.200  -91.000
      TRP6 233     1.020    20.356 -20.792  84.876  -99.200  -91.000
       HIS 235     0.900    22.770 -30.909  85.604  -99.200  -91.000
       HIS 236     0.900    13.843 -25.772  85.166  -99.200  -91.000
       TYR 237     0.840    16.190 -23.177  82.112  -99.200  -91.000