=============================================================================
          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.
       HIS  7     0.900     8.910  81.854  13.304  -99.200  -91.000
       HIS 19     0.900    16.768  68.648   8.539  -99.200  -91.000
       HIS 21     0.900    17.396  64.013  12.091  -99.200  -91.000
       PHE 34     1.000    11.969  72.307   7.327  -99.200  -91.000
       PHE 57     1.000     8.009  69.509  -4.169  -99.200  -91.000
       HIS 69     0.900    12.467  66.602  17.157  -99.200  -91.000
       TYR 73     0.840     2.205  75.073  15.158  -99.200  -91.000
       HIS 88     0.900     5.688  72.674 -10.708  -99.200  -91.000
       PHE 92     1.000     4.762  69.840   3.414  -99.200  -91.000
       HIS 93     0.900     0.198  61.965   1.445  -99.200  -91.000
       PHE 117     1.000     2.619  70.921   7.603  -99.200  -91.000
       PHE 125     1.000     2.804  62.038   8.826  -99.200  -91.000
       TYR 127     0.840     8.212  66.963   0.377  -99.200  -91.000
       HIS 128     0.900     1.150  64.176  -3.539  -99.200  -91.000
       TRP 137     1.040     3.316  65.056 -16.608  -99.200  -91.000
      TRP6 137     1.020     3.239  67.316 -17.268  -99.200  -91.000
       HIS 138     0.900     2.900  69.125 -12.074  -99.200  -91.000
       HIS 164     0.900    20.806  57.638  18.885  -99.200  -91.000
       TYR 165     0.840    17.465  58.108  13.393  -99.200  -91.000
       TYR 169     0.840    22.689  56.506   4.409  -99.200  -91.000
       PHE 174     1.000    10.713  59.831  -7.037  -99.200  -91.000
       TYR 177     0.840     3.922  55.074 -14.807  -99.200  -91.000
       TYR 186     0.840    12.171  53.572 -22.861  -99.200  -91.000
       TYR 189     0.840     8.359  63.435 -25.107  -99.200  -91.000
       TYR 196     0.840    -0.762  66.128 -19.732  -99.200  -91.000
       HIS 210     0.900    13.215  53.565 -17.743  -99.200  -91.000
       PHE 213     1.000    15.327  51.787  -4.447  -99.200  -91.000
       HIS 238     0.900    11.784  52.433  -0.294  -99.200  -91.000
       HIS 248     0.900    15.163  41.223   1.215  -99.200  -91.000
       HIS 253     0.900    16.991  39.524   8.931  -99.200  -91.000
       TRP 256     1.040    12.905  47.294  17.063  -99.200  -91.000
      TRP6 256     1.020    11.062  46.026  17.849  -99.200  -91.000
       TRP 258     1.040     7.418  52.684  13.802  -99.200  -91.000
      TRP6 258     1.020     9.735  52.672  14.259  -99.200  -91.000
       PHE 263     1.000     8.634  57.498  13.033  -99.200  -91.000
       TRP 274     1.040    10.566  47.741   5.064  -99.200  -91.000
      TRP6 274     1.020    12.559  46.506   5.410  -99.200  -91.000
       PHE 275     1.000     2.396  46.723   0.137  -99.200  -91.000
       TYR 286     0.840    20.261  45.010   9.592  -99.200  -91.000
       PHE 288     1.000    23.826  47.900   7.635  -99.200  -91.000
       TYR 294     0.840    24.577  44.212   4.437  -99.200  -91.000
       TYR 296     0.840    16.291  49.921   1.114  -99.200  -91.000
       HIS 299     0.900    12.775  39.753  -2.679  -99.200  -91.000
       PHE 305     1.000    18.525  42.010  -8.675  -99.200  -91.000
       HIS 312     0.900    24.985  47.801  -5.379  -99.200  -91.000
       TRP 319     1.040    32.097  36.575   7.970  -99.200  -91.000
      TRP6 319     1.020    30.287  37.144   6.576  -99.200  -91.000