=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 39 rings
        ring        int.           center             anis.    iso.
       HIS 12     0.900     4.213 -14.543 -74.491  -99.200  -91.000
       HIS 29     0.900     3.161  -8.265 -52.660  -99.200  -91.000
       TYR 34     0.840     2.384 -10.167 -59.457  -99.200  -91.000
       TYR 40     0.840     0.794 -10.751 -72.107  -99.200  -91.000
       TYR 50     0.840    -2.784 -24.229 -70.238  -99.200  -91.000
       PHE 57     1.000     0.785 -13.839 -52.290  -99.200  -91.000
       TYR 65     0.840    -3.867 -10.349 -57.102  -99.200  -91.000
       TRP 71     1.040    -3.322 -29.420 -71.654  -99.200  -91.000
      TRP6 71     1.020    -4.330 -27.734 -72.964  -99.200  -91.000
       HIS 85     0.900    10.828 -13.944 -59.640  -99.200  -91.000
       TYR 117     0.840     2.227 -33.533 -74.437  -99.200  -91.000
       HIS 122     0.900    -3.746 -31.510 -64.392  -99.200  -91.000
       PHE 125     1.000     2.568 -25.384 -68.182  -99.200  -91.000
       TRP 127     1.040     3.545 -17.503 -65.384  -99.200  -91.000
      TRP6 127     1.020     2.115 -19.234 -66.154  -99.200  -91.000
       TRP 128     1.040     5.989 -19.825 -58.391  -99.200  -91.000
      TRP6 128     1.020     4.150 -21.104 -57.592  -99.200  -91.000
       PHE 140     1.000    -1.536 -18.158 -49.637  -99.200  -91.000
       TYR 141     0.840     0.585 -24.352 -55.536  -99.200  -91.000
       TYR 156     0.840     8.259 -25.288 -59.305  -99.200  -91.000
       PHE 159     1.000    11.750 -23.859 -66.647  -99.200  -91.000
       TYR 169     0.840    23.682 -21.186 -72.244  -99.200  -91.000
       PHE 170     1.000    25.803 -20.976 -64.281  -99.200  -91.000
       TYR 172     0.840    17.267 -24.526 -60.353  -99.200  -91.000
       PHE 182     1.000    15.298 -28.643 -67.027  -99.200  -91.000
       TYR 185     0.840    16.967 -28.578 -76.063  -99.200  -91.000
       PHE 186     1.000    20.785 -26.174 -72.008  -99.200  -91.000
       HIS 205     0.900    14.983 -23.876 -56.510  -99.200  -91.000
       PHE 208     1.000     6.341 -26.126 -55.700  -99.200  -91.000
       PHE 219     1.000    21.041 -18.147 -61.926  -99.200  -91.000
       TYR 224     0.840    28.039 -16.058 -57.367  -99.200  -91.000
       TRP 234     1.040    28.551 -22.026 -71.142  -99.200  -91.000
      TRP6 234     1.020    28.680 -21.830 -68.797  -99.200  -91.000
       PHE 242     1.000    27.682 -15.926 -64.751  -99.200  -91.000
       TYR 246     0.840    20.294 -10.115 -58.999  -99.200  -91.000
       HIS 247     0.900    17.251  -8.481 -57.482  -99.200  -91.000
       HIS 270     0.900    14.141 -32.698 -74.749  -99.200  -91.000
       TRP 273     1.040     5.647 -32.246 -75.738  -99.200  -91.000
      TRP6 273     1.020     5.083 -29.949 -75.534  -99.200  -91.000