=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 46 rings
        ring        int.           center             anis.    iso.
       TYR  9     0.840    22.601 -10.241 -66.281  -99.200  -91.000
       HIS 10     0.900    28.733 -17.255 -67.766  -99.200  -91.000
       HIS 30     0.900    31.814 -18.382 -62.807  -99.200  -91.000
       HIS 39     0.900    39.456 -35.257 -40.206  -99.200  -91.000
       HIS 53     0.900    50.921 -43.304 -30.642  -99.200  -91.000
       TRP 62     1.040    58.786 -42.076 -23.114  -99.200  -91.000
      TRP6 62     1.020    59.243 -39.758 -23.038  -99.200  -91.000
       TRP 77     1.040    59.043 -35.246 -28.340  -99.200  -91.000
      TRP6 77     1.020    60.796 -36.416 -27.278  -99.200  -91.000
       TYR 79     0.840    52.112 -34.165 -33.152  -99.200  -91.000
       TYR 92     0.840    54.760 -48.009  -4.143  -99.200  -91.000
       PHE 96     1.000    55.912 -37.355 -12.869  -99.200  -91.000
       TYR 99     0.840    51.914 -36.408 -15.573  -99.200  -91.000
       PHE 111     1.000    64.015 -37.504 -23.920  -99.200  -91.000
       PHE 114     1.000    72.871 -38.422 -18.708  -99.200  -91.000
       PHE 117     1.000    73.473 -40.145  -9.544  -99.200  -91.000
       TRP 123     1.040    72.884 -46.445  -6.594  -99.200  -91.000
      TRP6 123     1.020    73.083 -44.263  -5.706  -99.200  -91.000
       HIS 126     0.900    72.996 -47.153   0.695  -99.200  -91.000
       HIS 138     0.900    58.828 -56.754 -18.301  -99.200  -91.000
       PHE 144     1.000    60.607 -48.481  -8.588  -99.200  -91.000
       TYR 145     0.840    57.857 -46.292 -11.753  -99.200  -91.000
       TRP 150     1.040    61.819 -48.848  -3.154  -99.200  -91.000
      TRP6 150     1.020    59.649 -49.738  -3.407  -99.200  -91.000
       TYR 158     0.840    69.115 -46.513   2.832  -99.200  -91.000
       TYR 165     0.840    75.344 -35.864 -14.599  -99.200  -91.000
       TRP 177     1.040    64.055 -36.752  -6.333  -99.200  -91.000
      TRP6 177     1.020    64.311 -34.822  -7.688  -99.200  -91.000
       HIS 180     0.900    58.112 -46.782   0.024  -99.200  -91.000
       HIS 181     0.900    56.182 -39.872   1.404  -99.200  -91.000
       TYR 192     0.840    63.274 -47.413   2.606  -99.200  -91.000
       TYR 198     0.840    68.785 -36.751   5.969  -99.200  -91.000
       PHE 200     1.000    69.056 -30.842   0.533  -99.200  -91.000
       TYR 206     0.840    64.649 -29.623  -6.096  -99.200  -91.000
       PHE 210     1.000    62.062 -34.289  -1.622  -99.200  -91.000
       TYR 229     0.840    56.332 -41.981  -8.815  -99.200  -91.000
       TYR 230     0.840    58.875 -34.717  -4.960  -99.200  -91.000
       TRP 231     1.040    59.310 -32.560 -13.088  -99.200  -91.000
      TRP6 231     1.020    60.001 -30.590 -14.207  -99.200  -91.000
       PHE 242     1.000    69.196 -37.038  -6.670  -99.200  -91.000
       TYR 253     0.840    69.408 -46.223 -18.041  -99.200  -91.000
       PHE 255     1.000    65.011 -39.809 -19.850  -99.200  -91.000
       HIS 273     0.900    48.356 -43.203 -41.515  -99.200  -91.000
       PHE 292     1.000    37.828 -17.024 -41.542  -99.200  -91.000
       HIS 296     0.900    39.569 -30.979 -31.780  -99.200  -91.000
       TYR 306     0.840    36.346 -24.780 -33.776  -99.200  -91.000