=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 38 rings
        ring        int.           center             anis.    iso.
       TYR 16     0.840     6.957  40.064  27.394  -99.200  -91.000
       PHE 27     1.000    -7.161  46.332  35.630  -99.200  -91.000
       HIS 55     0.900    26.279  28.697  25.230  -99.200  -91.000
       HIS 58     0.900    32.678  30.329  27.076  -99.200  -91.000
       TYR 60     0.840    36.330  29.838  17.005  -99.200  -91.000
       HIS 61     0.900    38.666  31.486  24.178  -99.200  -91.000
       HIS 65     0.900    42.772  29.353  22.818  -99.200  -91.000
       PHE 67     1.000    35.854  21.113  23.570  -99.200  -91.000
       HIS 70     0.900    38.611  19.769  30.941  -99.200  -91.000
       PHE 103     1.000     0.908  40.518  24.544  -99.200  -91.000
       TYR 110     0.840     0.993  41.785  18.403  -99.200  -91.000
       TYR 114     0.840     5.229  55.148  15.522  -99.200  -91.000
       PHE 117     1.000    -0.725  59.139  24.958  -99.200  -91.000
       HIS 139     0.900    -7.181  53.281  34.757  -99.200  -91.000
       TYR 184     0.840    24.254  46.780  29.114  -99.200  -91.000
       TRP 193     1.040    31.105  40.813  16.258  -99.200  -91.000
      TRP6 193     1.020    30.472  39.305  14.558  -99.200  -91.000
       PHE 205     1.000    35.152  62.647  27.117  -99.200  -91.000
       PHE 221     1.000    34.548  42.818  33.156  -99.200  -91.000
       PHE 232     1.000    39.560  47.523  27.816  -99.200  -91.000
       PHE 277     1.000    11.454  56.026  19.446  -99.200  -91.000
       PHE 302     1.000     6.279  52.718  38.051  -99.200  -91.000
       TYR 310     0.840    -1.428  55.357  35.308  -99.200  -91.000
       HIS 323     0.900    17.067  42.835  35.559  -99.200  -91.000
       TYR 335     0.840     1.374  51.727  43.440  -99.200  -91.000
       HIS 342     0.900     5.575  46.585  47.941  -99.200  -91.000
       TYR 345     0.840    13.526  52.065  39.516  -99.200  -91.000
       TYR 353     0.840    24.107  38.416  31.446  -99.200  -91.000
       TYR 375     0.840    33.519  49.664  54.138  -99.200  -91.000
       PHE 380     1.000    36.775  30.751  49.248  -99.200  -91.000
       PHE 382     1.000    33.861  31.491  42.064  -99.200  -91.000
       HIS 413     0.900    29.405  44.777  44.326  -99.200  -91.000
       HIS 424     0.900    19.550  35.931  40.175  -99.200  -91.000
       TYR 432     0.840    12.760  38.734  51.675  -99.200  -91.000
       HIS 444     0.900    25.803  27.793  50.831  -99.200  -91.000
       HIS 446     0.900    32.398  19.485  48.260  -99.200  -91.000
       TYR 461     0.840    29.949  35.453  60.647  -99.200  -91.000
       HIS 466     0.900    36.976  24.965  52.732  -99.200  -91.000