=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 41 rings
        ring        int.           center             anis.    iso.
       HIS  4     0.900    18.364  95.335  34.471  -99.200  -91.000
       HIS  7     0.900    14.595  96.452  43.550  -99.200  -91.000
       TYR 19     0.840    11.604  79.245  54.052  -99.200  -91.000
       TRP 26     1.040    12.072  68.470  48.484  -99.200  -91.000
      TRP6 26     1.020    13.672  68.156  46.768  -99.200  -91.000
       TYR 31     0.840    11.439  81.472  49.220  -99.200  -91.000
       PHE 41     1.000    11.186  89.999  33.555  -99.200  -91.000
       HIS 42     0.900    12.659  92.359  29.789  -99.200  -91.000
       TYR 48     0.840     0.252  88.878  42.504  -99.200  -91.000
       HIS 73     0.900    12.745  97.261  55.580  -99.200  -91.000
       HIS 79     0.900     7.591  87.946  62.122  -99.200  -91.000
       PHE 90     1.000    26.832  74.573  65.473  -99.200  -91.000
       TRP 94     1.040    33.183  68.941  52.105  -99.200  -91.000
      TRP6 94     1.020    33.093  66.587  52.347  -99.200  -91.000
       TRP 104     1.040    27.012  68.647  66.199  -99.200  -91.000
      TRP6 104     1.020    28.335  69.201  64.311  -99.200  -91.000
       TYR 105     0.840    19.787  76.093  68.380  -99.200  -91.000
       PHE 109     1.000    27.469  70.288  71.378  -99.200  -91.000
       HIS 131     0.900    42.419  71.722  56.661  -99.200  -91.000
       TYR 132     0.840    33.751  77.520  59.760  -99.200  -91.000
       PHE 135     1.000    38.305  72.733  53.537  -99.200  -91.000
       PHE 158     1.000    52.232  58.305  37.668  -99.200  -91.000
       TYR 170     0.840    40.566  77.378  36.230  -99.200  -91.000
       HIS 186     0.900    45.486  58.326  26.532  -99.200  -91.000
       HIS 192     0.900    40.137  55.172  31.263  -99.200  -91.000
       PHE 196     1.000    41.116  57.797  42.030  -99.200  -91.000
       PHE 208     1.000    48.379  69.807  45.241  -99.200  -91.000
       TYR 225     0.840    41.761  62.755  46.863  -99.200  -91.000
       HIS 238     0.900    46.001  72.796  54.777  -99.200  -91.000
       TYR 248     0.840    38.349  61.094  24.134  -99.200  -91.000
       PHE 251     1.000    37.289  65.295  28.349  -99.200  -91.000
       TYR 257     0.840    27.122  65.627  37.757  -99.200  -91.000
       PHE 258     1.000    32.198  65.365  37.980  -99.200  -91.000
       HIS 263     0.900    21.032  77.091  41.358  -99.200  -91.000
       PHE 264     1.000    23.936  74.420  31.750  -99.200  -91.000
       HIS 282     0.900    28.624  57.307  35.163  -99.200  -91.000
       HIS 293     0.900     3.614  45.309  38.379  -99.200  -91.000
       PHE 312     1.000    24.896  72.618  25.797  -99.200  -91.000
       TYR 319     0.840    29.053  75.190  23.546  -99.200  -91.000
       TRP 327     1.040    20.483  81.628  36.107  -99.200  -91.000
      TRP6 327     1.020    21.666  83.165  37.453  -99.200  -91.000