=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 42 rings
        ring        int.           center             anis.    iso.
       TRP 21     1.040    -3.091   9.371  17.346  -99.200  -91.000
      TRP6 21     1.020    -3.931   8.234  19.184  -99.200  -91.000
       TYR 40     0.840    13.414   2.762  16.213  -99.200  -91.000
       HIS 42     0.900     6.984  -1.719  11.716  -99.200  -91.000
       HIS 47     0.900    -5.585  11.419   5.050  -99.200  -91.000
       TYR 49     0.840    -2.119   7.802  13.191  -99.200  -91.000
       PHE 74     1.000     6.708  -4.328   6.800  -99.200  -91.000
       TRP 80     1.040   -11.073   8.476   9.109  -99.200  -91.000
      TRP6 80     1.020   -10.577   7.472  11.124  -99.200  -91.000
       TYR 83     0.840   -10.852   9.256   3.058  -99.200  -91.000
       HIS 84     0.900   -14.522   1.543   6.152  -99.200  -91.000
       TYR 104     0.840     7.818  -0.740  -1.564  -99.200  -91.000
       TYR 108     0.840    -4.004   1.916   2.898  -99.200  -91.000
       HIS 111     0.900    -6.648   4.260  11.542  -99.200  -91.000
       TRP 112     1.040   -10.731   2.908  13.972  -99.200  -91.000
      TRP6 112     1.020   -11.024   2.030  16.055  -99.200  -91.000
       PHE 116     1.000   -16.884   6.816  11.132  -99.200  -91.000
       PHE 122     1.000    -9.538  13.274   8.616  -99.200  -91.000
       PHE 123     1.000   -13.758  10.290  14.204  -99.200  -91.000
       TRP 142     1.040   -10.211  -8.462   2.557  -99.200  -91.000
      TRP6 142     1.020    -8.443  -7.554   3.856  -99.200  -91.000
       PHE 162     1.000   -11.925  -5.263  10.233  -99.200  -91.000
       HIS 164     0.900   -13.305 -15.263  17.108  -99.200  -91.000
       TYR 178     0.840    -4.102 -10.916  -2.712  -99.200  -91.000
       HIS 188     0.900    -2.704  -1.747  26.699  -99.200  -91.000
       TYR 190     0.840    -2.236  -1.538  32.752  -99.200  -91.000
       TYR 199     0.840   -10.701 -16.344  14.655  -99.200  -91.000
       TYR 210     0.840    -4.356   0.284  18.487  -99.200  -91.000
       TRP 220     1.040    -9.114   8.895  24.756  -99.200  -91.000
      TRP6 220     1.020    -8.735   9.098  22.517  -99.200  -91.000
       HIS 241     0.900    15.344  -9.389  32.288  -99.200  -91.000
       PHE 252     1.000     3.518  -8.619  27.482  -99.200  -91.000
       PHE 274     1.000    16.738  -0.780  16.560  -99.200  -91.000
       PHE 277     1.000    16.096  -5.680  18.177  -99.200  -91.000
       PHE 279     1.000    15.500  -6.886  27.557  -99.200  -91.000
       TYR 292     0.840     1.439  -7.177  35.650  -99.200  -91.000
       TRP 296     1.040    -7.915   1.724  30.110  -99.200  -91.000
      TRP6 296     1.020    -5.791   2.579  29.380  -99.200  -91.000
       HIS 307     0.900   -21.086   1.865  11.497  -99.200  -91.000
       TYR 310     0.840   -17.767   1.177  18.790  -99.200  -91.000
       PHE 312     1.000   -12.848  -1.858  19.827  -99.200  -91.000
       HIS 313     0.900   -21.312  -3.206  20.835  -99.200  -91.000