=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 40 rings
        ring        int.           center             anis.    iso.
       TYR 19     0.840    13.030 103.973   4.593  -99.200  -91.000
       PHE 30     1.000    -3.599  99.420   3.580  -99.200  -91.000
       HIS 61     0.900    34.130 116.375  17.579  -99.200  -91.000
       TYR 62     0.840    35.408 110.603  16.737  -99.200  -91.000
       TYR 63     0.840    42.438 116.390  10.558  -99.200  -91.000
       HIS 64     0.900    39.382 121.100  15.901  -99.200  -91.000
       HIS 67     0.900    45.908 119.443  12.785  -99.200  -91.000
       PHE 71     1.000    42.114 112.307  20.663  -99.200  -91.000
       HIS 105     0.900    17.174  91.868   4.544  -99.200  -91.000
       PHE 107     1.000    11.142  99.480   0.180  -99.200  -91.000
       HIS 114     0.900    13.230  99.162  -6.489  -99.200  -91.000
       TYR 118     0.840    10.692 111.600 -13.104  -99.200  -91.000
       PHE 155     1.000    21.956 133.945  -5.063  -99.200  -91.000
       TRP 197     1.040    33.829 120.808   3.432  -99.200  -91.000
      TRP6 197     1.020    35.176 119.096   2.550  -99.200  -91.000
       PHE 209     1.000    18.149 139.633   2.883  -99.200  -91.000
       HIS 212     0.900    17.995 134.107  12.850  -99.200  -91.000
       PHE 226     1.000    25.217 126.945  16.325  -99.200  -91.000
       PHE 235     1.000    31.020 128.411  10.022  -99.200  -91.000
       PHE 237     1.000    28.732 132.129  11.482  -99.200  -91.000
       PHE 283     1.000    11.684 116.589  -8.477  -99.200  -91.000
       PHE 308     1.000    -0.304 114.068   7.106  -99.200  -91.000
       TYR 316     0.840    -4.537 109.202   1.305  -99.200  -91.000
       HIS 329     0.900    12.948 114.691  13.054  -99.200  -91.000
       HIS 348     0.900    -2.755 115.223  17.802  -99.200  -91.000
       TYR 351     0.840     3.017 118.782  11.428  -99.200  -91.000
       TYR 359     0.840    22.166 115.613  14.128  -99.200  -91.000
       HIS 361     0.900    31.281 118.652  20.169  -99.200  -91.000
       TRP 366     1.040    14.651 124.545  18.049  -99.200  -91.000
      TRP6 366     1.020    16.500 124.730  16.574  -99.200  -91.000
       TYR 381     0.840     8.623 133.888  28.121  -99.200  -91.000
       PHE 386     1.000    22.976 123.396  35.875  -99.200  -91.000
       PHE 388     1.000    25.008 121.180  28.438  -99.200  -91.000
       HIS 419     0.900    14.307 126.692  22.900  -99.200  -91.000
       TYR 438     0.840     3.442 110.867  28.748  -99.200  -91.000
       HIS 450     0.900    16.516 113.665  34.365  -99.200  -91.000
       HIS 452     0.900    26.500 113.129  39.608  -99.200  -91.000
       PHE 459     1.000    14.902 118.119  29.765  -99.200  -91.000
       PHE 468     1.000    13.200 126.196  45.234  -99.200  -91.000
       PHE 474     1.000    25.300 129.311  37.057  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================