=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 36 rings
        ring        int.           center             anis.    iso.
       TRP 12     1.040    44.044  -0.306  23.867  -99.200  -91.000
      TRP6 12     1.020    44.459   0.859  21.864  -99.200  -91.000
       TRP 14     1.040    43.296   6.213  25.356  -99.200  -91.000
      TRP6 14     1.020    45.555   6.141  24.591  -99.200  -91.000
       TYR 20     0.840    23.942   5.742  39.534  -99.200  -91.000
       HIS 24     0.900    31.796  -0.943  32.765  -99.200  -91.000
       TRP 35     1.040    38.289  18.595  33.539  -99.200  -91.000
      TRP6 35     1.020    35.991  19.070  33.764  -99.200  -91.000
       HIS 41     0.900    24.492   6.154  25.934  -99.200  -91.000
       PHE 43     1.000    28.220   9.857  32.973  -99.200  -91.000
       HIS 47     0.900    21.490   6.774  36.963  -99.200  -91.000
       TYR 51     0.840    27.070   8.462  37.492  -99.200  -91.000
       HIS 58     0.900    45.287  -6.038  33.333  -99.200  -91.000
       TYR 63     0.840    44.685  -4.618  44.795  -99.200  -91.000
       HIS 78     0.900    26.537  19.899  23.093  -99.200  -91.000
       TYR 81     0.840    21.682  12.595  25.953  -99.200  -91.000
       PHE 101     1.000    48.340  12.341  33.346  -99.200  -91.000
       TYR 104     0.840    50.528  -0.433  34.343  -99.200  -91.000
       PHE 117     1.000    41.105  11.869  13.588  -99.200  -91.000
       HIS 122     0.900    41.740  -0.897   9.016  -99.200  -91.000
       TRP 128     1.040    36.979  -3.632  31.210  -99.200  -91.000
      TRP6 128     1.020    37.692  -1.410  31.412  -99.200  -91.000
       HIS 130     0.900    25.773  -6.554  27.476  -99.200  -91.000
       TYR 159     0.840    23.567   3.079  11.866  -99.200  -91.000
       HIS 168     0.900    18.943  12.121  11.574  -99.200  -91.000
       PHE 169     1.000    26.194   8.908  10.773  -99.200  -91.000
       TYR 179     0.840    35.204  -4.659  10.657  -99.200  -91.000
       TRP 202     1.040    47.650   5.387  19.664  -99.200  -91.000
      TRP6 202     1.020    46.354   3.885  18.395  -99.200  -91.000
       TYR 203     0.840    45.773  13.030  17.225  -99.200  -91.000
       TRP 210     1.040    23.729   6.306  17.795  -99.200  -91.000
      TRP6 210     1.020    22.657   5.489  15.848  -99.200  -91.000
       TYR 223     0.840    32.502   4.138  17.569  -99.200  -91.000
       TYR 229     0.840    29.499  17.213  20.136  -99.200  -91.000
       TRP 232     1.040    29.974  22.067  25.142  -99.200  -91.000
      TRP6 232     1.020    30.262  19.947  26.140  -99.200  -91.000