=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 33 rings
        ring        int.           center             anis.    iso.
       HIS 14     0.900    74.143  74.946 -17.091  -99.200  -91.000
       TYR 24     0.840    78.448  67.377 -18.927  -99.200  -91.000
       HIS 38     0.900    73.314  50.374  -8.762  -99.200  -91.000
       HIS 48     0.900    75.572  76.456   0.447  -99.200  -91.000
       TYR 49     0.840    79.477  73.548  -4.313  -99.200  -91.000
       TRP 50     1.040    69.202  73.723  -7.271  -99.200  -91.000
      TRP6 50     1.020    67.529  72.908  -5.816  -99.200  -91.000
       TYR 52     0.840    72.349  79.499  -0.271  -99.200  -91.000
       PHE 58     1.000    86.965  75.418  -2.337  -99.200  -91.000
       HIS 67     0.900    80.074  64.815  -2.313  -99.200  -91.000
       HIS 82     0.900    93.246  48.459  -8.726  -99.200  -91.000
       PHE 102     1.000   100.145  68.975   2.776  -99.200  -91.000
       TYR 107     0.840    94.351  59.851   0.504  -99.200  -91.000
       PHE 114     1.000    88.365  64.806  -9.936  -99.200  -91.000
       PHE 115     1.000    85.826  65.373  -2.337  -99.200  -91.000
       PHE 128     1.000    78.059  54.654 -19.578  -99.200  -91.000
       TYR 129     0.840    83.530  60.218 -11.955  -99.200  -91.000
       HIS 131     0.900    87.583  58.972  -8.921  -99.200  -91.000
       PHE 135     1.000    92.858  57.733  -4.278  -99.200  -91.000
       TYR 137     0.840    89.453  52.284  -2.292  -99.200  -91.000
       PHE 145     1.000    76.035  48.141  -7.744  -99.200  -91.000
       HIS 159     0.900    90.099  62.460   8.569  -99.200  -91.000
       HIS 170     0.900    87.779  57.512  24.494  -99.200  -91.000
       TYR 256     0.840    81.577  77.151  28.190  -99.200  -91.000
       HIS 279     0.900    86.134  75.800  30.439  -99.200  -91.000
       PHE 291     1.000    89.630  69.643   2.873  -99.200  -91.000
       TYR 293     0.840    86.353  61.292   2.513  -99.200  -91.000
       TRP 297     1.040    85.833  54.540  -0.321  -99.200  -91.000
      TRP6 297     1.020    85.782  56.763   0.508  -99.200  -91.000
       HIS 316     0.900    62.617  60.219   1.287  -99.200  -91.000
       PHE 318     1.000    63.102  60.906  -5.019  -99.200  -91.000
       PHE 327     1.000    70.106  67.750  -6.001  -99.200  -91.000
       PHE 330     1.000    69.658  67.470   1.431  -99.200  -91.000