=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 44 rings
        ring        int.           center             anis.    iso.
       TYR  8     0.840    42.231  55.260  72.127  -99.200  -91.000
       HIS 11     0.900    45.674  46.141  73.775  -99.200  -91.000
       PHE 25     1.000    41.922  45.158  54.408  -99.200  -91.000
       PHE 30     1.000    39.642  55.462  66.623  -99.200  -91.000
       TYR 39     0.840    50.168  54.675  67.153  -99.200  -91.000
       TYR 42     0.840    59.875  58.812  66.651  -99.200  -91.000
       PHE 43     1.000    58.243  51.627  65.784  -99.200  -91.000
       TYR 48     0.840    43.339  58.513  55.248  -99.200  -91.000
       PHE 49     1.000    47.230  59.793  65.473  -99.200  -91.000
       TYR 54     0.840    33.376  56.355  67.846  -99.200  -91.000
       PHE 72     1.000    38.146  49.846  70.499  -99.200  -91.000
       HIS 75     0.900    42.875  54.356  77.829  -99.200  -91.000
       TYR 88     0.840    33.516  45.782  68.236  -99.200  -91.000
       PHE 89     1.000    37.696  40.915  62.897  -99.200  -91.000
       TRP 97     1.040    28.031  38.060  77.984  -99.200  -91.000
      TRP6 97     1.020    27.203  36.314  79.348  -99.200  -91.000
       TRP 107     1.040    32.442  32.867  77.596  -99.200  -91.000
      TRP6 107     1.020    33.296  34.824  76.591  -99.200  -91.000
       TYR 119     0.840    36.562  27.722  99.352  -99.200  -91.000
       TYR 134     0.840    43.804  41.440  95.583  -99.200  -91.000
       PHE 135     1.000    43.044  39.198 104.241  -99.200  -91.000
       PHE 143     1.000    37.672  35.465 105.759  -99.200  -91.000
       TRP 144     1.040    35.638  33.538 110.882  -99.200  -91.000
      TRP6 144     1.020    34.120  34.996 109.801  -99.200  -91.000
       TYR 154     0.840    48.253  31.301  96.542  -99.200  -91.000
       TYR 161     0.840    49.136  36.266  80.976  -99.200  -91.000
       HIS 163     0.900    49.305  35.810  72.981  -99.200  -91.000
       TYR 164     0.840    43.070  30.098  72.976  -99.200  -91.000
       PHE 165     1.000    41.540  35.566  63.665  -99.200  -91.000
       TYR 166     0.840    35.529  29.997  65.441  -99.200  -91.000
       TYR 182     0.840    59.524  42.407  82.671  -99.200  -91.000
       PHE 200     1.000    62.561  48.808 103.565  -99.200  -91.000
       TYR 206     0.840    49.843  41.366  91.501  -99.200  -91.000
       TRP 243     1.040    33.393  37.425  64.507  -99.200  -91.000
      TRP6 243     1.020    31.152  37.592  65.248  -99.200  -91.000
       PHE 246     1.000    39.295  32.787  71.863  -99.200  -91.000
       PHE 252     1.000    49.494  24.981  81.461  -99.200  -91.000
       PHE 258     1.000    45.544  28.254  80.719  -99.200  -91.000
       PHE 261     1.000    44.593  33.147  88.301  -99.200  -91.000
       PHE 274     1.000    54.844  35.919  69.920  -99.200  -91.000
       TYR 280     0.840    52.986  27.567  69.855  -99.200  -91.000
       TRP 282     1.040    57.387  32.224  61.276  -99.200  -91.000
      TRP6 282     1.020    57.743  32.532  58.952  -99.200  -91.000
       TYR 285     0.840    48.993  31.099  58.854  -99.200  -91.000