=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 34 rings
        ring        int.           center             anis.    iso.
       HIS  1     0.900    30.713  27.763 -39.068  -99.200  -91.000
       HIS  2     0.900    24.290  24.873 -34.481  -99.200  -91.000
       HIS  3     0.900    27.014  24.829 -29.048  -99.200  -91.000
       HIS  4     0.900    26.172  17.995 -32.460  -99.200  -91.000
       PHE  9     1.000    26.146  31.937 -19.232  -99.200  -91.000
       TRP 27     1.040    25.015  34.955  -1.815  -99.200  -91.000
      TRP6 27     1.020    25.233  36.521  -3.601  -99.200  -91.000
       TYR 35     0.840    17.506  25.791  -7.917  -99.200  -91.000
       HIS 43     0.900    23.139  17.374 -16.453  -99.200  -91.000
       TYR 52     0.840    39.218  23.774  -8.793  -99.200  -91.000
       TYR 73     0.840    45.089  25.498 -12.787  -99.200  -91.000
       HIS 74     0.900    48.688  19.357 -16.024  -99.200  -91.000
       HIS 82     0.900    44.509  24.781 -21.554  -99.200  -91.000
       PHE 88     1.000    30.863  25.278 -27.037  -99.200  -91.000
       PHE 98     1.000    23.465  22.687 -15.273  -99.200  -91.000
       PHE 100     1.000    28.802  25.996 -10.019  -99.200  -91.000
       TYR 106     0.840    28.448  33.247 -14.628  -99.200  -91.000
       PHE 109     1.000    32.166  28.629 -22.027  -99.200  -91.000
       TYR 112     0.840    29.771  30.284 -28.254  -99.200  -91.000
       TYR 117     0.840    18.906  25.671 -15.140  -99.200  -91.000
       HIS 122     0.900    13.812  39.753  -4.538  -99.200  -91.000
       HIS 123     0.900    21.453  42.887   1.339  -99.200  -91.000
       PHE 125     1.000    23.948  40.318  -0.614  -99.200  -91.000
       PHE 130     1.000    29.267  44.824 -10.357  -99.200  -91.000
       PHE 131     1.000    24.597  36.604 -15.490  -99.200  -91.000
       TRP 139     1.040    17.315  35.012 -23.404  -99.200  -91.000
      TRP6 139     1.020    18.303  33.046 -22.634  -99.200  -91.000
       PHE 143     1.000    10.530  26.316 -10.948  -99.200  -91.000
       TYR 155     0.840    21.400  38.032   2.934  -99.200  -91.000
       TYR 157     0.840    16.959  32.377  -1.392  -99.200  -91.000
       TYR 158     0.840    10.619  35.662  -5.040  -99.200  -91.000
       TYR 159     0.840    15.923  28.527  -5.621  -99.200  -91.000
       HIS 160     0.900    13.209  34.882 -11.188  -99.200  -91.000
       TYR 162     0.840    14.497  34.627 -16.924  -99.200  -91.000