============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 -92.554 -62.867 41.094 -99.200 -91.000 TYR 25 0.840 -83.327 -74.874 26.040 -99.200 -91.000 PHE 26 1.000 -73.175 -77.905 26.409 -99.200 -91.000 HIS 28 0.900 -83.408 -81.911 24.788 -99.200 -91.000 PHE 32 1.000 -81.390 -82.076 18.749 -99.200 -91.000 TRP 35 1.040 -78.941 -89.529 17.850 -99.200 -91.000 TRP6 35 1.020 -80.799 -88.544 18.933 -99.200 -91.000 TYR 45 0.840 -72.293 -74.289 22.077 -99.200 -91.000 HIS 46 0.900 -74.138 -70.776 18.422 -99.200 -91.000 HIS 54 0.900 -81.940 -65.077 28.107 -99.200 -91.000 TYR 58 0.840 -83.412 -63.712 35.101 -99.200 -91.000 PHE 64 1.000 -77.842 -52.210 41.751 -99.200 -91.000 TYR 107 0.840 -94.016 -57.876 43.345 -99.200 -91.000 HIS 112 0.900 -93.790 -47.295 41.626 -99.200 -91.000 TYR 114 0.840 -91.368 -48.244 37.070 -99.200 -91.000 HIS 130 0.900 -85.488 -71.736 22.492 -99.200 -91.000 TRP 133 1.040 -85.309 -72.483 15.171 -99.200 -91.000 TRP6 133 1.020 -84.765 -74.452 16.366 -99.200 -91.000 TYR 149 0.840 -86.742 -81.330 11.408 -99.200 -91.000