============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. PHE 9 1.000 -26.627 35.526 -17.932 -99.200 -91.000 PHE 25 1.000 -23.249 12.686 5.234 -99.200 -91.000 TRP 38 1.040 -26.772 -0.261 4.398 -99.200 -91.000 TRP6 38 1.020 -25.664 -1.649 2.813 -99.200 -91.000 PHE 39 1.000 -30.414 2.924 7.448 -99.200 -91.000 TYR 41 0.840 -25.136 0.862 -2.084 -99.200 -91.000 TYR 95 0.840 -11.920 8.391 0.341 -99.200 -91.000 TRP 98 1.040 -7.120 6.829 -4.102 -99.200 -91.000 TRP6 98 1.020 -8.458 5.305 -2.897 -99.200 -91.000 PHE 106 1.000 -12.209 2.613 -0.145 -99.200 -91.000 TRP 107 1.040 -16.585 5.382 0.275 -99.200 -91.000 TRP6 107 1.020 -16.817 4.312 2.361 -99.200 -91.000 TYR 108 0.840 -20.114 -0.628 -8.055 -99.200 -91.000 PHE 118 1.000 -18.407 -12.656 1.117 -99.200 -91.000 TYR 126 0.840 -26.934 2.967 13.295 -99.200 -91.000 PHE 160 1.000 -5.243 15.022 7.755 -99.200 -91.000 TYR 193 0.840 -17.791 24.472 -21.775 -99.200 -91.000 PHE 202 1.000 -11.268 15.897 -21.320 -99.200 -91.000 PHE 209 1.000 -12.076 27.469 -20.222 -99.200 -91.000 PHE 219 1.000 -24.669 23.124 -5.609 -99.200 -91.000 PHE 232 1.000 -13.314 20.078 -12.678 -99.200 -91.000 PHE 233 1.000 -12.025 21.470 -19.137 -99.200 -91.000 PHE 256 1.000 -14.302 40.692 -20.966 -99.200 -91.000 TRP 269 1.040 -19.516 7.747 -11.472 -99.200 -91.000 TRP6 269 1.020 -18.700 5.674 -10.635 -99.200 -91.000 PHE 270 1.000 -26.090 7.298 -10.591 -99.200 -91.000 TRP 280 1.040 -22.899 24.347 -19.295 -99.200 -91.000 TRP6 280 1.020 -24.848 23.092 -19.793 -99.200 -91.000 PHE 282 1.000 -20.403 28.876 -21.760 -99.200 -91.000 PHE 291 1.000 -12.198 37.213 -16.606 -99.200 -91.000 PHE 292 1.000 -17.190 32.558 -13.492 -99.200 -91.000