============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 10 0.840 11.204 -7.645 24.246 -99.200 -91.000 TYR 12 0.840 7.687 0.855 28.750 -99.200 -91.000 PHE 16 1.000 14.368 -1.273 17.096 -99.200 -91.000 PHE 89 1.000 -0.100 -9.672 16.577 -99.200 -91.000 PHE 90 1.000 4.764 -2.237 18.379 -99.200 -91.000 TYR 102 0.840 -8.947 -10.326 14.206 -99.200 -91.000 TYR 106 0.840 -4.175 -4.707 8.728 -99.200 -91.000 TYR 107 0.840 5.737 -7.702 11.904 -99.200 -91.000 HIS 126 0.900 34.438 -1.836 8.513 -99.200 -91.000 TRP 127 1.040 38.340 -11.051 5.916 -99.200 -91.000 TRP6 127 1.020 39.220 -11.946 7.913 -99.200 -91.000 TRP 133 1.040 40.592 -6.467 11.788 -99.200 -91.000 TRP6 133 1.020 38.453 -5.759 11.112 -99.200 -91.000 PHE 143 1.000 31.124 -17.238 12.731 -99.200 -91.000 HIS 152 0.900 13.074 -11.199 17.403 -99.200 -91.000 TYR 161 0.840 19.197 -15.002 4.727 -99.200 -91.000 TRP 183 1.040 16.493 -10.111 21.120 -99.200 -91.000 TRP6 183 1.020 17.472 -10.031 18.971 -99.200 -91.000 TRP 195 1.040 31.921 -17.848 23.970 -99.200 -91.000 TRP6 195 1.020 30.491 -16.573 22.597 -99.200 -91.000 HIS 225 0.900 39.213 -11.727 29.154 -99.200 -91.000 PHE 233 1.000 32.190 -5.846 11.837 -99.200 -91.000 PHE 266 1.000 -0.546 7.438 16.533 -99.200 -91.000 TRP 284 1.040 2.902 4.375 6.840 -99.200 -91.000 TRP6 284 1.020 5.243 4.408 7.142 -99.200 -91.000 TYR 295 0.840 16.859 -4.296 9.406 -99.200 -91.000 PHE 306 1.000 23.117 6.400 8.796 -99.200 -91.000