============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 5 0.840 14.531 16.467 6.431 -99.200 -91.000 TYR 14 0.840 2.469 14.598 11.708 -99.200 -91.000 TYR 22 0.840 13.346 13.027 31.894 -99.200 -91.000 HIS 23 0.900 11.432 13.717 23.796 -99.200 -91.000 PHE 24 1.000 7.746 10.118 28.701 -99.200 -91.000 TRP 34 1.040 -9.125 10.845 22.758 -99.200 -91.000 TRP6 34 1.020 -8.554 9.082 24.219 -99.200 -91.000 HIS 40 0.900 8.394 1.685 23.741 -99.200 -91.000 TYR 42 0.840 0.871 3.934 31.951 -99.200 -91.000 PHE 64 1.000 5.099 23.173 27.914 -99.200 -91.000 HIS 73 0.900 -4.085 -3.499 22.165 -99.200 -91.000 TYR 76 0.840 3.109 -3.018 26.006 -99.200 -91.000 TRP 121 1.040 12.197 17.146 19.606 -99.200 -91.000 TRP6 121 1.020 9.855 16.780 19.574 -99.200 -91.000 TYR 131 0.840 20.052 11.462 23.442 -99.200 -91.000 TYR 152 0.840 15.007 -6.178 13.566 -99.200 -91.000 PHE 161 1.000 5.035 0.030 9.495 -99.200 -91.000 TYR 165 0.840 16.780 4.801 3.534 -99.200 -91.000 TRP 192 1.040 10.160 -3.790 17.910 -99.200 -91.000 TRP6 192 1.020 11.485 -5.475 16.893 -99.200 -91.000 TYR 205 0.840 9.486 2.695 12.356 -99.200 -91.000 TYR 211 0.840 -2.777 -2.146 17.187 -99.200 -91.000 TRP 214 1.040 -7.633 -0.284 21.876 -99.200 -91.000 TRP6 214 1.020 -5.736 1.112 22.115 -99.200 -91.000