============================================================================= 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. PHE 33 1.000 20.269 20.407 -4.489 -99.200 -91.000 HIS 49 0.900 33.979 13.539 10.670 -99.200 -91.000 TYR 55 0.840 29.735 -1.731 15.129 -99.200 -91.000 TYR 66 0.840 17.944 21.080 -8.150 -99.200 -91.000 PHE 81 1.000 12.951 32.624 -2.322 -99.200 -91.000 TRP 92 1.040 6.397 37.332 8.387 -99.200 -91.000 TRP6 92 1.020 5.098 37.873 10.271 -99.200 -91.000 HIS 111 0.900 16.985 19.713 -12.031 -99.200 -91.000 PHE 120 1.000 6.807 7.492 0.040 -99.200 -91.000 PHE 136 1.000 -0.033 14.015 -8.185 -99.200 -91.000 HIS 138 0.900 4.885 22.466 -10.796 -99.200 -91.000 TYR 160 0.840 5.719 15.728 25.696 -99.200 -91.000 TYR 161 0.840 1.783 20.486 23.997 -99.200 -91.000 HIS 181 0.900 1.611 21.744 9.532 -99.200 -91.000 TYR 191 0.840 -12.372 9.672 14.692 -99.200 -91.000 PHE 201 1.000 -7.683 7.838 30.677 -99.200 -91.000 PHE 216 1.000 -8.835 19.236 21.251 -99.200 -91.000 TYR 234 0.840 15.974 23.225 14.860 -99.200 -91.000 TYR 248 0.840 9.184 3.850 -0.079 -99.200 -91.000 TYR 266 0.840 -11.801 12.648 4.924 -99.200 -91.000 HIS 268 0.900 -13.460 18.775 0.386 -99.200 -91.000 PHE 272 1.000 -1.435 15.622 -3.236 -99.200 -91.000 PHE 300 1.000 -10.842 16.535 5.396 -99.200 -91.000 HIS 315 0.900 -1.979 33.844 -10.471 -99.200 -91.000