============================================================================= 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. PHE 4 1.000 -1.942 -27.288 -8.909 -99.200 -91.000 PHE 13 1.000 0.662 -11.155 11.402 -99.200 -91.000 HIS 35 0.900 17.362 -31.668 -5.108 -99.200 -91.000 PHE 41 1.000 24.509 -27.749 -3.218 -99.200 -91.000 TYR 42 0.840 22.618 -38.972 -4.270 -99.200 -91.000 PHE 59 1.000 17.374 -30.824 -11.243 -99.200 -91.000 HIS 84 0.900 19.458 -22.715 -16.822 -99.200 -91.000 PHE 90 1.000 15.406 -17.916 -10.014 -99.200 -91.000 HIS 93 0.900 19.189 -27.434 -5.850 -99.200 -91.000 TRP 99 1.040 12.139 -40.205 12.196 -99.200 -91.000 TRP6 99 1.020 11.042 -38.435 13.306 -99.200 -91.000 PHE 129 1.000 8.919 -24.543 1.248 -99.200 -91.000 PHE 139 1.000 12.091 -35.365 9.636 -99.200 -91.000 TYR 155 0.840 10.004 -16.217 5.922 -99.200 -91.000 PHE 156 1.000 5.122 -16.162 4.337 -99.200 -91.000 TYR 168 0.840 1.497 -22.983 -5.647 -99.200 -91.000 PHE 169 1.000 3.372 -29.958 2.824 -99.200 -91.000 PHE 172 1.000 3.987 -38.170 -7.411 -99.200 -91.000 TYR 180 0.840 -3.724 -31.075 4.078 -99.200 -91.000