============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. PHE 18 1.000 15.354 8.088 -30.042 -99.200 -91.000 HIS 24 0.900 21.374 5.363 -38.646 -99.200 -91.000 TRP 31 1.040 4.686 2.644 -27.822 -99.200 -91.000 TRP6 31 1.020 5.836 2.343 -25.765 -99.200 -91.000 TYR 58 0.840 0.580 19.951 -28.327 -99.200 -91.000 TYR 63 0.840 -11.221 12.530 -23.279 -99.200 -91.000 TYR 73 0.840 8.426 3.574 -20.648 -99.200 -91.000 TYR 96 0.840 -1.788 21.955 -18.822 -99.200 -91.000 TYR 132 0.840 15.684 27.303 -5.102 -99.200 -91.000 HIS 133 0.900 12.873 30.335 -7.809 -99.200 -91.000 HIS 158 0.900 25.555 10.811 -13.118 -99.200 -91.000 PHE 169 1.000 5.615 14.496 -6.087 -99.200 -91.000 TYR 172 0.840 -0.587 22.355 -8.624 -99.200 -91.000 PHE 198 1.000 -0.590 10.653 -13.681 -99.200 -91.000 TYR 199 0.840 -1.995 5.832 -10.228 -99.200 -91.000 PHE 204 1.000 -10.266 18.327 -7.335 -99.200 -91.000 PHE 219 1.000 -14.251 4.830 4.663 -99.200 -91.000 PHE 235 1.000 -10.159 26.196 -5.630 -99.200 -91.000 TYR 248 0.840 -2.345 26.868 -18.674 -99.200 -91.000 PHE 250 1.000 4.516 25.222 -9.726 -99.200 -91.000