============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 3 0.840 33.785 22.876 15.974 -99.200 -91.000 TRP 21 1.040 20.759 5.975 22.520 -99.200 -91.000 TRP6 21 1.020 21.008 4.460 20.717 -99.200 -91.000 PHE 36 1.000 24.201 -4.431 9.147 -99.200 -91.000 PHE 40 1.000 22.256 -6.567 5.224 -99.200 -91.000 TYR 49 0.840 29.158 -1.584 -0.462 -99.200 -91.000 PHE 50 1.000 26.986 -4.315 5.413 -99.200 -91.000 HIS 68 0.900 28.113 -4.687 11.403 -99.200 -91.000 TYR 74 0.840 27.080 -1.108 23.454 -99.200 -91.000 PHE 79 1.000 28.470 8.497 15.881 -99.200 -91.000 PHE 96 1.000 32.489 4.505 15.621 -99.200 -91.000 HIS 100 0.900 31.162 3.208 8.279 -99.200 -91.000 PHE 110 1.000 27.104 6.703 7.657 -99.200 -91.000 PHE 126 1.000 10.393 7.593 20.247 -99.200 -91.000 TYR 130 0.840 10.589 12.160 18.569 -99.200 -91.000 TRP 134 1.040 17.482 9.339 15.769 -99.200 -91.000 TRP6 134 1.020 19.442 8.272 16.549 -99.200 -91.000