============================================================================= 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. TYR 11 0.840 -5.126 -2.706 -10.165 -99.200 -91.000 HIS 14 0.900 5.288 -1.056 -14.463 -99.200 -91.000 PHE 23 1.000 0.841 3.871 -17.663 -99.200 -91.000 TYR 27 0.840 -10.972 -5.530 -13.222 -99.200 -91.000 PHE 31 1.000 -19.741 -2.360 -13.904 -99.200 -91.000 HIS 32 0.900 -26.284 -6.579 -16.015 -99.200 -91.000 HIS 52 0.900 -13.778 4.642 -20.928 -99.200 -91.000 PHE 57 1.000 -20.950 -9.994 -22.071 -99.200 -91.000 TRP 61 1.040 -25.173 -13.827 -18.765 -99.200 -91.000 TRP6 61 1.020 -24.780 -13.802 -21.108 -99.200 -91.000 PHE 63 1.000 -22.541 -5.125 -18.610 -99.200 -91.000 TYR 64 0.840 -14.168 -7.654 -18.117 -99.200 -91.000 TYR 67 0.840 -13.537 4.182 -15.950 -99.200 -91.000 TYR 68 0.840 -5.819 3.123 -19.498 -99.200 -91.000 PHE 71 1.000 0.173 6.486 -9.560 -99.200 -91.000 TYR 79 0.840 -1.893 9.938 -6.907 -99.200 -91.000 HIS 85 0.900 -24.060 0.015 -10.701 -99.200 -91.000 TRP 96 1.040 -2.310 3.138 -5.009 -99.200 -91.000 TRP6 96 1.020 -0.308 4.384 -4.835 -99.200 -91.000