============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TYR 7 0.840 13.664 15.487 0.247 -99.200 -91.000 TRP 8 1.040 11.784 16.830 -4.019 -99.200 -91.000 TRP6 8 1.020 11.095 15.366 -5.734 -99.200 -91.000 HIS 10 0.900 10.414 12.237 2.882 -99.200 -91.000 PHE 16 1.000 6.114 6.305 13.468 -99.200 -91.000 HIS 43 0.900 6.129 20.998 -8.787 -99.200 -91.000 HIS 46 0.900 15.546 21.364 -5.822 -99.200 -91.000 TYR 51 0.840 11.141 13.810 -11.121 -99.200 -91.000 TYR 55 0.840 5.583 7.976 -0.673 -99.200 -91.000 HIS 56 0.900 8.649 -0.382 -2.098 -99.200 -91.000 TYR 79 0.840 -12.900 5.293 -4.125 -99.200 -91.000 PHE 81 1.000 -5.564 -1.709 -0.832 -99.200 -91.000 PHE 82 1.000 -1.801 -2.002 -5.317 -99.200 -91.000 HIS 84 0.900 -6.483 4.290 1.488 -99.200 -91.000 TRP 89 1.040 0.565 0.580 1.045 -99.200 -91.000 TRP6 89 1.020 -0.554 -1.006 -0.277 -99.200 -91.000 PHE 98 1.000 4.727 1.960 9.525 -99.200 -91.000 HIS 99 0.900 11.639 0.463 12.713 -99.200 -91.000