============================================================================= 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. HIS 22 0.900 5.745 21.539 -5.527 -99.200 -91.000 PHE 24 1.000 0.227 23.487 -8.009 -99.200 -91.000 TRP 32 1.040 -4.537 24.465 -12.438 -99.200 -91.000 TRP6 32 1.020 -5.958 22.829 -11.496 -99.200 -91.000 PHE 35 1.000 -5.536 21.722 -0.388 -99.200 -91.000 HIS 47 0.900 0.746 8.663 5.105 -99.200 -91.000 PHE 55 1.000 -9.049 16.722 -0.098 -99.200 -91.000 TYR 60 0.840 -8.671 19.784 -3.780 -99.200 -91.000 TYR 69 0.840 12.535 8.419 -8.019 -99.200 -91.000 TRP 70 1.040 12.104 8.473 -13.426 -99.200 -91.000 TRP6 70 1.020 12.646 6.262 -12.778 -99.200 -91.000 PHE 78 1.000 7.930 11.479 -23.576 -99.200 -91.000 HIS 79 0.900 5.875 10.556 -19.105 -99.200 -91.000 HIS 81 0.900 4.571 18.513 -14.204 -99.200 -91.000 PHE 86 1.000 -7.827 14.292 -6.871 -99.200 -91.000 TYR 96 0.840 -10.835 11.905 -2.663 -99.200 -91.000 TYR 105 0.840 11.861 7.512 -22.615 -99.200 -91.000 TYR 107 0.840 2.737 9.400 -15.577 -99.200 -91.000