============================================================================= 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. HIS 22 0.900 3.478 6.523 4.440 -99.200 -91.000 PHE 24 1.000 0.260 4.109 9.591 -99.200 -91.000 TRP 32 1.040 -1.371 -0.362 13.367 -99.200 -91.000 TRP6 32 1.020 0.052 0.195 15.178 -99.200 -91.000 PHE 35 1.000 2.286 10.896 16.174 -99.200 -91.000 HIS 47 0.900 17.130 14.560 11.360 -99.200 -91.000 PHE 55 1.000 6.919 10.316 20.242 -99.200 -91.000 TYR 60 0.840 3.497 7.007 19.132 -99.200 -91.000 TYR 69 0.840 15.907 1.261 -1.227 -99.200 -91.000 TRP 70 1.040 14.356 -4.393 -1.168 -99.200 -91.000 TRP6 70 1.020 16.462 -3.629 -0.422 -99.200 -91.000 HIS 79 0.900 4.484 -6.575 4.316 -99.200 -91.000 HIS 81 0.900 3.675 -1.644 4.184 -99.200 -91.000 PHE 86 1.000 8.357 4.172 18.820 -99.200 -91.000 TYR 96 0.840 10.893 6.682 22.221 -99.200 -91.000 TYR 105 0.840 12.906 -12.604 0.594 -99.200 -91.000 TYR 107 0.840 12.634 -5.859 9.971 -99.200 -91.000