============================================================================= 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 43.281 -6.686 2.871 -99.200 -91.000 PHE 24 1.000 45.444 -3.980 8.005 -99.200 -91.000 TRP 32 1.040 45.777 0.616 12.053 -99.200 -91.000 TRP6 32 1.020 44.571 -0.355 13.851 -99.200 -91.000 PHE 35 1.000 45.746 -11.576 14.344 -99.200 -91.000 HIS 47 0.900 33.116 -20.058 9.402 -99.200 -91.000 PHE 55 1.000 41.104 -12.581 18.771 -99.200 -91.000 TYR 60 0.840 43.426 -8.220 17.529 -99.200 -91.000 TYR 69 0.840 29.310 -6.788 -3.369 -99.200 -91.000 TRP 70 1.040 26.900 -2.363 -3.645 -99.200 -91.000 TRP6 70 1.020 28.120 -1.916 -1.726 -99.200 -91.000 HIS 79 0.900 37.747 4.627 2.613 -99.200 -91.000 HIS 81 0.900 40.168 -0.011 2.365 -99.200 -91.000 PHE 86 1.000 37.716 -6.991 17.212 -99.200 -91.000 TYR 96 0.840 36.116 -10.303 20.783 -99.200 -91.000 TYR 105 0.840 27.515 7.583 -1.398 -99.200 -91.000 TYR 107 0.840 30.066 1.064 7.934 -99.200 -91.000