============================================================================= 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 7 0.840 17.035 36.559 12.816 -99.200 -91.000 HIS 11 0.900 22.863 38.348 14.959 -99.200 -91.000 TYR 19 0.840 16.849 27.817 10.777 -99.200 -91.000 TYR 33 0.840 19.621 24.357 -1.809 -99.200 -91.000 HIS 44 0.900 15.999 44.486 8.278 -99.200 -91.000 HIS 58 0.900 33.507 29.432 18.465 -99.200 -91.000 HIS 71 0.900 -1.807 31.520 21.489 -99.200 -91.000 HIS 78 0.900 -2.138 30.150 30.300 -99.200 -91.000 TRP 90 1.040 29.425 23.383 15.890 -99.200 -91.000 TRP6 90 1.020 30.682 25.040 17.020 -99.200 -91.000 TRP 110 1.040 14.074 38.542 32.768 -99.200 -91.000 TRP6 110 1.020 14.773 40.710 33.405 -99.200 -91.000 TYR 121 0.840 10.723 16.030 13.472 -99.200 -91.000 TYR 131 0.840 13.767 20.006 23.285 -99.200 -91.000 PHE 134 1.000 17.699 23.549 30.104 -99.200 -91.000 PHE 136 1.000 10.291 22.432 27.686 -99.200 -91.000 TYR 145 0.840 3.327 18.315 14.611 -99.200 -91.000 PHE 152 1.000 2.829 12.567 5.395 -99.200 -91.000 TYR 156 0.840 7.701 10.923 22.149 -99.200 -91.000