============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. PHE 5 1.000 40.427 28.072 13.759 -99.200 -91.000 TYR 18 0.840 10.642 43.069 7.244 -99.200 -91.000 TRP 20 1.040 10.475 40.974 2.158 -99.200 -91.000 TRP6 20 1.020 12.794 40.665 1.951 -99.200 -91.000 PHE 30 1.000 25.810 29.248 11.697 -99.200 -91.000 TRP 36 1.040 38.742 18.269 23.133 -99.200 -91.000 TRP6 36 1.020 36.625 17.369 23.656 -99.200 -91.000 TYR 53 0.840 38.822 20.113 11.389 -99.200 -91.000 HIS 63 0.900 18.912 23.212 14.165 -99.200 -91.000 PHE 69 1.000 16.516 28.074 11.572 -99.200 -91.000 PHE 87 1.000 30.422 17.870 18.882 -99.200 -91.000 TRP 91 1.040 33.188 29.808 26.065 -99.200 -91.000 TRP6 91 1.020 34.541 30.069 24.164 -99.200 -91.000