============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. PHE 10 1.000 31.874 -23.102 -6.155 -99.200 -91.000 HIS 18 0.900 29.496 -28.755 -3.961 -99.200 -91.000 TYR 39 0.840 29.080 -40.438 -8.574 -99.200 -91.000 TYR 43 0.840 29.241 -33.975 -18.454 -99.200 -91.000 TYR 56 0.840 16.711 -30.851 -13.886 -99.200 -91.000 PHE 68 1.000 21.948 -23.022 -4.031 -99.200 -91.000 TYR 83 0.840 33.918 -20.924 -10.756 -99.200 -91.000 TRP 93 1.040 36.842 -27.798 -9.730 -99.200 -91.000 TRP6 93 1.020 35.549 -26.011 -8.891 -99.200 -91.000