============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. PHE 16 1.000 -1.640 15.856 17.626 -99.200 -91.000 PHE 23 1.000 9.809 13.699 21.323 -99.200 -91.000 TYR 24 0.840 15.259 6.389 22.094 -99.200 -91.000 PHE 25 1.000 14.969 13.129 17.799 -99.200 -91.000 PHE 39 1.000 8.157 8.842 -3.547 -99.200 -91.000 TYR 50 0.840 10.522 5.761 18.261 -99.200 -91.000