============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. PHE 5 1.000 -12.650 -23.055 20.486 -99.200 -91.000 TYR 11 0.840 -0.232 -23.415 15.082 -99.200 -91.000 TYR 22 0.840 -14.460 -25.259 5.660 -99.200 -91.000 PHE 23 1.000 -9.706 -18.400 9.373 -99.200 -91.000 TYR 24 0.840 -16.634 -16.602 13.868 -99.200 -91.000 PHE 34 1.000 -6.807 -23.209 8.992 -99.200 -91.000 TYR 36 0.840 -3.961 -29.123 10.721 -99.200 -91.000 PHE 46 1.000 -14.366 -25.396 14.319 -99.200 -91.000