============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. TYR 12 0.840 22.792 -14.729 -15.412 -99.200 -91.000 PHE 14 1.000 19.274 -12.257 -18.854 -99.200 -91.000 PHE 31 1.000 26.524 -6.820 -19.713 -99.200 -91.000 PHE 38 1.000 25.856 -14.832 -4.225 -99.200 -91.000 PHE 50 1.000 26.946 -4.879 -14.425 -99.200 -91.000 PHE 57 1.000 42.796 -10.040 -4.207 -99.200 -91.000 TYR 58 0.840 34.600 -7.637 -5.779 -99.200 -91.000