============================================================================= 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 6 1.000 11.608 -0.983 22.729 -99.200 -91.000 PHE 14 1.000 5.931 6.434 25.063 -99.200 -91.000 PHE 19 1.000 2.382 1.255 11.260 -99.200 -91.000 PHE 40 1.000 -2.486 1.938 20.212 -99.200 -91.000 PHE 89 1.000 12.633 6.776 13.940 -99.200 -91.000 TYR 102 0.840 9.100 -13.251 14.357 -99.200 -91.000 TRP 111 1.040 12.901 9.005 22.800 -99.200 -91.000 TRP6 111 1.020 12.914 6.655 22.568 -99.200 -91.000