============================================================================= 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 9 1.000 28.549 23.910 32.086 -99.200 -91.000 PHE 14 1.000 24.871 22.831 19.722 -99.200 -91.000 TRP 16 1.040 24.586 15.038 27.664 -99.200 -91.000 TRP6 16 1.020 22.290 15.375 27.800 -99.200 -91.000 HIS 17 0.900 20.138 19.992 21.977 -99.200 -91.000 PHE 22 1.000 23.690 8.839 17.304 -99.200 -91.000 PHE 32 1.000 26.115 8.476 21.560 -99.200 -91.000 TRP 67 1.040 33.467 32.518 15.467 -99.200 -91.000 TRP6 67 1.020 35.498 31.779 16.441 -99.200 -91.000