============================================================================= 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 8.582 40.071 -1.476 -99.200 -91.000 PHE 14 1.000 -1.506 47.452 -4.997 -99.200 -91.000 TRP 16 1.040 6.944 44.457 -11.242 -99.200 -91.000 TRP6 16 1.020 5.462 42.928 -12.273 -99.200 -91.000 HIS 17 0.900 -1.641 44.053 -9.887 -99.200 -91.000 PHE 22 1.000 2.007 53.998 -16.922 -99.200 -91.000 PHE 32 1.000 6.500 52.249 -16.152 -99.200 -91.000 TRP 67 1.040 -4.055 52.352 7.369 -99.200 -91.000 TRP6 67 1.020 -2.193 53.770 7.757 -99.200 -91.000