============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 4 rings ring int. center anis. iso. PHE 8 1.000 20.993 9.830 9.550 -99.200 -91.000 TYR 12 0.840 33.291 12.075 6.098 -99.200 -91.000 HIS 66 0.900 35.279 23.992 -3.899 -99.200 -91.000 TYR 72 0.840 23.778 20.160 -7.851 -99.200 -91.000