============================================================================= 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 31 1.000 13.724 88.772 36.828 -99.200 -91.000 TYR 32 0.840 9.386 88.456 40.195 -99.200 -91.000 PHE 33 1.000 16.548 89.016 48.456 -99.200 -91.000 TYR 62 0.840 13.111 98.584 54.949 -99.200 -91.000