============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 2 rings ring int. center anis. iso. TYR 14 0.840 -16.145 -16.271 21.707 -99.200 -91.000 TYR 19 0.840 -18.508 -3.356 25.701 -99.200 -91.000