============================================================================= 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 -17.314 -13.209 57.318 -99.200 -91.000 TYR 19 0.840 -19.498 -0.431 61.876 -99.200 -91.000