============================================================================= 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. PHE 11 1.000 137.040 33.177 -2.106 -99.200 -91.000 TYR 27 0.840 153.336 37.131 3.387 -99.200 -91.000