============================================================================= 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 10 1.000 3.563 28.284 -12.067 -99.200 -91.000 TYR 26 0.840 -9.406 24.980 -0.637 -99.200 -91.000