============================================================================= 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 -2.667 9.114 17.628 -99.200 -91.000 TYR 26 0.840 3.642 6.137 33.096 -99.200 -91.000