============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 4 rings ring int. center anis. iso. PHE 9 1.000 22.851 9.944 33.613 -99.200 -91.000 TYR 13 0.840 20.644 4.614 32.479 -99.200 -91.000 PHE 14 1.000 19.740 1.462 37.517 -99.200 -91.000 TYR 29 0.840 23.936 16.612 33.816 -99.200 -91.000