============================================================================= 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 6 1.000 10.389 52.961 -5.158 -99.200 -91.000 TYR 7 0.840 3.156 61.086 -3.529 -99.200 -91.000 PHE 21 1.000 7.468 57.948 5.871 -99.200 -91.000 PHE 29 1.000 12.486 50.802 10.229 -99.200 -91.000