============================================================================= 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 10.429 8.337 7.630 -99.200 -91.000 TYR 7 0.840 3.115 0.145 5.969 -99.200 -91.000 PHE 21 1.000 7.474 3.205 -3.377 -99.200 -91.000 PHE 29 1.000 12.446 10.373 -7.719 -99.200 -91.000