============================================================================= 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. TRP 2 1.040 4.581 35.358 9.863 -99.200 -91.000 TRP6 2 1.020 6.033 37.197 9.630 -99.200 -91.000 PHE 25 1.000 1.452 31.244 -1.657 -99.200 -91.000 TYR 46 0.840 2.617 37.878 7.599 -99.200 -91.000