============================================================================= 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 -5.636 59.373 -11.970 -99.200 -91.000 TRP6 2 1.020 -4.802 60.715 -10.226 -99.200 -91.000 PHE 25 1.000 -10.523 49.512 -5.825 -99.200 -91.000 TYR 46 0.840 -2.694 56.781 -9.766 -99.200 -91.000