============================================================================= 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 5.325 14.806 15.587 -99.200 -91.000 TRP6 2 1.020 3.151 15.042 16.470 -99.200 -91.000 PHE 25 1.000 10.359 26.436 13.835 -99.200 -91.000 TYR 46 0.840 3.096 17.262 13.287 -99.200 -91.000