============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 17.370 42.475 22.381 -99.200 -91.000 TRP6 6 1.020 17.652 43.293 20.170 -99.200 -91.000 TRP 42 1.040 14.344 4.013 30.779 -99.200 -91.000 TRP6 42 1.020 14.941 3.617 28.524 -99.200 -91.000 PHE 53 1.000 15.626 11.218 12.876 -99.200 -91.000 TYR 59 0.840 13.318 8.534 33.091 -99.200 -91.000 HIS 69 0.900 6.228 30.967 36.625 -99.200 -91.000 PHE 99 1.000 5.035 38.580 16.072 -99.200 -91.000