============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. HIS 1 0.900 -7.904 22.389 20.898 -99.200 -91.000 TRP 5 1.040 -15.159 22.123 12.682 -99.200 -91.000 TRP6 5 1.020 -15.433 24.421 13.240 -99.200 -91.000 PHE 14 1.000 -20.524 27.849 17.479 -99.200 -91.000 PHE 18 1.000 -24.674 33.757 16.787 -99.200 -91.000 PHE 28 1.000 -27.050 41.986 15.860 -99.200 -91.000 PHE 68 1.000 -25.424 29.630 13.306 -99.200 -91.000 PHE 100 1.000 -16.154 28.716 18.684 -99.200 -91.000 PHE 111 1.000 -16.787 29.500 12.583 -99.200 -91.000 PHE 122 1.000 -21.225 37.601 3.552 -99.200 -91.000