============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 9 0.840 17.799 20.711 13.383 -99.200 -91.000 PHE 21 1.000 29.882 25.599 13.834 -99.200 -91.000 PHE 31 1.000 22.035 18.596 14.632 -99.200 -91.000 HIS 36 0.900 15.377 29.694 18.710 -99.200 -91.000 PHE 54 1.000 16.619 19.615 19.728 -99.200 -91.000 PHE 59 1.000 14.511 30.192 23.914 -99.200 -91.000 TRP 66 1.040 24.548 17.633 23.596 -99.200 -91.000 TRP6 66 1.020 25.144 15.469 22.932 -99.200 -91.000 PHE 84 1.000 30.549 20.830 0.681 -99.200 -91.000 TYR 108 0.840 29.070 31.278 3.675 -99.200 -91.000 TYR 122 0.840 15.300 35.896 21.348 -99.200 -91.000 TRP 146 1.040 25.980 33.325 13.247 -99.200 -91.000 TRP6 146 1.020 26.125 35.603 12.658 -99.200 -91.000 PHE 180 1.000 28.054 35.072 16.746 -99.200 -91.000 TYR 190 0.840 24.978 21.176 26.783 -99.200 -91.000