============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 27 0.840 33.319 20.659 210.230 -99.200 -91.000 PHE 29 1.000 39.742 19.138 211.688 -99.200 -91.000 TYR 32 0.840 33.162 21.506 205.026 -99.200 -91.000 TYR 35 0.840 38.611 30.559 205.383 -99.200 -91.000 TRP 36 1.040 42.776 29.541 213.125 -99.200 -91.000 TRP6 36 1.020 42.195 29.244 215.394 -99.200 -91.000 TRP 47 1.040 41.785 34.946 206.371 -99.200 -91.000 TRP6 47 1.020 43.585 34.750 204.862 -99.200 -91.000 PHE 51 1.000 46.317 22.712 209.285 -99.200 -91.000 TYR 52 0.840 41.765 20.829 202.349 -99.200 -91.000 TYR 60 0.840 50.538 31.293 208.409 -99.200 -91.000 PHE 64 1.000 47.185 39.429 211.695 -99.200 -91.000 TYR 80 0.840 45.663 21.854 218.903 -99.200 -91.000 TYR 93 0.840 43.832 36.669 218.869 -99.200 -91.000 TYR 94 0.840 34.904 35.775 217.270 -99.200 -91.000 TYR 102 0.840 37.616 21.350 197.102 -99.200 -91.000 TYR 104 0.840 41.576 29.332 199.631 -99.200 -91.000 PHE 107 1.000 35.854 33.893 206.742 -99.200 -91.000 TYR 109 0.840 27.228 26.404 210.183 -99.200 -91.000 TRP 110 1.040 31.898 33.201 211.627 -99.200 -91.000 TRP6 110 1.020 33.437 34.995 211.631 -99.200 -91.000