============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. TYR 2 0.840 12.206 14.043 22.306 -99.200 -91.000 TYR 31 0.840 13.590 25.633 14.755 -99.200 -91.000 TRP 34 1.040 14.050 14.745 7.783 -99.200 -91.000 TRP6 34 1.020 13.606 12.496 8.275 -99.200 -91.000 TYR 35 0.840 21.896 15.398 9.770 -99.200 -91.000 TYR 36 0.840 22.154 9.401 0.720 -99.200 -91.000 TYR 48 0.840 18.552 24.969 6.904 -99.200 -91.000 PHE 51 1.000 10.313 25.828 6.097 -99.200 -91.000 TYR 85 0.840 17.330 8.950 2.557 -99.200 -91.000 TYR 86 0.840 21.062 7.226 10.032 -99.200 -91.000 TRP 90 1.040 19.703 20.388 18.436 -99.200 -91.000 TRP6 90 1.020 21.899 20.368 19.291 -99.200 -91.000 PHE 102 1.000 22.471 11.965 14.968 -99.200 -91.000 PHE 123 1.000 30.851 -25.706 -3.380 -99.200 -91.000 PHE 144 1.000 20.726 -12.507 -3.079 -99.200 -91.000 TYR 145 0.840 16.982 -5.888 -7.637 -99.200 -91.000 TRP 153 1.040 23.126 -22.373 7.962 -99.200 -91.000 TRP6 153 1.020 24.278 -23.871 6.538 -99.200 -91.000 TYR 177 0.840 21.944 -6.326 -4.130 -99.200 -91.000 TYR 182 0.840 31.567 -18.966 4.871 -99.200 -91.000 TRP 190 1.040 30.445 -33.980 7.208 -99.200 -91.000 TRP6 190 1.020 28.545 -33.180 6.021 -99.200 -91.000 HIS 193 0.900 22.833 -33.815 13.659 -99.200 -91.000 TYR 196 0.840 24.652 -30.980 9.679 -99.200 -91.000 HIS 202 0.900 14.969 -12.755 -3.521 -99.200 -91.000