============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TRP 15 1.040 -30.423 15.519 -36.397 -99.200 -91.000 TRP6 15 1.020 -28.328 15.860 -37.445 -99.200 -91.000 PHE 21 1.000 -26.875 18.208 -21.461 -99.200 -91.000 TYR 22 0.840 -29.157 27.392 -20.995 -99.200 -91.000 TRP 29 1.040 -21.344 21.139 -22.884 -99.200 -91.000 TRP6 29 1.020 -21.283 23.033 -21.469 -99.200 -91.000 PHE 32 1.000 -25.488 17.470 -31.907 -99.200 -91.000 PHE 41 1.000 -23.219 4.431 -45.665 -99.200 -91.000 TRP 42 1.040 -28.512 3.630 -44.144 -99.200 -91.000 TRP6 42 1.020 -27.644 1.881 -45.468 -99.200 -91.000 HIS 44 0.900 -24.347 12.880 -47.968 -99.200 -91.000 TYR 72 0.840 -28.374 22.317 -49.718 -99.200 -91.000 PHE 74 1.000 -30.775 26.800 -45.664 -99.200 -91.000 TYR 100 0.840 -38.971 19.529 -41.121 -99.200 -91.000 PHE 125 1.000 -53.112 13.959 -29.878 -99.200 -91.000 TYR 126 0.840 -49.798 20.417 -29.452 -99.200 -91.000 PHE 134 1.000 -44.636 3.432 -34.782 -99.200 -91.000 PHE 144 1.000 -31.325 12.582 -40.268 -99.200 -91.000 PHE 147 1.000 -38.167 11.440 -41.889 -99.200 -91.000 PHE 159 1.000 -25.676 -4.744 -42.477 -99.200 -91.000