============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 25 1.000 119.241 24.699 83.357 -99.200 -91.000 TYR 35 0.840 131.352 32.216 98.583 -99.200 -91.000 PHE 54 1.000 121.664 30.193 106.144 -99.200 -91.000 TYR 66 0.840 137.829 35.248 116.770 -99.200 -91.000 TYR 90 0.840 121.088 23.879 111.856 -99.200 -91.000 TYR 92 0.840 119.322 12.341 113.424 -99.200 -91.000 PHE 93 1.000 116.620 18.424 111.493 -99.200 -91.000 TYR 95 0.840 122.364 24.575 106.675 -99.200 -91.000 TYR 112 0.840 141.376 22.571 109.844 -99.200 -91.000 TYR 136 0.840 141.449 13.839 96.318 -99.200 -91.000 PHE 143 1.000 151.717 18.226 97.497 -99.200 -91.000 TYR 161 0.840 142.040 21.266 80.157 -99.200 -91.000 PHE 184 1.000 142.287 35.801 99.329 -99.200 -91.000 TYR 185 0.840 146.924 38.030 91.535 -99.200 -91.000 TYR 187 0.840 147.159 33.270 89.832 -99.200 -91.000 PHE 198 1.000 148.182 22.890 82.014 -99.200 -91.000