============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. PHE 7 1.000 22.401 -28.192 -3.542 -99.200 -91.000 PHE 13 1.000 24.015 -21.666 -12.248 -99.200 -91.000 PHE 29 1.000 13.720 -17.669 -16.835 -99.200 -91.000 TYR 53 0.840 22.388 -13.040 -7.946 -99.200 -91.000 TYR 54 0.840 23.668 -6.494 -12.877 -99.200 -91.000 TYR 110 0.840 29.321 0.612 -1.007 -99.200 -91.000 TYR 119 0.840 27.733 -18.848 11.353 -99.200 -91.000 HIS 120 0.900 26.853 -14.356 13.607 -99.200 -91.000 HIS 121 0.900 23.823 -12.072 4.126 -99.200 -91.000 PHE 122 1.000 26.883 -17.532 2.822 -99.200 -91.000 TYR 136 0.840 26.797 -17.608 -7.474 -99.200 -91.000 PHE 144 1.000 33.396 -13.232 2.522 -99.200 -91.000 PHE 146 1.000 32.440 -17.810 0.995 -99.200 -91.000 TYR 156 0.840 31.276 -29.102 10.833 -99.200 -91.000 TYR 172 0.840 40.668 -27.801 -11.709 -99.200 -91.000 PHE 187 1.000 29.449 -28.285 1.753 -99.200 -91.000 TYR 191 0.840 36.258 -27.155 -8.371 -99.200 -91.000 TRP 195 1.040 38.440 -21.042 -18.069 -99.200 -91.000 TRP6 195 1.020 36.806 -19.370 -17.717 -99.200 -91.000 TRP 208 1.040 30.450 -27.051 -16.072 -99.200 -91.000 TRP6 208 1.020 30.297 -27.879 -18.282 -99.200 -91.000 TYR 209 0.840 27.337 -25.390 -8.661 -99.200 -91.000 PHE 241 1.000 30.941 -27.380 -25.216 -99.200 -91.000 TRP 245 1.040 36.214 -24.424 -22.854 -99.200 -91.000 TRP6 245 1.020 33.872 -24.425 -22.430 -99.200 -91.000 PHE 248 1.000 31.633 -18.942 -22.147 -99.200 -91.000 PHE 251 1.000 36.175 -10.247 -26.143 -99.200 -91.000 TYR 258 0.840 22.438 -11.170 -21.592 -99.200 -91.000