============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. PHE 3 1.000 58.361 63.832 14.474 -99.200 -91.000 PHE 19 1.000 37.623 61.555 12.484 -99.200 -91.000 TRP 24 1.040 44.830 71.476 12.879 -99.200 -91.000 TRP6 24 1.020 46.831 70.904 11.730 -99.200 -91.000 PHE 30 1.000 54.530 65.580 18.288 -99.200 -91.000 TYR 40 0.840 44.696 71.741 7.156 -99.200 -91.000 TYR 49 0.840 40.971 59.971 -1.413 -99.200 -91.000 PHE 56 1.000 51.412 66.305 3.732 -99.200 -91.000 PHE 70 1.000 34.785 57.969 1.707 -99.200 -91.000 PHE 82 1.000 56.907 57.327 -1.080 -99.200 -91.000 PHE 87 1.000 52.724 56.519 4.946 -99.200 -91.000 PHE 105 1.000 39.606 56.566 18.334 -99.200 -91.000 PHE 112 1.000 24.868 49.012 26.253 -99.200 -91.000 PHE 132 1.000 22.905 56.117 14.361 -99.200 -91.000 PHE 144 1.000 30.347 56.502 15.706 -99.200 -91.000 PHE 148 1.000 21.039 55.870 19.717 -99.200 -91.000 PHE 169 1.000 31.340 61.123 7.686 -99.200 -91.000 TYR 183 0.840 14.714 66.808 16.477 -99.200 -91.000 PHE 191 1.000 25.068 58.768 18.916 -99.200 -91.000 TRP 216 1.040 15.636 66.432 25.293 -99.200 -91.000 TRP6 216 1.020 16.793 67.745 26.890 -99.200 -91.000 TYR 225 0.840 25.545 71.666 28.345 -99.200 -91.000 TYR 230 0.840 17.128 75.942 24.298 -99.200 -91.000 TYR 257 0.840 59.949 64.753 19.235 -99.200 -91.000 PHE 261 1.000 54.542 54.682 13.565 -99.200 -91.000 PHE 269 1.000 44.016 55.026 20.836 -99.200 -91.000 PHE 296 1.000 22.870 49.272 31.261 -99.200 -91.000