============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. HIS 4 0.900 32.945 1.517 33.471 -99.200 -91.000 PHE 17 1.000 19.707 -9.559 46.396 -99.200 -91.000 TYR 21 0.840 16.973 -20.818 50.665 -99.200 -91.000 PHE 36 1.000 22.613 -15.822 71.592 -99.200 -91.000 TYR 55 0.840 20.288 -10.723 72.891 -99.200 -91.000 TYR 56 0.840 27.516 -7.257 69.389 -99.200 -91.000 TRP 61 1.040 21.806 -17.706 55.926 -99.200 -91.000 TRP6 61 1.020 21.497 -15.830 57.342 -99.200 -91.000 TRP 68 1.040 29.792 -12.508 43.478 -99.200 -91.000 TRP6 68 1.020 28.813 -12.186 45.622 -99.200 -91.000 TYR 73 0.840 28.370 -10.634 38.595 -99.200 -91.000 PHE 79 1.000 25.533 -8.494 47.586 -99.200 -91.000 TRP 87 1.040 14.898 -18.028 54.519 -99.200 -91.000 TRP6 87 1.020 16.525 -18.895 56.012 -99.200 -91.000 TYR 94 0.840 9.594 -22.702 74.580 -99.200 -91.000 HIS 112 0.900 34.062 -15.211 46.805 -99.200 -91.000 PHE 118 1.000 20.292 -9.597 60.364 -99.200 -91.000 PHE 126 1.000 16.119 -13.920 80.096 -99.200 -91.000 PHE 145 1.000 18.172 -16.215 72.475 -99.200 -91.000 TRP 148 1.040 7.214 -20.294 66.873 -99.200 -91.000 TRP6 148 1.020 7.481 -20.161 69.231 -99.200 -91.000 TYR 150 0.840 12.092 -23.191 58.038 -99.200 -91.000 PHE 153 1.000 14.363 -35.053 61.262 -99.200 -91.000 TYR 169 0.840 27.699 -7.222 81.422 -99.200 -91.000 TYR 170 0.840 27.576 0.438 81.336 -99.200 -91.000 TYR 175 0.840 21.264 -6.426 87.956 -99.200 -91.000 HIS 188 0.900 11.718 -34.790 70.268 -99.200 -91.000 TYR 189 0.840 9.577 -26.758 71.072 -99.200 -91.000 TYR 196 0.840 10.485 -28.010 65.490 -99.200 -91.000 PHE 205 1.000 21.274 -12.079 86.563 -99.200 -91.000