============================================================================= 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. HIS 6 0.900 -24.507 -3.515 -73.115 -99.200 -91.000 PHE 22 1.000 -36.274 -1.324 -54.067 -99.200 -91.000 TYR 27 0.840 -38.759 8.607 -46.710 -99.200 -91.000 PHE 55 1.000 -43.753 11.370 -54.953 -99.200 -91.000 TYR 66 0.840 -45.470 -0.895 -66.553 -99.200 -91.000 TYR 79 0.840 -40.145 -3.530 -52.288 -99.200 -91.000 HIS 99 0.900 -50.085 4.247 -73.401 -99.200 -91.000 TYR 125 0.840 -31.643 4.309 -77.835 -99.200 -91.000 TYR 132 0.840 -19.718 7.099 -85.875 -99.200 -91.000 PHE 142 1.000 -34.784 16.302 -79.457 -99.200 -91.000 PHE 147 1.000 -41.267 15.777 -80.161 -99.200 -91.000 TYR 149 0.840 -40.391 14.491 -69.398 -99.200 -91.000 PHE 150 1.000 -43.655 20.513 -75.076 -99.200 -91.000 HIS 151 0.900 -47.824 14.862 -77.531 -99.200 -91.000 HIS 159 0.900 -58.457 15.021 -65.988 -99.200 -91.000 TYR 175 0.840 -29.160 22.604 -65.320 -99.200 -91.000 TYR 184 0.840 -30.269 11.457 -71.660 -99.200 -91.000 PHE 194 1.000 -42.944 20.754 -70.629 -99.200 -91.000 TRP 218 1.040 -26.232 0.139 -60.031 -99.200 -91.000 TRP6 218 1.020 -24.882 -0.205 -61.944 -99.200 -91.000 PHE 226 1.000 -23.588 5.510 -70.440 -99.200 -91.000 PHE 234 1.000 -23.620 5.593 -63.821 -99.200 -91.000 TYR 246 0.840 -30.599 5.498 -50.302 -99.200 -91.000 TYR 252 0.840 -37.868 13.011 -58.527 -99.200 -91.000 TYR 254 0.840 -38.292 21.365 -50.994 -99.200 -91.000 TYR 262 0.840 -42.481 32.554 -51.879 -99.200 -91.000 HIS 268 0.900 -28.969 21.568 -60.781 -99.200 -91.000