============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 22 0.840 35.217 73.006 50.826 -99.200 -91.000 PHE 35 1.000 26.667 56.542 60.619 -99.200 -91.000 TYR 68 0.840 26.827 52.312 61.014 -99.200 -91.000 TRP 94 1.040 47.660 63.642 70.130 -99.200 -91.000 TRP6 94 1.020 49.040 63.287 68.239 -99.200 -91.000 PHE 102 1.000 39.703 56.964 76.049 -99.200 -91.000 TYR 117 0.840 22.403 48.517 57.087 -99.200 -91.000 PHE 122 1.000 40.219 50.787 48.839 -99.200 -91.000 PHE 137 1.000 36.079 48.288 58.746 -99.200 -91.000 HIS 138 0.900 41.087 41.730 57.282 -99.200 -91.000 PHE 160 1.000 61.455 61.815 54.212 -99.200 -91.000 PHE 163 1.000 58.406 68.886 57.207 -99.200 -91.000 HIS 183 0.900 50.369 58.444 61.315 -99.200 -91.000 HIS 186 0.900 59.504 53.776 68.204 -99.200 -91.000 TYR 193 0.840 64.623 52.498 48.929 -99.200 -91.000 PHE 199 1.000 67.186 63.088 37.759 -99.200 -91.000 PHE 204 1.000 69.219 67.064 43.358 -99.200 -91.000 TYR 238 0.840 40.914 71.013 60.143 -99.200 -91.000 TYR 239 0.840 42.133 72.924 56.476 -99.200 -91.000 PHE 252 1.000 37.635 50.835 44.899 -99.200 -91.000 TYR 265 0.840 46.131 39.939 55.981 -99.200 -91.000 TYR 270 0.840 58.521 45.478 53.300 -99.200 -91.000 HIS 273 0.900 54.450 35.647 58.003 -99.200 -91.000 PHE 276 1.000 45.023 45.100 57.573 -99.200 -91.000 HIS 298 0.900 71.482 44.243 60.427 -99.200 -91.000 PHE 304 1.000 59.104 47.281 58.262 -99.200 -91.000