============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 -92.402 -62.843 40.953 -99.200 -91.000 TYR 25 0.840 -82.863 -74.530 24.648 -99.200 -91.000 PHE 26 1.000 -73.035 -77.832 26.171 -99.200 -91.000 HIS 28 0.900 -83.160 -81.606 24.475 -99.200 -91.000 PHE 32 1.000 -81.199 -82.200 18.608 -99.200 -91.000 TRP 35 1.040 -78.641 -89.403 17.864 -99.200 -91.000 TRP6 35 1.020 -80.564 -88.471 18.875 -99.200 -91.000 TYR 45 0.840 -72.264 -74.108 21.754 -99.200 -91.000 HIS 46 0.900 -74.214 -70.482 18.070 -99.200 -91.000 HIS 54 0.900 -82.059 -65.023 28.105 -99.200 -91.000 TYR 58 0.840 -83.225 -63.638 34.968 -99.200 -91.000 PHE 64 1.000 -77.674 -52.107 41.611 -99.200 -91.000 TYR 107 0.840 -93.937 -57.848 43.186 -99.200 -91.000 HIS 112 0.900 -93.725 -47.211 41.560 -99.200 -91.000 TYR 114 0.840 -91.319 -48.197 37.021 -99.200 -91.000 HIS 130 0.900 -84.239 -68.675 23.383 -99.200 -91.000 TRP 133 1.040 -85.106 -72.494 15.289 -99.200 -91.000 TRP6 133 1.020 -84.470 -74.431 16.467 -99.200 -91.000 TYR 149 0.840 -86.580 -81.267 11.306 -99.200 -91.000