============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. PHE 6 1.000 48.500 -21.062 45.593 -99.200 -91.000 PHE 8 1.000 45.139 -12.908 49.927 -99.200 -91.000 TYR 24 0.840 35.358 3.803 60.520 -99.200 -91.000 PHE 30 1.000 28.727 -4.569 47.562 -99.200 -91.000 TYR 47 0.840 39.570 -6.929 20.655 -99.200 -91.000 PHE 63 1.000 24.413 -14.560 32.025 -99.200 -91.000 PHE 104 1.000 42.357 2.392 47.348 -99.200 -91.000 PHE 120 1.000 44.904 5.222 43.194 -99.200 -91.000 PHE 124 1.000 38.490 -9.875 44.223 -99.200 -91.000 TYR 125 0.840 42.287 -7.484 46.643 -99.200 -91.000 PHE 128 1.000 38.162 -9.398 51.282 -99.200 -91.000 TYR 146 0.840 41.319 -25.298 38.791 -99.200 -91.000 TRP 148 1.040 41.524 -16.400 45.162 -99.200 -91.000 TRP6 148 1.020 40.261 -14.783 46.368 -99.200 -91.000 PHE 156 1.000 45.633 -16.862 47.006 -99.200 -91.000 PHE 176 1.000 30.264 -17.604 51.672 -99.200 -91.000 TYR 184 0.840 24.820 -2.993 50.586 -99.200 -91.000 HIS 197 0.900 26.698 5.318 43.321 -99.200 -91.000 PHE 200 1.000 25.983 6.808 31.331 -99.200 -91.000 TYR 203 0.840 28.861 -6.415 28.108 -99.200 -91.000