============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. HIS 5 0.900 -29.346 -27.397 70.365 -99.200 -91.000 PHE 11 1.000 -18.374 -22.891 69.955 -99.200 -91.000 PHE 26 1.000 -21.402 -17.538 68.251 -99.200 -91.000 TRP 27 1.040 -29.749 -19.767 66.920 -99.200 -91.000 TRP6 27 1.020 -32.075 -20.130 67.124 -99.200 -91.000 TRP 30 1.040 -34.564 -12.776 71.577 -99.200 -91.000 TRP6 30 1.020 -32.876 -11.266 70.899 -99.200 -91.000 TYR 48 0.840 -21.388 -24.515 50.132 -99.200 -91.000 TYR 69 0.840 -15.020 -18.200 69.821 -99.200 -91.000 PHE 80 1.000 -14.995 -21.327 65.444 -99.200 -91.000 PHE 101 1.000 -17.971 -15.600 55.528 -99.200 -91.000 PHE 142 1.000 0.372 -39.812 47.718 -99.200 -91.000 TYR 151 0.840 4.938 -18.348 51.380 -99.200 -91.000 PHE 168 1.000 1.463 -23.040 49.300 -99.200 -91.000 PHE 171 1.000 0.153 -34.137 43.745 -99.200 -91.000 HIS 178 0.900 -10.220 -37.044 46.653 -99.200 -91.000 TRP 188 1.040 1.282 -39.034 64.177 -99.200 -91.000 TRP6 188 1.020 1.969 -37.569 65.904 -99.200 -91.000 PHE 189 1.000 5.084 -37.432 56.453 -99.200 -91.000 TYR 199 0.840 -3.015 -21.798 48.925 -99.200 -91.000 PHE 204 1.000 0.937 -23.114 43.378 -99.200 -91.000