============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 3 1.000 -13.158 -20.904 12.747 -99.200 -91.000 PHE 21 1.000 -12.138 -26.032 16.936 -99.200 -91.000 PHE 55 1.000 -15.800 -19.971 26.823 -99.200 -91.000 HIS 86 0.900 -6.131 -27.370 30.554 -99.200 -91.000 HIS 102 0.900 -1.143 -24.284 34.176 -99.200 -91.000 PHE 104 1.000 -5.302 -22.158 38.870 -99.200 -91.000 HIS 121 0.900 0.701 -16.626 29.022 -99.200 -91.000 TYR 138 0.840 -1.823 -18.829 48.138 -99.200 -91.000 PHE 147 1.000 -15.301 -12.536 35.948 -99.200 -91.000 PHE 161 1.000 -20.345 -22.129 42.469 -99.200 -91.000 TRP 167 1.040 -15.074 -11.210 47.847 -99.200 -91.000 TRP6 167 1.020 -12.920 -11.701 47.023 -99.200 -91.000 TYR 169 0.840 -18.081 -6.676 38.055 -99.200 -91.000 TYR 185 0.840 -30.716 -12.700 29.093 -99.200 -91.000 PHE 188 1.000 -31.465 -17.858 36.842 -99.200 -91.000 TYR 196 0.840 -21.642 -10.048 37.596 -99.200 -91.000 PHE 202 1.000 -28.746 -8.928 25.630 -99.200 -91.000