============================================================================= 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. PHE 12 1.000 -4.541 9.241 -7.353 -99.200 -91.000 PHE 27 1.000 1.015 14.069 -3.586 -99.200 -91.000 TRP 43 1.040 -4.864 -7.787 -5.115 -99.200 -91.000 TRP6 43 1.020 -7.062 -7.958 -4.255 -99.200 -91.000 TYR 46 0.840 2.876 1.897 -2.857 -99.200 -91.000 HIS 47 0.900 -3.225 6.135 4.792 -99.200 -91.000 HIS 50 0.900 -0.825 17.664 -0.589 -99.200 -91.000 PHE 81 1.000 -16.717 -5.992 -4.065 -99.200 -91.000 PHE 101 1.000 -7.284 4.572 -31.675 -99.200 -91.000 PHE 112 1.000 -6.574 12.823 -24.546 -99.200 -91.000 PHE 119 1.000 -15.812 -3.408 -20.115 -99.200 -91.000 HIS 120 0.900 -10.976 -2.174 -26.844 -99.200 -91.000 PHE 129 1.000 -28.124 -11.012 -22.308 -99.200 -91.000 TYR 132 0.840 -23.535 -6.939 -18.949 -99.200 -91.000 PHE 140 1.000 -18.703 13.394 -9.197 -99.200 -91.000 TYR 189 0.840 -20.106 -4.164 -13.588 -99.200 -91.000 PHE 200 1.000 -12.453 6.190 -15.587 -99.200 -91.000 PHE 218 1.000 8.274 0.734 -25.632 -99.200 -91.000 PHE 239 1.000 -9.796 21.823 -8.775 -99.200 -91.000