============================================================================= 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 9 1.000 -23.130 -25.931 -7.139 -99.200 -91.000 PHE 24 1.000 -29.103 -30.407 -3.955 -99.200 -91.000 TRP 40 1.040 -22.777 -8.910 -7.210 -99.200 -91.000 TRP6 40 1.020 -20.874 -8.753 -5.801 -99.200 -91.000 TYR 43 0.840 -31.189 -17.981 -5.446 -99.200 -91.000 HIS 44 0.900 -29.882 -18.761 3.237 -99.200 -91.000 HIS 47 0.900 -28.505 -32.600 0.230 -99.200 -91.000 PHE 78 1.000 -11.835 -10.348 -2.937 -99.200 -91.000 PHE 98 1.000 -14.475 -25.286 -31.178 -99.200 -91.000 PHE 109 1.000 -17.719 -31.987 -22.923 -99.200 -91.000 PHE 116 1.000 -8.850 -15.253 -18.524 -99.200 -91.000 HIS 117 0.900 -12.107 -17.341 -25.961 -99.200 -91.000 PHE 126 1.000 3.745 -8.055 -19.096 -99.200 -91.000 TYR 129 0.840 -1.579 -11.525 -16.102 -99.200 -91.000 PHE 137 1.000 -9.049 -30.641 -5.495 -99.200 -91.000 TYR 186 0.840 -6.157 -13.565 -11.371 -99.200 -91.000 PHE 197 1.000 -13.645 -24.085 -13.870 -99.200 -91.000 PHE 215 1.000 -26.866 -18.511 -24.543 -99.200 -91.000 PHE 236 1.000 -18.133 -38.934 -5.972 -99.200 -91.000