============================================================================= 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. TRP 15 1.040 -15.700 0.540 -23.701 -99.200 -91.000 TRP6 15 1.020 -13.755 1.013 -22.471 -99.200 -91.000 PHE 21 1.000 -22.824 14.281 -23.162 -99.200 -91.000 TYR 22 0.840 -19.776 17.773 -31.448 -99.200 -91.000 TRP 29 1.040 -17.521 17.426 -21.568 -99.200 -91.000 TRP6 29 1.020 -17.422 19.417 -22.810 -99.200 -91.000 PHE 32 1.000 -15.324 7.155 -21.708 -99.200 -91.000 PHE 41 1.000 -11.129 -7.577 -10.611 -99.200 -91.000 TRP 42 1.040 -14.962 -9.841 -13.455 -99.200 -91.000 TRP6 42 1.020 -14.255 -11.340 -11.742 -99.200 -91.000 HIS 44 0.900 -5.813 -5.672 -17.449 -99.200 -91.000 TYR 72 0.840 -1.925 -4.360 -26.871 -99.200 -91.000 PHE 74 1.000 -3.452 -0.366 -32.115 -99.200 -91.000 TYR 100 0.840 -14.758 -5.209 -32.431 -99.200 -91.000 PHE 125 1.000 -32.898 -6.902 -38.300 -99.200 -91.000 TYR 126 0.840 -30.152 -3.548 -41.801 -99.200 -91.000 PHE 134 1.000 -30.353 -11.154 -25.217 -99.200 -91.000 PHE 144 1.000 -14.848 -4.037 -22.156 -99.200 -91.000 PHE 147 1.000 -17.841 -9.383 -26.055 -99.200 -91.000 PHE 159 1.000 -19.232 -11.253 -5.611 -99.200 -91.000