============================================================================= 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. TYR 10 0.840 -92.542 -38.119 -40.817 -99.200 -91.000 TYR 25 0.840 -82.917 -26.493 -24.577 -99.200 -91.000 PHE 26 1.000 -73.189 -23.192 -26.207 -99.200 -91.000 HIS 28 0.900 -83.214 -19.228 -24.446 -99.200 -91.000 PHE 32 1.000 -81.215 -18.772 -18.465 -99.200 -91.000 TRP 35 1.040 -78.668 -11.571 -17.760 -99.200 -91.000 TRP6 35 1.020 -80.577 -12.535 -18.755 -99.200 -91.000 TYR 45 0.840 -72.374 -26.871 -21.809 -99.200 -91.000 HIS 46 0.900 -77.558 -32.776 -19.063 -99.200 -91.000 HIS 54 0.900 -82.195 -36.010 -28.021 -99.200 -91.000 TYR 58 0.840 -83.371 -37.364 -34.947 -99.200 -91.000 PHE 64 1.000 -77.868 -48.873 -41.578 -99.200 -91.000 TYR 107 0.840 -94.079 -43.144 -43.063 -99.200 -91.000 HIS 112 0.900 -93.971 -53.617 -41.647 -99.200 -91.000 TYR 114 0.840 -91.496 -52.791 -36.904 -99.200 -91.000 HIS 130 0.900 -84.342 -32.417 -23.322 -99.200 -91.000 TRP 133 1.040 -85.072 -28.381 -15.294 -99.200 -91.000 TRP6 133 1.020 -84.449 -26.465 -16.504 -99.200 -91.000 TYR 149 0.840 -86.613 -19.713 -11.185 -99.200 -91.000