============================================================================= 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 -64.671 -6.696 -38.276 -99.200 -91.000 TYR 25 0.840 -63.726 -28.802 -39.625 -99.200 -91.000 PHE 26 1.000 -71.330 -34.365 -35.041 -99.200 -91.000 HIS 28 0.900 -66.959 -32.323 -44.834 -99.200 -91.000 PHE 32 1.000 -64.138 -37.810 -44.063 -99.200 -91.000 TRP 35 1.040 -68.490 -43.117 -47.294 -99.200 -91.000 TRP6 35 1.020 -67.761 -40.972 -47.982 -99.200 -91.000 TYR 45 0.840 -66.737 -36.000 -31.846 -99.200 -91.000 HIS 46 0.900 -61.195 -36.005 -31.088 -99.200 -91.000 HIS 54 0.900 -61.777 -22.135 -32.148 -99.200 -91.000 TYR 58 0.840 -65.369 -15.866 -32.243 -99.200 -91.000 PHE 64 1.000 -67.038 -8.053 -20.259 -99.200 -91.000 TYR 107 0.840 -63.049 -1.780 -35.839 -99.200 -91.000 HIS 112 0.900 -56.688 2.346 -28.367 -99.200 -91.000 TYR 114 0.840 -55.065 -2.562 -27.203 -99.200 -91.000 HIS 130 0.900 -59.019 -26.568 -36.522 -99.200 -91.000 TRP 133 1.040 -54.972 -33.407 -39.910 -99.200 -91.000 TRP6 133 1.020 -57.073 -33.851 -40.876 -99.200 -91.000 TYR 149 0.840 -55.855 -39.748 -47.158 -99.200 -91.000