============================================================================= 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. TYR 3 0.840 -3.087 -23.584 52.880 -99.200 -91.000 PHE 4 1.000 -6.332 -28.557 57.121 -99.200 -91.000 PHE 12 1.000 -20.088 -18.332 47.226 -99.200 -91.000 TRP 69 1.040 -42.345 -15.931 50.168 -99.200 -91.000 TRP6 69 1.020 -40.898 -17.777 50.461 -99.200 -91.000 PHE 80 1.000 -30.446 -13.413 35.926 -99.200 -91.000 HIS 92 0.900 -29.734 -6.990 58.591 -99.200 -91.000 PHE 99 1.000 -36.535 -14.191 53.561 -99.200 -91.000 PHE 108 1.000 -34.225 -19.245 52.468 -99.200 -91.000 HIS 111 0.900 -38.577 -20.422 45.979 -99.200 -91.000 PHE 132 1.000 -30.115 -24.044 50.153 -99.200 -91.000 PHE 136 1.000 -24.015 -23.877 56.093 -99.200 -91.000 HIS 152 0.900 -32.876 -32.531 46.615 -99.200 -91.000 HIS 164 0.900 -18.329 -28.491 38.664 -99.200 -91.000 TYR 174 0.840 -24.501 -28.959 55.205 -99.200 -91.000 PHE 178 1.000 -21.618 -32.641 59.859 -99.200 -91.000 HIS 179 0.900 -12.882 -27.962 63.670 -99.200 -91.000 PHE 206 1.000 -7.626 -23.300 49.044 -99.200 -91.000 TYR 238 0.840 -6.984 -33.208 43.731 -99.200 -91.000 PHE 253 1.000 0.340 -27.360 56.473 -99.200 -91.000