============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 3 0.840 2.931 -25.248 -25.444 -99.200 -91.000 HIS 9 0.900 1.258 -18.874 -14.835 -99.200 -91.000 TYR 19 0.840 -23.516 -18.140 -22.462 -99.200 -91.000 TRP 51 1.040 -5.013 -12.864 -18.666 -99.200 -91.000 TRP6 51 1.020 -4.162 -10.968 -19.798 -99.200 -91.000 HIS 54 0.900 -3.710 -15.810 -12.614 -99.200 -91.000 PHE 58 1.000 -0.126 -5.963 -14.643 -99.200 -91.000 TRP 74 1.040 -9.413 0.450 -22.131 -99.200 -91.000 TRP6 74 1.020 -11.648 0.409 -22.869 -99.200 -91.000 TYR 84 0.840 -8.371 -17.952 -30.211 -99.200 -91.000 PHE 89 1.000 -18.501 -18.630 -35.134 -99.200 -91.000 TYR 95 0.840 -18.313 -7.744 -30.674 -99.200 -91.000 TYR 99 0.840 -25.074 -8.725 -28.934 -99.200 -91.000 TYR 125 0.840 -4.208 -12.099 -35.249 -99.200 -91.000 PHE 135 1.000 -6.874 -14.937 -27.404 -99.200 -91.000 HIS 150 0.900 -0.393 9.451 -18.318 -99.200 -91.000 HIS 165 0.900 10.624 -10.504 -28.887 -99.200 -91.000 TYR 171 0.840 3.765 -21.807 -29.209 -99.200 -91.000 HIS 176 0.900 3.943 -22.635 -35.216 -99.200 -91.000 HIS 203 0.900 -18.198 4.552 -32.923 -99.200 -91.000 PHE 204 1.000 -18.067 1.449 -28.342 -99.200 -91.000 TYR 205 0.840 -13.946 10.941 -24.222 -99.200 -91.000 HIS 216 0.900 -23.270 -1.207 -15.713 -99.200 -91.000 PHE 219 1.000 -17.130 0.664 -22.081 -99.200 -91.000