============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. HIS 17 0.900 27.126 2.278 -3.350 -99.200 -91.000 PHE 30 1.000 27.689 5.280 12.924 -99.200 -91.000 TYR 33 0.840 24.734 -7.291 13.875 -99.200 -91.000 TRP 46 1.040 31.414 -9.931 2.648 -99.200 -91.000 TRP6 46 1.020 31.923 -9.018 4.784 -99.200 -91.000 PHE 125 1.000 14.936 -6.008 14.386 -99.200 -91.000 PHE 151 1.000 2.736 3.018 -19.197 -99.200 -91.000 TYR 155 0.840 8.736 2.281 -6.872 -99.200 -91.000 PHE 160 1.000 1.134 7.992 -3.568 -99.200 -91.000 PHE 176 1.000 5.254 4.700 23.449 -99.200 -91.000 HIS 179 0.900 13.736 10.358 18.175 -99.200 -91.000 HIS 189 0.900 24.121 5.655 -12.622 -99.200 -91.000 PHE 192 1.000 17.133 2.437 -7.623 -99.200 -91.000 HIS 210 0.900 -3.945 2.540 -30.222 -99.200 -91.000 PHE 212 1.000 5.095 -2.373 -26.835 -99.200 -91.000 HIS 213 0.900 3.295 5.686 -29.258 -99.200 -91.000 PHE 215 1.000 6.639 -0.007 -20.160 -99.200 -91.000 TYR 216 0.840 10.215 4.068 -27.570 -99.200 -91.000 TYR 218 0.840 7.527 6.255 -16.889 -99.200 -91.000 HIS 221 0.900 9.438 12.444 -18.551 -99.200 -91.000 PHE 226 1.000 16.241 6.975 -12.838 -99.200 -91.000 PHE 240 1.000 18.900 6.023 3.875 -99.200 -91.000 TYR 253 0.840 15.821 14.056 8.182 -99.200 -91.000 PHE 254 1.000 10.797 15.612 0.781 -99.200 -91.000 PHE 259 1.000 12.200 14.714 -8.723 -99.200 -91.000 TYR 275 0.840 1.026 14.461 -9.956 -99.200 -91.000 HIS 280 0.900 -1.447 12.807 -20.925 -99.200 -91.000 PHE 284 1.000 2.241 9.459 -21.290 -99.200 -91.000