============================================================================= 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 31 0.900 24.474 -20.295 -43.096 -99.200 -91.000 TYR 37 0.840 24.639 -22.312 -37.670 -99.200 -91.000 TRP 40 1.040 15.615 -24.983 -27.598 -99.200 -91.000 TRP6 40 1.020 13.502 -24.063 -27.087 -99.200 -91.000 TYR 41 0.840 21.515 -19.159 -25.929 -99.200 -91.000 TYR 54 0.840 26.114 -27.639 -29.835 -99.200 -91.000 PHE 60 1.000 28.499 -25.211 -23.896 -99.200 -91.000 PHE 67 1.000 17.622 -28.980 -19.123 -99.200 -91.000 PHE 76 1.000 13.656 -25.539 -35.298 -99.200 -91.000 TYR 91 0.840 14.109 -23.636 -19.577 -99.200 -91.000 TYR 92 0.840 14.820 -15.387 -22.960 -99.200 -91.000 PHE 94 1.000 20.466 -16.830 -31.336 -99.200 -91.000 HIS 98 0.900 17.926 -17.079 -42.251 -99.200 -91.000 PHE 103 1.000 18.667 -14.331 -27.861 -99.200 -91.000 PHE 123 1.000 -3.216 -1.660 3.873 -99.200 -91.000 PHE 140 1.000 0.282 -3.915 0.580 -99.200 -91.000 PHE 144 1.000 -2.003 -13.501 -6.571 -99.200 -91.000 TYR 145 0.840 -0.032 -21.903 -8.330 -99.200 -91.000 TRP 153 1.040 -7.412 0.405 -7.679 -99.200 -91.000 TRP6 153 1.020 -7.394 0.723 -5.335 -99.200 -91.000 TRP 168 1.040 1.290 -8.196 -11.173 -99.200 -91.000 TRP6 168 1.020 1.445 -6.295 -12.557 -99.200 -91.000 TYR 178 0.840 3.209 -16.755 -8.982 -99.200 -91.000 TYR 191 0.840 -9.160 10.093 0.214 -99.200 -91.000 HIS 194 0.900 -15.272 11.407 -7.007 -99.200 -91.000 TYR 197 0.840 -11.929 7.026 -2.437 -99.200 -91.000 HIS 203 0.900 -6.472 -16.559 -7.748 -99.200 -91.000 PHE 214 1.000 -10.849 3.893 2.012 -99.200 -91.000