============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TRP 11 1.040 10.859 -0.614 -11.045 -99.200 -91.000 TRP6 11 1.020 9.780 -2.616 -10.296 -99.200 -91.000 PHE 27 1.000 8.180 -4.853 -16.470 -99.200 -91.000 HIS 34 0.900 15.133 -8.522 -28.753 -99.200 -91.000 PHE 44 1.000 19.110 -2.808 -0.441 -99.200 -91.000 HIS 56 0.900 9.713 -12.907 -20.098 -99.200 -91.000 PHE 59 1.000 11.572 -8.821 -17.522 -99.200 -91.000 PHE 78 1.000 14.936 -12.766 0.035 -99.200 -91.000 TRP 82 1.040 22.319 -10.091 -12.945 -99.200 -91.000 TRP6 82 1.020 23.079 -8.934 -14.895 -99.200 -91.000 HIS 87 0.900 32.067 6.389 -8.596 -99.200 -91.000 TYR 93 0.840 23.478 13.607 -7.178 -99.200 -91.000 TYR 94 0.840 25.178 12.164 -1.532 -99.200 -91.000 PHE 113 1.000 26.276 -10.573 -5.168 -99.200 -91.000 TRP 151 1.040 38.045 -6.657 -17.364 -99.200 -91.000 TRP6 151 1.020 37.178 -4.450 -17.535 -99.200 -91.000 TYR 158 0.840 28.576 8.538 -21.069 -99.200 -91.000 TRP 162 1.040 25.655 15.849 -19.079 -99.200 -91.000 TRP6 162 1.020 24.485 15.232 -21.057 -99.200 -91.000 HIS 179 0.900 27.649 3.637 -24.830 -99.200 -91.000 TRP 185 1.040 41.929 3.103 -20.760 -99.200 -91.000 TRP6 185 1.020 41.780 1.330 -19.193 -99.200 -91.000 TYR 202 0.840 22.382 7.550 -22.668 -99.200 -91.000 TYR 215 0.840 20.593 -2.258 -29.560 -99.200 -91.000 PHE 223 1.000 18.817 1.871 -24.884 -99.200 -91.000 PHE 234 1.000 12.342 -1.858 -18.644 -99.200 -91.000