============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 7 0.840 17.795 50.973 64.432 -99.200 -91.000 HIS 9 0.900 12.794 42.232 68.655 -99.200 -91.000 PHE 10 1.000 12.437 49.519 68.972 -99.200 -91.000 TRP 17 1.040 32.043 46.053 89.679 -99.200 -91.000 TRP6 17 1.020 31.842 48.320 90.333 -99.200 -91.000 HIS 18 0.900 35.864 43.785 84.787 -99.200 -91.000 TYR 23 0.840 40.992 54.986 79.620 -99.200 -91.000 HIS 25 0.900 31.894 56.845 80.794 -99.200 -91.000 TYR 31 0.840 29.012 50.323 73.583 -99.200 -91.000 TYR 32 0.840 31.700 45.237 67.847 -99.200 -91.000 PHE 34 1.000 25.145 45.454 76.308 -99.200 -91.000 PHE 35 1.000 26.085 46.195 68.084 -99.200 -91.000 TYR 42 0.840 13.491 38.481 65.733 -99.200 -91.000 TYR 67 0.840 32.216 51.767 70.196 -99.200 -91.000 PHE 68 1.000 26.969 57.385 66.736 -99.200 -91.000 PHE 73 1.000 26.808 48.420 87.911 -99.200 -91.000 TYR 92 0.840 21.374 39.561 62.257 -99.200 -91.000 PHE 97 1.000 18.028 54.285 69.898 -99.200 -91.000 PHE 110 1.000 25.370 40.415 64.469 -99.200 -91.000 HIS 112 0.900 24.217 35.608 63.239 -99.200 -91.000 PHE 114 1.000 21.398 32.542 59.749 -99.200 -91.000