============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TYR 3 0.840 14.841 15.056 48.416 -99.200 -91.000 PHE 4 1.000 21.549 10.569 48.432 -99.200 -91.000 TYR 45 0.840 -3.321 -1.228 43.216 -99.200 -91.000 PHE 50 1.000 3.775 -0.085 42.275 -99.200 -91.000 TRP 55 1.040 -3.659 7.462 50.358 -99.200 -91.000 TRP6 55 1.020 -3.312 8.160 52.577 -99.200 -91.000 HIS 59 0.900 -10.342 9.077 44.330 -99.200 -91.000 PHE 60 1.000 -8.320 7.692 54.514 -99.200 -91.000 PHE 87 1.000 -0.595 13.068 52.165 -99.200 -91.000 PHE 89 1.000 -7.342 16.979 49.337 -99.200 -91.000 TYR 105 0.840 -3.055 21.462 48.925 -99.200 -91.000 PHE 126 1.000 -1.079 28.651 38.390 -99.200 -91.000 TYR 138 0.840 7.016 21.561 58.300 -99.200 -91.000 HIS 140 0.900 12.872 21.128 49.128 -99.200 -91.000 HIS 142 0.900 10.110 18.416 58.894 -99.200 -91.000 HIS 151 0.900 -3.140 18.421 38.239 -99.200 -91.000 PHE 153 1.000 -8.000 16.549 35.463 -99.200 -91.000 HIS 154 0.900 -12.633 20.403 32.155 -99.200 -91.000 TYR 203 0.840 13.184 28.592 30.281 -99.200 -91.000 PHE 227 1.000 9.096 13.186 21.525 -99.200 -91.000 PHE 233 1.000 0.770 9.798 37.632 -99.200 -91.000 HIS 250 0.900 16.646 1.990 28.682 -99.200 -91.000