============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 5 0.840 37.088 30.601 18.375 -99.200 -91.000 TYR 14 0.840 25.890 30.677 25.617 -99.200 -91.000 TYR 22 0.840 32.072 10.201 34.072 -99.200 -91.000 HIS 23 0.900 32.207 17.624 29.546 -99.200 -91.000 PHE 24 1.000 26.907 13.377 31.752 -99.200 -91.000 TRP 34 1.040 13.749 25.084 34.999 -99.200 -91.000 TRP6 34 1.020 13.070 22.851 34.787 -99.200 -91.000 HIS 40 0.900 23.268 12.606 22.491 -99.200 -91.000 TYR 42 0.840 17.973 9.688 32.202 -99.200 -91.000 PHE 64 1.000 32.238 22.466 40.710 -99.200 -91.000 HIS 73 0.900 9.823 16.447 23.030 -99.200 -91.000 TYR 76 0.840 16.101 10.555 23.015 -99.200 -91.000 TRP 121 1.040 35.142 22.199 28.663 -99.200 -91.000 TRP6 121 1.020 33.098 23.131 29.365 -99.200 -91.000 TYR 131 0.840 37.460 13.278 24.760 -99.200 -91.000 TYR 152 0.840 24.638 13.159 8.341 -99.200 -91.000 PHE 161 1.000 20.348 23.763 13.516 -99.200 -91.000 TYR 165 0.840 32.785 25.702 8.336 -99.200 -91.000 TRP 192 1.040 21.855 12.997 14.554 -99.200 -91.000 TRP6 192 1.020 22.231 12.118 12.404 -99.200 -91.000 TYR 205 0.840 25.093 21.081 15.363 -99.200 -91.000 TYR 211 0.840 12.098 20.084 20.126 -99.200 -91.000 TRP 214 1.040 8.428 19.697 26.322 -99.200 -91.000 TRP6 214 1.020 10.766 19.514 26.583 -99.200 -91.000