============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 4 1.000 37.775 2.869 16.968 -99.200 -91.000 TYR 18 0.840 43.993 20.242 15.283 -99.200 -91.000 TYR 24 0.840 34.325 25.678 11.422 -99.200 -91.000 TYR 25 0.840 39.701 28.238 17.939 -99.200 -91.000 HIS 31 0.900 35.659 16.094 20.454 -99.200 -91.000 PHE 67 1.000 39.688 7.869 16.455 -99.200 -91.000 TYR 88 0.840 26.936 0.760 9.004 -99.200 -91.000 PHE 104 1.000 35.717 11.280 13.599 -99.200 -91.000 PHE 114 1.000 27.758 14.168 0.062 -99.200 -91.000 TRP 126 1.040 30.603 -1.522 -5.823 -99.200 -91.000 TRP6 126 1.020 29.388 -0.902 -3.874 -99.200 -91.000 TRP 138 1.040 34.213 14.845 1.729 -99.200 -91.000 TRP6 138 1.020 33.868 12.830 0.518 -99.200 -91.000 TYR 139 0.840 37.483 15.218 -5.484 -99.200 -91.000 PHE 153 1.000 31.634 5.164 0.509 -99.200 -91.000 TRP 158 1.040 40.608 -2.033 4.821 -99.200 -91.000 TRP6 158 1.020 39.435 -0.143 5.744 -99.200 -91.000 TYR 161 0.840 42.129 5.332 4.164 -99.200 -91.000