============================================================================= 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 20 0.840 21.919 17.069 43.183 -99.200 -91.000 HIS 41 0.900 16.899 21.313 34.733 -99.200 -91.000 HIS 47 0.900 27.970 15.810 25.686 -99.200 -91.000 PHE 56 1.000 24.840 11.900 16.073 -99.200 -91.000 PHE 60 1.000 29.092 17.603 16.293 -99.200 -91.000 TRP 61 1.040 22.892 16.843 23.514 -99.200 -91.000 TRP6 61 1.020 20.863 17.397 22.444 -99.200 -91.000 TYR 64 0.840 16.303 15.146 16.263 -99.200 -91.000 TYR 69 0.840 13.009 11.309 36.224 -99.200 -91.000 HIS 94 0.900 20.502 20.674 29.874 -99.200 -91.000 TYR 95 0.840 18.595 14.258 25.453 -99.200 -91.000 PHE 109 1.000 10.134 10.596 45.854 -99.200 -91.000 TYR 114 0.840 16.998 10.109 46.745 -99.200 -91.000 PHE 118 1.000 19.784 9.521 33.372 -99.200 -91.000 TYR 119 0.840 14.097 2.563 32.968 -99.200 -91.000 PHE 128 1.000 19.233 11.848 13.618 -99.200 -91.000 HIS 131 0.900 23.428 9.895 4.318 -99.200 -91.000 TRP 141 1.040 20.407 5.190 15.339 -99.200 -91.000 TRP6 141 1.020 21.810 6.602 16.605 -99.200 -91.000 PHE 142 1.000 20.986 3.871 21.548 -99.200 -91.000 PHE 145 1.000 21.446 2.839 26.436 -99.200 -91.000 TYR 149 0.840 24.073 7.365 35.922 -99.200 -91.000 PHE 151 1.000 21.494 11.078 43.344 -99.200 -91.000 TYR 153 0.840 18.358 16.014 47.255 -99.200 -91.000