============================================================================= 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 21 0.840 11.145 4.656 19.835 -99.200 -91.000 TYR 31 0.840 19.081 10.188 4.233 -99.200 -91.000 PHE 32 1.000 26.397 5.999 7.659 -99.200 -91.000 TYR 36 0.840 23.791 13.894 23.750 -99.200 -91.000 HIS 53 0.900 24.736 22.652 29.860 -99.200 -91.000 PHE 55 1.000 29.102 14.397 22.915 -99.200 -91.000 TYR 59 0.840 24.327 15.209 18.680 -99.200 -91.000 HIS 60 0.900 22.634 20.890 19.041 -99.200 -91.000 PHE 77 1.000 24.651 14.816 13.164 -99.200 -91.000 PHE 78 1.000 16.998 10.839 13.931 -99.200 -91.000 HIS 99 0.900 24.394 5.188 27.106 -99.200 -91.000 TYR 103 0.840 20.748 2.907 16.106 -99.200 -91.000 PHE 114 1.000 17.701 1.168 10.990 -99.200 -91.000 TRP 116 1.040 16.798 4.458 15.522 -99.200 -91.000 TRP6 116 1.020 15.978 6.455 16.477 -99.200 -91.000 PHE 121 1.000 24.312 0.204 19.686 -99.200 -91.000 TYR 122 0.840 30.040 2.065 13.260 -99.200 -91.000 TYR 124 0.840 32.976 10.133 20.902 -99.200 -91.000 PHE 137 1.000 30.301 13.323 18.198 -99.200 -91.000 PHE 140 1.000 32.009 7.540 16.798 -99.200 -91.000 PHE 155 1.000 47.169 23.596 20.773 -99.200 -91.000