============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 6 0.840 -13.921 2.422 1.039 -99.200 -91.000 TYR 13 0.840 -22.354 14.889 9.731 -99.200 -91.000 TRP 16 1.040 -19.867 13.862 14.117 -99.200 -91.000 TRP6 16 1.020 -18.440 14.544 15.885 -99.200 -91.000 TRP 20 1.040 -22.662 4.039 16.906 -99.200 -91.000 TRP6 20 1.020 -22.656 1.803 16.096 -99.200 -91.000 PHE 21 1.000 -18.707 1.245 12.766 -99.200 -91.000 PHE 28 1.000 -12.600 2.287 12.728 -99.200 -91.000 TYR 36 0.840 -13.682 17.002 -6.916 -99.200 -91.000 PHE 42 1.000 -14.791 5.027 -2.422 -99.200 -91.000 TYR 43 0.840 -17.418 10.246 -3.667 -99.200 -91.000 PHE 53 1.000 -26.640 5.736 -0.151 -99.200 -91.000 PHE 62 1.000 -19.081 -0.103 1.132 -99.200 -91.000 HIS 67 0.900 -23.545 1.908 0.372 -99.200 -91.000 PHE 71 1.000 -23.111 9.681 12.772 -99.200 -91.000