============================================================================= 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. HIS 21 0.900 8.947 -19.813 -26.726 -99.200 -91.000 PHE 23 1.000 4.001 -22.677 -24.199 -99.200 -91.000 TRP 31 1.040 -0.134 -24.374 -19.716 -99.200 -91.000 TRP6 31 1.020 -1.918 -23.091 -20.548 -99.200 -91.000 PHE 34 1.000 -2.124 -22.039 -31.700 -99.200 -91.000 HIS 46 0.900 1.959 -7.845 -37.157 -99.200 -91.000 PHE 54 1.000 -6.473 -17.639 -31.505 -99.200 -91.000 TYR 59 0.840 -5.466 -20.573 -28.105 -99.200 -91.000 TYR 68 0.840 13.684 -6.044 -24.014 -99.200 -91.000 TRP 69 1.040 13.501 -6.347 -18.529 -99.200 -91.000 TRP6 69 1.020 13.477 -4.094 -19.212 -99.200 -91.000 PHE 77 1.000 10.086 -9.850 -8.707 -99.200 -91.000 HIS 78 0.900 7.845 -9.565 -13.080 -99.200 -91.000 HIS 80 0.900 7.528 -17.301 -17.469 -99.200 -91.000 PHE 85 1.000 -5.634 -15.140 -25.189 -99.200 -91.000 TYR 95 0.840 -9.212 -13.178 -29.521 -99.200 -91.000 TYR 104 0.840 13.126 -5.317 -9.338 -99.200 -91.000 TYR 106 0.840 4.145 -8.852 -16.290 -99.200 -91.000