============================================================================= 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 22 0.900 -21.464 4.299 -5.402 -99.200 -91.000 PHE 24 1.000 -23.060 -0.935 -7.938 -99.200 -91.000 TRP 32 1.040 -23.841 -5.628 -12.432 -99.200 -91.000 TRP6 32 1.020 -22.143 -6.957 -11.472 -99.200 -91.000 PHE 35 1.000 -21.348 -6.909 -0.290 -99.200 -91.000 HIS 47 0.900 -8.340 0.187 5.690 -99.200 -91.000 PHE 55 1.000 -16.208 -9.996 0.022 -99.200 -91.000 TYR 60 0.840 -19.243 -9.707 -3.828 -99.200 -91.000 TYR 69 0.840 -8.637 12.012 -7.605 -99.200 -91.000 TRP 70 1.040 -8.849 11.654 -13.089 -99.200 -91.000 TRP6 70 1.020 -6.662 12.221 -12.428 -99.200 -91.000 PHE 78 1.000 -11.637 7.707 -23.042 -99.200 -91.000 HIS 79 0.900 -10.682 5.435 -18.696 -99.200 -91.000 HIS 81 0.900 -18.474 4.123 -13.959 -99.200 -91.000 PHE 86 1.000 -13.634 -8.939 -6.687 -99.200 -91.000 TYR 96 0.840 -11.319 -11.707 -2.707 -99.200 -91.000 TYR 105 0.840 -7.796 11.592 -22.173 -99.200 -91.000 TYR 107 0.840 -9.411 1.954 -15.326 -99.200 -91.000