============================================================================= 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. PHE 1 1.000 -7.742 6.024 31.748 -99.200 -91.000 HIS 28 0.900 -4.017 17.029 18.152 -99.200 -91.000 PHE 34 1.000 -10.094 14.767 27.438 -99.200 -91.000 PHE 35 1.000 -16.878 18.055 26.885 -99.200 -91.000 TRP 37 1.040 -11.613 16.007 20.790 -99.200 -91.000 TRP6 37 1.020 -12.388 13.848 20.150 -99.200 -91.000 PHE 40 1.000 -4.553 13.681 8.171 -99.200 -91.000 TYR 49 0.840 -11.041 17.620 -2.995 -99.200 -91.000 HIS 53 0.900 -0.757 15.571 4.149 -99.200 -91.000 PHE 54 1.000 -7.859 18.500 2.103 -99.200 -91.000 TYR 64 0.840 -19.789 12.654 21.452 -99.200 -91.000 TYR 66 0.840 -27.029 10.561 26.401 -99.200 -91.000 PHE 73 1.000 -13.151 19.891 5.301 -99.200 -91.000 TRP 78 1.040 -12.951 25.059 -6.311 -99.200 -91.000 TRP6 78 1.020 -13.626 27.292 -5.899 -99.200 -91.000 HIS 79 0.900 -16.445 18.515 -1.745 -99.200 -91.000 TRP 98 1.040 -24.723 11.903 17.682 -99.200 -91.000 TRP6 98 1.020 -22.676 11.583 16.543 -99.200 -91.000 TYR 132 0.840 -18.780 18.369 -8.999 -99.200 -91.000 HIS 136 0.900 -15.933 17.151 -13.025 -99.200 -91.000 PHE 139 1.000 -14.659 20.319 -8.159 -99.200 -91.000 TRP 146 1.040 -8.220 27.075 -4.556 -99.200 -91.000 TRP6 146 1.020 -9.792 28.133 -3.163 -99.200 -91.000 PHE 150 1.000 -5.050 28.232 -0.429 -99.200 -91.000