============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 37 rings ring int. center anis. iso. HIS 2 0.900 17.140 -27.620 33.087 -99.200 -91.000 PHE 10 1.000 11.070 -4.940 38.898 -99.200 -91.000 HIS 11 0.900 16.881 0.817 35.138 -99.200 -91.000 PHE 22 1.000 26.033 -0.698 35.834 -99.200 -91.000 PHE 26 1.000 25.197 -10.732 36.138 -99.200 -91.000 HIS 30 0.900 27.226 -14.608 35.996 -99.200 -91.000 TYR 64 0.840 21.479 7.592 50.970 -99.200 -91.000 TYR 72 0.840 16.518 -0.060 54.906 -99.200 -91.000 PHE 75 1.000 7.860 -5.743 50.474 -99.200 -91.000 TRP 78 1.040 21.633 -5.612 52.169 -99.200 -91.000 TRP6 78 1.020 22.423 -5.123 49.991 -99.200 -91.000 PHE 82 1.000 24.563 2.627 41.975 -99.200 -91.000 TYR 91 0.840 20.391 25.328 26.745 -99.200 -91.000 TYR 97 0.840 13.309 34.126 24.470 -99.200 -91.000 TRP 106 1.040 19.351 29.655 36.757 -99.200 -91.000 TRP6 106 1.020 17.455 28.654 37.752 -99.200 -91.000 TYR 107 0.840 16.872 33.914 38.900 -99.200 -91.000 PHE 117 1.000 9.445 25.652 34.254 -99.200 -91.000 PHE 119 1.000 7.997 20.542 37.872 -99.200 -91.000 TYR 129 0.840 12.660 13.250 45.801 -99.200 -91.000 TYR 141 0.840 24.120 31.269 44.679 -99.200 -91.000 TYR 142 0.840 20.549 32.581 41.637 -99.200 -91.000 PHE 148 1.000 8.466 26.114 44.241 -99.200 -91.000 PHE 160 1.000 9.800 23.797 48.404 -99.200 -91.000 TYR 167 0.840 12.605 28.463 53.128 -99.200 -91.000 HIS 195 0.900 7.924 12.333 24.613 -99.200 -91.000 TYR 204 0.840 15.478 26.851 28.275 -99.200 -91.000 PHE 205 1.000 15.322 17.447 29.827 -99.200 -91.000 PHE 206 1.000 14.575 23.311 36.608 -99.200 -91.000 TYR 208 0.840 18.989 12.809 38.263 -99.200 -91.000 HIS 215 0.900 18.849 10.340 26.185 -99.200 -91.000 PHE 217 1.000 17.987 16.801 25.591 -99.200 -91.000 PHE 219 1.000 25.356 20.336 31.053 -99.200 -91.000 TYR 233 0.840 28.757 24.186 48.750 -99.200 -91.000 TYR 237 0.840 23.325 20.549 48.224 -99.200 -91.000 TYR 257 0.840 21.729 8.029 40.690 -99.200 -91.000 PHE 274 1.000 23.065 -5.922 37.593 -99.200 -91.000