============================================================================= 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. TYR 6 0.840 -38.788 -26.647 -7.284 -99.200 -91.000 PHE 13 1.000 -32.280 -13.758 -15.468 -99.200 -91.000 PHE 19 1.000 -23.621 -2.129 -15.245 -99.200 -91.000 PHE 22 1.000 -22.369 4.330 -14.726 -99.200 -91.000 HIS 26 0.900 -18.607 6.908 -14.895 -99.200 -91.000 TYR 41 0.840 -28.302 -5.289 -8.508 -99.200 -91.000 PHE 44 1.000 -34.287 -3.375 -8.751 -99.200 -91.000 PHE 55 1.000 -47.882 -14.756 -1.797 -99.200 -91.000 TYR 57 0.840 -34.893 -18.478 -3.372 -99.200 -91.000 TYR 66 0.840 -32.779 -7.944 -7.387 -99.200 -91.000 HIS 78 0.900 -50.317 -15.933 -5.416 -99.200 -91.000 HIS 79 0.900 -46.602 -19.657 -11.977 -99.200 -91.000 HIS 85 0.900 -49.893 -7.051 -8.798 -99.200 -91.000 HIS 111 0.900 -40.299 -18.270 -20.869 -99.200 -91.000 TYR 127 0.840 -31.853 -23.571 -4.778 -99.200 -91.000 PHE 130 1.000 -27.822 -25.491 -12.928 -99.200 -91.000 TYR 154 0.840 -44.029 -20.498 -24.159 -99.200 -91.000 TYR 156 0.840 -51.385 -12.271 -23.529 -99.200 -91.000 PHE 169 1.000 -50.830 -8.174 -13.325 -99.200 -91.000 HIS 170 0.900 -53.153 -1.915 -21.396 -99.200 -91.000 HIS 173 0.900 -48.163 -8.445 -30.594 -99.200 -91.000 TRP 189 1.040 -48.243 -10.651 -25.290 -99.200 -91.000 TRP6 189 1.020 -50.236 -9.758 -26.217 -99.200 -91.000 PHE 190 1.000 -43.343 -3.390 -25.249 -99.200 -91.000