============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 45 rings ring int. center anis. iso. HIS 8 0.900 -33.998 12.639 -41.678 -99.200 -91.000 TYR 9 0.840 -24.187 12.359 -43.856 -99.200 -91.000 TRP 15 1.040 -25.204 18.001 -31.823 -99.200 -91.000 TRP6 15 1.020 -23.255 17.424 -30.613 -99.200 -91.000 TYR 19 0.840 -18.320 18.964 -28.922 -99.200 -91.000 PHE 27 1.000 -7.145 24.913 -27.329 -99.200 -91.000 TYR 34 0.840 -0.142 26.682 -33.958 -99.200 -91.000 PHE 35 1.000 -9.297 22.271 -31.102 -99.200 -91.000 TYR 49 0.840 -13.456 16.522 -43.050 -99.200 -91.000 TYR 55 0.840 -20.576 25.811 -39.319 -99.200 -91.000 TYR 56 0.840 -11.903 30.006 -44.417 -99.200 -91.000 PHE 63 1.000 -11.080 24.877 -39.634 -99.200 -91.000 TYR 65 0.840 -2.805 31.630 -34.806 -99.200 -91.000 PHE 69 1.000 -0.688 15.907 -35.458 -99.200 -91.000 TYR 74 0.840 -6.702 2.960 -48.925 -99.200 -91.000 HIS 81 0.900 -5.912 6.188 -57.005 -99.200 -91.000 TYR 85 0.840 -8.121 7.020 -46.663 -99.200 -91.000 HIS 86 0.900 -0.850 12.110 -48.135 -99.200 -91.000 PHE 88 1.000 -12.376 12.411 -47.756 -99.200 -91.000 TRP 90 1.040 -5.294 19.910 -52.317 -99.200 -91.000 TRP6 90 1.020 -4.349 21.714 -51.116 -99.200 -91.000 PHE 93 1.000 -11.485 20.676 -42.998 -99.200 -91.000 PHE 94 1.000 -6.064 19.103 -44.523 -99.200 -91.000 HIS 96 0.900 -12.744 23.384 -51.046 -99.200 -91.000 HIS 100 0.900 -0.595 29.380 -41.392 -99.200 -91.000 HIS 105 0.900 1.853 17.686 -39.012 -99.200 -91.000 PHE 121 1.000 0.507 10.948 -38.226 -99.200 -91.000 PHE 134 1.000 -7.387 11.034 -33.878 -99.200 -91.000 HIS 143 0.900 -12.142 0.057 -39.802 -99.200 -91.000 PHE 146 1.000 -7.767 1.824 -43.177 -99.200 -91.000 PHE 173 1.000 -15.019 5.080 -51.429 -99.200 -91.000 PHE 174 1.000 -8.955 1.955 -53.982 -99.200 -91.000 HIS 207 0.900 -23.664 2.248 -43.929 -99.200 -91.000 PHE 210 1.000 -23.726 -7.229 -35.409 -99.200 -91.000 TYR 213 0.840 -25.385 -5.487 -30.082 -99.200 -91.000 HIS 222 0.900 -8.416 -9.004 -29.733 -99.200 -91.000 TRP 224 1.040 -16.937 -6.649 -32.518 -99.200 -91.000 TRP6 224 1.020 -18.073 -6.509 -34.585 -99.200 -91.000 PHE 229 1.000 -11.953 5.378 -28.892 -99.200 -91.000 HIS 232 0.900 -11.094 9.399 -24.302 -99.200 -91.000 PHE 237 1.000 -19.198 6.212 -28.976 -99.200 -91.000 TYR 254 0.840 -29.183 7.825 -19.438 -99.200 -91.000 PHE 255 1.000 -26.478 7.852 -23.649 -99.200 -91.000 HIS 262 0.900 -25.572 14.717 -23.698 -99.200 -91.000 TYR 270 0.840 -19.886 30.375 -27.374 -99.200 -91.000