============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 32 rings ring int. center anis. iso. PHE 12 1.000 41.910 -39.494 19.262 -99.200 -91.000 PHE 16 1.000 35.562 -31.283 13.068 -99.200 -91.000 TYR 59 0.840 45.173 -13.832 15.247 -99.200 -91.000 PHE 77 1.000 58.667 -31.012 29.226 -99.200 -91.000 PHE 79 1.000 50.610 -24.197 32.506 -99.200 -91.000 TYR 80 0.840 52.048 -25.437 28.073 -99.200 -91.000 TYR 83 0.840 45.769 -29.783 30.958 -99.200 -91.000 HIS 88 0.900 43.139 -33.884 29.196 -99.200 -91.000 TYR 90 0.840 45.437 -38.010 30.096 -99.200 -91.000 PHE 96 1.000 46.992 -36.034 19.656 -99.200 -91.000 PHE 131 1.000 63.620 -32.039 3.099 -99.200 -91.000 TYR 145 0.840 58.261 -39.566 23.660 -99.200 -91.000 HIS 147 0.900 55.864 -43.851 25.596 -99.200 -91.000 PHE 149 1.000 58.430 -38.897 17.557 -99.200 -91.000 TYR 156 0.840 58.340 -29.861 3.271 -99.200 -91.000 PHE 157 1.000 54.623 -23.789 -0.255 -99.200 -91.000 PHE 159 1.000 53.809 -33.987 -7.152 -99.200 -91.000 HIS 161 0.900 61.991 -28.853 -1.365 -99.200 -91.000 PHE 162 1.000 54.167 -32.007 -1.699 -99.200 -91.000 PHE 172 1.000 64.176 -41.042 11.847 -99.200 -91.000 PHE 177 1.000 50.489 -37.299 15.664 -99.200 -91.000 PHE 205 1.000 58.481 -9.582 5.181 -99.200 -91.000 TYR 212 0.840 45.116 -14.705 2.868 -99.200 -91.000 PHE 224 1.000 54.634 -34.784 3.708 -99.200 -91.000 TYR 225 0.840 45.726 -41.389 2.154 -99.200 -91.000 PHE 234 1.000 46.709 -36.601 14.197 -99.200 -91.000 TYR 240 0.840 37.943 -19.864 8.154 -99.200 -91.000 PHE 246 1.000 33.193 -34.837 1.839 -99.200 -91.000 HIS 248 0.900 41.986 -29.977 6.469 -99.200 -91.000 PHE 270 1.000 37.098 -27.508 18.356 -99.200 -91.000 TYR 286 0.840 30.930 -40.705 1.505 -99.200 -91.000 PHE 292 1.000 34.409 -38.780 4.181 -99.200 -91.000