============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. PHE 11 1.000 95.924 37.608 -36.443 -99.200 -91.000 TRP 15 1.040 94.719 52.405 -33.421 -99.200 -91.000 TRP6 15 1.020 92.469 52.726 -32.791 -99.200 -91.000 PHE 28 1.000 86.064 51.248 -38.761 -99.200 -91.000 PHE 35 1.000 99.427 34.849 -38.988 -99.200 -91.000 HIS 38 0.900 98.753 28.986 -26.213 -99.200 -91.000 PHE 54 1.000 86.288 11.136 -33.194 -99.200 -91.000 TYR 55 0.840 83.924 8.588 -22.614 -99.200 -91.000 PHE 60 1.000 79.743 19.176 -26.882 -99.200 -91.000 TYR 62 0.840 84.147 30.904 -28.127 -99.200 -91.000 TRP 98 1.040 78.497 12.275 -35.538 -99.200 -91.000 TRP6 98 1.020 80.540 12.005 -34.392 -99.200 -91.000 PHE 105 1.000 83.505 19.741 -37.951 -99.200 -91.000 TYR 117 0.840 79.488 53.340 -48.163 -99.200 -91.000 TYR 123 0.840 86.233 31.129 -40.823 -99.200 -91.000 HIS 141 0.900 91.903 32.611 -46.678 -99.200 -91.000 PHE 144 1.000 92.083 43.773 -44.396 -99.200 -91.000 PHE 147 1.000 90.718 35.235 -43.223 -99.200 -91.000 PHE 149 1.000 91.268 28.962 -40.847 -99.200 -91.000 TYR 150 0.840 96.915 28.297 -34.839 -99.200 -91.000 PHE 155 1.000 91.602 17.714 -22.677 -99.200 -91.000 PHE 158 1.000 95.877 25.467 -29.368 -99.200 -91.000 TYR 162 0.840 95.750 28.796 -45.342 -99.200 -91.000 HIS 164 0.900 95.655 35.388 -46.851 -99.200 -91.000 PHE 166 1.000 96.566 42.579 -43.984 -99.200 -91.000 TYR 181 0.840 94.550 34.972 -51.235 -99.200 -91.000 PHE 183 1.000 92.798 26.394 -45.741 -99.200 -91.000