============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 25 1.000 108.875 -16.639 129.008 -99.200 -91.000 TYR 35 0.840 95.244 -4.695 139.370 -99.200 -91.000 PHE 54 1.000 100.887 4.971 134.016 -99.200 -91.000 TYR 66 0.840 84.372 11.023 143.537 -99.200 -91.000 TYR 90 0.840 97.655 9.633 127.592 -99.200 -91.000 TYR 92 0.840 95.331 9.906 116.080 -99.200 -91.000 PHE 93 1.000 100.216 9.816 121.041 -99.200 -91.000 TYR 95 0.840 98.403 4.489 128.897 -99.200 -91.000 TYR 112 0.840 79.677 1.566 133.051 -99.200 -91.000 TYR 136 0.840 81.494 -12.484 125.378 -99.200 -91.000 PHE 143 1.000 73.177 -13.743 132.857 -99.200 -91.000 TYR 161 0.840 88.390 -26.854 133.331 -99.200 -91.000 PHE 184 1.000 86.204 -6.724 146.294 -99.200 -91.000 TYR 185 0.840 85.211 -15.056 150.237 -99.200 -91.000 TYR 187 0.840 84.166 -17.498 145.942 -99.200 -91.000 PHE 198 1.000 82.728 -26.662 136.821 -99.200 -91.000