============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 25 1.000 113.375 -31.109 94.790 -99.200 -91.000 HIS 28 0.900 109.264 -34.396 87.069 -99.200 -91.000 PHE 35 1.000 110.631 -35.235 72.824 -99.200 -91.000 TYR 40 0.840 113.318 -42.381 56.021 -99.200 -91.000 TYR 58 0.840 106.528 -24.622 63.760 -99.200 -91.000 TYR 66 0.840 108.761 -29.116 53.292 -99.200 -91.000 TYR 92 0.840 118.035 -8.406 70.149 -99.200 -91.000 TYR 95 0.840 110.872 -20.590 70.878 -99.200 -91.000 HIS 109 0.900 122.874 -34.341 55.647 -99.200 -91.000 PHE 111 1.000 122.369 -29.702 59.239 -99.200 -91.000 TYR 124 0.840 132.507 -36.143 67.155 -99.200 -91.000 PHE 133 1.000 131.864 -33.836 82.571 -99.200 -91.000 TYR 135 0.840 131.443 -31.855 71.698 -99.200 -91.000 TYR 142 0.840 132.875 -40.442 64.827 -99.200 -91.000 TYR 184 0.840 113.502 -41.711 66.071 -99.200 -91.000