============================================================================= 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 1.000 135.354 22.785 70.727 -99.200 -91.000 HIS 28 0.900 128.492 27.163 66.028 -99.200 -91.000 PHE 35 1.000 115.372 32.936 67.241 -99.200 -91.000 TYR 40 0.840 101.961 45.366 67.785 -99.200 -91.000 TYR 58 0.840 107.036 22.298 65.972 -99.200 -91.000 TYR 66 0.840 95.040 32.829 67.660 -99.200 -91.000 TYR 92 0.840 106.154 11.680 82.775 -99.200 -91.000 TYR 95 0.840 109.359 20.315 72.067 -99.200 -91.000 HIS 109 0.900 100.376 40.960 79.395 -99.200 -91.000 PHE 111 1.000 102.363 35.504 80.375 -99.200 -91.000 TYR 124 0.840 112.890 41.884 87.920 -99.200 -91.000 PHE 133 1.000 126.599 34.676 87.745 -99.200 -91.000 TYR 135 0.840 115.774 36.306 88.069 -99.200 -91.000 TYR 142 0.840 111.905 46.605 86.796 -99.200 -91.000 TYR 184 0.840 111.192 41.766 68.052 -99.200 -91.000