============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 39 0.840 -17.615 45.611 -38.568 -99.200 -91.000 PHE 41 1.000 -11.864 47.846 -42.090 -99.200 -91.000 TYR 46 0.840 -1.342 54.627 -55.878 -99.200 -91.000 TYR 81 0.840 -33.731 52.215 -88.315 -99.200 -91.000 TYR 82 0.840 -36.754 51.101 -84.642 -99.200 -91.000 HIS 90 0.900 -12.510 53.687 -68.553 -99.200 -91.000 PHE 92 1.000 -13.989 51.617 -56.911 -99.200 -91.000 PHE 94 1.000 -9.214 50.361 -52.310 -99.200 -91.000 TYR 100 0.840 -8.108 57.583 -47.106 -99.200 -91.000 TYR 118 0.840 -25.983 62.594 -63.188 -99.200 -91.000 TYR 119 0.840 -26.945 61.797 -68.023 -99.200 -91.000 PHE 130 1.000 -24.730 81.756 -68.064 -99.200 -91.000 PHE 138 1.000 -21.720 90.350 -65.595 -99.200 -91.000 PHE 141 1.000 -25.630 96.910 -63.481 -99.200 -91.000 PHE 159 1.000 -28.937 78.419 -69.884 -99.200 -91.000 TYR 160 0.840 -26.529 70.933 -72.815 -99.200 -91.000 PHE 163 1.000 -23.179 76.824 -70.466 -99.200 -91.000 TYR 182 0.840 -26.004 97.918 -71.930 -99.200 -91.000 TYR 187 0.840 -22.898 86.625 -78.192 -99.200 -91.000 TYR 191 0.840 -32.920 81.568 -77.658 -99.200 -91.000 PHE 196 1.000 -27.099 82.082 -81.727 -99.200 -91.000