============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 1 0.900 -36.230 -35.451 4.173 -99.200 -91.000 PHE 2 1.000 -39.326 -35.243 17.068 -99.200 -91.000 TYR 9 0.840 -43.711 -24.009 21.022 -99.200 -91.000 TYR 16 0.840 -28.427 -12.274 19.751 -99.200 -91.000 HIS 22 0.900 -27.625 -8.289 12.324 -99.200 -91.000 PHE 23 1.000 -32.273 -8.313 19.392 -99.200 -91.000 HIS 42 0.900 -42.423 -3.371 12.507 -99.200 -91.000 PHE 45 1.000 -40.497 -12.635 14.791 -99.200 -91.000 TYR 56 0.840 -48.652 -22.310 11.052 -99.200 -91.000 TYR 65 0.840 -49.389 -17.114 10.482 -99.200 -91.000 TYR 75 0.840 -43.394 -15.861 1.660 -99.200 -91.000 PHE 86 1.000 -39.828 -21.634 8.682 -99.200 -91.000 HIS 94 0.900 -25.669 -25.780 25.185 -99.200 -91.000 TYR 95 0.840 -26.373 -21.032 19.941 -99.200 -91.000 TYR 98 0.840 -36.850 -21.678 14.909 -99.200 -91.000 HIS 103 0.900 -38.804 -25.705 -0.370 -99.200 -91.000 TRP 108 1.040 -33.213 -25.275 0.528 -99.200 -91.000 TRP6 108 1.020 -34.740 -24.415 -1.054 -99.200 -91.000 PHE 109 1.000 -30.595 -26.034 8.513 -99.200 -91.000 HIS 125 0.900 -23.366 -24.885 4.843 -99.200 -91.000 TYR 126 0.840 -28.373 -30.034 10.155 -99.200 -91.000 PHE 133 1.000 -32.187 -17.559 13.772 -99.200 -91.000