============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. HIS 23 0.900 -12.618 4.331 -18.936 -99.200 -91.000 TYR 27 0.840 -10.651 -2.111 -11.871 -99.200 -91.000 HIS 32 0.900 -25.697 5.539 -6.862 -99.200 -91.000 TYR 33 0.840 -27.885 9.260 -12.380 -99.200 -91.000 HIS 34 0.900 -31.045 10.795 -4.740 -99.200 -91.000 PHE 80 1.000 -22.062 -9.904 -11.479 -99.200 -91.000 PHE 83 1.000 -19.399 -2.503 -17.811 -99.200 -91.000 PHE 96 1.000 -20.517 16.839 6.211 -99.200 -91.000 TYR 97 0.840 -28.766 15.873 6.196 -99.200 -91.000 PHE 122 1.000 -26.205 -5.650 5.886 -99.200 -91.000 PHE 128 1.000 -18.124 -7.335 -4.971 -99.200 -91.000 PHE 150 1.000 -22.269 18.077 10.356 -99.200 -91.000 TYR 153 0.840 -20.568 12.464 8.032 -99.200 -91.000 HIS 158 0.900 -17.573 6.242 15.309 -99.200 -91.000 TYR 174 0.840 -17.947 -16.678 0.668 -99.200 -91.000 TRP 200 1.040 -13.001 23.526 8.134 -99.200 -91.000 TRP6 200 1.020 -12.907 21.726 9.672 -99.200 -91.000 PHE 222 1.000 -1.585 -0.069 -1.418 -99.200 -91.000 TYR 230 0.840 -1.430 -11.403 4.468 -99.200 -91.000 HIS 246 0.900 -2.863 20.380 20.703 -99.200 -91.000