============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 5 1.000 -18.551 -5.926 21.569 -99.200 -91.000 HIS 6 0.900 -22.850 -11.630 19.217 -99.200 -91.000 TYR 13 0.840 -13.626 -10.502 18.644 -99.200 -91.000 HIS 43 0.900 -2.886 -14.721 40.406 -99.200 -91.000 HIS 46 0.900 -3.057 -13.197 36.608 -99.200 -91.000 PHE 66 1.000 1.604 -14.636 22.406 -99.200 -91.000 TYR 72 0.840 4.558 -20.947 32.517 -99.200 -91.000 PHE 92 1.000 -5.215 -10.589 20.176 -99.200 -91.000 TYR 100 0.840 6.394 -12.997 18.644 -99.200 -91.000 HIS 125 0.900 11.095 -11.464 31.745 -99.200 -91.000 PHE 126 1.000 12.325 -6.994 32.914 -99.200 -91.000 PHE 146 1.000 -6.409 -0.350 33.506 -99.200 -91.000 PHE 147 1.000 1.546 -3.623 31.396 -99.200 -91.000 TYR 152 0.840 7.816 0.079 41.058 -99.200 -91.000 PHE 165 1.000 10.293 2.364 21.037 -99.200 -91.000 TYR 191 0.840 4.142 -25.134 40.736 -99.200 -91.000 HIS 212 0.900 4.598 0.438 58.615 -99.200 -91.000 TYR 239 0.840 16.187 -8.394 42.990 -99.200 -91.000