============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 15 0.840 38.140 17.957 -25.523 -99.200 -91.000 HIS 17 0.900 30.730 18.572 -24.984 -99.200 -91.000 HIS 20 0.900 27.071 26.864 -16.819 -99.200 -91.000 HIS 24 0.900 17.566 38.534 -23.138 -99.200 -91.000 PHE 32 1.000 18.390 55.331 -6.684 -99.200 -91.000 PHE 47 1.000 29.269 24.597 -5.682 -99.200 -91.000 PHE 53 1.000 25.885 34.371 -17.548 -99.200 -91.000 PHE 57 1.000 30.851 20.006 -15.330 -99.200 -91.000 TYR 91 0.840 25.686 27.018 -29.798 -99.200 -91.000 HIS 99 0.900 46.701 21.720 -20.079 -99.200 -91.000 HIS 105 0.900 28.561 23.209 -25.912 -99.200 -91.000 PHE 106 1.000 26.245 33.016 -22.451 -99.200 -91.000 TYR 107 0.840 22.346 26.375 -25.294 -99.200 -91.000 HIS 129 0.900 16.838 29.179 -2.216 -99.200 -91.000 TYR 142 0.840 21.661 50.604 -12.867 -99.200 -91.000 PHE 154 1.000 27.082 41.993 -11.611 -99.200 -91.000 PHE 158 1.000 31.449 38.376 -12.590 -99.200 -91.000 TYR 168 0.840 28.568 36.310 -27.505 -99.200 -91.000 HIS 189 0.900 39.592 51.785 -10.839 -99.200 -91.000