============================================================================= 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 9 0.840 22.048 1.321 44.777 -99.200 -91.000 HIS 13 0.900 16.115 3.890 45.072 -99.200 -91.000 TYR 21 0.840 22.639 -4.449 37.725 -99.200 -91.000 TYR 35 0.840 20.490 -17.786 41.719 -99.200 -91.000 HIS 46 0.900 24.599 0.924 53.876 -99.200 -91.000 HIS 60 0.900 5.846 2.236 35.332 -99.200 -91.000 HIS 73 0.900 41.075 6.610 35.689 -99.200 -91.000 HIS 80 0.900 41.248 13.544 30.262 -99.200 -91.000 TRP 92 1.040 9.870 -2.279 32.001 -99.200 -91.000 TRP6 92 1.020 8.450 -0.425 32.397 -99.200 -91.000 TRP 112 1.040 24.990 19.457 36.653 -99.200 -91.000 TRP6 112 1.020 24.263 21.040 38.266 -99.200 -91.000 TYR 123 0.840 29.060 -8.464 26.748 -99.200 -91.000 TYR 133 0.840 25.381 2.132 25.153 -99.200 -91.000 PHE 136 1.000 20.961 9.554 24.458 -99.200 -91.000 PHE 138 1.000 28.776 7.248 25.022 -99.200 -91.000 TYR 147 0.840 36.497 -5.898 28.029 -99.200 -91.000 PHE 154 1.000 37.340 -17.028 27.671 -99.200 -91.000 TYR 158 0.840 31.763 -3.326 18.005 -99.200 -91.000