============================================================================= 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. TYR 5 0.840 -13.407 16.227 -7.132 -99.200 -91.000 HIS 11 0.900 -9.484 6.493 9.145 -99.200 -91.000 TYR 12 0.840 -8.941 4.958 5.463 -99.200 -91.000 HIS 14 0.900 -7.985 14.926 9.905 -99.200 -91.000 TYR 44 0.840 -11.581 1.651 -9.137 -99.200 -91.000 TRP 57 1.040 -8.416 5.680 -7.269 -99.200 -91.000 TRP6 57 1.020 -8.312 6.341 -9.535 -99.200 -91.000 TYR 64 0.840 1.690 13.765 -7.358 -99.200 -91.000 TYR 69 0.840 3.291 19.769 -4.891 -99.200 -91.000 HIS 71 0.900 10.993 22.471 3.829 -99.200 -91.000 TYR 78 0.840 20.864 8.180 3.569 -99.200 -91.000 HIS 90 0.900 0.720 -4.026 6.322 -99.200 -91.000 TRP 96 1.040 -3.111 0.780 16.495 -99.200 -91.000 TRP6 96 1.020 -1.303 2.271 16.736 -99.200 -91.000 PHE 131 1.000 3.146 7.781 20.124 -99.200 -91.000 PHE 136 1.000 7.175 15.928 15.044 -99.200 -91.000 PHE 137 1.000 4.075 5.519 16.380 -99.200 -91.000 TRP 154 1.040 -10.150 15.701 15.276 -99.200 -91.000 TRP6 154 1.020 -9.426 17.573 16.500 -99.200 -91.000 TYR 173 0.840 2.094 12.068 18.261 -99.200 -91.000 PHE 177 1.000 -5.188 15.787 18.437 -99.200 -91.000 PHE 182 1.000 -4.844 17.638 13.611 -99.200 -91.000