============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 32 rings ring int. center anis. iso. TYR 15 0.840 15.617 2.973 20.050 -99.200 -91.000 PHE 18 1.000 6.789 -7.241 27.488 -99.200 -91.000 TYR 26 0.840 -2.927 -8.064 34.416 -99.200 -91.000 PHE 31 1.000 4.041 -3.212 25.791 -99.200 -91.000 TYR 34 0.840 12.777 8.909 22.120 -99.200 -91.000 PHE 48 1.000 -3.052 8.950 19.410 -99.200 -91.000 TYR 50 0.840 -1.559 5.057 23.835 -99.200 -91.000 TYR 60 0.840 13.113 -3.146 14.009 -99.200 -91.000 TRP 70 1.040 6.669 -4.270 1.368 -99.200 -91.000 TRP6 70 1.020 8.646 -3.192 2.137 -99.200 -91.000 HIS 80 0.900 -5.664 0.590 6.156 -99.200 -91.000 TYR 93 0.840 13.560 4.549 -3.606 -99.200 -91.000 PHE 101 1.000 8.462 5.285 7.336 -99.200 -91.000 PHE 105 1.000 10.752 8.621 16.573 -99.200 -91.000 TYR 114 0.840 35.579 -6.413 16.100 -99.200 -91.000 TYR 134 0.840 31.282 -8.389 6.943 -99.200 -91.000 PHE 145 1.000 23.445 1.368 2.905 -99.200 -91.000 PHE 146 1.000 25.794 -3.041 4.794 -99.200 -91.000 TYR 154 0.840 28.932 1.061 2.285 -99.200 -91.000 TRP 158 1.040 23.253 -8.634 -0.049 -99.200 -91.000 TRP6 158 1.020 22.125 -9.117 1.991 -99.200 -91.000 PHE 160 1.000 31.620 -12.730 5.370 -99.200 -91.000 TYR 185 0.840 28.184 -10.906 14.142 -99.200 -91.000 PHE 187 1.000 23.968 -6.623 14.945 -99.200 -91.000 PHE 196 1.000 20.568 1.756 26.408 -99.200 -91.000 TYR 216 0.840 15.457 4.977 14.720 -99.200 -91.000 TYR 226 0.840 -5.029 9.292 13.487 -99.200 -91.000 HIS 244 0.900 18.442 17.769 25.203 -99.200 -91.000 TRP 250 1.040 13.173 6.729 28.062 -99.200 -91.000 TRP6 250 1.020 12.730 4.880 29.434 -99.200 -91.000 TRP 251 1.040 20.340 6.614 23.780 -99.200 -91.000 TRP6 251 1.020 18.086 6.574 23.147 -99.200 -91.000