============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. HIS 10 0.900 -19.663 31.553 -8.137 -99.200 -91.000 TYR 14 0.840 -8.771 26.768 -4.245 -99.200 -91.000 TRP 35 1.040 -1.475 21.344 -18.336 -99.200 -91.000 TRP6 35 1.020 -1.185 19.041 -18.766 -99.200 -91.000 HIS 41 0.900 -10.035 7.508 -6.374 -99.200 -91.000 HIS 55 0.900 -21.677 27.626 -4.069 -99.200 -91.000 PHE 73 1.000 -0.240 13.920 -20.395 -99.200 -91.000 TYR 75 0.840 3.213 9.027 -9.739 -99.200 -91.000 TYR 78 0.840 -4.010 4.745 -9.394 -99.200 -91.000 TYR 101 0.840 -16.966 35.856 -10.406 -99.200 -91.000 HIS 106 0.900 0.017 30.289 -8.468 -99.200 -91.000 TRP 125 1.040 -19.952 21.082 -5.881 -99.200 -91.000 TRP6 125 1.020 -17.872 21.855 -6.703 -99.200 -91.000 HIS 129 0.900 -24.673 12.630 10.077 -99.200 -91.000 TRP 134 1.040 -24.518 14.128 -6.821 -99.200 -91.000 TRP6 134 1.020 -25.791 16.041 -7.372 -99.200 -91.000 HIS 156 0.900 -6.784 6.366 13.973 -99.200 -91.000 TYR 157 0.840 -7.369 4.656 6.730 -99.200 -91.000 PHE 159 1.000 1.459 -1.587 9.697 -99.200 -91.000 PHE 193 1.000 -2.783 21.141 -4.836 -99.200 -91.000 PHE 199 1.000 -6.889 5.328 0.975 -99.200 -91.000 TYR 214 0.840 -7.121 14.473 2.418 -99.200 -91.000 HIS 221 0.900 3.521 11.666 -5.260 -99.200 -91.000 TRP 224 1.040 4.379 12.351 -13.658 -99.200 -91.000 TRP6 224 1.020 2.101 12.609 -13.079 -99.200 -91.000