============================================================================= 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 15.834 2.959 20.129 -99.200 -91.000 PHE 18 1.000 7.042 -7.428 27.270 -99.200 -91.000 TYR 26 0.840 -2.774 -8.312 34.303 -99.200 -91.000 PHE 31 1.000 4.312 -3.357 25.688 -99.200 -91.000 TYR 34 0.840 13.086 8.748 22.279 -99.200 -91.000 PHE 48 1.000 -2.765 8.830 19.438 -99.200 -91.000 TYR 50 0.840 -1.282 4.827 23.844 -99.200 -91.000 TYR 60 0.840 13.357 -3.168 14.011 -99.200 -91.000 TRP 70 1.040 6.987 -4.273 1.310 -99.200 -91.000 TRP6 70 1.020 8.909 -3.126 2.034 -99.200 -91.000 HIS 80 0.900 -5.316 0.599 6.029 -99.200 -91.000 TYR 93 0.840 14.073 4.725 -3.463 -99.200 -91.000 PHE 101 1.000 8.804 5.351 7.433 -99.200 -91.000 PHE 105 1.000 11.110 8.588 16.712 -99.200 -91.000 TYR 114 0.840 35.976 -6.499 15.869 -99.200 -91.000 TYR 134 0.840 31.564 -8.361 6.738 -99.200 -91.000 PHE 145 1.000 23.857 1.513 2.966 -99.200 -91.000 PHE 146 1.000 26.102 -2.937 4.745 -99.200 -91.000 TYR 154 0.840 29.253 1.124 2.221 -99.200 -91.000 TRP 158 1.040 23.531 -8.483 -0.351 -99.200 -91.000 TRP6 158 1.020 22.340 -8.992 1.640 -99.200 -91.000 PHE 160 1.000 31.654 -12.590 5.337 -99.200 -91.000 TYR 185 0.840 28.510 -10.970 13.910 -99.200 -91.000 PHE 187 1.000 24.287 -6.570 14.956 -99.200 -91.000 PHE 196 1.000 20.892 1.415 26.367 -99.200 -91.000 TYR 216 0.840 15.794 4.941 14.785 -99.200 -91.000 TYR 226 0.840 -4.690 9.272 13.573 -99.200 -91.000 HIS 244 0.900 18.701 17.537 25.483 -99.200 -91.000 TRP 250 1.040 13.468 6.461 28.153 -99.200 -91.000 TRP6 250 1.020 13.003 4.579 29.513 -99.200 -91.000 TRP 251 1.040 20.652 6.418 23.932 -99.200 -91.000 TRP6 251 1.020 18.408 6.395 23.300 -99.200 -91.000