============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. PHE 34 1.000 17.578 0.989 6.844 -99.200 -91.000 TYR 43 0.840 11.148 4.846 -14.223 -99.200 -91.000 TYR 58 0.840 18.347 8.899 -11.227 -99.200 -91.000 PHE 74 1.000 28.429 4.441 12.072 -99.200 -91.000 PHE 91 1.000 17.759 2.961 -4.471 -99.200 -91.000 TYR 95 0.840 25.332 3.653 7.751 -99.200 -91.000 TYR 101 0.840 24.190 1.554 12.076 -99.200 -91.000 PHE 118 1.000 10.666 8.741 -10.765 -99.200 -91.000 PHE 130 1.000 10.505 0.834 -3.044 -99.200 -91.000 PHE 146 1.000 20.712 -6.312 3.222 -99.200 -91.000 TRP 148 1.040 22.323 -3.458 15.251 -99.200 -91.000 TRP6 148 1.020 22.379 -1.505 16.559 -99.200 -91.000 TYR 157 0.840 10.084 -4.543 5.477 -99.200 -91.000 TYR 174 0.840 -10.604 6.081 -6.674 -99.200 -91.000 TYR 179 0.840 -7.776 6.372 7.815 -99.200 -91.000 PHE 202 1.000 -17.315 -4.554 -6.661 -99.200 -91.000 TYR 205 0.840 -15.290 -6.618 -0.198 -99.200 -91.000 TYR 211 0.840 -5.728 -4.553 12.906 -99.200 -91.000 TYR 227 0.840 -14.435 -6.320 13.003 -99.200 -91.000 TYR 244 0.840 -28.951 -7.997 -8.570 -99.200 -91.000 HIS 252 0.900 -11.392 -10.681 9.834 -99.200 -91.000 TYR 265 0.840 -24.738 -8.095 -5.530 -99.200 -91.000 TYR 271 0.840 -24.486 -6.988 -10.505 -99.200 -91.000 PHE 288 1.000 -8.903 -0.659 11.588 -99.200 -91.000 PHE 300 1.000 -7.273 -1.329 0.627 -99.200 -91.000 PHE 316 1.000 -13.359 -12.433 -7.792 -99.200 -91.000 TRP 318 1.040 -21.715 -7.977 -15.547 -99.200 -91.000 TRP6 318 1.020 -23.440 -6.369 -15.482 -99.200 -91.000 TYR 319 0.840 -20.151 -11.770 -18.459 -99.200 -91.000 TYR 327 0.840 -8.076 -2.894 -9.066 -99.200 -91.000 PHE 328 1.000 -3.667 3.832 -11.289 -99.200 -91.000