============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. TYR 4 0.840 -4.012 20.943 36.741 -99.200 -91.000 PHE 5 1.000 1.853 12.374 34.535 -99.200 -91.000 TRP 10 1.040 14.196 15.540 27.982 -99.200 -91.000 TRP6 10 1.020 15.889 15.003 29.551 -99.200 -91.000 PHE 26 1.000 14.090 20.233 32.667 -99.200 -91.000 PHE 31 1.000 8.285 19.660 40.995 -99.200 -91.000 PHE 41 1.000 7.647 9.569 30.590 -99.200 -91.000 HIS 46 0.900 21.002 9.997 26.651 -99.200 -91.000 TYR 47 0.840 15.139 5.646 34.396 -99.200 -91.000 HIS 49 0.900 24.283 11.701 32.563 -99.200 -91.000 PHE 58 1.000 12.378 18.057 38.269 -99.200 -91.000 PHE 68 1.000 6.521 -10.096 22.100 -99.200 -91.000 TYR 73 0.840 9.831 -12.232 23.756 -99.200 -91.000 TYR 89 0.840 4.798 8.260 36.256 -99.200 -91.000 HIS 94 0.900 5.087 10.149 20.653 -99.200 -91.000 TRP 95 1.040 2.654 10.804 14.875 -99.200 -91.000 TRP6 95 1.020 1.472 9.701 13.154 -99.200 -91.000 TYR 100 0.840 8.778 8.001 11.927 -99.200 -91.000 PHE 101 1.000 10.314 2.698 15.064 -99.200 -91.000 HIS 102 0.900 4.679 0.370 9.715 -99.200 -91.000 PHE 126 1.000 -6.295 8.583 23.790 -99.200 -91.000 PHE 149 1.000 -5.950 2.809 25.981 -99.200 -91.000 PHE 156 1.000 -10.075 3.858 35.876 -99.200 -91.000 TYR 163 0.840 -6.911 14.880 20.883 -99.200 -91.000 TRP 167 1.040 -4.664 17.442 13.475 -99.200 -91.000 TRP6 167 1.020 -4.964 19.231 14.998 -99.200 -91.000 HIS 184 0.900 -7.558 16.692 26.933 -99.200 -91.000 TYR 207 0.840 -2.790 19.699 22.967 -99.200 -91.000 PHE 228 1.000 0.462 21.655 29.692 -99.200 -91.000 PHE 239 1.000 9.161 20.374 30.905 -99.200 -91.000