============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. PHE 27 1.000 -9.106 4.686 -21.576 -99.200 -91.000 PHE 29 1.000 -5.146 5.803 -26.426 -99.200 -91.000 TYR 32 0.840 -10.877 9.871 -20.632 -99.200 -91.000 TYR 33 0.840 -5.418 16.719 -22.200 -99.200 -91.000 TRP 36 1.040 4.234 7.930 -21.280 -99.200 -91.000 TRP6 36 1.020 4.446 5.613 -20.820 -99.200 -91.000 TRP 47 1.040 2.922 15.181 -15.894 -99.200 -91.000 TRP6 47 1.020 3.673 16.966 -17.225 -99.200 -91.000 PHE 50 1.000 -0.626 17.534 -20.735 -99.200 -91.000 TYR 58 0.840 -5.372 12.748 -31.288 -99.200 -91.000 TYR 62 0.840 7.357 16.153 -24.362 -99.200 -91.000 PHE 70 1.000 12.804 10.585 -20.966 -99.200 -91.000 TYR 82 0.840 3.722 3.464 -29.648 -99.200 -91.000 TYR 96 0.840 10.700 5.926 -16.863 -99.200 -91.000 TYR 97 0.840 4.235 3.719 -11.735 -99.200 -91.000 TYR 103 0.840 -10.658 18.769 -22.053 -99.200 -91.000 TYR 109 0.840 -9.851 4.191 -14.034 -99.200 -91.000 TRP 110 1.040 -2.231 6.951 -11.709 -99.200 -91.000 TRP6 110 1.020 -0.089 7.946 -11.599 -99.200 -91.000