============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 24 1.000 21.865 21.991 3.706 -99.200 -91.000 PHE 29 1.000 32.895 12.592 0.989 -99.200 -91.000 TYR 33 0.840 40.688 14.536 10.014 -99.200 -91.000 PHE 38 1.000 28.167 20.097 10.987 -99.200 -91.000 TYR 41 0.840 26.869 26.011 8.270 -99.200 -91.000 TRP 57 1.040 20.766 21.691 16.792 -99.200 -91.000 TRP6 57 1.020 20.968 21.831 19.136 -99.200 -91.000 TYR 65 0.840 29.216 7.645 25.622 -99.200 -91.000 TYR 73 0.840 16.641 12.724 20.534 -99.200 -91.000 PHE 83 1.000 18.671 3.221 5.120 -99.200 -91.000 TRP 98 1.040 19.328 4.863 15.394 -99.200 -91.000 TRP6 98 1.020 20.390 6.103 17.140 -99.200 -91.000 HIS 104 0.900 9.819 8.600 25.834 -99.200 -91.000 PHE 105 1.000 13.936 10.822 25.230 -99.200 -91.000 HIS 125 0.900 36.135 -2.840 -1.329 -99.200 -91.000 PHE 153 1.000 6.922 15.713 5.125 -99.200 -91.000 TYR 155 0.840 14.137 5.670 1.175 -99.200 -91.000 PHE 170 1.000 20.661 18.453 4.834 -99.200 -91.000