============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 5 1.000 19.782 -2.445 7.895 -99.200 -91.000 TYR 21 0.840 26.173 -8.936 8.356 -99.200 -91.000 PHE 23 1.000 19.821 -14.672 -0.216 -99.200 -91.000 TYR 24 0.840 24.689 -15.642 9.678 -99.200 -91.000 TYR 27 0.840 13.799 -14.589 12.877 -99.200 -91.000 PHE 45 1.000 13.057 -11.710 17.226 -99.200 -91.000 HIS 47 0.900 16.622 -3.610 10.464 -99.200 -91.000 TYR 51 0.840 13.260 -1.403 9.026 -99.200 -91.000 TYR 64 0.840 18.202 6.505 7.507 -99.200 -91.000 TYR 66 0.840 24.708 6.670 7.662 -99.200 -91.000 HIS 67 0.900 26.129 13.560 11.277 -99.200 -91.000 PHE 96 1.000 23.488 -7.095 10.919 -99.200 -91.000 TYR 103 0.840 28.826 -13.899 9.159 -99.200 -91.000 TYR 105 0.840 32.249 -16.948 5.393 -99.200 -91.000 TYR 107 0.840 24.547 -20.967 12.401 -99.200 -91.000 TYR 110 0.840 19.530 -23.326 9.343 -99.200 -91.000