============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 14 0.840 22.538 59.606 -4.948 -99.200 -91.000 TYR 24 0.840 22.940 73.498 -1.295 -99.200 -91.000 TYR 25 0.840 20.513 68.216 -8.087 -99.200 -91.000 TYR 26 0.840 20.412 74.649 -13.405 -99.200 -91.000 TYR 29 0.840 14.750 67.218 -16.823 -99.200 -91.000 PHE 36 1.000 24.540 65.986 -4.943 -99.200 -91.000 TYR 38 0.840 30.345 63.995 -3.498 -99.200 -91.000 PHE 48 1.000 28.004 73.928 -8.478 -99.200 -91.000 TYR 49 0.840 32.748 72.084 -1.118 -99.200 -91.000 TRP 51 1.040 20.330 78.212 -3.745 -99.200 -91.000 TRP6 51 1.020 20.472 80.552 -4.157 -99.200 -91.000 TRP 59 1.040 25.973 83.613 -14.826 -99.200 -91.000 TRP6 59 1.020 25.202 85.462 -16.049 -99.200 -91.000