============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. HIS 17 0.900 11.172 38.016 13.350 -99.200 -91.000 PHE 22 1.000 17.471 25.232 16.959 -99.200 -91.000 TYR 25 0.840 21.731 28.922 10.015 -99.200 -91.000 PHE 31 1.000 22.229 17.701 1.963 -99.200 -91.000 PHE 42 1.000 19.830 7.170 15.748 -99.200 -91.000 PHE 47 1.000 35.824 9.262 11.815 -99.200 -91.000 PHE 51 1.000 31.649 -0.855 21.699 -99.200 -91.000 PHE 89 1.000 31.688 -1.853 15.940 -99.200 -91.000 PHE 101 1.000 24.530 -8.894 22.332 -99.200 -91.000 TYR 103 0.840 19.399 -0.194 25.413 -99.200 -91.000 TYR 111 0.840 13.877 -2.201 17.511 -99.200 -91.000 TRP 114 1.040 19.211 -9.752 18.207 -99.200 -91.000 TRP6 114 1.020 21.456 -9.019 18.333 -99.200 -91.000 PHE 132 1.000 24.775 -7.153 8.675 -99.200 -91.000 TRP 137 1.040 19.875 -4.159 15.227 -99.200 -91.000 TRP6 137 1.020 19.345 -3.970 17.522 -99.200 -91.000 PHE 152 1.000 25.868 13.821 19.277 -99.200 -91.000