============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. TYR 15 0.840 20.893 26.614 36.859 -99.200 -91.000 PHE 20 1.000 16.379 29.248 30.025 -99.200 -91.000 TYR 35 0.840 0.000 34.501 28.533 -99.200 -91.000 PHE 39 1.000 9.163 33.635 35.951 -99.200 -91.000 PHE 43 1.000 8.148 30.794 38.584 -99.200 -91.000 PHE 47 1.000 13.687 33.982 32.314 -99.200 -91.000 TYR 50 0.840 12.981 31.153 39.412 -99.200 -91.000 TYR 70 0.840 38.857 29.825 32.848 -99.200 -91.000 PHE 78 1.000 26.432 35.878 35.272 -99.200 -91.000 TYR 83 0.840 27.014 41.767 33.789 -99.200 -91.000 PHE 84 1.000 30.723 34.403 38.465 -99.200 -91.000 PHE 88 1.000 29.739 35.124 44.062 -99.200 -91.000 TYR 91 0.840 22.178 37.385 44.392 -99.200 -91.000 TYR 92 0.840 25.884 35.408 46.873 -99.200 -91.000