============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 5 0.840 60.059 -1.418 18.572 -99.200 -91.000 TYR 14 0.840 55.316 11.012 21.279 -99.200 -91.000 TYR 22 0.840 50.440 2.900 41.851 -99.200 -91.000 HIS 23 0.900 53.304 3.795 33.977 -99.200 -91.000 PHE 24 1.000 47.985 6.909 37.801 -99.200 -91.000 TRP 34 1.040 47.200 23.071 29.083 -99.200 -91.000 TRP6 34 1.020 45.278 22.544 30.332 -99.200 -91.000 HIS 40 0.900 41.217 3.687 31.060 -99.200 -91.000 TYR 42 0.840 40.063 12.514 38.526 -99.200 -91.000 PHE 64 1.000 60.566 12.163 38.874 -99.200 -91.000 HIS 73 0.900 34.068 15.053 26.508 -99.200 -91.000 TYR 76 0.840 35.142 8.176 31.490 -99.200 -91.000 TRP 121 1.040 57.820 2.889 31.060 -99.200 -91.000 TRP6 121 1.020 57.236 5.095 30.438 -99.200 -91.000 TYR 131 0.840 52.383 -4.501 35.120 -99.200 -91.000 TYR 152 0.840 36.624 -5.446 20.947 -99.200 -91.000 PHE 161 1.000 42.366 4.759 16.462 -99.200 -91.000 TYR 165 0.840 50.109 -6.190 14.239 -99.200 -91.000 TRP 193 1.040 37.263 0.059 25.054 -99.200 -91.000 TRP6 193 1.020 36.180 -1.816 24.146 -99.200 -91.000 TYR 206 0.840 44.592 1.567 20.548 -99.200 -91.000 TYR 212 0.840 36.882 13.111 21.927 -99.200 -91.000 TRP 215 1.040 36.305 19.236 25.441 -99.200 -91.000 TRP6 215 1.020 37.841 17.884 26.624 -99.200 -91.000