============================================================================= 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. TYR 35 0.840 7.211 68.746 21.228 -99.200 -91.000 PHE 41 1.000 14.471 67.615 15.640 -99.200 -91.000 TYR 80 0.840 24.820 48.403 8.916 -99.200 -91.000 HIS 87 0.900 26.232 42.076 -4.515 -99.200 -91.000 TYR 104 0.840 18.498 43.921 4.007 -99.200 -91.000 PHE 126 1.000 13.583 63.887 -6.304 -99.200 -91.000 PHE 135 1.000 17.243 66.151 1.590 -99.200 -91.000 HIS 172 0.900 -0.536 61.896 -8.363 -99.200 -91.000 TRP 185 1.040 12.890 49.062 -3.507 -99.200 -91.000 TRP6 185 1.020 13.582 50.732 -5.034 -99.200 -91.000 TRP 204 1.040 -3.605 50.943 12.922 -99.200 -91.000 TRP6 204 1.020 -3.198 53.222 13.409 -99.200 -91.000 TYR 215 0.840 26.915 65.060 19.386 -99.200 -91.000 TRP 225 1.040 -1.439 52.648 3.184 -99.200 -91.000 TRP6 225 1.020 0.900 52.472 2.928 -99.200 -91.000 TYR 237 0.840 13.843 63.394 11.292 -99.200 -91.000 PHE 238 1.000 15.288 61.378 21.869 -99.200 -91.000