============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 5 0.840 37.306 39.397 25.321 -99.200 -91.000 PHE 15 1.000 25.866 50.008 25.720 -99.200 -91.000 TYR 21 0.840 24.524 46.616 12.615 -99.200 -91.000 PHE 23 1.000 23.089 40.364 22.042 -99.200 -91.000 TYR 34 0.840 16.310 47.594 20.543 -99.200 -91.000 TRP 41 1.040 17.688 36.597 17.906 -99.200 -91.000 TRP6 41 1.020 18.464 36.546 20.144 -99.200 -91.000 HIS 53 0.900 23.543 37.477 35.955 -99.200 -91.000 TYR 65 0.840 22.534 31.947 35.076 -99.200 -91.000 TRP 73 1.040 17.296 32.464 25.092 -99.200 -91.000 TRP6 73 1.020 19.580 32.770 24.504 -99.200 -91.000 TYR 84 0.840 33.796 27.947 24.879 -99.200 -91.000 TYR 97 0.840 33.140 33.345 15.660 -99.200 -91.000 TRP 102 1.040 49.108 30.437 17.701 -99.200 -91.000 TRP6 102 1.020 48.954 32.748 17.195 -99.200 -91.000 HIS 109 0.900 47.282 38.471 35.245 -99.200 -91.000