============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 31 0.840 -34.262 55.741-198.564 -99.200 -91.000 TYR 37 0.840 -37.031 51.190-197.037 -99.200 -91.000 TRP 40 1.040 -49.401 44.775-194.925 -99.200 -91.000 TRP6 40 1.020 -51.126 45.554-193.521 -99.200 -91.000 TYR 41 0.840 -43.541 41.539-189.693 -99.200 -91.000 TYR 54 0.840 -39.554 41.590-199.412 -99.200 -91.000 TRP 55 1.040 -38.519 47.663-199.764 -99.200 -91.000 TRP6 55 1.020 -36.811 46.775-201.113 -99.200 -91.000 PHE 67 1.000 -52.111 35.327-196.794 -99.200 -91.000 PHE 76 1.000 -47.947 52.127-197.152 -99.200 -91.000 TYR 91 0.840 -53.559 38.349-191.287 -99.200 -91.000 TYR 92 0.840 -49.793 42.414-184.489 -99.200 -91.000 TYR 96 0.840 -39.111 47.585-193.856 -99.200 -91.000 TYR 97 0.840 -38.824 56.810-194.378 -99.200 -91.000 PHE 103 1.000 -43.707 45.369-185.001 -99.200 -91.000 PHE 121 1.000 -68.751 16.846-173.967 -99.200 -91.000 PHE 123 1.000 -65.039 17.040-167.847 -99.200 -91.000 PHE 144 1.000 -68.845 27.883-178.173 -99.200 -91.000 TYR 145 0.840 -69.352 31.560-186.038 -99.200 -91.000 TRP 153 1.040 -70.500 27.539-163.377 -99.200 -91.000 TRP6 153 1.020 -70.406 25.184-163.346 -99.200 -91.000 TYR 178 0.840 -64.836 31.415-181.990 -99.200 -91.000 TYR 191 0.840 -68.371 19.591-154.095 -99.200 -91.000 HIS 194 0.900 -75.344 25.243-151.450 -99.200 -91.000 TYR 197 0.840 -72.188 22.015-156.240 -99.200 -91.000 HIS 203 0.900 -73.955 29.056-179.438 -99.200 -91.000 PHE 214 1.000 -71.520 17.954-159.829 -99.200 -91.000