============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 5 0.840 33.949-210.467 31.646 -99.200 -91.000 PHE 7 1.000 33.646-210.804 25.916 -99.200 -91.000 PHE 12 1.000 21.492-214.383 16.585 -99.200 -91.000 TYR 23 0.840 20.947-221.953 28.210 -99.200 -91.000 TYR 75 0.840 8.803-211.613 40.375 -99.200 -91.000 TYR 82 0.840 8.686-207.375 40.001 -99.200 -91.000 HIS 94 0.900 8.263-190.168 37.638 -99.200 -91.000 TYR 97 0.840 4.701-190.142 27.871 -99.200 -91.000 TYR 101 0.840 5.699-186.218 25.369 -99.200 -91.000 TYR 104 0.840 2.387-190.240 36.649 -99.200 -91.000 PHE 130 1.000 17.098-206.882 33.436 -99.200 -91.000 HIS 139 0.900 -7.885-196.097 31.962 -99.200 -91.000 PHE 142 1.000 -6.440-189.330 24.053 -99.200 -91.000 PHE 145 1.000 -9.878-200.238 32.800 -99.200 -91.000 TYR 148 0.840 0.459-203.990 26.149 -99.200 -91.000 TYR 156 0.840 6.099-204.480 23.470 -99.200 -91.000 PHE 157 1.000 4.598-211.890 23.660 -99.200 -91.000 TRP 159 1.040 -0.660-212.223 26.738 -99.200 -91.000 TRP6 159 1.020 -1.109-214.224 25.567 -99.200 -91.000 PHE 174 1.000 -10.454-222.311 35.986 -99.200 -91.000 TRP 179 1.040 -11.191-212.763 29.169 -99.200 -91.000 TRP6 179 1.020 -11.793-212.049 26.992 -99.200 -91.000 HIS 190 0.900 -15.642-216.173 41.807 -99.200 -91.000 PHE 204 1.000 -6.062-219.449 46.896 -99.200 -91.000 TYR 223 0.840 -3.742-183.383 45.034 -99.200 -91.000 PHE 234 1.000 -1.041-200.880 41.752 -99.200 -91.000