============================================================================= 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 33.734-210.478 31.744 -99.200 -91.000 PHE 7 1.000 33.505-210.763 25.962 -99.200 -91.000 PHE 12 1.000 21.261-214.475 16.654 -99.200 -91.000 TYR 23 0.840 20.716-221.920 28.319 -99.200 -91.000 TYR 75 0.840 8.575-211.658 40.341 -99.200 -91.000 TYR 82 0.840 8.491-207.424 40.014 -99.200 -91.000 HIS 94 0.900 8.034-190.102 37.665 -99.200 -91.000 TYR 97 0.840 4.411-190.162 27.881 -99.200 -91.000 TYR 101 0.840 5.286-186.043 25.414 -99.200 -91.000 TYR 104 0.840 2.111-190.181 36.731 -99.200 -91.000 PHE 130 1.000 16.776-206.865 33.673 -99.200 -91.000 HIS 139 0.900 -8.185-196.030 32.055 -99.200 -91.000 PHE 142 1.000 -6.844-189.341 24.200 -99.200 -91.000 PHE 145 1.000 -10.107-200.247 32.907 -99.200 -91.000 TYR 148 0.840 0.200-203.991 26.179 -99.200 -91.000 TYR 156 0.840 5.827-204.509 23.519 -99.200 -91.000 PHE 157 1.000 4.373-211.918 23.707 -99.200 -91.000 TRP 159 1.040 -0.957-212.249 26.779 -99.200 -91.000 TRP6 159 1.020 -1.455-214.304 25.726 -99.200 -91.000 PHE 174 1.000 -10.825-222.325 36.077 -99.200 -91.000 TRP 179 1.040 -11.471-212.824 29.273 -99.200 -91.000 TRP6 179 1.020 -11.976-212.114 27.069 -99.200 -91.000 HIS 190 0.900 -16.044-216.171 41.718 -99.200 -91.000 PHE 204 1.000 -6.282-219.552 46.979 -99.200 -91.000 TYR 223 0.840 -3.739-183.470 45.010 -99.200 -91.000 PHE 234 1.000 -1.369-200.761 41.818 -99.200 -91.000