============================================================================= 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 33.092-210.546 32.018 -99.200 -91.000 PHE 7 1.000 32.850-210.794 26.293 -99.200 -91.000 PHE 12 1.000 20.561-214.357 17.015 -99.200 -91.000 TYR 23 0.840 20.006-221.964 28.563 -99.200 -91.000 TYR 75 0.840 7.778-211.399 40.594 -99.200 -91.000 TYR 82 0.840 7.750-207.210 40.273 -99.200 -91.000 HIS 94 0.900 7.694-189.842 37.952 -99.200 -91.000 TYR 97 0.840 3.997-189.985 28.132 -99.200 -91.000 TYR 101 0.840 5.125-186.105 25.667 -99.200 -91.000 TYR 104 0.840 1.746-189.948 36.887 -99.200 -91.000 PHE 130 1.000 16.316-206.807 33.815 -99.200 -91.000 HIS 139 0.900 -8.632-195.601 32.221 -99.200 -91.000 PHE 142 1.000 -7.113-189.024 24.160 -99.200 -91.000 PHE 145 1.000 -10.575-199.747 32.969 -99.200 -91.000 TYR 148 0.840 -0.380-203.738 26.421 -99.200 -91.000 TYR 156 0.840 5.335-204.303 23.707 -99.200 -91.000 PHE 157 1.000 3.707-211.790 23.956 -99.200 -91.000 TRP 159 1.040 -1.491-211.986 27.105 -99.200 -91.000 TRP6 159 1.020 -1.919-214.050 26.037 -99.200 -91.000 PHE 174 1.000 -11.472-221.888 36.084 -99.200 -91.000 TRP 179 1.040 -12.207-212.361 29.365 -99.200 -91.000 TRP6 179 1.020 -12.707-211.719 27.147 -99.200 -91.000 HIS 190 0.900 -16.607-215.960 41.775 -99.200 -91.000 PHE 204 1.000 -7.155-218.997 47.103 -99.200 -91.000 TYR 223 0.840 -4.167-183.115 45.303 -99.200 -91.000 PHE 234 1.000 -1.867-200.429 42.040 -99.200 -91.000