============================================================================= 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 33.564-210.743 31.879 -99.200 -91.000 PHE 7 1.000 33.334-210.894 26.117 -99.200 -91.000 PHE 12 1.000 20.953-214.572 16.877 -99.200 -91.000 TYR 23 0.840 20.495-222.079 28.517 -99.200 -91.000 TYR 75 0.840 8.436-211.353 40.687 -99.200 -91.000 TYR 82 0.840 8.374-207.208 40.393 -99.200 -91.000 HIS 94 0.900 8.173-189.818 37.870 -99.200 -91.000 TYR 97 0.840 4.551-190.056 28.108 -99.200 -91.000 TYR 101 0.840 5.643-186.137 25.430 -99.200 -91.000 TYR 104 0.840 2.366-190.010 36.770 -99.200 -91.000 PHE 130 1.000 16.762-206.920 33.745 -99.200 -91.000 HIS 139 0.900 -8.048-195.735 32.176 -99.200 -91.000 PHE 142 1.000 -6.489-189.154 24.106 -99.200 -91.000 PHE 145 1.000 -10.092-199.749 32.906 -99.200 -91.000 TYR 148 0.840 0.176-203.840 26.276 -99.200 -91.000 TYR 156 0.840 5.777-204.470 23.664 -99.200 -91.000 PHE 157 1.000 4.195-211.848 23.963 -99.200 -91.000 TRP 159 1.040 -0.922-211.964 27.206 -99.200 -91.000 TRP6 159 1.020 -1.194-214.051 26.139 -99.200 -91.000 PHE 174 1.000 -10.891-221.858 36.236 -99.200 -91.000 TRP 179 1.040 -11.554-212.443 29.450 -99.200 -91.000 TRP6 179 1.020 -12.149-211.869 27.235 -99.200 -91.000 HIS 190 0.900 -16.012-215.889 41.935 -99.200 -91.000 PHE 204 1.000 -6.645-219.170 47.284 -99.200 -91.000 TYR 223 0.840 -3.422-183.305 45.183 -99.200 -91.000 PHE 234 1.000 -1.258-200.496 41.994 -99.200 -91.000