============================================================================= 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 33.366-210.517 32.104 -99.200 -91.000 PHE 7 1.000 32.897-210.759 26.414 -99.200 -91.000 PHE 12 1.000 20.736-214.457 17.112 -99.200 -91.000 TYR 23 0.840 20.276-221.948 28.688 -99.200 -91.000 TYR 75 0.840 8.132-211.524 40.980 -99.200 -91.000 TYR 82 0.840 7.862-207.213 40.560 -99.200 -91.000 HIS 94 0.900 7.404-189.892 38.236 -99.200 -91.000 TYR 97 0.840 3.687-189.964 28.405 -99.200 -91.000 TYR 101 0.840 4.597-185.842 26.015 -99.200 -91.000 TYR 104 0.840 1.752-190.186 37.281 -99.200 -91.000 PHE 130 1.000 16.327-206.802 34.024 -99.200 -91.000 HIS 139 0.900 -8.781-195.995 32.727 -99.200 -91.000 PHE 142 1.000 -7.465-189.317 24.689 -99.200 -91.000 PHE 145 1.000 -10.671-200.211 33.316 -99.200 -91.000 TYR 148 0.840 -0.475-203.961 26.694 -99.200 -91.000 TYR 156 0.840 5.385-204.583 24.101 -99.200 -91.000 PHE 157 1.000 3.621-212.022 24.222 -99.200 -91.000 TRP 159 1.040 -1.485-212.325 27.297 -99.200 -91.000 TRP6 159 1.020 -1.934-214.423 26.312 -99.200 -91.000 PHE 174 1.000 -11.077-222.394 36.755 -99.200 -91.000 TRP 179 1.040 -11.986-212.845 29.986 -99.200 -91.000 TRP6 179 1.020 -12.546-212.169 27.793 -99.200 -91.000 HIS 190 0.900 -16.295-216.315 42.650 -99.200 -91.000 PHE 204 1.000 -6.602-219.307 47.587 -99.200 -91.000 TYR 223 0.840 -4.136-183.589 45.742 -99.200 -91.000 PHE 234 1.000 -1.793-200.692 42.350 -99.200 -91.000