============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. TYR 39 0.840 30.821 87.208 -1.343 -99.200 -91.000 TYR 40 0.840 35.384 88.328 -0.512 -99.200 -91.000 PHE 41 1.000 39.439 87.582 -5.152 -99.200 -91.000 HIS 79 0.900 60.371 105.657 -8.133 -99.200 -91.000 TYR 87 0.840 59.897 95.891 -10.757 -99.200 -91.000 TYR 88 0.840 63.301 90.368 -1.701 -99.200 -91.000 TYR 90 0.840 54.041 93.168 -4.027 -99.200 -91.000 TYR 92 0.840 53.146 88.847 -8.286 -99.200 -91.000 TYR 115 0.840 45.912 100.169 -11.990 -99.200 -91.000 HIS 120 0.900 55.226 105.430 -18.533 -99.200 -91.000 TYR 123 0.840 60.229 106.857 -13.411 -99.200 -91.000 PHE 126 1.000 59.836 110.340 -8.484 -99.200 -91.000 PHE 136 1.000 68.051 114.210 -10.565 -99.200 -91.000 PHE 144 1.000 66.098 107.808 -14.828 -99.200 -91.000 TYR 145 0.840 57.976 103.147 -16.114 -99.200 -91.000 PHE 146 1.000 59.557 102.097 -20.932 -99.200 -91.000 PHE 155 1.000 70.499 90.131 -8.171 -99.200 -91.000 PHE 156 1.000 65.350 91.967 -6.757 -99.200 -91.000 HIS 164 0.900 64.840 75.829 -12.056 -99.200 -91.000 PHE 166 1.000 74.760 80.487 -13.175 -99.200 -91.000 TYR 179 0.840 70.138 94.476 -9.205 -99.200 -91.000 HIS 182 0.900 75.349 97.217 -9.538 -99.200 -91.000 PHE 186 1.000 75.427 101.872 -13.920 -99.200 -91.000