============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 21 0.840 74.186 -25.749 26.902 -99.200 -91.000 PHE 34 1.000 76.278 -16.957 8.250 -99.200 -91.000 HIS 50 0.900 85.238 -29.295 23.690 -99.200 -91.000 PHE 55 1.000 73.907 -31.381 27.972 -99.200 -91.000 TYR 67 0.840 74.378 -16.460 4.760 -99.200 -91.000 PHE 95 1.000 64.899 2.422 5.818 -99.200 -91.000 TYR 111 0.840 74.677 -21.747 -0.523 -99.200 -91.000 PHE 116 1.000 58.479 -23.159 10.464 -99.200 -91.000 HIS 130 0.900 62.860 -6.497 4.051 -99.200 -91.000 PHE 131 1.000 63.945 -14.850 5.409 -99.200 -91.000 HIS 139 0.900 50.940 -17.699 2.958 -99.200 -91.000 PHE 154 1.000 48.005 -13.712 29.605 -99.200 -91.000 PHE 157 1.000 54.585 -12.626 34.489 -99.200 -91.000 HIS 161 0.900 45.955 -14.570 41.671 -99.200 -91.000 PHE 162 1.000 43.831 -18.340 39.182 -99.200 -91.000 HIS 177 0.900 56.552 -3.515 18.615 -99.200 -91.000 PHE 197 1.000 40.104 -20.197 38.133 -99.200 -91.000 HIS 214 0.900 54.899 -9.534 36.079 -99.200 -91.000 TRP 219 1.040 59.992 -5.118 27.320 -99.200 -91.000 TRP6 219 1.020 61.870 -3.683 27.316 -99.200 -91.000 TYR 232 0.840 71.152 -14.769 28.084 -99.200 -91.000 PHE 233 1.000 70.051 -18.368 30.549 -99.200 -91.000 TYR 246 0.840 59.152 -27.530 9.246 -99.200 -91.000 PHE 259 1.000 50.006 -13.730 4.027 -99.200 -91.000 HIS 263 0.900 41.440 -17.864 10.425 -99.200 -91.000 TYR 264 0.840 42.812 -13.581 15.289 -99.200 -91.000 TYR 270 0.840 54.501 -13.038 7.540 -99.200 -91.000