============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 37 1.000 57.705 12.970 19.769 -99.200 -91.000 TYR 77 0.840 58.388 -1.106 3.506 -99.200 -91.000 PHE 84 1.000 55.889 19.791 6.026 -99.200 -91.000 PHE 115 1.000 48.014 18.890 20.082 -99.200 -91.000 HIS 136 0.900 41.986 24.485 25.962 -99.200 -91.000 PHE 147 1.000 58.690 13.122 24.629 -99.200 -91.000 PHE 151 1.000 60.116 19.378 30.888 -99.200 -91.000 TYR 158 0.840 52.084 25.410 27.005 -99.200 -91.000 PHE 162 1.000 50.060 20.414 24.857 -99.200 -91.000 TYR 181 0.840 84.486 34.885 58.276 -99.200 -91.000 HIS 187 0.900 91.996 45.000 52.461 -99.200 -91.000 TYR 189 0.840 89.245 42.728 43.021 -99.200 -91.000 TYR 196 0.840 90.822 30.731 42.479 -99.200 -91.000 PHE 204 1.000 77.355 31.729 41.937 -99.200 -91.000 HIS 223 0.900 93.312 32.100 38.109 -99.200 -91.000 PHE 239 1.000 83.049 26.197 34.926 -99.200 -91.000 TYR 269 0.840 76.344 30.329 51.582 -99.200 -91.000 HIS 271 0.900 68.192 27.253 44.672 -99.200 -91.000 PHE 283 1.000 87.349 36.847 49.122 -99.200 -91.000 HIS 285 0.900 82.814 47.000 52.833 -99.200 -91.000 TRP 290 1.040 83.206 42.347 58.664 -99.200 -91.000 TRP6 290 1.020 84.487 41.963 60.617 -99.200 -91.000 TYR 299 0.840 67.222 30.262 56.296 -99.200 -91.000 PHE 300 1.000 70.891 27.983 54.419 -99.200 -91.000