============================================================================= 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 17 0.840 30.284 -14.624 24.166 -99.200 -91.000 PHE 30 1.000 39.436 -17.888 22.745 -99.200 -91.000 HIS 49 0.900 32.334 -15.242 12.933 -99.200 -91.000 TYR 53 0.840 26.446 -5.514 14.617 -99.200 -91.000 TYR 64 0.840 51.473 -23.651 26.163 -99.200 -91.000 HIS 103 0.900 57.325 -18.970 24.677 -99.200 -91.000 TYR 106 0.840 52.173 -16.286 33.802 -99.200 -91.000 HIS 121 0.900 52.082 -29.405 41.866 -99.200 -91.000 TYR 123 0.840 53.093 -19.882 46.228 -99.200 -91.000 PHE 136 1.000 35.553 -18.810 38.773 -99.200 -91.000 PHE 145 1.000 25.248 -18.349 50.907 -99.200 -91.000 TYR 147 0.840 18.698 -19.336 41.375 -99.200 -91.000 PHE 153 1.000 16.218 -14.345 53.200 -99.200 -91.000 HIS 168 0.900 34.569 -24.452 43.192 -99.200 -91.000 PHE 176 1.000 24.050 -19.926 55.654 -99.200 -91.000 PHE 188 1.000 20.318 -16.748 57.006 -99.200 -91.000 TRP 216 1.040 24.982 -20.699 30.260 -99.200 -91.000 TRP6 216 1.020 26.254 -20.656 28.249 -99.200 -91.000 HIS 224 0.900 32.568 -9.889 39.313 -99.200 -91.000 HIS 231 0.900 38.374 -2.003 32.652 -99.200 -91.000 PHE 247 1.000 40.245 -15.160 56.839 -99.200 -91.000 HIS 249 0.900 43.414 -21.782 59.723 -99.200 -91.000 PHE 254 1.000 41.567 -21.386 53.802 -99.200 -91.000 TRP 271 1.040 35.283 -10.352 54.561 -99.200 -91.000 TRP6 271 1.020 33.632 -11.440 53.250 -99.200 -91.000 TYR 276 0.840 28.307 -23.707 61.596 -99.200 -91.000 TYR 292 0.840 50.844 -28.817 47.462 -99.200 -91.000