============================================================================= 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 7 1.000 19.709 33.080 56.427 -99.200 -91.000 TYR 8 0.840 16.703 37.077 56.366 -99.200 -91.000 HIS 41 0.900 9.535 33.716 44.860 -99.200 -91.000 PHE 42 1.000 6.100 32.006 36.340 -99.200 -91.000 HIS 43 0.900 8.048 36.310 34.298 -99.200 -91.000 PHE 46 1.000 8.992 28.282 36.155 -99.200 -91.000 PHE 78 1.000 11.288 44.919 37.495 -99.200 -91.000 TRP 118 1.040 3.911 30.617 51.391 -99.200 -91.000 TRP6 118 1.020 2.428 31.752 49.960 -99.200 -91.000 PHE 151 1.000 11.087 19.983 28.404 -99.200 -91.000 PHE 153 1.000 4.817 25.598 35.675 -99.200 -91.000 HIS 170 0.900 -1.957 33.395 34.953 -99.200 -91.000 PHE 172 1.000 -2.888 38.206 43.086 -99.200 -91.000 PHE 180 1.000 -6.565 39.136 25.978 -99.200 -91.000 PHE 185 1.000 -10.609 39.971 16.276 -99.200 -91.000 PHE 187 1.000 -6.965 28.915 18.966 -99.200 -91.000 PHE 229 1.000 -4.137 33.589 45.545 -99.200 -91.000 TYR 233 0.840 -6.788 30.395 36.696 -99.200 -91.000 PHE 234 1.000 -7.630 26.950 39.978 -99.200 -91.000 PHE 251 1.000 -13.415 22.407 32.879 -99.200 -91.000 PHE 265 1.000 -6.199 22.922 43.063 -99.200 -91.000 PHE 272 1.000 -6.009 28.280 44.290 -99.200 -91.000 PHE 273 1.000 -7.349 30.438 49.326 -99.200 -91.000 PHE 276 1.000 -0.669 30.358 44.959 -99.200 -91.000