============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 33 0.840 25.147 -6.803 72.869 -99.200 -91.000 HIS 48 0.900 7.832 0.547 62.296 -99.200 -91.000 PHE 58 1.000 19.631 -9.922 67.854 -99.200 -91.000 PHE 86 1.000 42.564 2.551 79.455 -99.200 -91.000 TYR 133 0.840 45.901 -9.280 65.119 -99.200 -91.000 PHE 139 1.000 40.120 -2.479 58.694 -99.200 -91.000 PHE 152 1.000 37.711 21.554 61.773 -99.200 -91.000 HIS 172 0.900 40.182 9.049 66.391 -99.200 -91.000 PHE 189 1.000 46.261 24.177 53.691 -99.200 -91.000 PHE 229 1.000 36.989 1.747 58.424 -99.200 -91.000 TYR 248 0.840 46.118 3.038 66.050 -99.200 -91.000 TYR 255 0.840 56.973 6.487 60.197 -99.200 -91.000 PHE 258 1.000 48.085 -2.407 67.049 -99.200 -91.000 PHE 259 1.000 51.904 6.156 61.545 -99.200 -91.000 PHE 282 1.000 53.414 21.694 61.608 -99.200 -91.000 PHE 304 1.000 42.004 -3.492 80.311 -99.200 -91.000