============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 2 1.000 56.545 27.487 23.968 -99.200 -91.000 PHE 51 1.000 44.297 28.602 22.452 -99.200 -91.000 TYR 79 0.840 46.024 17.475 23.068 -99.200 -91.000 TRP 101 1.040 64.660 20.663 0.287 -99.200 -91.000 TRP6 101 1.020 64.419 19.181 2.126 -99.200 -91.000 PHE 102 1.000 68.425 28.913 -2.160 -99.200 -91.000 TYR 121 0.840 65.189 13.524 10.358 -99.200 -91.000 TYR 122 0.840 65.518 15.153 5.634 -99.200 -91.000 PHE 233 1.000 65.577 36.123 5.899 -99.200 -91.000 HIS 261 0.900 45.482 34.154 13.450 -99.200 -91.000 TYR 268 0.840 58.640 22.209 6.246 -99.200 -91.000 PHE 269 1.000 63.340 18.621 10.222 -99.200 -91.000 PHE 282 1.000 56.283 21.991 16.391 -99.200 -91.000 TYR 283 0.840 57.002 14.332 15.796 -99.200 -91.000