============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 1 0.900 -13.344 16.848 -41.798 -99.200 -91.000 PHE 4 1.000 -4.852 15.229 -35.244 -99.200 -91.000 PHE 5 1.000 -3.586 6.297 -41.296 -99.200 -91.000 TYR 22 0.840 -23.496 -12.145 -26.992 -99.200 -91.000 PHE 30 1.000 -8.856 -11.953 -31.495 -99.200 -91.000 PHE 40 1.000 2.379 -12.562 -25.159 -99.200 -91.000 PHE 41 1.000 0.870 -5.884 -30.151 -99.200 -91.000 PHE 46 1.000 -16.288 -2.976 -30.000 -99.200 -91.000 PHE 52 1.000 -13.845 -14.278 -38.764 -99.200 -91.000 TYR 56 0.840 -16.746 -19.016 -38.705 -99.200 -91.000 PHE 87 1.000 -9.796 -18.209 -39.157 -99.200 -91.000