============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. PHE 2 1.000 43.758 24.643 2.187 -99.200 -91.000 PHE 5 1.000 51.345 26.792 -5.619 -99.200 -91.000 TYR 6 0.840 61.701 24.645 -5.418 -99.200 -91.000 TYR 23 0.840 59.067 38.671 9.643 -99.200 -91.000 PHE 26 1.000 60.108 31.937 6.000 -99.200 -91.000 HIS 27 0.900 54.087 40.234 7.991 -99.200 -91.000 PHE 51 1.000 69.878 33.712 3.895 -99.200 -91.000 PHE 58 1.000 56.260 20.882 -0.598 -99.200 -91.000