============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. HIS 32 0.900 8.441 -1.753 24.585 -99.200 -91.000 PHE 36 1.000 10.174 6.921 28.919 -99.200 -91.000 HIS 49 0.900 17.759 14.742 21.363 -99.200 -91.000 PHE 67 1.000 7.422 13.587 20.042 -99.200 -91.000 PHE 86 1.000 11.019 5.750 20.042 -99.200 -91.000 HIS 95 0.900 5.012 5.861 11.495 -99.200 -91.000 PHE 139 1.000 26.442 10.057 31.796 -99.200 -91.000 HIS 151 0.900 15.177 13.941 41.267 -99.200 -91.000 HIS 154 0.900 15.296 21.791 40.305 -99.200 -91.000