============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. PHE 8 1.000 4.625 -6.258 2.043 -99.200 -91.000 PHE 11 1.000 5.584 0.139 10.329 -99.200 -91.000 HIS 14 0.900 5.494 13.067 13.019 -99.200 -91.000 HIS 22 0.900 18.374 16.916 21.547 -99.200 -91.000 PHE 24 1.000 13.006 12.335 19.795 -99.200 -91.000 TYR 35 0.840 -3.281 -12.319 9.000 -99.200 -91.000 PHE 53 1.000 17.230 10.380 22.916 -99.200 -91.000 TRP 55 1.040 17.080 3.610 17.530 -99.200 -91.000 TRP6 55 1.020 16.260 5.481 16.347 -99.200 -91.000 PHE 62 1.000 10.576 4.755 16.144 -99.200 -91.000