============================================================================= 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. PHE 5 1.000 6.140 3.112 16.461 -99.200 -91.000 PHE 12 1.000 20.634 7.122 6.262 -99.200 -91.000 HIS 23 0.900 28.885 28.327 -2.670 -99.200 -91.000 TYR 24 0.840 21.064 28.506 -0.742 -99.200 -91.000 PHE 25 1.000 25.929 24.046 1.941 -99.200 -91.000 PHE 36 1.000 17.593 -2.075 16.773 -99.200 -91.000 PHE 54 1.000 31.485 24.364 1.614 -99.200 -91.000 PHE 56 1.000 30.005 15.978 1.474 -99.200 -91.000 HIS 57 0.900 37.128 15.740 3.590 -99.200 -91.000