============================================================================= 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. TYR 24 0.840 29.107 10.675 -38.542 -99.200 -91.000 TYR 26 0.840 29.772 16.660 -37.060 -99.200 -91.000 TYR 57 0.840 18.905 20.277 -42.889 -99.200 -91.000 PHE 78 1.000 13.941 5.521 -53.093 -99.200 -91.000 TRP 83 1.040 15.474 3.430 -58.345 -99.200 -91.000 TRP6 83 1.020 17.137 2.777 -56.796 -99.200 -91.000 HIS 95 0.900 22.262 20.631 -26.758 -99.200 -91.000 PHE 104 1.000 25.752 11.031 -34.248 -99.200 -91.000 TRP 110 1.040 26.348 -5.067 -36.000 -99.200 -91.000 TRP6 110 1.020 28.619 -4.556 -36.438 -99.200 -91.000 TYR 111 0.840 27.655 -6.878 -41.244 -99.200 -91.000