============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. TRP 2 1.040 5.858 5.347 -33.638 -99.200 -91.000 TRP6 2 1.020 5.467 3.460 -32.262 -99.200 -91.000 PHE 5 1.000 2.896 3.208 -26.883 -99.200 -91.000 HIS 9 0.900 4.104 2.936 -22.202 -99.200 -91.000 PHE 27 1.000 9.202 6.085 -18.016 -99.200 -91.000 HIS 28 0.900 4.899 11.277 -13.886 -99.200 -91.000 PHE 35 1.000 9.835 0.859 -18.784 -99.200 -91.000 TYR 37 0.840 13.448 -7.990 -24.723 -99.200 -91.000 PHE 62 1.000 3.082 -7.055 -28.797 -99.200 -91.000 TYR 63 0.840 9.904 -10.619 -21.385 -99.200 -91.000 TYR 76 0.840 9.182 2.442 -9.413 -99.200 -91.000 PHE 85 1.000 0.771 -3.764 -25.550 -99.200 -91.000 HIS 96 0.900 -3.197 7.186 -22.584 -99.200 -91.000 PHE 97 1.000 0.524 -0.061 -21.651 -99.200 -91.000