============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 16 1.000 6.252 -5.716 -24.268 -99.200 -91.000 TYR 17 0.840 5.333 -2.455 -32.442 -99.200 -91.000 PHE 28 1.000 10.434 11.120 -27.533 -99.200 -91.000 TYR 44 0.840 5.776 8.597 -24.869 -99.200 -91.000 PHE 53 1.000 13.277 -0.677 -18.130 -99.200 -91.000 HIS 56 0.900 17.609 -0.333 -11.518 -99.200 -91.000 PHE 60 1.000 13.767 -5.514 -11.307 -99.200 -91.000 TYR 63 0.840 14.173 -12.046 -6.947 -99.200 -91.000 TYR 64 0.840 12.485 -15.206 -15.356 -99.200 -91.000 TYR 87 0.840 9.740 19.023 -12.257 -99.200 -91.000 TYR 90 0.840 10.257 6.864 -15.935 -99.200 -91.000 TYR 91 0.840 6.728 4.428 -8.060 -99.200 -91.000 PHE 102 1.000 2.778 -8.884 -14.099 -99.200 -91.000 PHE 128 1.000 11.943 -3.342 -22.965 -99.200 -91.000 PHE 139 1.000 20.509 5.797 -33.518 -99.200 -91.000