============================================================================= 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. TRP 3 1.040 8.455 20.000 32.838 -99.200 -91.000 TRP6 3 1.020 8.647 22.256 32.211 -99.200 -91.000 PHE 5 1.000 14.196 15.260 24.550 -99.200 -91.000 PHE 22 1.000 10.305 12.929 16.873 -99.200 -91.000 TYR 25 0.840 12.056 6.554 14.180 -99.200 -91.000 TYR 28 0.840 20.604 3.076 20.638 -99.200 -91.000 HIS 48 0.900 17.929 12.782 25.060 -99.200 -91.000 TYR 52 0.840 18.550 12.631 29.432 -99.200 -91.000 TYR 69 0.840 15.734 8.792 32.397 -99.200 -91.000 TYR 73 0.840 15.978 21.276 30.840 -99.200 -91.000 TYR 75 0.840 12.088 24.725 27.065 -99.200 -91.000 PHE 94 1.000 26.537 17.082 30.354 -99.200 -91.000 PHE 106 1.000 14.733 13.569 18.729 -99.200 -91.000 TYR 111 0.840 8.800 9.740 12.282 -99.200 -91.000 HIS 115 0.900 14.017 2.330 10.516 -99.200 -91.000