Table S7.

Cluster analysis of the AMC NMR ensemble calculated in H₂O/D₂O

Cluster	Model numbers*	Representative structure#
1	2-4-5-6-7-10-11-12-13-14	2
2	9-15-16-17-18	17
3	1-3-8-19-20	8

Notes:

^*Numbers refer to CYANA¹ structures; lower numbers indicate better models in terms of experimental constraints violations.

^#Representative models were chosen by the software Chimera³ using the approach described in Kelley et al.⁶

Abbreviations: AMC, antimicrobial cyclic peptide; D₂O, deuterium oxide; NMR, nuclear magnetic resonance.