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Here, we show that stretched poly(vinyl acetate) can be used for the partial alignment of a linear <jats:italic>\u03b2<\/jats:italic>\u2010peptide with proteinogenic side chains in methanol. <jats:sup>1<\/jats:sup>D<jats:sub>CH<\/jats:sub>, <jats:sup>1<\/jats:sup>D<jats:sub>NH<\/jats:sub>, and <jats:sup>2<\/jats:sup>D<jats:sub>HH<\/jats:sub> RDCs were collected with this sample and included as restraints in a simulated annealing calculation. Incorporation of RDCs in the structure calculation process improves the long\u2010range definition in the backbone of the resulting 3<jats:sub>14<\/jats:sub>\u2010helix and uncovers side\u2010chain mobility. Experimental side\u2010chain RDCs of the central leucine and valine residues are in good agreement with predicted values from a local three\u2010state model. Copyright \u00a9 2016 John Wiley &amp; Sons, Ltd.<\/jats:p>","DOI":"10.1002\/mrc.4569","type":"journal-article","created":{"date-parts":[[2016,12,17]],"date-time":"2016-12-17T02:38:52Z","timestamp":1481942332000},"page":"655-661","source":"Crossref","is-referenced-by-count":11,"title":["<scp>RDC<\/scp>\u2010enhanced structure calculation of a <i>\u03b2<\/i>\u2010heptapeptide in methanol"],"prefix":"10.1002","volume":"55","author":[{"given":"Carla","family":"Rigling","sequence":"first","affiliation":[{"name":"Laboratorium f\u00fcr Organische Chemie ETH Z\u00fcrich  Vladimir\u2010Prelog\u2010Weg 3 8093 Z\u00fcrich Switzerland"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Marc\u2010Olivier","family":"Ebert","sequence":"additional","affiliation":[{"name":"Laboratorium f\u00fcr Organische Chemie ETH Z\u00fcrich  Vladimir\u2010Prelog\u2010Weg 3 8093 Z\u00fcrich Switzerland"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2017,2,2]]},"reference":[{"key":"e_1_2_5_2_1","doi-asserted-by":"publisher","DOI":"10.1016\/S0076-6879(01)39313-8"},{"key":"e_1_2_5_2_2","doi-asserted-by":"publisher","DOI":"10.1146\/annurev.biophys.33.110502.140306"},{"key":"e_1_2_5_2_3","doi-asserted-by":"publisher","DOI":"10.1021\/cr030419i"},{"key":"e_1_2_5_2_4","doi-asserted-by":"publisher","DOI":"10.1016\/j.pnmrs.2004.11.002"},{"key":"e_1_2_5_3_1","doi-asserted-by":"publisher","DOI":"10.1002\/ejoc.200800686"},{"key":"e_1_2_5_3_2","doi-asserted-by":"publisher","DOI":"10.1016\/j.trac.2008.11.016"},{"key":"e_1_2_5_3_3","doi-asserted-by":"publisher","DOI":"10.1016\/S0066-4103(09)06804-5"},{"key":"e_1_2_5_3_4","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201101561"},{"key":"e_1_2_5_4_1","doi-asserted-by":"publisher","DOI":"10.1002\/anie.200902398"},{"key":"e_1_2_5_4_2","doi-asserted-by":"crossref","first-page":"279","DOI":"10.1002\/9783527664610.ch8","volume-title":"Structure Elucidation in Organic Chemistry: The Search for the Right Tools","author":"Gil R. 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