Thesis Title: Subtitle - NMR Spectroscopy Research Group

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60 Chapter 2. Possum: paramagnetically orchestrated spectral solver of unassigned methyls. Figure S2.5 Comparisons of calculated and experimental PCS in the cz- 186/ /Dy 3+ complex for methyl groups of (a) Met, (b) Ala, (c) Thr, (d) Val, (e) Leu, and (f) Ile. The distances rC-Ln are indicated in Å at the top of each plot. For residues with two methyl groups, the distance value shown at the top refers to the C 1 (Val), C 1 (Leu), or C 1 (Ile) atom.
Figure S2.5 continued 2.9 Supporting information. 61
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Computational study of proteins wit
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iii Schmitz C, Stanton-Cook MJ, Su
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v Acknowledgements I would like to
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vii Keywords paramagnetic nmr, pseu
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ix 2.3.3 Manual resonance assignmen
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xi List of Figures Figure 1.1 NMR e
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xiii
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xv List of Abbreviations α Subunit
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2 Chapter 1. Introduction. The scal
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4 Chapter 1. Introduction. In contr
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6 Chapter 1. Introduction. as the c
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8 Chapter 1. Introduction. Figure 1
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Page 28 and 29: 12 Chapter 1. Introduction. 1.3 Com
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Page 36 and 37: 20 Chapter 1. Introduction. The det
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Page 42 and 43: 26 Chapter 1. Introduction. Su XC,
Page 44 and 45: 28 Chapter 2. Possum: paramagnetica
Page 91 and 92: Chapter 3 Numbat: new user-friendly
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Page 95 and 96: 3.5 Algorithm. 79 rhombic component
Page 97 and 98: 3.6 Program Features. 81 each fitti
Page 99 and 100: 3.6 Program Features. 83 A new PCS
Page 101 and 102: 3.6 Program Features. 85 Carlo prot
Page 103 and 104: 3.7 Study case. 87 The coordinates
Page 105 and 106: 3.7 Study case. 89 illustrates how
Page 107 and 108: 3.7 Study case. 91 can be used to a
Page 109 and 110: 3.9 Acknowledgment. 93 variables, t
Page 111 and 112: 3.10 References. 95 Galassi M, Davi
Page 113 and 114: 3.11 Supporting information. 97 Zwe
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Page 118 and 119: 102 Chapter 4. Protein Structure De
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110 Chapter 4. Protein Structure De
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Chapter 5 Conclusion and perspectiv
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5.1 The use of PCS for structure de
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5.1 The use of PCS for structure de
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5.3 The use of PCS for protein dock
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Thesis Title: Subtitle - NMR Spectroscopy Research Group

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