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Table 2 Assignments of the 1 H-NMR signals for 2 (ppm)

From: T1BT* structural study of an anti-plasmodial peptide through NMR and molecular dynamics

Residue

NH

CαH

CβH

CγH

CδH

CεH

Ac

8.82

4.78

    

D1

8.37

4.80

3.05, 3.02

   

P2

 

3.81

2.37, 2.03

2.01

2.81, 2.78

 

N3

8.43

4.81

3.04

   

A4

8.03

4.23

1.46

   

N5

8.41

4.77

2.96, 2.88

   

P6

 

3.81

2.37, 2.03

2.01

2.81, 2.78

 

N7

8.41

4.77

2.96, 2.88

   

V8

8.05

4.11

1.96

0.95

  

D9

8.39

4.29

3.02, 2.88

   

P10

 

3.87

2.38, 2.11

2.05

2.99, 2.61

 

N11

8.45

4.75

2.91, 2.81

   

A12

7.92

4.34

1.47

   

N13

8.37

5.08

2.98

   

P14

 

3.75

2.38, 2.10

2.05

2.95

 

N15

8.33

4.75

2.93, 2.92

   

V16

7.86

4.19

2.18

0.99

  

N17

8.54

5.07

2.97, 2.82

   

P18

 

3.50

2.38, 2.11

2.01

2.52, 2.51

 

N19

8.22

4.74

2.92, 2.81

   

A20

8.05

4.35

1.46

   

N21

8.35

5.04

2.92, 2.77

   

P22

 

3.51

2.38, 2.10

2.03

2.58

 

N23

8.36

4.75

2.93, 2.91

   

A24

8.01

4.35

1.46

   

N25

8.41

4.81

2.96, 2.88

   

P26

 

3.47

2.39, 2.10

2.01

2.52

 

N27

8.18

4.74

2.92, 2.79

   

A28

7.97

4.34

1.46

   

E29

8.27

4.26

2.76, 2.75

2.91, 2.90

  

Y30

8.05

4.53

3.21, 3.11

   

L31

8.01

4.21

1.78, 1.76

1.63

1.01, 1.00

 

N32

8.27

4.64

2.93, 2.77

   

K33

8.11

4.30

1.69, 1.68

1.61

1.48, 1.45

1.79, 1.77

I34

8.25

4.32

1.30

1.05

1.01

 

Q35

7.85

4.61

3.15, 3.11

3.05

  

N36

8.43

4.82

3.04

   

S37

8.39

4.54

3.93

   

L38

8.25

4.46

1.81

1.69

1.02

 

S39

8.26

4.49

4.02, 3.97

   

T40

8.15

4.64

2.92

1.45

  

E41

8.33

4.56

2.82, 2.81

3.01, 2.98

  

W42

8.16

4.56

3.37, 3.28

   

S43

8.24

4.50

4.02, 3.96

   

P44

 

3.91

2.38, 2.11

2.06

2.85, 2.82

 

C45

8.16

4.73

3.38, 3.28

   

S46

8.24

4.50

4.02, 3.96

   

V47

8.08

4.43

1.27

1.05, 1.04

  

T48

8.21

4.64

2.01

1.29

  
  1. Description: The data provided represents the assignments of the proton signals derivated form 2.