S.N.

SASA

Binding Site

Catalytic Site

Val

Ile

Asp

Thr

Gly

Substituent-X

SASA_r =

17.28

SASA_r =

24.16

SASA_r =

20.69

SASA_r =

15.66

SASA_r =

0

SASA_H

SASA_X

ΔSASA_dr

ΔSASA_dr

ΔSASA_dr

ΔSASA_dr

ΔSASA_dr

36

204.14

173.54

30.60

13.32

6.44

9.91

14.94

-----

37

196.90

173.54

23.36

6.08

0.80

2.67

7.70

-----

38

210.24

173.54

36.70

19.42

12.54

16.01

21.04

-----

39

209.14

173.54

35.60

18.32

11.44

14.91

19.94

-----

40

200.29

173.54

26.75

9.47

2.590

6.06

11.09

-----

41

238.92

173.54

65.38

48.10

41.22

44.69

49.72

-----

42

236.15

173.54

62.61

45.33

38.45

41.92

46.95

-----

43

196.47

173.54

22.93

5.65

1.230

2.24

7.27

-----

44

211.99

173.54

38.45

21.17

14.29

17.76

22.79

-----

45

240.08

173.54

66.54

49.26

42.38

45.85

50.88

-----

46

230.73

173.54

57.19

39.91

33.03

36.50

41.53

-----

47

199.90

173.54

26.36

9.08

2.200

5.67

10.70

-----

48

209.20

173.54

35.66

18.38

11.50

14.97

20.00

-----

49

215.38

173.54

41.84

24.56

17.68

21.15

26.18

-----

50

209.80

173.54

36.26

18.98

12.10

15.57

20.60

-----

51

207.86

173.54

34.32

17.04

10.16

13.63

18.66

-----