Secondary structure calculation program - copyright by David Keith Smith, 1989
1qf9A.pdb
1QF9 KINASE MOL_ID: 1; MOL_ID: 1;
Sequence length - 194
A A K K hydrogen bonding Ooi's
strk chain/ l amino u & S structure bridge dihedral angles donor acceptor donor acceptor N N
num seq.no t acids t S + patterns partners phi psi omega alpha kappa tco to/energy fr/energy to/energy fr/energy 8 14
1 A 1 MET M 0 0 999.9 -32.8 129.8 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 6
2 A 2 GLU E - 0 0 -52.6 146.3 180.0 -96.1 999.9 123.8 0 0.0 0 0.0 0 0.0 0 0.0 3 8
3 A 3 LYS K - 0 0 -82.1 128.6 177.2 -121.4 35.8 132.7 0 0.0 0 0.0 0 0.0 0 0.0 5 16
4 A 4 SER S - 0 0 -65.0 136.6 170.6 -118.9 25.6 112.7 0 0.0 0 0.0 0 0.0 0 0.0 5 22
5 A 5 LYS K - 0 0 -70.1 150.7 -175.7 -87.6 44.6 117.7 0 0.0 0 0.0 0 0.0 0 0.0 8 29
6 A 6 PRO P e - 0 0 -62.9 143.8 159.0 -125.5 31.4 110.6 0 0.0 110 -2.8 0 0.0 0 0.0 12 39
7 A 7 ASN N E E Aa - 110 0 -74.9 136.5 176.0 -160.8 29.6 136.6 0 0.0 86 -2.7 0 0.0 0 0.0 11 45
8 A 8 VAL V E E Aab - 111 86 -124.1 132.5 166.9 -169.7 13.1 169.7 110 -2.3 112 -3.3 0 0.0 113 -0.6 13 61
9 A 9 VAL V E E Aab - 113 87 -115.2 119.7 167.1 -142.6 17.8 176.8 86 -2.3 88 -2.4 0 0.0 0 0.0 12 67
10 A 10 PHE F E E Aab - 114 88 -71.7 131.7 179.4 -154.4 13.6 136.0 113 -1.7 115 -3.5 0 0.0 12 -0.6 14 68
11 A 11 VAL V E E Aab + 115 89 -116.6 110.5 -171.8 167.8 23.5 161.8 88 -2.8 90 -3.1 0 0.0 0 0.0 14 71
12 A 12 LEU L E E Aa + 116 0 -127.9 174.9 -158.3 123.7 11.3 136.8 115 -2.8 117 -2.6 10 -0.6 0 0.0 14 65
13 A 13 GLY G E E Aa - 117 0 146.1 157.0 176.2 -60.9 59.9 144.2 0 0.0 0 0.0 0 0.0 0 0.0 13 66
14 A 14 GLY G S e > TS- 0 0 -62.8 172.0 171.1 -63.2 75.9 95.4 117 -0.6 17 -1.9 0 0.0 0 0.0 12 64
15 A 15 PRO P T T 3 TS+ 0 0 -55.8 120.8 176.7 4.6 125.5 113.0 0 0.0 0 0.0 0 0.0 0 0.0 10 67
16 A 16 GLY G T T 3 TS+ 0 0 77.3 15.7 178.3 134.7 84.2 48.6 0 0.0 0 0.0 0 0.0 0 0.0 10 61
17 A 17 SER S S t < TS- 0 0 -72.6 -12.7 170.9 -98.4 82.8 50.4 14 -1.9 0 0.0 0 0.0 0 0.0 11 55
18 A 18 GLY G S h > TS+ 0 0 107.7 28.0 -177.6 140.9 76.5 45.8 0 0.0 22 -2.2 0 0.0 0 0.0 9 56
19 A 19 LYS K H H > TS+ 0 0 -66.2 -48.7 179.0 43.0 78.3 18.6 0 0.0 23 -2.5 0 0.0 0 0.0 13 59
20 A 20 GLY G H H > TS+ 0 0 -64.2 -41.4 178.4 53.7 112.9 21.6 0 0.0 24 -2.0 0 0.0 0 0.0 8 49
21 A 21 THR T H H > TS+ 0 0 -59.0 -46.0 -178.3 39.9 114.6 24.0 0 0.0 25 -1.1 0 0.0 0 0.0 7 51
22 A 22 GLN Q H H X TS+ 0 0 -76.9 -32.3 177.3 59.6 109.8 32.1 18 -2.2 26 -1.8 0 0.0 0 0.0 11 57
23 A 23 CYS C H H X TS+ 0 0 -63.3 -35.6 175.7 56.1 100.7 27.2 19 -2.5 27 -2.5 0 0.0 0 0.0 11 53
24 A 24 ALA A H H X TS+ 0 0 -62.7 -38.7 175.6 50.7 106.4 24.4 20 -2.0 28 -2.3 0 0.0 0 0.0 9 36
25 A 25 ASN N H H X TS+ 0 0 -64.0 -40.6 -179.6 49.8 110.0 25.5 21 -1.1 29 -2.4 0 0.0 0 0.0 9 37
26 A 26 ILE I H H X TS+ 0 0 -67.9 -41.2 172.3 51.3 109.0 27.7 22 -1.8 30 -2.1 0 0.0 32 -0.6 12 47
27 A 27 VAL V H H X TS+ 0 0 -55.1 -45.7 -176.7 49.1 112.3 18.2 23 -2.5 31 -1.7 0 0.0 0 0.0 11 34
28 A 28 ARG R H H < TS+ 0 0 -62.5 -47.0 -168.5 29.5 122.0 23.6 24 -2.3 0 0.0 0 0.0 0 0.0 8 27
29 A 29 ASP D H H < TS+ 0 0 -94.5 -17.6 -171.8 27.0 133.3 52.7 25 -2.4 0 0.0 0 0.0 0 0.0 6 29
30 A 30 PHE F H H < TS- 0 0 -125.6 -15.1 175.4 -125.8 93.6 62.3 26 -2.1 0 0.0 0 0.0 0 0.0 7 33
31 A 31 GLY G h < T + 0 0 70.9 26.2 166.0 149.3 54.2 42.3 27 -1.7 0 0.0 0 0.0 0 0.0 7 30
32 A 32 TRP W - 0 0 -76.5 161.5 176.5 -109.9 51.3 119.5 26 -0.6 0 0.0 0 0.0 0 0.0 11 44
33 A 33 VAL V E E Ac - 86 0 -97.2 127.0 -176.2 -139.8 27.2 144.4 85 -3.2 87 -2.8 0 0.0 35 -0.7 9 46
34 A 34 HIS H E E Ac - 87 0 -93.5 114.9 174.2 -177.5 19.6 143.9 0 0.0 36 -0.6 0 0.0 0 0.0 11 49
35 A 35 LEU L E E Ac - 88 0 -112.2 100.1 173.0 -168.7 5.4 152.4 87 -3.0 89 -3.1 33 -0.7 37 -0.7 12 53
36 A 36 SER S E E >Ac T - 89 0 -85.6 113.3 -178.8 -156.0 11.0 142.2 34 -0.6 40 -2.7 0 0.0 0 0.0 12 56
37 A 37 ALA A H H > TS+ 0 0 -57.7 -37.2 177.6 52.7 95.2 26.7 89 -2.6 41 -2.3 35 -0.7 0 0.0 13 58
38 A 38 GLY G H H > TS+ 0 0 -65.6 -44.1 172.2 46.7 110.3 23.6 0 0.0 42 -2.4 0 0.0 0 0.0 7 64
39 A 39 ASP D H H > TS+ 0 0 -58.5 -47.3 179.9 51.7 111.4 24.2 0 0.0 43 -2.7 0 0.0 0 0.0 8 49
40 A 40 LEU L H H X TS+ 0 0 -59.6 -39.5 -180.0 48.2 111.1 25.6 36 -2.7 44 -2.0 0 0.0 0 0.0 12 45
41 A 41 LEU L H H X TS+ 0 0 -70.2 -41.1 173.7 50.3 110.3 25.2 37 -2.3 45 -1.9 0 0.0 0 0.0 11 51
42 A 42 ARG R H H X TS+ 0 0 -61.9 -40.1 170.2 50.6 111.4 26.5 38 -2.4 46 -1.3 0 0.0 0 0.0 10 44
43 A 43 GLN Q H H X TS+ 0 0 -56.0 -46.6 -170.0 53.5 107.4 24.0 39 -2.7 47 -0.9 0 0.0 0 0.0 8 34
44 A 44 GLU E H H < >TS+ 0 0 -67.5 -35.3 177.7 43.8 111.6 31.5 40 -2.0 49 -1.0 0 0.0 0 0.0 11 37
45 A 45 GLN Q H H < 5TS+ 0 0 -75.8 -23.0 -168.6 67.5 103.5 37.9 41 -1.9 0 0.0 0 0.0 0 0.0 13 31
46 A 46 GLN Q H H < 5TS+ 0 0 -88.4 -12.6 153.2 49.9 100.1 52.5 42 -1.3 0 0.0 0 0.0 0 0.0 8 24
47 A 47 SER S T h < 5TS- 0 0 -139.5 130.9 -80.2 -101.7 115.6 155.1 43 -0.9 49 -0.7 0 0.0 0 0.0 7 18
48 A 48 GLY G T T 5T + 0 0 -114.6 64.0 -152.2 160.4 55.4 123.2 0 0.0 0 0.0 0 0.0 0 0.0 7 17
49 A 49 SER S t > 3 TS+ 0 0 -92.3 3.2 -158.3 102.2 88.2 67.2 0 0.0 55 -2.4 0 0.0 0 0.0 9 29
52 A 52 GLY G H H > < TS+ 0 0 -70.3 -38.2 -174.0 39.7 82.5 34.2 49 -1.6 56 -1.8 0 0.0 0 0.0 12 30
53 A 53 GLU E H H > TS+ 0 0 -91.7 -19.0 159.4 56.5 112.5 43.6 0 0.0 57 -1.7 0 0.0 0 0.0 9 26
54 A 54 MET M H H > TS+ 0 0 -60.3 -53.0 -178.4 48.6 108.4 22.9 0 0.0 58 -2.6 0 0.0 0 0.0 7 31
55 A 55 ILE I H H X TS+ 0 0 -57.4 -42.6 177.8 52.0 110.4 19.9 51 -2.4 59 -3.0 0 0.0 0 0.0 12 39
56 A 56 ALA A H H X TS+ 0 0 -57.5 -47.0 -174.9 45.3 112.0 23.6 52 -1.8 60 -2.2 0 0.0 0 0.0 10 37
57 A 57 THR T H H X TS+ 0 0 -68.2 -44.5 -178.9 45.1 115.8 23.8 53 -1.7 61 -1.2 0 0.0 0 0.0 8 31
58 A 58 MET M H H < >TS+ 0 0 -68.7 -41.9 176.3 51.7 112.0 23.0 54 -2.6 63 -2.6 0 0.0 0 0.0 11 38
59 A 59 ILE I H H < >5TS+ 0 0 -59.3 -44.8 179.8 52.7 107.6 21.6 55 -3.0 62 -1.6 0 0.0 0 0.0 12 49
60 A 60 LYS K H H < 35TS+ 0 0 -61.7 -29.2 -178.2 44.0 114.1 34.0 56 -2.2 0 0.0 0 0.0 0 0.0 10 38
61 A 61 ASN N T h < 35TS- 0 0 -99.3 6.4 179.9 -115.2 113.4 70.0 57 -1.2 0 0.0 0 0.0 0 0.0 10 32
62 A 62 GLY G T T <5T + 0 0 66.0 25.0 177.0 147.6 65.7 44.5 59 -1.6 0 0.0 0 0.0 0 0.0 12 45
63 A 63 GLU E t > T - 0 0 -45.8 132.4 -167.3 -126.4 43.1 108.1 0 0.0 69 -1.6 0 0.0 70 -1.2 6 41
67 A 67 SER S H H > 3 TS+ 0 0 -66.2 -24.7 179.7 69.2 102.0 45.8 0 0.0 71 -3.1 0 0.0 0 0.0 9 41
68 A 68 ILE I H H > 3 TS+ 0 0 -63.8 -31.9 173.7 44.7 104.5 37.8 0 0.0 72 -0.7 0 0.0 0 0.0 7 36
69 A 69 VAL V H H > < TS+ 0 0 -69.4 -55.4 -169.9 40.5 118.7 14.3 66 -1.6 73 -1.9 0 0.0 0 0.0 9 45
70 A 70 THR T H H X TS+ 0 0 -68.7 -40.4 -178.5 48.1 115.6 31.3 66 -1.2 74 -2.2 0 0.0 0 0.0 12 53
71 A 71 VAL V H H X TS+ 0 0 -72.1 -32.9 172.1 53.9 109.8 29.3 67 -3.1 75 -2.9 0 0.0 0 0.0 12 51
72 A 72 LYS K H H X TS+ 0 0 -61.7 -43.2 178.3 49.2 109.1 25.0 68 -0.7 76 -2.4 0 0.0 0 0.0 8 44
73 A 73 LEU L H H X TS+ 0 0 -63.9 -43.2 175.4 45.1 114.2 24.0 69 -1.9 77 -1.6 0 0.0 0 0.0 11 46
74 A 74 LEU L H H X TS+ 0 0 -63.3 -45.7 -174.3 50.1 113.3 21.8 70 -2.2 78 -2.4 0 0.0 0 0.0 11 57
75 A 75 LYS K H H X TS+ 0 0 -66.1 -41.7 174.9 52.7 108.0 27.8 71 -2.9 79 -2.8 0 0.0 0 0.0 9 50
76 A 76 ASN N H H X TS+ 0 0 -55.4 -50.0 -177.6 45.4 111.8 21.6 72 -2.4 80 -1.6 0 0.0 0 0.0 8 33
77 A 77 ALA A H H < TS+ 0 0 -65.1 -42.1 177.3 49.8 113.5 24.2 73 -1.6 0 0.0 0 0.0 0 0.0 9 39
78 A 78 ILE I H H < > TS+ 0 0 -60.2 -44.6 -178.3 50.9 109.9 20.3 74 -2.4 81 -1.7 0 0.0 0 0.0 9 43
79 A 79 ASP D H H < 3 TS+ 0 0 -66.8 -26.9 177.8 56.1 106.4 38.3 75 -2.8 0 0.0 0 0.0 0 0.0 7 31
80 A 80 ALA A T h < 3 TS+ 0 0 -77.9 -10.0 -171.9 56.5 104.5 58.5 76 -1.6 0 0.0 0 0.0 0 0.0 6 22
81 A 81 ASN N S t X TS- 0 0 -128.2 60.2 175.2 -178.8 72.3 117.9 78 -1.7 84 -1.4 0 0.0 0 0.0 7 29
82 A 82 GLN Q T T 3 TS+ 0 0 -58.2 136.6 177.7 23.5 70.1 109.1 0 0.0 0 0.0 0 0.0 0 0.0 7 27
83 A 83 GLY G T T 3 TS+ 0 0 82.2 7.7 170.4 109.6 100.0 54.9 0 0.0 0 0.0 0 0.0 0 0.0 8 26
84 A 84 LYS K t < T - 0 0 -103.5 162.2 165.7 -130.0 62.4 138.8 81 -1.4 0 0.0 0 0.0 0 0.0 9 36
85 A 85 ASN N e - 0 0 -105.7 159.7 -163.1 -133.8 27.8 141.9 0 0.0 33 -3.2 0 0.0 0 0.0 9 47
86 A 86 PHE F E E Abc - 8 33 -130.2 126.5 161.1 -156.1 17.9 160.7 7 -2.7 9 -2.3 0 0.0 88 -0.8 13 60
87 A 87 LEU L E E Abc - 9 34 -87.4 103.8 177.4 -160.1 21.9 155.1 33 -2.8 35 -3.0 0 0.0 89 -0.8 14 60
88 A 88 VAL V E E Abc> T - 10 35 -91.8 107.1 -159.7 -159.0 15.6 145.2 9 -2.4 11 -2.8 86 -0.8 91 -0.5 13 62
89 A 89 ASP D E E Abc3 T + 11 36 -104.7 123.0 176.2 1.6 61.8 140.7 35 -3.1 37 -2.6 87 -0.8 0 0.0 14 60
90 A 90 GLY G T e 3 TS+ 0 0 78.2 26.9 -179.1 139.9 99.3 38.3 11 -3.1 0 0.0 0 0.0 0 0.0 13 65
91 A 91 PHE F t < T + 0 0 -155.9 138.8 -1.6 35.8 44.1 164.2 88 -0.5 0 0.0 0 0.0 0 0.0 12 70
92 A 92 PRO P + 0 0 -81.6 141.8 -178.3 161.0 63.3 60.3 0 0.0 0 0.0 0 0.0 0 0.0 11 70
93 A 93 ARG R + 0 0 -106.7 -9.2 163.7 14.3 66.8 56.8 0 0.0 0 0.0 0 0.0 0 0.0 13 60
94 A 94 ASN N S h > TS- 0 0 -147.8 -179.9 -178.6 -94.6 86.1 156.7 0 0.0 98 -1.9 0 0.0 0 0.0 11 46
95 A 95 GLU E H H > TS+ 0 0 -64.3 -36.3 173.0 55.5 122.6 30.8 0 0.0 99 -2.9 0 0.0 0 0.0 11 36
96 A 96 GLU E H H > TS+ 0 0 -60.0 -47.5 170.5 50.6 106.9 20.9 0 0.0 100 -2.7 0 0.0 0 0.0 7 35
97 A 97 ASN N H H > TS+ 0 0 -48.0 -52.2 -172.9 45.8 113.8 20.7 0 0.0 101 -2.2 0 0.0 0 0.0 12 49
98 A 98 ASN N H H X TS+ 0 0 -67.0 -43.0 178.9 47.1 113.4 25.0 94 -1.9 102 -2.5 0 0.0 0 0.0 12 51
99 A 99 ASN N H H X TS+ 0 0 -65.3 -40.4 -179.4 51.2 111.4 24.2 95 -2.9 103 -2.4 0 0.0 0 0.0 8 33
100 A 100 SER S H H X TS+ 0 0 -68.6 -34.5 169.0 51.0 110.3 28.2 96 -2.7 104 -1.7 0 0.0 0 0.0 11 33
101 A 101 TRP W H H X TS+ 0 0 -58.7 -56.8 -176.5 46.6 110.8 15.5 97 -2.2 105 -3.0 0 0.0 0 0.0 10 46
102 A 102 GLU E H H X TS+ 0 0 -58.0 -37.5 179.4 50.3 113.6 31.1 98 -2.5 106 -0.9 0 0.0 0 0.0 8 36
103 A 103 GLU E H H < TS+ 0 0 -65.3 -37.7 -166.8 27.2 123.9 29.6 99 -2.4 0 0.0 0 0.0 0 0.0 7 24
104 A 104 ASN N H H < TS+ 0 0 -98.5 -28.5 -154.8 25.7 131.9 44.3 100 -1.7 0 0.0 0 0.0 0 0.0 7 31
105 A 105 MET M H H X > TS+ 0 0 -123.3 -10.7 -154.6 102.0 83.9 60.4 101 -3.0 108 -1.8 0 0.0 109 -1.2 9 39
106 A 106 LYS K T h < 3 TS+ 0 0 -72.8 -32.5 179.9 40.9 86.7 43.9 102 -0.9 0 0.0 0 0.0 0 0.0 9 30
107 A 107 ASP D T T 4 3 TS+ 0 0 -85.8 -1.5 -163.4 51.7 117.6 65.7 0 0.0 0 0.0 0 0.0 0 0.0 5 22
108 A 108 PHE F T T 4 < TS+ 0 0 -121.3 -15.4 172.4 43.7 107.7 56.6 105 -1.8 0 0.0 0 0.0 0 0.0 7 34
109 A 109 VAL V t < T - 0 0 -129.1 151.2 161.6 -138.2 63.6 162.6 105 -1.2 111 -0.7 0 0.0 0 0.0 10 39
110 A 110 ASP D E E Aa - 7 0 -97.9 99.2 178.5 -159.9 25.9 155.4 6 -2.8 8 -2.3 0 0.0 0 0.0 10 34
111 A 111 THR T E E Aa - 8 0 -89.2 122.6 -148.3 -175.4 10.8 137.1 109 -0.7 0 0.0 0 0.0 0 0.0 8 49
112 A 112 LYS K E E A* - 0 0 -100.3 -54.8 170.8 -35.0 44.1 27.6 8 -3.3 0 0.0 0 0.0 0 0.0 8 47
113 A 113 PHE F E E Aa - 9 0 -157.1 170.1 164.5 -102.0 51.4 165.3 8 -0.6 10 -1.7 0 0.0 115 -0.5 10 48
114 A 114 VAL V E E Aad - 10 169 -93.0 123.9 166.2 -151.7 26.8 158.5 168 -3.5 170 -3.2 0 0.0 116 -0.7 13 53
115 A 115 LEU L E E Aad - 11 170 -91.3 114.9 -174.6 -165.9 18.8 154.6 10 -3.5 12 -2.8 113 -0.5 117 -0.6 12 64
116 A 116 PHE F E E Aad - 12 171 -111.8 118.5 172.8 -155.6 12.9 155.7 170 -2.9 172 -2.9 114 -0.7 118 -0.7 11 57
117 A 117 PHE F E E Aad - 13 172 -91.0 115.3 -175.8 -151.9 15.2 147.2 12 -2.6 14 -0.6 115 -0.6 0 0.0 15 57
118 A 118 ASP D E E A d + 0 173 -94.0 125.5 -175.8 158.0 26.5 139.0 172 -1.9 174 -3.0 116 -0.7 0 0.0 12 47
119 A 119 CYS C - 0 0 -146.4 143.6 170.4 -105.3 42.6 176.7 0 0.0 0 0.0 0 0.0 0 0.0 12 39
120 A 120 PRO P h > T - 0 0 -66.1 141.8 176.8 -126.9 28.6 117.0 0 0.0 124 -2.4 0 0.0 0 0.0 7 33
121 A 121 GLU E H H > TS+ 0 0 -52.5 -41.6 -174.6 56.9 109.2 28.5 0 0.0 125 -2.8 0 0.0 0 0.0 8 34
122 A 122 GLU E H H > TS+ 0 0 -66.4 -34.6 175.4 45.9 108.8 27.9 0 0.0 126 -1.6 0 0.0 0 0.0 6 29
123 A 123 VAL V H H > TS+ 0 0 -72.0 -43.6 175.6 51.2 112.1 20.6 0 0.0 127 -2.3 0 0.0 0 0.0 9 31
124 A 124 MET M H H X TS+ 0 0 -59.0 -40.6 -179.4 54.6 107.1 26.6 120 -2.4 128 -2.2 0 0.0 0 0.0 13 45
125 A 125 THR T H H X TS+ 0 0 -61.4 -42.3 -178.0 47.2 109.1 22.0 121 -2.8 129 -2.3 0 0.0 0 0.0 11 37
126 A 126 GLN Q H H X TS+ 0 0 -69.0 -42.5 173.7 49.4 112.1 22.0 122 -1.6 130 -2.4 0 0.0 0 0.0 8 34
127 A 127 ARG R H H X TS+ 0 0 -57.7 -42.8 -174.0 49.1 112.2 29.5 123 -2.3 131 -2.9 0 0.0 0 0.0 9 41
128 A 128 LEU L H H X TS+ 0 0 -73.6 -37.9 171.1 48.6 110.5 29.1 124 -2.2 132 -2.1 0 0.0 0 0.0 13 42
129 A 129 LEU L H H X TS+ 0 0 -63.0 -44.9 173.0 47.8 114.0 23.5 125 -2.3 133 -0.6 0 0.0 0 0.0 11 32
130 A 130 LYS K H H < > TS+ 0 0 -58.2 -49.3 176.8 48.8 112.5 17.6 126 -2.4 133 -1.5 0 0.0 0 0.0 8 25
131 A 131 ARG R H H X > TS+ 0 0 -57.5 -38.3 -176.3 64.4 101.9 29.4 127 -2.9 135 -2.1 0 0.0 134 -1.9 9 28
132 A 132 GLY G H H < 3 TS+ 0 0 -66.1 -14.4 174.9 75.4 84.3 48.2 128 -2.1 0 0.0 0 0.0 0 0.0 11 25
133 A 133 GLU E T h < < TS+ 0 0 -62.5 -25.5 -172.1 4.7 121.9 37.5 130 -1.5 0 0.0 129 -0.6 0 0.0 7 19
134 A 134 SER S T T 4 < TS+ 0 0 -139.0 -8.9 -171.3 86.3 109.0 61.9 131 -1.9 0 0.0 0 0.0 0 0.0 6 15
135 A 135 SER S S t < TS- 0 0 -73.8 -29.7 -170.8 -148.2 70.7 41.4 131 -2.1 0 0.0 0 0.0 0 0.0 7 24
136 A 136 GLY G + 0 0 63.7 15.5 180.0 150.6 44.6 50.6 0 0.0 0 0.0 0 0.0 0 0.0 7 22
137 A 137 ARG R t > T - 0 0 -81.8 140.4 -174.7 -137.4 50.8 126.5 0 0.0 140 -1.1 0 0.0 0 0.0 6 37
138 A 138 SER S T T 3 TS+ 0 0 -73.3 -9.5 -173.6 50.9 101.1 58.4 0 0.0 0 0.0 0 0.0 0 0.0 7 41
139 A 139 ASP D T T 3 TS+ 0 0 -113.5 4.7 179.0 97.4 77.3 67.9 0 0.0 141 -1.0 0 0.0 0 0.0 11 44
140 A 140 ASP D t < T + 0 0 -92.5 53.4 175.1 96.5 65.3 107.4 137 -1.1 0 0.0 0 0.0 0 0.0 13 41
141 A 141 ASN N S h > TS- 0 0 -136.7 160.9 -170.9 -102.9 88.9 156.4 139 -1.0 145 -2.9 0 0.0 0 0.0 10 32
142 A 142 ILE I H H > TS+ 0 0 -55.0 -42.3 179.1 51.4 118.2 27.6 0 0.0 146 -2.1 0 0.0 0 0.0 8 32
143 A 143 GLU E H H > TS+ 0 0 -57.7 -58.2 -178.7 38.2 116.1 19.5 0 0.0 147 -1.6 0 0.0 0 0.0 7 28
144 A 144 SER S H H > TS+ 0 0 -62.4 -40.0 -173.9 59.8 111.8 27.6 0 0.0 148 -2.8 0 0.0 0 0.0 12 37
145 A 145 ILE I H H X TS+ 0 0 -59.9 -44.1 -178.5 45.9 106.1 23.0 141 -2.9 149 -2.0 0 0.0 0 0.0 14 43
146 A 146 LYS K H H X TS+ 0 0 -71.6 -31.8 170.8 51.9 111.9 28.1 142 -2.1 150 -1.8 0 0.0 0 0.0 8 36
147 A 147 LYS K H H X TS+ 0 0 -66.1 -37.1 176.8 53.9 107.4 23.3 143 -1.6 151 -2.2 0 0.0 0 0.0 11 36
148 A 148 ARG R H H X TS+ 0 0 -64.5 -39.1 175.6 53.0 105.7 27.7 144 -2.8 152 -2.2 0 0.0 0 0.0 12 48
149 A 149 PHE F H H X TS+ 0 0 -61.2 -42.7 -178.0 50.1 107.9 23.1 145 -2.0 153 -2.6 0 0.0 0 0.0 11 46
150 A 150 ASN N H H X TS+ 0 0 -65.8 -41.9 175.2 49.7 110.3 17.7 146 -1.8 154 -3.0 0 0.0 0 0.0 8 35
151 A 151 THR T H H X >TS+ 0 0 -60.1 -42.9 175.0 47.1 113.3 25.4 147 -2.2 155 -2.5 0 0.0 156 -1.2 12 40
152 A 152 PHE F H H < >TS+ 0 0 -60.7 -44.6 -171.0 45.0 115.9 24.5 148 -2.2 157 -2.0 0 0.0 0 0.0 12 48
153 A 153 ASN N H H < 5TS+ 0 0 -71.9 -39.1 -169.9 35.1 122.0 25.6 149 -2.6 0 0.0 0 0.0 0 0.0 8 37
154 A 154 VAL V H H < 5TS+ 0 0 -89.5 -36.4 -174.1 15.7 134.2 31.3 150 -3.0 0 0.0 0 0.0 0 0.0 8 27
155 A 155 GLN Q T h X 5TS+ 0 0 -107.6 -43.8 -168.6 45.1 123.6 34.6 151 -2.5 159 -0.8 0 0.0 0 0.0 11 36
156 A 156 THR T H H > TS+ 0 0 -62.5 -38.7 177.7 51.2 105.6 30.4 0 0.0 162 -1.8 0 0.0 0 0.0 10 33
159 A 159 VAL V H H X TS+ 0 0 -65.2 -46.9 176.2 48.1 110.1 22.8 155 -0.8 163 -2.1 0 0.0 0 0.0 13 42
160 A 160 ILE I H H X TS+ 0 0 -58.9 -42.8 177.3 51.1 111.4 22.9 156 -2.0 164 -2.1 0 0.0 0 0.0 10 45
161 A 161 ASP D H H X TS+ 0 0 -63.6 -35.7 175.3 55.2 106.7 33.1 157 -2.5 165 -1.3 0 0.0 0 0.0 8 35
162 A 162 HIS H H H X TS+ 0 0 -61.4 -46.9 178.2 42.5 111.6 20.7 158 -1.8 166 -0.7 0 0.0 0 0.0 8 33
163 A 163 TYR Y H H < >>TS+ 0 0 -68.7 -30.3 -177.4 59.2 109.2 35.3 159 -2.1 168 -2.3 0 0.0 166 -0.5 11 38
164 A 164 ASN N H H < >5TS+ 0 0 -72.6 -27.1 173.6 65.5 94.0 38.4 160 -2.1 167 -1.5 0 0.0 0 0.0 9 31
165 A 165 LYS K H H < 35TS+ 0 0 -59.2 -35.9 179.3 45.1 104.5 30.2 161 -1.3 0 0.0 0 0.0 0 0.0 7 16
166 A 166 PHE F T h < <5TS- 0 0 -97.1 18.3 173.0 -109.7 121.0 80.0 162 -0.7 0 0.0 163 -0.5 0 0.0 6 17
167 A 167 ASP D T T <5TS+ 0 0 67.9 29.4 -167.4 128.0 81.7 38.7 164 -1.5 0 0.0 0 0.0 0 0.0 6 20
168 A 168 LYS K e > T - 0 0 -61.4 147.5 -167.1 -111.8 55.1 103.9 0 0.0 181 -2.3 0 0.0 180 -0.6 7 27
178 A 178 VAL V H H > 3 TS+ 0 0 -61.7 -28.1 179.1 51.2 115.7 39.0 0 0.0 182 -2.3 0 0.0 0 0.0 8 31
179 A 179 ASN N H H > 3 TS+ 0 0 -78.8 -33.7 173.3 51.2 108.6 33.0 0 0.0 183 -2.1 0 0.0 0 0.0 6 28
180 A 180 GLU E H H > < TS+ 0 0 -66.7 -42.5 171.7 47.2 112.4 23.8 177 -0.6 184 -1.3 0 0.0 0 0.0 8 25
181 A 181 VAL V H H X TS+ 0 0 -59.5 -46.9 -176.0 48.0 113.5 18.9 177 -2.3 185 -1.8 0 0.0 0 0.0 12 37
182 A 182 TYR Y H H X TS+ 0 0 -69.5 -31.8 176.5 64.2 100.7 33.9 178 -2.3 186 -3.6 0 0.0 0 0.0 10 40
183 A 183 ASN N H H X TS+ 0 0 -53.9 -44.6 176.8 42.4 108.6 16.4 179 -2.1 187 -2.3 0 0.0 0 0.0 8 31
184 A 184 ASP D H H X TS+ 0 0 -68.4 -41.5 175.9 52.7 113.4 30.1 180 -1.3 188 -2.2 0 0.0 0 0.0 9 35
185 A 185 VAL V H H X TS+ 0 0 -57.9 -51.0 -179.4 46.1 111.0 18.6 181 -1.8 189 -2.1 0 0.0 0 0.0 11 52
186 A 186 GLU E H H X TS+ 0 0 -62.0 -40.2 177.5 51.1 112.3 23.3 182 -3.6 190 -2.1 0 0.0 0 0.0 9 39
187 A 187 ASN N H H X TS+ 0 0 -63.9 -37.8 178.7 52.0 109.2 26.6 183 -2.3 191 -2.7 0 0.0 0 0.0 8 26
188 A 188 LEU L H H X TS+ 0 0 -62.7 -51.1 -175.1 46.5 109.6 22.1 184 -2.2 192 -2.1 0 0.0 0 0.0 8 36
189 A 189 PHE F H H < >TS+ 0 0 -66.5 -33.5 170.7 50.5 113.5 27.8 185 -2.1 194 -2.8 0 0.0 0 0.0 9 41
190 A 190 LYS K H H < >5TS+ 0 0 -63.3 -47.1 177.9 48.9 110.4 17.6 186 -2.1 193 -1.9 0 0.0 0 0.0 8 24
191 A 191 SER S H H < 35TS+ 0 0 -63.6 -29.9 178.9 57.1 106.7 33.9 187 -2.7 0 0.0 0 0.0 0 0.0 7 18
192 A 192 MET M T h < 35TS- 0 0 -83.3 1.6 173.3 -106.7 123.0 65.9 188 -2.1 0 0.0 0 0.0 0 0.0 6 27
193 A 193 GLY G T T <5T 0 0 87.5 16.3 -179.7 999.9 999.9 48.2 190 -1.9 0 0.0 0 0.0 0 0.0 5 20
194 A 194 PHE F t 5555< >5555< 5-turns
3-turns >33< >33< >33< >33< >33X33< >33< 3-turns
bridge-2 bbbb cccc bridge-2
bridge-1 aaaaaaa cccc bbbb bridge-1
sheets AAAAAAA AAAA AAAA sheets
4-turns >>>>XXXXXX<<<< >>>>XXXX<<<< >>>>XXX<<<< >>>>XXXXXXX<<<< >>>>XXX 4-turns
summary eEEEEEEEeTTthHHHHHHHHHHHHh EEEEHHHHHHHHHHhTtThHHHHHHHHHhTt hHHHHHHHHHHHHHhtTTteEEEEet hHHHHHH summary
sequence MEKSKPNVVFVLGGPGSGKGTQCANIVRDFGWVHLSAGDLLRQEQQSGSKDGEMIATMIKNGEIVPSIVTVKLLKNAIDANQGKNFLVDGFPRNEENNNS sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand HHHHHTTT EEEEEEEEE HHHHHHHHHHHHTTS TT SHHHHHHHHHHHHHTHHHHHHHHHHTT EEEEE SS HHHHHHHHHHHHHHTT Kabs/Sand
chirality ++++++++---------+--++++++++++++++-+-+++-++++++++++++++++++++++++-++-----++--++++++++++++++- chirality
bends SSSSSSSS SSSSSSSSSSSSSSS SS SSSSSSSSSSSSSSSSSSSSSSSSSSS SS SSSSSSSSSSSSSSS bends
turns TTTTTTTTT TTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTT turns
5-turns >>555<< >5555< >5555< 5-turns
3-turns >33< >>3<< >33< >>3<< >33< >33< 3-turns
bridge-2 ddddd bridge-2
bridge-1 aa*aaaaa ddddd bridge-1
sheets AAAAAAAAA AAAAA sheets
4-turns XX<>>>XXXXXX>>>XXXXXXX<<>>XXXX<<<< >>>>XXXXXXXX<<<< 4-turns
summary HHHHHhTTtEEEEEEEEE hHHHHHHHHHHHHhTt tTTthHHHHHHHHHHHHHhHHHHHHHHHHhTeEEEEEeSShHHHHHHHHHHHHHHhTt summary
sequence WEENMKDFVDTKFVLFFDCPEEVMTQRLLKRGESSGRSDDNIESIKKRFNTFNVQTKLVIDHYNKFDKVKIIPANRDVNEVYNDVENLFKSMGF sequence
110 120 130 140 150 160 170 180 190