Secondary structure calculation program - copyright by David Keith Smith, 1989
1pfkA.pdb
1PFK TRANSFERASE(PHOSPHOTRANSFERASE) PHOSPHOFRUCTOKINASE (E.C.2.7.1.11) (R-STATE) COMPL (ESCHERICHIA $COLI)
Sequence length - 320
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 0 MET M 0 0 999.9 -174.0 -179.5 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 3 24
2 A 1 ILE I + 0 0 74.2 98.3 179.5 147.3 999.9 25.1 0 0.0 0 0.0 0 0.0 0 0.0 9 36
3 A 2 LYS K e + 0 0 -126.6 -28.6 -179.3 39.6 66.9 59.4 0 0.0 34 -1.8 0 0.0 0 0.0 9 35
4 A 3 LYS K E E Aa - 34 0 -135.4 130.8 -179.2 -175.4 62.8 173.4 0 0.0 96 -2.9 0 0.0 97 -0.8 12 46
5 A 4 ILE I E E Aab - 35 97 -119.9 160.7 179.3 -141.8 13.3 146.2 34 -2.7 36 -2.0 0 0.0 0 0.0 14 62
6 A 5 GLY G E E Aab - 36 98 -118.1 162.2 -179.7 -162.4 11.8 140.0 97 -3.0 99 -1.3 0 0.0 0 0.0 13 69
7 A 6 VAL V E E Aab + 37 99 -152.4 130.5 179.7 167.2 11.9 164.2 36 -1.2 38 -2.6 0 0.0 0 0.0 13 85
8 A 7 LEU L E E A b - 0 100 -138.2 165.6 177.4 -132.9 28.4 155.7 99 -2.1 101 -1.9 0 0.0 0 0.0 16 75
9 A 8 THR T E E A b - 0 101 -121.4 129.0 -177.4 -177.2 30.6 169.7 70 -0.5 0 0.0 0 0.0 0 0.0 16 69
10 A 9 SER S e + 0 0 -129.5 151.1 179.9 5.8 38.2 159.0 101 -2.9 0 0.0 0 0.0 0 0.0 16 63
11 A 10 GLY G S S S+ 0 0 79.6 -160.4 -178.9 1.5 108.4 111.4 72 -1.5 0 0.0 0 0.0 0 0.0 13 59
12 A 11 GLY G S S S- 0 0 -64.5 127.4 180.0 -114.4 82.8 115.0 0 0.0 0 0.0 0 0.0 0 0.0 10 57
13 A 12 ASP D - 0 0 -64.7 153.6 -179.8 -168.0 34.0 105.4 0 0.0 0 0.0 0 0.0 0 0.0 14 62
14 A 13 ALA A t > T - 0 0 -146.4 137.0 179.2 -101.8 30.2 175.2 0 0.0 17 -2.1 0 0.0 0 0.0 15 72
15 A 14 PRO P T T 3 TS+ 0 0 -61.4 122.8 -178.8 40.7 109.8 113.0 0 0.0 0 0.0 0 0.0 0 0.0 19 64
16 A 15 GLY G T h > 3 TS+ 0 0 120.7 -15.9 178.4 107.9 78.8 81.1 64 -0.6 20 -1.9 0 0.0 0 0.0 19 70
17 A 16 MET M H H > < TS+ 0 0 -56.4 -49.7 178.5 51.5 80.7 22.2 14 -2.1 21 -2.5 0 0.0 0 0.0 17 78
18 A 17 ASN N H H > TS+ 0 0 -55.1 -40.5 179.6 51.6 109.6 28.5 66 -1.1 22 -2.3 0 0.0 0 0.0 15 71
19 A 18 ALA A H H > TS+ 0 0 -65.2 -34.5 -179.6 50.4 108.7 35.6 0 0.0 23 -1.8 0 0.0 0 0.0 14 66
20 A 19 ALA A H H X TS+ 0 0 -68.0 -46.5 178.9 49.1 110.1 25.4 16 -1.9 24 -2.4 0 0.0 0 0.0 14 76
21 A 20 ILE I H H X TS+ 0 0 -55.0 -54.3 -178.9 49.4 111.5 16.9 17 -2.5 25 -2.8 0 0.0 0 0.0 11 77
22 A 21 ARG R H H X TS+ 0 0 -55.1 -40.0 -179.8 56.2 107.5 28.5 18 -2.3 26 -2.4 0 0.0 0 0.0 14 63
23 A 22 GLY G H H X TS+ 0 0 -55.7 -53.0 -179.3 41.9 112.3 18.0 19 -1.8 27 -2.0 0 0.0 0 0.0 14 66
24 A 23 VAL V H H X TS+ 0 0 -57.9 -56.5 -178.0 47.1 115.2 26.3 20 -2.4 28 -2.7 0 0.0 0 0.0 13 68
25 A 24 VAL V H H X TS+ 0 0 -57.8 -49.9 -178.5 47.6 113.6 23.9 21 -2.8 29 -2.5 0 0.0 0 0.0 13 60
26 A 25 ARG R H H X TS+ 0 0 -63.1 -45.0 -179.3 45.6 114.4 24.2 22 -2.4 30 -1.9 0 0.0 0 0.0 10 45
27 A 26 SER S H H X TS+ 0 0 -61.8 -51.5 179.9 49.7 113.5 20.7 23 -2.0 31 -1.2 0 0.0 0 0.0 11 43
28 A 27 ALA A H H < >>TS+ 0 0 -52.1 -51.3 179.5 51.5 109.1 25.5 24 -2.7 33 -1.6 0 0.0 31 -0.8 13 49
29 A 28 LEU L H H < >5TS+ 0 0 -52.8 -51.0 179.1 53.6 107.4 21.2 25 -2.5 32 -2.0 0 0.0 0 0.0 12 38
30 A 29 THR T H H < 35TS+ 0 0 -55.7 -31.9 -179.1 51.6 107.5 42.4 26 -1.9 0 0.0 0 0.0 0 0.0 7 29
31 A 30 GLU E T h < <5TS- 0 0 -93.7 12.3 178.6 -105.3 121.7 74.8 27 -1.2 0 0.0 28 -0.8 0 0.0 6 29
32 A 31 GLY G T T <5TS+ 0 0 84.9 -8.9 -179.9 132.8 77.0 76.0 29 -2.0 0 0.0 0 0.0 0 0.0 7 26
33 A 32 LEU L t TS+ 0 0 -83.3 154.6 176.7 9.4 73.9 120.2 49 -2.4 44 -0.7 0 0.0 0 0.0 14 46
40 A 39 ASP D T h > >5TS- 0 0 45.2 48.0 178.9 -100.4 101.7 40.0 69 -2.4 43 -1.9 0 0.0 44 -0.8 14 44
41 A 40 GLY G H H > 35TS- 0 0 49.7 -135.0 -178.5 -8.2 94.3 97.9 70 -0.8 45 -1.2 0 0.0 0 0.0 16 65
42 A 41 TYR Y H H > 35TS+ 0 0 -68.4 -14.4 179.2 65.9 131.8 51.1 0 0.0 46 -1.6 0 0.0 0 0.0 12 60
43 A 42 LEU L H H > <5TS+ 0 0 -72.6 -50.0 179.5 40.4 105.1 18.4 40 -1.9 47 -2.7 0 0.0 0 0.0 11 45
44 A 43 GLY G H H < XTS+ 0 0 -68.3 -26.4 179.9 59.0 111.5 39.4 40 -0.8 49 -3.1 39 -0.7 0 0.0 12 46
45 A 44 LEU L H H < >5TS+ 0 0 -65.8 -46.3 179.7 41.4 111.0 16.9 41 -1.2 48 -0.7 0 0.0 0 0.0 15 61
46 A 45 TYR Y H H < 35TS+ 0 0 -64.1 -49.7 -179.9 44.1 119.0 20.6 42 -1.6 0 0.0 0 0.0 0 0.0 12 45
47 A 46 GLU E T h < 35TS- 0 0 -77.9 2.9 179.7 -121.8 111.9 67.3 43 -2.7 0 0.0 0 0.0 0 0.0 7 36
48 A 47 ASP D T T <5T + 0 0 56.3 50.0 179.3 161.4 52.7 23.0 45 -0.7 50 -0.7 0 0.0 0 0.0 9 37
49 A 48 ARG R e TS+ 0 0 -68.5 -28.9 -178.4 54.0 126.9 38.6 0 0.0 58 -0.6 0 0.0 0 0.0 9 31
56 A 55 TYR Y G G > TS+ 0 0 -79.4 -24.1 -178.9 72.4 90.1 44.7 0 0.0 59 -1.5 0 0.0 0 0.0 6 28
57 A 56 SER S G G 3 TS+ 0 0 -66.4 -19.1 179.8 44.9 102.1 43.4 0 0.0 0 0.0 0 0.0 0 0.0 6 35
58 A 57 VAL V G G X TS+ 0 0 -106.1 10.5 179.0 116.1 87.9 79.2 55 -0.6 61 -0.9 0 0.0 0 0.0 13 46
59 A 58 SER S T g < TS+ 0 0 -77.7 149.3 179.0 17.1 78.9 122.1 56 -1.5 0 0.0 0 0.0 0 0.0 8 30
60 A 59 ASP D T T 3 TS+ 0 0 58.7 29.8 -179.5 98.4 102.7 42.5 0 0.0 0 0.0 0 0.0 0 0.0 6 29
61 A 60 MET M t X T + 0 0 -114.6 -27.2 -176.4 84.5 52.0 53.5 58 -0.9 64 -1.9 0 0.0 0 0.0 9 42
62 A 61 ILE I T T 3 TS+ 0 0 -53.1 -33.2 -179.7 40.2 97.1 43.0 0 0.0 0 0.0 0 0.0 0 0.0 11 46
63 A 62 ASN N T T 3 TS+ 0 0 -102.8 12.2 -179.6 99.4 97.7 76.3 0 0.0 0 0.0 0 0.0 0 0.0 10 36
64 A 63 ARG R t < T - 0 0 -104.4 144.4 179.0 -135.6 63.1 139.6 61 -1.9 16 -0.6 0 0.0 0 0.0 12 41
65 A 64 GLY G + 0 0 -78.9 -176.8 -179.4 31.7 67.8 95.2 0 0.0 0 0.0 0 0.0 0 0.0 13 51
66 A 65 GLY G S S S- 0 0 61.3 -163.3 -179.3 -77.6 93.0 92.2 0 0.0 18 -1.1 0 0.0 0 0.0 13 53
67 A 66 THR T t > T - 0 0 -139.7 123.7 -179.0 -150.5 21.7 171.2 0 0.0 70 -0.8 0 0.0 0 0.0 11 60
68 A 67 PHE F T T 3 TS+ 0 0 -71.0 -16.2 178.7 56.2 99.7 56.4 0 0.0 0 0.0 0 0.0 0 0.0 5 51
69 A 68 LEU L T T 3 TS- 0 0 -87.7 -16.1 -178.3 -128.7 111.0 55.1 0 0.0 40 -2.4 0 0.0 0 0.0 11 57
70 A 69 GLY G t < T - 0 0 85.0 169.4 178.8 -127.4 16.4 93.0 67 -0.8 41 -0.8 0 0.0 9 -0.5 10 48
71 A 70 SER S - 0 0 -143.8 163.9 179.5 -168.6 21.9 157.1 0 0.0 0 0.0 0 0.0 0 0.0 14 50
72 A 71 ALA A - 0 0 -156.5 162.4 177.6 -127.4 29.0 168.6 0 0.0 11 -1.5 0 0.0 74 -0.7 11 43
73 A 72 ARG R + 0 0 -114.3 97.8 -179.3 171.2 35.0 163.0 0 0.0 0 0.0 0 0.0 0 0.0 10 38
74 A 73 PHE F g > T + 0 0 -114.9 81.8 -179.3 177.9 7.7 145.1 72 -0.7 77 -2.0 0 0.0 0 0.0 7 38
75 A 74 PRO P G G > TS+ 0 0 -55.2 -29.5 -179.1 74.3 72.4 44.6 0 0.0 78 -1.7 0 0.0 0 0.0 5 32
76 A 75 GLU E G G > TS+ 0 0 -60.6 -21.3 180.0 87.0 70.0 46.9 0 0.0 79 -3.2 0 0.0 0 0.0 6 30
77 A 76 PHE F G G < TS+ 0 0 -55.9 -12.3 -179.8 77.6 72.3 50.3 74 -2.0 0 0.0 0 0.0 0 0.0 10 40
78 A 77 ARG R G G < TS+ 0 0 -67.8 -27.5 179.5 90.8 74.8 40.0 75 -1.7 0 0.0 0 0.0 0 0.0 8 35
79 A 78 ASP D S h > < TS- 0 0 -74.5 130.1 179.5 -145.4 74.2 123.9 76 -3.2 83 -1.5 0 0.0 0 0.0 7 26
80 A 79 GLU E H H > TS+ 0 0 -69.3 -15.6 -179.2 58.3 98.2 54.2 0 0.0 84 -0.6 0 0.0 0 0.0 7 28
81 A 80 ASN N H H > TS+ 0 0 -85.9 -32.6 176.9 50.3 103.0 34.9 0 0.0 85 -1.6 0 0.0 0 0.0 6 25
82 A 81 ILE I H H > TS+ 0 0 -69.1 -39.2 179.7 50.2 111.2 27.4 0 0.0 86 -2.2 0 0.0 0 0.0 11 29
83 A 82 ARG R H H X TS+ 0 0 -68.6 -28.4 179.0 59.6 104.4 38.2 79 -1.5 87 -2.2 0 0.0 0 0.0 12 40
84 A 83 ALA A H H X TS+ 0 0 -64.2 -43.9 179.0 45.8 106.8 24.2 80 -0.6 88 -1.6 0 0.0 0 0.0 8 33
85 A 84 VAL V H H X TS+ 0 0 -61.9 -53.9 179.5 53.7 110.2 15.0 81 -1.6 89 -2.5 0 0.0 0 0.0 9 31
86 A 85 ALA A H H X TS+ 0 0 -48.9 -46.8 -179.0 50.0 108.2 28.8 82 -2.2 90 -2.1 0 0.0 0 0.0 12 52
87 A 86 ILE I H H X TS+ 0 0 -64.8 -33.7 178.7 53.5 107.5 34.5 83 -2.2 91 -2.5 0 0.0 0 0.0 10 48
88 A 87 GLU E H H X TS+ 0 0 -65.2 -47.5 179.8 51.4 107.6 17.4 84 -1.6 92 -2.7 0 0.0 0 0.0 8 33
89 A 88 ASN N H H X TS+ 0 0 -54.2 -43.8 -179.6 51.7 109.3 27.0 85 -2.5 93 -1.3 0 0.0 0 0.0 11 41
90 A 89 LEU L H H < >>TS+ 0 0 -59.4 -50.8 -178.7 44.0 112.1 20.0 86 -2.1 95 -1.9 0 0.0 93 -0.6 11 51
91 A 90 LYS K H H < >5TS+ 0 0 -64.9 -36.6 179.2 57.2 109.1 32.0 87 -2.5 94 -1.1 0 0.0 0 0.0 9 35
92 A 91 LYS K H H < 35TS+ 0 0 -62.8 -31.2 -179.0 49.4 106.8 39.6 88 -2.7 0 0.0 0 0.0 0 0.0 7 26
93 A 92 ARG R T h < <5TS- 0 0 -86.5 -8.9 -179.5 -116.5 115.8 62.1 89 -1.3 0 0.0 90 -0.6 0 0.0 6 34
94 A 93 GLY G T T <5T + 0 0 79.8 16.9 179.8 160.9 57.4 52.3 91 -1.1 0 0.0 0 0.0 0 0.0 7 32
95 A 94 ILE I t T - 0 0 -95.6 -160.4 -179.9 -61.6 66.1 88.1 0 0.0 107 -2.0 0 0.0 0 0.0 14 63
104 A 103 ASP D H H > TS+ 0 0 -54.5 -43.0 179.6 49.8 133.3 29.7 0 0.0 108 -0.9 0 0.0 0 0.0 9 61
105 A 104 GLY G H H > > TS+ 0 0 -64.9 -48.2 179.2 50.5 108.7 23.1 0 0.0 109 -1.5 0 0.0 108 -0.8 8 50
106 A 105 SER S H H > 3 TS+ 0 0 -60.7 -32.1 179.3 61.1 104.0 33.7 0 0.0 110 -2.2 0 0.0 0 0.0 12 63
107 A 106 TYR Y H H X 3 TS+ 0 0 -65.1 -32.1 178.6 53.1 101.2 34.5 103 -2.0 111 -1.5 0 0.0 0 0.0 13 63
108 A 107 MET M H H X < TS+ 0 0 -68.3 -45.9 179.3 48.8 108.6 21.2 104 -0.9 112 -2.6 105 -0.8 0 0.0 9 54
109 A 108 GLY G H H X TS+ 0 0 -56.7 -48.5 -179.7 49.8 111.3 24.4 105 -1.5 113 -2.2 0 0.0 0 0.0 10 65
110 A 109 ALA A H H X TS+ 0 0 -57.0 -39.4 179.8 50.1 111.2 34.6 106 -2.2 114 -1.1 0 0.0 0 0.0 13 67
111 A 110 MET M H H X TS+ 0 0 -67.8 -48.2 178.8 50.7 108.8 23.9 107 -1.5 115 -2.0 0 0.0 0 0.0 12 53
112 A 111 ARG R H H X TS+ 0 0 -59.9 -39.0 178.7 49.2 111.1 32.9 108 -2.6 116 -0.6 0 0.0 0 0.0 8 46
113 A 112 LEU L H H < >TS+ 0 0 -70.6 -30.2 -179.5 51.1 109.8 42.6 109 -2.2 118 -2.1 0 0.0 0 0.0 13 53
114 A 113 THR T H H < >5TS+ 0 0 -73.3 -37.2 180.0 55.8 106.2 34.2 110 -1.1 117 -1.2 0 0.0 0 0.0 12 43
115 A 114 GLU E H H < 35TS+ 0 0 -65.1 -24.7 -179.1 53.0 105.4 44.5 111 -2.0 0 0.0 0 0.0 0 0.0 7 35
116 A 115 MET M T h < 35TS- 0 0 -91.7 -5.5 179.8 -97.3 128.3 65.7 112 -0.6 0 0.0 0 0.0 0 0.0 6 34
117 A 116 GLY G T T <5TS+ 0 0 107.3 -13.5 -180.0 122.4 85.9 79.6 114 -1.2 0 0.0 0 0.0 0 0.0 6 33
118 A 117 PHE F t T - 0 0 -170.1 140.4 178.8 -134.5 61.8 150.7 138 -1.5 129 -0.7 124 -0.6 0 0.0 16 74
127 A 126 ILE I T T 3 TS+ 0 0 -69.6 -25.6 -176.9 74.6 96.4 37.4 0 0.0 0 0.0 0 0.0 0 0.0 15 72
128 A 127 ASP D T T 3 TS- 0 0 -57.6 -36.2 179.9 -140.8 86.1 44.4 0 0.0 0 0.0 0 0.0 0 0.0 12 63
129 A 128 ASN N t < T + 0 0 74.2 26.7 -177.7 128.8 60.0 45.2 126 -0.7 0 0.0 0 0.0 0 0.0 13 66
130 A 129 ASP D + 0 0 -98.9 13.1 178.7 111.6 27.5 79.0 0 0.0 0 0.0 0 0.0 0 0.0 9 58
131 A 130 ILE I t > T - 0 0 -90.6 141.5 179.5 -123.3 65.2 132.9 0 0.0 134 -0.7 0 0.0 0 0.0 9 62
132 A 131 LYS K T T 3 TS+ 0 0 -84.3 145.3 179.6 32.6 88.4 123.4 0 0.0 0 0.0 0 0.0 0 0.0 9 51
133 A 132 GLY G T T 3 TS+ 0 0 88.5 10.6 179.1 83.8 101.3 58.1 0 0.0 0 0.0 0 0.0 0 0.0 11 45
134 A 133 THR T t < T - 0 0 -142.9 135.0 178.3 -147.0 64.8 172.9 131 -0.7 0 0.0 0 0.0 0 0.0 11 54
135 A 134 ASP D S S S+ 0 0 -64.7 -43.4 179.8 14.0 90.3 24.8 287 -3.9 0 0.0 0 0.0 0 0.0 9 49
136 A 135 TYR Y - 0 0 -136.8 158.3 179.7 -147.5 65.0 157.1 0 0.0 0 0.0 0 0.0 0 0.0 8 63
137 A 136 THR T t > T - 0 0 -119.7 150.4 -179.4 -85.0 43.4 149.9 0 0.0 140 -1.9 0 0.0 0 0.0 15 74
138 A 137 ILE I B B a 3 TS+ 125 0 -63.9 126.4 -180.0 26.3 114.9 115.3 124 -3.5 126 -1.5 0 0.0 0 0.0 16 77
139 A 138 GLY G T h > 3 TS+ 0 0 108.1 -20.7 -179.5 104.1 89.4 85.5 0 0.0 143 -2.5 0 0.0 0 0.0 16 70
140 A 139 PHE F H H > < TS+ 0 0 -56.5 -59.2 -179.1 44.6 82.9 14.1 137 -1.9 144 -2.6 0 0.0 0 0.0 14 66
141 A 140 PHE F H H > TS+ 0 0 -54.2 -37.3 -179.4 51.4 113.4 35.1 0 0.0 145 -1.4 0 0.0 0 0.0 11 57
142 A 141 THR T H H > TS+ 0 0 -68.7 -48.5 179.1 46.2 110.9 20.7 0 0.0 146 -2.0 0 0.0 0 0.0 13 57
143 A 142 ALA A H H X TS+ 0 0 -62.4 -35.4 178.2 59.3 108.1 28.1 139 -2.5 147 -2.4 0 0.0 0 0.0 14 62
144 A 143 LEU L H H X TS+ 0 0 -59.5 -37.6 179.6 45.7 107.4 31.4 140 -2.6 148 -2.6 0 0.0 0 0.0 12 58
145 A 144 SER S H H X TS+ 0 0 -73.5 -37.8 -179.5 54.4 109.1 30.7 141 -1.4 149 -2.5 0 0.0 0 0.0 8 49
146 A 145 THR T H H X TS+ 0 0 -60.0 -42.6 -179.4 41.8 114.9 24.9 142 -2.0 150 -1.4 0 0.0 0 0.0 10 50
147 A 146 VAL V H H X TS+ 0 0 -68.5 -55.9 -178.1 48.9 113.6 20.5 143 -2.4 151 -2.3 0 0.0 0 0.0 12 59
148 A 147 VAL V H H X TS+ 0 0 -55.1 -41.8 179.2 51.8 111.2 30.1 144 -2.6 152 -2.4 0 0.0 0 0.0 11 47
149 A 148 GLU E H H X TS+ 0 0 -61.3 -42.7 -180.0 52.9 107.4 24.3 145 -2.5 153 -1.7 0 0.0 0 0.0 8 42
150 A 149 ALA A H H X TS+ 0 0 -57.4 -44.6 -179.4 49.9 109.7 22.6 146 -1.4 154 -1.3 0 0.0 0 0.0 9 48
151 A 150 ILE I H H X TS+ 0 0 -63.0 -42.2 179.5 57.7 102.7 30.5 147 -2.3 155 -2.3 0 0.0 0 0.0 9 52
152 A 151 ASP D H H X TS+ 0 0 -54.8 -40.7 -179.2 49.6 109.1 27.4 148 -2.4 156 -1.3 0 0.0 0 0.0 9 35
153 A 152 ARG R H H X TS+ 0 0 -67.1 -36.8 -178.8 49.0 109.1 35.8 149 -1.7 157 -1.0 0 0.0 0 0.0 8 37
154 A 153 LEU L H H X TS+ 0 0 -76.5 -29.7 178.2 61.8 103.2 39.2 150 -1.3 158 -3.0 0 0.0 0 0.0 9 43
155 A 154 ARG R H H X TS+ 0 0 -60.9 -42.2 -178.9 51.9 103.2 25.0 151 -2.3 159 -2.0 0 0.0 0 0.0 10 40
156 A 155 ASP D H H X TS+ 0 0 -61.0 -45.6 -176.6 37.4 116.1 26.2 152 -1.3 160 -1.4 0 0.0 0 0.0 8 26
157 A 156 THR T H H X TS+ 0 0 -76.9 -38.6 -179.8 50.4 115.7 30.2 153 -1.0 161 -0.9 0 0.0 0 0.0 8 28
158 A 157 SER S H H X >TS+ 0 0 -71.7 -25.6 177.4 54.4 109.9 34.1 154 -3.0 163 -2.6 0 0.0 162 -0.6 14 38
159 A 158 SER S H H < >5TS+ 0 0 -69.7 -45.3 -179.3 53.8 102.9 25.8 155 -2.0 162 -0.8 0 0.0 0 0.0 10 32
160 A 159 SER S H H < 35TS+ 0 0 -58.5 -24.8 -176.7 32.4 122.2 44.5 156 -1.4 0 0.0 0 0.0 0 0.0 6 23
161 A 160 HIS H H H < 35TS- 0 0 -117.6 3.8 179.9 -119.4 103.0 67.1 157 -0.9 0 0.0 0 0.0 0 0.0 8 25
162 A 161 GLN Q T h < <5T + 0 0 53.9 52.4 -179.8 154.1 63.2 16.8 159 -0.8 0 0.0 158 -0.6 0 0.0 10 34
163 A 162 ARG R e T - 0 0 141.3 -28.2 179.2 -144.5 57.3 89.0 0 0.0 173 -1.2 0 0.0 174 -0.7 14 57
172 A 171 ARG R T T 3 TS- 0 0 75.7 -95.6 179.9 -5.8 85.5 128.2 0 0.0 0 0.0 0 0.0 0 0.0 8 40
173 A 172 TYR Y T T 3 TS+ 0 0 -116.8 17.6 -179.9 88.0 120.9 82.4 171 -1.2 0 0.0 0 0.0 0 0.0 5 36
174 A 173 CYS C t < T - 0 0 -126.8 132.5 -179.3 -163.4 53.9 165.9 171 -0.7 0 0.0 0 0.0 0 0.0 13 47
175 A 174 GLY G h > T + 0 0 -88.0 -7.8 -179.6 98.4 64.9 60.7 0 0.0 179 -3.1 0 0.0 0 0.0 11 55
176 A 175 ASP D H H > TS+ 0 0 -47.5 -54.1 -179.5 47.9 87.3 23.0 0 0.0 180 -3.3 0 0.0 0 0.0 9 58
177 A 176 LEU L H H > TS+ 0 0 -51.4 -58.5 -178.9 43.2 115.5 19.7 0 0.0 181 -2.2 0 0.0 0 0.0 15 64
178 A 177 THR T H H > TS+ 0 0 -55.1 -44.8 -177.3 46.9 117.6 26.9 0 0.0 182 -2.3 0 0.0 0 0.0 16 64
179 A 178 LEU L H H X TS+ 0 0 -67.8 -50.4 178.8 45.0 112.4 22.4 175 -3.1 183 -1.8 0 0.0 0 0.0 13 61
180 A 179 ALA A H H X TS+ 0 0 -60.7 -39.7 -179.8 52.5 115.1 23.7 176 -3.3 184 -2.5 0 0.0 0 0.0 10 59
181 A 180 ALA A H H X TS+ 0 0 -62.0 -43.2 -178.4 53.3 105.2 24.1 177 -2.2 185 -2.3 0 0.0 0 0.0 12 59
182 A 181 ALA A H H < >TS+ 0 0 -63.2 -38.1 178.6 44.5 111.9 32.2 178 -2.3 187 -3.0 0 0.0 0 0.0 15 55
183 A 182 ILE I H H < >5TS+ 0 0 -71.2 -44.4 -178.3 47.9 115.2 20.2 179 -1.8 186 -1.0 0 0.0 0 0.0 9 45
184 A 183 ALA A H H < 35TS+ 0 0 -68.0 -28.4 179.6 42.8 116.6 37.6 180 -2.5 0 0.0 0 0.0 0 0.0 8 42
185 A 184 GLY G T h < 35TS- 0 0 -95.6 -0.4 -178.8 -121.6 110.2 64.2 181 -2.3 0 0.0 0 0.0 0 0.0 9 48
186 A 185 GLY G T T <5T - 0 0 61.1 45.4 -178.9 -168.5 43.6 26.7 183 -1.0 0 0.0 0 0.0 0 0.0 8 50
187 A 186 CYS C t T - 0 0 -128.0 160.9 -178.9 -120.2 42.9 150.8 0 0.0 195 -0.9 0 0.0 0 0.0 13 52
193 A 192 PRO P T T 3 TS+ 0 0 -74.4 -14.4 -179.5 65.6 106.4 49.6 0 0.0 0 0.0 0 0.0 0 0.0 11 38
194 A 193 GLU E T T 3 TS+ 0 0 -83.1 -12.0 179.6 56.1 101.7 54.1 0 0.0 0 0.0 0 0.0 0 0.0 7 35
195 A 194 VAL V S t < TS- 0 0 -123.2 149.5 179.5 -98.4 97.3 155.1 192 -0.9 0 0.0 0 0.0 0 0.0 6 35
196 A 195 GLU E - 0 0 -63.3 130.9 -179.2 -130.5 39.2 118.5 0 0.0 198 -0.6 0 0.0 0 0.0 6 24
197 A 196 PHE F - 0 0 -99.3 118.5 -178.5 -172.8 22.8 144.0 0 0.0 199 -0.6 0 0.0 0 0.0 7 30
198 A 197 SER S h > > T - 0 0 -111.7 92.3 179.5 -164.8 17.8 145.4 196 -0.6 202 -1.8 0 0.0 201 -0.7 6 24
199 A 198 ARG R H H > 3 TS+ 0 0 -41.9 -31.2 -178.4 59.7 94.2 39.7 197 -0.6 203 -1.9 0 0.0 0 0.0 6 36
200 A 199 GLU E H H > 3 TS+ 0 0 -63.5 -57.8 179.9 46.6 101.7 16.6 0 0.0 204 -2.8 0 0.0 0 0.0 6 24
201 A 200 ASP D H H > < TS+ 0 0 -54.8 -39.6 -179.6 55.7 111.5 32.6 198 -0.7 205 -2.9 0 0.0 0 0.0 7 28
202 A 201 LEU L H H X TS+ 0 0 -61.8 -52.2 179.3 41.4 110.4 21.4 198 -1.8 206 -2.3 0 0.0 0 0.0 9 44
203 A 202 VAL V H H X TS+ 0 0 -63.9 -43.4 -179.9 50.3 116.9 21.9 199 -1.9 207 -2.6 0 0.0 0 0.0 11 40
204 A 203 ASN N H H X TS+ 0 0 -63.3 -42.2 -179.8 48.3 110.7 26.1 200 -2.8 208 -2.1 0 0.0 0 0.0 8 32
205 A 204 GLU E H H X TS+ 0 0 -63.8 -47.5 179.7 47.4 113.4 19.6 201 -2.9 209 -2.3 0 0.0 0 0.0 10 37
206 A 205 ILE I H H X TS+ 0 0 -57.8 -46.4 179.3 51.0 110.7 27.6 202 -2.3 210 -1.9 0 0.0 0 0.0 11 48
207 A 206 LYS K H H X TS+ 0 0 -59.4 -43.9 178.4 53.0 108.6 23.6 203 -2.6 211 -1.8 0 0.0 0 0.0 9 36
208 A 207 ALA A H H X TS+ 0 0 -54.2 -51.3 179.2 53.8 106.3 20.0 204 -2.1 212 -1.9 0 0.0 0 0.0 8 30
209 A 208 GLY G H H < >TS+ 0 0 -51.4 -45.2 179.6 49.2 107.8 31.5 205 -2.3 214 -2.3 0 0.0 0 0.0 11 36
210 A 209 ILE I H H < >5TS+ 0 0 -67.2 -33.8 179.8 57.8 105.6 36.9 206 -1.9 213 -1.1 0 0.0 0 0.0 9 36
211 A 210 ALA A H H < 35TS+ 0 0 -61.7 -44.4 -180.0 49.5 106.1 24.7 207 -1.8 0 0.0 0 0.0 0 0.0 7 20
212 A 211 LYS K T h < 35TS- 0 0 -75.4 -0.4 179.2 -103.2 126.6 68.4 208 -1.9 0 0.0 0 0.0 0 0.0 6 16
213 A 212 GLY G T T <5T + 0 0 84.4 23.3 179.5 170.2 55.8 49.9 210 -1.1 0 0.0 0 0.0 0 0.0 6 22
214 A 213 LYS K t > T - 0 0 -101.2 102.7 -178.7 -157.2 35.7 154.9 0 0.0 231 -3.3 0 0.0 230 -0.9 7 32
228 A 227 VAL V H H > 3 TS+ 0 0 -53.2 -29.8 178.5 55.9 95.6 37.0 226 -0.8 232 -1.6 0 0.0 0 0.0 11 39
229 A 228 ASP D H H > 3 TS+ 0 0 -68.9 -40.7 -179.1 41.6 110.8 30.1 0 0.0 233 -1.6 0 0.0 0 0.0 8 30
230 A 229 GLU E H H > < TS+ 0 0 -71.1 -45.5 179.8 49.8 116.1 23.3 227 -0.9 234 -2.5 0 0.0 0 0.0 8 29
231 A 230 LEU L H H X TS+ 0 0 -61.3 -32.2 -178.8 54.7 108.6 38.6 227 -3.3 235 -1.5 0 0.0 0 0.0 9 45
232 A 231 ALA A H H X TS+ 0 0 -69.0 -48.4 178.7 45.7 108.7 25.5 228 -1.6 236 -2.2 0 0.0 0 0.0 12 41
233 A 232 HIS H H H X TS+ 0 0 -60.6 -47.7 -179.7 54.8 110.5 24.2 229 -1.6 237 -2.4 0 0.0 0 0.0 9 29
234 A 233 PHE F H H X TS+ 0 0 -55.5 -42.2 -179.4 46.6 110.1 28.4 230 -2.5 238 -2.0 0 0.0 0 0.0 8 33
235 A 234 ILE I H H X TS+ 0 0 -68.4 -43.6 179.6 53.9 109.2 23.5 231 -1.5 239 -1.2 0 0.0 0 0.0 12 46
236 A 235 GLU E H H X TS+ 0 0 -57.0 -43.9 -179.2 45.4 111.5 26.9 232 -2.2 240 -2.0 0 0.0 0 0.0 11 36
237 A 236 LYS K H H < TS+ 0 0 -65.6 -51.4 179.9 46.7 114.5 20.5 233 -2.4 0 0.0 0 0.0 0 0.0 8 24
238 A 237 GLU E H H < TS+ 0 0 -69.8 -11.6 -178.9 28.3 125.6 61.0 234 -2.0 0 0.0 0 0.0 0 0.0 7 27
239 A 238 THR T H H < TS- 0 0 -127.1 -14.2 -179.8 -129.3 91.2 59.4 235 -1.2 0 0.0 0 0.0 0 0.0 8 38
240 A 239 GLY G S h < TS+ 0 0 74.3 4.8 -180.0 120.1 71.5 60.4 236 -2.0 0 0.0 0 0.0 0 0.0 7 29
241 A 240 ARG R S S S- 0 0 -105.9 131.2 -179.9 -108.4 72.7 152.4 0 0.0 0 0.0 0 0.0 0 0.0 10 40
242 A 241 GLU E e - 0 0 -60.2 133.2 -178.3 -159.9 38.9 106.1 0 0.0 164 -2.3 0 0.0 0 0.0 8 39
243 A 242 THR T E E Bg - 164 0 -117.9 148.5 -179.5 -166.7 10.2 151.0 0 0.0 0 0.0 0 0.0 0 0.0 12 46
244 A 243 ARG R E E Bg - 165 0 -140.3 135.2 179.3 -150.5 8.7 175.6 164 -1.9 166 -3.6 0 0.0 0 0.0 10 44
245 A 244 ALA A E E Bg - 166 0 -108.9 132.2 178.6 -169.6 11.5 156.8 0 0.0 0 0.0 0 0.0 0 0.0 11 43
246 A 245 THR T E E Bg - 167 0 -124.1 129.4 178.8 -158.0 10.0 174.5 166 -3.8 168 -2.5 0 0.0 248 -0.7 9 47
247 A 246 VAL V E E Bg - 168 0 -108.1 100.1 -177.8 -166.3 2.8 155.7 0 0.0 0 0.0 0 0.0 0 0.0 7 42
248 A 247 LEU L e > T + 0 0 -51.8 -47.0 178.5 162.8 30.5 29.4 168 -1.2 251 -1.0 246 -0.7 0 0.0 12 46
249 A 248 GLY G G G > T - 0 0 67.2 -147.9 -177.3 -3.8 55.9 104.8 168 -0.5 252 -1.6 0 0.0 0 0.0 8 40
250 A 249 HIS H G G > TS+ 0 0 -62.0 -9.5 177.2 81.5 111.5 63.3 0 0.0 253 -1.2 0 0.0 0 0.0 6 35
251 A 250 ILE I G G X TS+ 0 0 -66.3 -30.9 178.8 65.4 85.3 32.1 248 -1.0 254 -1.1 0 0.0 0 0.0 8 38
252 A 251 GLN Q G G < TS+ 0 0 -59.3 -27.4 -177.0 54.3 97.6 42.9 249 -1.6 0 0.0 0 0.0 0 0.0 11 49
253 A 252 ARG R G G < TS+ 0 0 -84.2 -18.8 -177.7 60.2 104.4 53.3 250 -1.2 0 0.0 0 0.0 0 0.0 11 52
254 A 253 GLY G g < T + 0 0 -109.2 175.3 179.9 66.0 60.9 118.0 251 -1.1 0 0.0 0 0.0 0 0.0 11 47
255 A 254 GLY G S S S- 0 0 98.1 168.4 -178.9 -37.7 81.7 96.9 0 0.0 0 0.0 0 0.0 0 0.0 9 44
256 A 255 SER S - 0 0 -66.0 124.2 -178.9 -107.2 68.6 113.7 0 0.0 0 0.0 0 0.0 0 0.0 10 42
257 A 256 PRO P - 0 0 -56.6 141.1 178.2 -119.7 30.3 100.2 0 0.0 0 0.0 0 0.0 0 0.0 14 47
258 A 257 VAL V h > > T - 0 0 -74.8 161.1 179.6 -95.0 36.4 110.8 0 0.0 262 -2.4 0 0.0 261 -0.6 8 42
259 A 258 PRO P H H > 3 TS+ 0 0 -43.9 -53.0 178.7 54.0 123.5 30.5 0 0.0 263 -2.3 0 0.0 0 0.0 6 35
260 A 259 TYR Y H H > 3 TS+ 0 0 -51.0 -48.7 -179.1 46.0 110.2 27.7 0 0.0 264 -2.8 0 0.0 0 0.0 8 43
261 A 260 ASP D H H > < TS+ 0 0 -63.3 -51.1 178.2 52.5 111.2 16.3 258 -0.6 265 -2.7 0 0.0 0 0.0 15 58
262 A 261 ARG R H H X TS+ 0 0 -49.8 -45.5 -176.6 39.7 116.8 28.8 258 -2.4 266 -1.5 0 0.0 0 0.0 14 51
263 A 262 ILE I H H X TS+ 0 0 -75.0 -44.1 -179.0 48.9 114.7 31.7 259 -2.3 267 -2.4 0 0.0 0 0.0 9 45
264 A 263 LEU L H H X TS+ 0 0 -61.3 -49.3 179.9 50.6 112.4 20.0 260 -2.8 268 -2.3 0 0.0 0 0.0 9 53
265 A 264 ALA A H H X TS+ 0 0 -54.7 -48.7 178.9 47.9 110.9 27.6 261 -2.7 269 -2.2 0 0.0 0 0.0 14 71
266 A 265 SER S H H X TS+ 0 0 -60.2 -47.0 -178.2 49.5 112.7 22.4 262 -1.5 270 -2.4 0 0.0 0 0.0 13 50
267 A 266 ARG R H H X TS+ 0 0 -62.2 -36.8 -179.3 45.7 112.6 31.7 263 -2.4 271 -1.6 0 0.0 0 0.0 9 49
268 A 267 MET M H H X TS+ 0 0 -75.2 -35.8 179.0 55.7 110.5 32.0 264 -2.3 272 -2.1 0 0.0 0 0.0 14 60
269 A 268 GLY G H H X TS+ 0 0 -60.8 -54.4 -179.2 43.5 110.0 17.1 265 -2.2 273 -1.4 0 0.0 0 0.0 15 64
270 A 269 ALA A H H X TS+ 0 0 -59.5 -38.7 -179.8 54.2 112.9 29.2 266 -2.4 274 -1.4 0 0.0 0 0.0 13 51
271 A 270 TYR Y H H X TS+ 0 0 -65.5 -38.1 179.6 61.5 99.0 33.4 267 -1.6 275 -2.5 0 0.0 0 0.0 9 51
272 A 271 ALA A H H X TS+ 0 0 -53.6 -55.4 -179.8 47.0 105.8 14.4 268 -2.1 276 -2.5 0 0.0 0 0.0 13 66
273 A 272 ILE I H H X TS+ 0 0 -55.0 -40.2 -179.8 54.3 109.0 31.9 269 -1.4 277 -2.4 0 0.0 0 0.0 11 58
274 A 273 ASP D H H X TS+ 0 0 -62.4 -44.2 179.1 48.4 109.1 23.2 270 -1.4 278 -0.6 0 0.0 0 0.0 8 43
275 A 274 LEU L H H < >>TS+ 0 0 -59.8 -46.1 -179.0 52.9 110.2 25.7 271 -2.5 280 -1.8 0 0.0 278 -1.2 10 45
276 A 275 LEU L H H < >5TS+ 0 0 -56.5 -49.7 -179.8 49.8 106.8 26.3 272 -2.5 279 -1.5 0 0.0 0 0.0 11 53
277 A 276 LEU L H H < 35TS+ 0 0 -65.3 -11.9 -178.2 58.9 106.7 56.3 273 -2.4 0 0.0 0 0.0 0 0.0 8 37
278 A 277 ALA A T h < <5TS- 0 0 -93.1 -15.1 178.8 -108.2 119.0 58.1 275 -1.2 0 0.0 274 -0.6 0 0.0 6 26
279 A 278 GLY G T T <5T + 0 0 97.0 14.0 178.8 139.3 70.0 57.3 276 -1.5 0 0.0 0 0.0 0 0.0 6 31
280 A 279 TYR Y t T - 0 291 -127.2 113.6 179.4 -23.8 67.8 162.3 291 -3.5 291 -1.4 286 -0.6 0 0.0 10 31
289 A 288 ASN N T T 3 TS- 0 0 54.1 47.2 179.9 -48.5 128.5 26.9 287 -0.5 0 0.0 0 0.0 0 0.0 5 17
290 A 289 GLU E T T 3 TS+ 0 0 73.2 7.9 -179.3 117.0 117.4 61.9 0 0.0 0 0.0 0 0.0 0 0.0 5 21
291 A 290 GLN Q E E AI < T - 288 0 -112.4 139.9 177.2 -125.3 68.4 153.3 288 -1.4 288 -3.5 0 0.0 293 -0.5 6 22
292 A 291 LEU L E E AI + 287 0 -78.2 120.7 -178.9 175.7 45.4 134.1 0 0.0 0 0.0 0 0.0 0 0.0 9 36
293 A 292 VAL V E E AI - 286 0 -133.4 156.2 178.0 -151.9 24.1 160.8 286 -3.1 286 -3.1 291 -0.5 0 0.0 8 42
294 A 293 HIS H E E AI + 285 0 -131.7 141.2 -179.8 180.0 13.1 166.6 0 0.0 0 0.0 0 0.0 0 0.0 8 48
295 A 294 HIS H E E AI - 284 0 -134.0 157.4 177.7 -91.2 41.7 157.9 284 -2.2 284 -2.5 0 0.0 0 0.0 10 44
296 A 295 ASP D E E >AI T - 283 0 -65.6 133.6 -179.3 -130.8 39.5 123.5 0 0.0 300 -1.5 0 0.0 0 0.0 9 41
297 A 296 ILE I H H > > TS+ 0 0 -51.9 -52.4 -178.3 55.4 107.9 21.3 282 -3.2 301 -2.4 0 0.0 300 -0.6 12 52
298 A 297 ILE I H H > 3 TS+ 0 0 -46.7 -45.9 -179.0 54.2 104.3 29.8 0 0.0 302 -2.2 0 0.0 0 0.0 9 38
299 A 298 ASP D H H > 3 TS+ 0 0 -58.9 -41.3 -179.0 45.3 110.5 33.3 0 0.0 303 -0.6 0 0.0 0 0.0 9 33
300 A 299 ALA A H H X < TS+ 0 0 -69.5 -48.0 -179.4 45.5 114.8 24.9 296 -1.5 304 -0.7 297 -0.6 0 0.0 11 44
301 A 300 ILE I H H < TS+ 0 0 -59.3 -57.4 -177.5 22.7 127.6 16.9 297 -2.4 0 0.0 0 0.0 0 0.0 11 40
302 A 301 GLU E H H < TS+ 0 0 -78.3 -67.7 -176.2 24.2 129.4 13.6 298 -2.2 0 0.0 0 0.0 0 0.0 6 26
303 A 302 ASN N H H < TS+ 0 0 -97.6 19.8 177.4 92.1 95.3 80.7 299 -0.6 0 0.0 0 0.0 0 0.0 7 19
304 A 303 MET M h < T - 0 0 -99.7 180.0 -179.0 -142.9 60.7 116.0 300 -0.7 0 0.0 0 0.0 0 0.0 9 27
305 A 304 LYS K - 0 0 -150.7 153.3 179.6 -115.9 12.0 173.6 0 0.0 0 0.0 0 0.0 0 0.0 6 26
306 A 305 ARG R - 0 0 -87.6 126.3 -179.3 -123.6 35.2 136.8 0 0.0 0 0.0 0 0.0 0 0.0 5 32
307 A 306 PRO P - 0 0 -80.2 121.6 178.1 -127.0 16.9 127.8 0 0.0 0 0.0 0 0.0 0 0.0 4 29
308 A 307 PHE F - 0 0 -65.3 119.5 -178.5 -149.7 19.5 123.5 0 0.0 310 -0.5 0 0.0 0 0.0 5 27
309 A 308 LYS K h > > T + 0 0 -92.6 47.6 179.4 145.5 44.4 107.7 0 0.0 313 -1.7 0 0.0 312 -1.4 6 32
310 A 309 GLY G H H > 3 T + 0 0 -48.8 -33.1 179.1 70.7 68.9 33.6 308 -0.5 314 -3.1 0 0.0 0 0.0 6 25
311 A 310 ASP D H H > 3 TS+ 0 0 -50.2 -53.2 -179.2 38.8 100.3 30.4 0 0.0 315 -1.1 0 0.0 0 0.0 6 21
312 A 311 TRP W H H > < TS+ 0 0 -71.4 -40.6 -179.5 50.7 118.2 26.5 309 -1.4 316 -2.3 0 0.0 0 0.0 9 33
313 A 312 LEU L H H X TS+ 0 0 -65.8 -37.0 -180.0 53.0 105.6 37.1 309 -1.7 317 -1.9 0 0.0 0 0.0 9 38
314 A 313 ASP D H H X TS+ 0 0 -67.6 -36.1 178.6 45.9 113.5 29.8 310 -3.1 318 -0.7 0 0.0 0 0.0 8 25
315 A 314 CYS C H H X > TS+ 0 0 -70.9 -44.1 178.8 59.4 106.7 24.1 311 -1.1 319 -1.4 0 0.0 318 -0.9 8 24
316 A 315 ALA A H H X > TS+ 0 0 -50.2 -52.4 -180.0 47.7 105.5 24.5 312 -2.3 319 -0.6 0 0.0 320 -0.5 10 35
317 A 316 LYS K H H < 3 TS+ 0 0 -63.0 -25.1 -179.4 59.4 106.7 45.7 313 -1.9 0 0.0 0 0.0 0 0.0 7 36
318 A 317 LYS K H H < < TS+ 0 0 -72.6 -34.8 -177.0 44.8 106.7 37.9 315 -0.9 0 0.0 314 -0.7 0 0.0 6 21
319 A 318 LEU L H H < < T 0 0 -91.6 -6.8 -179.4 999.9 999.9 62.0 315 -1.4 0 0.0 316 -0.6 0 0.0 6 26
320 A 319 TYR Y h < T 0 0 -47.3 999.9 999.9 999.9 999.9 39.7 316 -0.5 0 0.0 0 0.0 0 0.0 8 40
1pfkA.pdb
1PFK TRANSFERASE(PHOSPHOTRANSFERASE) PHOSPHOFRUCTOKINASE (E.C.2.7.1.11) (R-STATE) COMPL (ESCHERICHIA $COLI)
author author
Kabs/Sand EEEEEE SS TTHHHHHHHHHHHHHHTT EEEEESTHHHHHHTT EEEE SGGGTT TT S TT GGGGSHHHHHHHHHHHHHTT EEEE Kabs/Sand
chirality ++---+--++---++++++++++++++++-+------+--+++++-++-----+++++++++-+--+----++++++-+++++++++++++-+-+---- chirality
bends SS SSSSSSSSSSSSSSSSSS SSSSSSSSS SSSSSS SS S SS SSSSSSSSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTT TTTTTTTTTTT TTTTTTTTTT TTTT TTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555X5555< >5555< 5-turns
3-turns >33< >>3<< >33< >33< >>3X<3X33< >33< >>><<< >>3<< 3-turns
bridge-2 bbbbb CCCC ddd bridge-2
bridge-1 aaaa aaaa CCCC bbbb bridge-1
sheets AAAAAA AAAAA AAAA AAAA sheets
4-turns >>>>XXXXXXXX<<<< >>>><<<< >>>>XXXXXXX<<<< 4-turns
summary eEEEEEEeSS tThHHHHHHHHHHHHHHhTtEEEEEehHHHHHHhTeEEEE gGGGgTtTTt StTTt gGGGGhHHHHHHHHHHHHHhTt EEEE summary
sequence MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVV sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand EE HHHHHHHHHHHHTT EEEEEB TT TT S BTHHHHHHHHHHHHHHHHHHHHHHT EEEEEE TT HHHHHHHHHTT SEEE TTS HH Kabs/Sand
chirality +--++++++++++++-+-+----++-+-++-++-+--+++++++++++++++++++++++-+-------+--+-++++++++++---+--+-++----++ chirality
bends SSSSSSSSSSSSSS SS SS S SSSSSSSSSSSSSSSSSSSSSSSS SS SSSSSSSSSS S SSS SS bends
turns TTTTTTTTTTTTTTTT TTTT TTTT TTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTT TTTT TTT turns
5-turns >5555< >5555< >5555< 5-turns
3-turns >33< >33< >33< >33< >33< >33< >33< >33< >33< >33 3-turns
bridge-2 dd ee ggggg bridge-2
bridge-1 b ddddda a ffffff hhh bridge-1
sheets AA AAAAA BBBBBB BBB sheets
4-turns >>>>XXXXXX<<<< >>>>XXXXXXXXXXXXXXXX<<<< >>>>XXX<<<< >>> 4-turns
summary EEhHHHHHHHHHHHHhTteEEEEEetTTt tTTtS tBhHHHHHHHHHHHHHHHHHHHHHHheEEEEEE tTTthHHHHHHHHHhTtSEEEtTTt hHH summary
sequence IGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSRE sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand HHHHHHHHHHHTT S EEEEEESSSS HHHHHHHHHHHHSS EEEEE GGGGG S HHHHHHHHHHHHHHHHHHHTT SEEEEEETTEEEEEEHHHH Kabs/Sand
chirality +++++++++++-+-+----+--++---+++++++++++-+-------+-+++++----+++++++++++++++++++-++++--+-+--+-+-+--++++ chirality
bends SSSSSSSSSSSS S SSSS SSSSSSSSSSSSSS SSSS S SSSSSSSSSSSSSSSSSSSS S SS SSSS bends
turns TTTTTTTTTTTTTT TTTTTTTTTTTTTT TTTTTTT TTTTTTTTTTTTTTTTTTTTTTT TTTT TTTTT turns
5-turns >5555< >5555< 5-turns
3-turns < >33< >33< >>>X<<< >33< >>3<< >33< >33< 3-turns
bridge-2 hhh IIIIII bridge-2
bridge-1 ffffff ggggg ee IIIIII bridge-1
sheets BBBBBB BBBBB AAAAAA AAAAAA sheets
4-turns >XXXXXXX<<<< >>>>XXXXXX<<<< >>>>XXXXXXXXXXXXX<<<< >>>>X 4-turns
summary HHHHHHHHHHHhTtS EEEEEEeSSShHHHHHHHHHHHHhSeEEEEEeGGGGGgS hHHHHHHHHHHHHHHHHHHHhTt eEEEEEETTEEEEEEHHHH summary
sequence DLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDA sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand HHH HHHHHHHHHH Kabs/Sand
chirality +++-----++++++++++ chirality
bends SSS SSSSSSSS bends
turns TTTT TTTTTTTTTTTT turns
5-turns 5-turns
3-turns >33< >>3<< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns <<<< >>>>XXXX<<<< 4-turns
summary HHHh hHHHHHHHHHHh summary
sequence IENMKRPFKGDWLDCAKKLY sequence
310 320