Secondary structure calculation program - copyright by David Keith Smith, 1989
2tmgA.pdb
2TMG OXIDOREDUCTASE MOL_ID: 1; MOL_ID: 1;
Sequence length - 408
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 4 SER S h > T 0 0 999.9 143.4 -179.7 999.9 999.9 999.9 0 0.0 5 -2.4 0 0.0 0 0.0 5 18
2 A 5 LEU L H H > T + 0 0 -51.7 -43.2 -179.8 44.8 999.9 30.0 0 0.0 6 -0.8 0 0.0 0 0.0 8 28
3 A 6 TYR Y H H > > TS+ 0 0 -68.2 -56.9 179.8 48.8 111.5 15.1 0 0.0 7 -2.5 0 0.0 6 -1.4 10 33
4 A 7 GLU E H H > 3 TS+ 0 0 -53.0 -35.4 179.8 59.2 107.1 32.8 0 0.0 8 -1.8 0 0.0 0 0.0 7 27
5 A 8 MET M H H X 3 TS+ 0 0 -63.4 -31.8 180.0 43.9 109.1 35.9 1 -2.4 9 -1.2 0 0.0 0 0.0 8 27
6 A 9 ALA A H H X < TS+ 0 0 -79.7 -44.0 178.6 55.6 108.5 27.6 3 -1.4 10 -1.9 2 -0.8 0 0.0 11 44
7 A 10 VAL V H H X TS+ 0 0 -56.6 -34.0 179.5 56.4 105.1 32.9 3 -2.5 11 -3.2 0 0.0 0 0.0 9 41
8 A 11 GLU E H H X TS+ 0 0 -62.1 -54.0 179.7 49.1 104.6 15.3 4 -1.8 12 -2.0 0 0.0 0 0.0 8 32
9 A 12 GLN Q H H X TS+ 0 0 -53.0 -37.8 -180.0 47.9 114.7 31.4 5 -1.2 13 -1.2 0 0.0 0 0.0 8 48
10 A 13 PHE F H H X TS+ 0 0 -68.6 -54.5 179.1 56.1 105.4 15.9 6 -1.9 14 -2.5 0 0.0 0 0.0 9 58
11 A 14 ASN N H H X TS+ 0 0 -47.1 -36.5 179.7 60.1 102.2 34.3 7 -3.2 15 -1.2 0 0.0 0 0.0 8 41
12 A 15 ARG R H H X > TS+ 0 0 -57.2 -62.3 -179.5 35.7 111.4 10.5 8 -2.0 16 -1.7 0 0.0 15 -1.4 9 39
13 A 16 ALA A H H X 3 TS+ 0 0 -64.0 -25.6 -179.9 68.4 108.7 39.2 9 -1.2 17 -1.1 0 0.0 0 0.0 12 47
14 A 17 ALA A H H < 3>TS+ 0 0 -64.1 -27.9 -179.7 42.5 105.2 34.2 10 -2.5 19 -0.8 0 0.0 0 0.0 12 40
15 A 18 SER S H H < <5TS+ 0 0 -82.6 -50.2 179.3 64.0 101.0 21.9 12 -1.4 0 0.0 11 -1.2 0 0.0 8 33
16 A 19 LEU L H H < 5TS+ 0 0 -44.4 -27.1 179.7 50.7 110.0 39.7 12 -1.7 0 0.0 0 0.0 0 0.0 7 33
17 A 20 MET M T h < 5TS- 0 0 -114.7 147.2 179.7 -109.8 100.0 150.8 13 -1.1 19 -1.7 0 0.0 0 0.0 7 35
18 A 21 ASP D T T 5T + 0 0 -77.6 89.6 -179.2 171.1 50.4 125.2 0 0.0 20 -0.6 0 0.0 0 0.0 6 27
19 A 22 LEU L t T - 0 0 -39.6 128.1 -178.7 -129.6 28.7 93.3 18 -0.6 24 -2.2 0 0.0 0 0.0 6 27
21 A 24 SER S H H > TS+ 0 0 -49.3 -58.1 -179.2 40.7 104.9 22.8 0 0.0 25 -1.1 0 0.0 0 0.0 6 24
22 A 25 ASP D H H > TS+ 0 0 -65.4 -31.7 179.2 57.1 111.5 35.2 0 0.0 26 -1.3 0 0.0 0 0.0 6 19
23 A 26 LEU L H H > TS+ 0 0 -66.0 -37.1 178.9 53.8 104.4 29.0 0 0.0 27 -1.6 0 0.0 0 0.0 9 32
24 A 27 ALA A H H X TS+ 0 0 -65.6 -32.5 180.0 59.7 101.8 35.5 20 -2.2 28 -0.9 0 0.0 0 0.0 10 43
25 A 28 GLU E H H X TS+ 0 0 -65.7 -39.3 178.7 46.8 105.3 28.9 21 -1.1 29 -2.0 0 0.0 0 0.0 8 32
26 A 29 VAL V H H < TS+ 0 0 -70.5 -36.6 179.1 52.7 110.6 27.1 22 -1.3 0 0.0 0 0.0 0 0.0 8 36
27 A 30 LEU L H H < TS+ 0 0 -69.2 -17.6 -179.7 53.1 110.0 45.5 23 -1.6 0 0.0 0 0.0 0 0.0 10 58
28 A 31 ARG R H H < TS+ 0 0 -80.8 -61.7 179.4 60.5 99.9 14.9 24 -0.9 0 0.0 0 0.0 0 0.0 7 55
29 A 32 ARG R S h < TS- 0 0 -69.3 146.4 179.9 -117.1 88.2 112.2 25 -2.0 0 0.0 0 0.0 0 0.0 7 46
30 A 33 PRO P - 0 0 -86.1 141.4 -178.0 -134.1 12.8 129.3 0 0.0 0 0.0 0 0.0 0 0.0 13 52
31 A 34 LYS K S S S+ 0 0 -58.8 -52.6 -178.1 17.0 82.0 23.2 57 -4.1 0 0.0 0 0.0 0 0.0 9 45
32 A 35 ARG R E E AA + 56 0 -133.5 139.3 176.5 179.9 51.1 170.4 56 -3.3 56 -2.7 0 0.0 0 0.0 7 44
33 A 36 VAL V E E AA - 55 0 -133.8 115.8 179.3 -173.3 11.5 168.7 0 0.0 35 -0.5 0 0.0 0 0.0 10 47
34 A 37 LEU L E E AA - 54 0 -116.0 123.9 179.3 -174.0 0.9 165.7 54 -3.3 54 -2.5 0 0.0 0 0.0 9 44
35 A 38 ILE I E E AA - 53 0 -117.5 125.2 -179.2 -171.4 7.9 168.0 33 -0.5 0 0.0 0 0.0 0 0.0 8 43
36 A 39 VAL V E E AA - 52 0 -123.3 144.1 177.1 -161.1 19.1 159.0 52 -2.7 52 -3.2 0 0.0 38 -0.5 10 40
37 A 40 GLU E E E AA + 51 0 -119.1 102.2 -177.9 173.1 28.2 161.9 0 0.0 0 0.0 0 0.0 0 0.0 8 33
38 A 41 PHE F E E AA - 50 0 -120.3 142.8 179.9 -127.5 26.6 156.9 50 -2.1 50 -2.6 36 -0.5 0 0.0 11 34
39 A 42 PRO P E E AA - 49 0 -80.5 160.5 178.9 -168.0 20.1 111.5 0 0.0 0 0.0 0 0.0 0 0.0 8 32
40 A 43 VAL V E E AA - 48 0 -149.0 131.0 179.3 -124.0 23.8 166.1 48 -0.6 48 -2.3 0 0.0 42 -0.7 12 38
41 A 44 ARG R E E AA - 47 0 -80.7 117.4 180.0 -143.7 31.3 134.4 0 0.0 0 0.0 0 0.0 0 0.0 10 26
42 A 45 MET M e > T - 0 0 -78.7 153.0 -180.0 -106.3 23.9 116.6 46 -2.8 45 -3.0 40 -0.7 0 0.0 9 29
43 A 46 ASP D T T 3 TS+ 0 0 -44.2 -49.4 -179.9 56.1 120.8 29.1 0 0.0 0 0.0 0 0.0 0 0.0 8 21
44 A 47 ASP D T T 3 TS- 0 0 -65.0 -5.7 178.6 -105.4 123.7 56.3 0 0.0 0 0.0 0 0.0 0 0.0 4 16
45 A 48 GLY G S t < TS+ 0 0 103.2 -13.1 -179.8 118.7 80.7 73.2 42 -3.0 0 0.0 0 0.0 0 0.0 6 16
46 A 49 HIS H e - 0 0 -91.3 151.0 -179.3 -119.0 61.3 129.3 0 0.0 42 -2.8 0 0.0 0 0.0 7 17
47 A 50 VAL V E E AA - 41 0 -88.6 141.9 178.6 -165.9 23.8 130.5 0 0.0 0 0.0 0 0.0 0 0.0 8 21
48 A 51 GLU E E E AA - 40 0 -131.4 124.5 179.9 -140.7 12.7 172.2 40 -2.3 40 -0.6 0 0.0 0 0.0 8 31
49 A 52 VAL V E E AA - 39 0 -83.3 133.6 179.7 -165.5 22.1 131.3 0 0.0 0 0.0 0 0.0 0 0.0 8 32
50 A 53 PHE F E E AA - 38 0 -122.6 155.3 179.7 -129.5 16.4 152.5 38 -2.6 38 -2.1 0 0.0 0 0.0 12 47
51 A 54 THR T E E AA + 37 0 -104.3 126.7 -179.6 178.8 28.7 151.7 0 0.0 105 -2.5 0 0.0 0 0.0 10 44
52 A 55 GLY G E E AAB - 36 104 -128.9 151.4 179.7 -160.5 9.6 159.7 36 -3.2 36 -2.7 0 0.0 0 0.0 13 56
53 A 56 TYR Y E E AAB + 35 103 -134.2 141.7 174.9 179.3 11.1 171.7 103 -2.9 103 -2.0 0 0.0 0 0.0 13 58
54 A 57 ARG R E E AAB - 34 102 -138.2 124.3 -179.0 -171.1 13.5 168.6 34 -2.5 34 -3.3 0 0.0 0 0.0 13 67
55 A 58 VAL V E E AAB - 33 101 -124.0 124.8 177.3 -167.1 14.3 166.5 101 -3.4 101 -1.8 0 0.0 57 -0.8 15 60
56 A 59 GLN Q E E AAB + 32 100 -108.4 103.9 -178.4 175.4 14.6 155.4 32 -2.7 32 -3.3 0 0.0 0 0.0 16 60
57 A 60 HIS H E E A * - 0 0 -70.4 -75.5 -179.5 -4.9 61.6 5.5 99 -2.4 31 -4.1 55 -0.8 0 0.0 17 62
58 A 61 ASN N E E A B + 0 99 -125.5 147.9 -178.2 171.5 49.3 161.4 99 -0.6 99 -2.5 0 0.0 0 0.0 14 63
59 A 62 VAL V t > T + 0 0 -133.5 -2.1 -178.7 114.8 44.3 66.7 0 0.0 62 -2.7 0 0.0 0 0.0 13 58
60 A 63 ALA A T T 3 TS+ 0 0 -41.2 -40.7 -177.8 40.4 85.9 39.1 0 0.0 0 0.0 0 0.0 0 0.0 8 49
61 A 64 ARG R T T 3 TS- 0 0 -94.8 2.0 -179.1 -52.6 130.6 66.4 0 0.0 0 0.0 0 0.0 0 0.0 12 47
62 A 65 GLY G S t < TS- 0 0 153.5 -174.6 -179.8 -27.7 84.2 160.2 59 -2.7 0 0.0 0 0.0 0 0.0 9 48
63 A 66 PRO P S S S- 0 0 -73.3 141.3 -179.6 -93.5 74.3 117.6 0 0.0 98 -2.6 0 0.0 0 0.0 14 56
64 A 67 ALA A E E Bc - 136 0 -52.0 139.3 179.0 -166.9 43.3 99.6 135 -2.0 137 -2.3 0 0.0 0 0.0 16 63
65 A 68 LYS K E E Bc + 137 0 -135.4 126.9 179.8 119.5 25.8 172.4 0 0.0 100 -1.5 0 0.0 0 0.0 14 72
66 A 69 GLY G e - 0 0 176.6 143.5 -179.1 -101.0 49.3 144.5 137 -0.9 0 0.0 0 0.0 0 0.0 14 76
67 A 70 GLY G e - 0 0 -66.0 176.4 179.1 -116.3 29.5 84.0 0 0.0 102 -1.5 0 0.0 0 0.0 11 74
68 A 71 ILE I E E Ada - 102 140 -119.6 135.6 -176.9 -145.7 22.8 164.2 139 -2.2 141 -1.0 0 0.0 0 0.0 14 77
69 A 72 ARG R E E Ad - 103 0 -107.8 131.9 177.2 -164.3 9.4 148.4 102 -2.1 104 -3.1 0 0.0 71 -0.7 13 57
70 A 73 TYR Y E E Ad + 104 0 -113.1 98.5 -179.0 129.3 42.0 154.3 142 -2.8 0 0.0 0 0.0 0 0.0 15 54
71 A 74 HIS H E E Ad - 105 0 -149.9 148.4 -179.3 -136.1 59.2 174.2 104 -1.8 106 -0.8 69 -0.7 0 0.0 13 38
72 A 75 PRO P S S S+ 0 0 -82.0 -10.0 -178.9 48.8 107.6 51.0 0 0.0 0 0.0 0 0.0 0 0.0 8 32
73 A 76 ASP D S S S+ 0 0 -106.5 -2.7 179.8 128.7 78.1 63.1 0 0.0 0 0.0 0 0.0 0 0.0 6 26
74 A 77 VAL V - 0 0 -55.1 138.5 -179.8 -170.7 37.5 102.6 0 0.0 0 0.0 0 0.0 0 0.0 12 39
75 A 78 THR T h > T - 0 0 -135.6 152.7 180.0 -112.3 39.0 164.7 0 0.0 79 -2.4 0 0.0 0 0.0 7 38
76 A 79 LEU L H H > TS+ 0 0 -43.3 -53.9 179.4 54.1 119.8 22.1 0 0.0 80 -2.9 0 0.0 0 0.0 7 43
77 A 80 ASP D H H > TS+ 0 0 -44.3 -63.8 179.7 48.3 106.9 21.9 0 0.0 81 -2.9 0 0.0 0 0.0 9 42
78 A 81 GLU E H H > TS+ 0 0 -46.6 -47.1 -179.9 48.1 113.9 28.2 0 0.0 82 -2.7 0 0.0 0 0.0 10 48
79 A 82 VAL V H H X TS+ 0 0 -60.8 -57.2 178.7 50.4 109.9 12.6 75 -2.4 83 -3.1 0 0.0 0 0.0 15 58
80 A 83 LYS K H H X TS+ 0 0 -45.3 -52.6 180.0 49.1 112.2 23.6 76 -2.9 84 -3.4 0 0.0 0 0.0 14 53
81 A 84 ALA A H H X TS+ 0 0 -54.2 -54.9 -178.2 46.4 112.6 15.3 77 -2.9 85 -2.3 0 0.0 0 0.0 11 52
82 A 85 LEU L H H X TS+ 0 0 -58.9 -36.6 179.3 49.0 113.2 31.5 78 -2.7 86 -1.9 0 0.0 0 0.0 10 62
83 A 86 ALA A H H X TS+ 0 0 -64.6 -52.0 179.6 56.2 107.7 13.4 79 -3.1 87 -1.8 0 0.0 0 0.0 16 64
84 A 87 PHE F H H X TS+ 0 0 -44.9 -48.8 179.0 48.0 107.8 29.0 80 -3.4 88 -1.1 0 0.0 0 0.0 14 61
85 A 88 TRP W H H X TS+ 0 0 -62.5 -42.6 -179.0 60.6 103.6 24.5 81 -2.3 89 -3.5 0 0.0 0 0.0 11 69
86 A 89 MET M H H X TS+ 0 0 -51.2 -43.2 -179.0 60.6 97.9 25.7 82 -1.9 90 -3.2 0 0.0 0 0.0 14 75
87 A 90 THR T H H X TS+ 0 0 -51.0 -50.6 -179.8 32.2 115.1 24.0 83 -1.8 91 -1.5 0 0.0 0 0.0 16 73
88 A 91 TRP W H H X TS+ 0 0 -76.7 -39.8 -179.5 59.5 115.0 27.4 84 -1.1 92 -2.9 0 0.0 0 0.0 14 75
89 A 92 LYS K H H X TS+ 0 0 -54.5 -46.5 -179.4 40.3 111.7 23.4 85 -3.5 93 -1.4 0 0.0 0 0.0 12 76
90 A 93 THR T H H X >TS+ 0 0 -69.5 -40.5 -179.6 56.5 113.1 24.9 86 -3.2 95 -1.8 0 0.0 94 -0.9 15 70
91 A 94 ALA A H H < >5TS+ 0 0 -58.3 -45.4 -179.4 49.0 105.7 26.0 87 -1.5 94 -0.5 0 0.0 0 0.0 16 65
92 A 95 VAL V H H < 35TS+ 0 0 -64.9 -37.1 179.9 48.5 111.9 25.9 88 -2.9 0 0.0 0 0.0 0 0.0 15 66
93 A 96 MET M H H < 35TS- 0 0 -74.9 -12.5 -179.4 -126.5 113.3 48.3 89 -1.4 0 0.0 0 0.0 0 0.0 12 65
94 A 97 ASN N T h < <5T + 0 0 66.4 54.2 179.5 160.7 49.8 15.6 90 -0.9 0 0.0 91 -0.5 0 0.0 7 58
95 A 98 LEU L t T - 0 0 -101.4 102.9 -179.8 -161.4 16.8 148.9 0 0.0 110 -1.6 0 0.0 0 0.0 9 34
108 A 111 PRO P G G > TS+ 0 0 -50.5 -35.1 -179.1 71.4 83.7 34.2 0 0.0 111 -2.2 0 0.0 0 0.0 10 40
109 A 112 LYS K G G 3 TS+ 0 0 -53.7 -34.7 179.8 48.7 96.7 37.8 0 0.0 0 0.0 0 0.0 0 0.0 5 24
110 A 113 LYS K G G < TS+ 0 0 -91.3 13.4 -179.2 82.5 102.0 76.5 107 -1.6 0 0.0 0 0.0 0 0.0 5 25
111 A 114 LEU L S g < TS- 0 0 -122.0 143.4 -179.9 -124.7 76.1 159.6 108 -2.2 0 0.0 0 0.0 0 0.0 9 33
112 A 115 SER S h > T - 0 0 -82.7 154.2 179.0 -108.0 30.9 119.1 0 0.0 116 -3.6 0 0.0 0 0.0 9 28
113 A 116 ARG R H H > TS+ 0 0 -45.0 -42.0 -179.5 50.3 124.2 30.0 0 0.0 117 -2.6 0 0.0 0 0.0 6 30
114 A 117 ARG R H H > TS+ 0 0 -64.8 -47.1 -179.9 45.3 112.4 21.3 0 0.0 118 -1.8 0 0.0 0 0.0 8 26
115 A 118 GLU E H H > TS+ 0 0 -64.4 -43.7 179.0 50.0 113.4 24.0 0 0.0 119 -3.2 0 0.0 0 0.0 12 37
116 A 119 LEU L H H X TS+ 0 0 -57.5 -59.5 179.6 49.2 110.1 9.2 112 -3.6 120 -3.8 0 0.0 0 0.0 10 49
117 A 120 GLU E H H X TS+ 0 0 -46.5 -38.2 -179.9 49.9 113.8 31.8 113 -2.6 121 -1.5 0 0.0 0 0.0 10 41
118 A 121 ARG R H H X > TS+ 0 0 -65.6 -60.4 179.5 42.4 112.8 10.2 114 -1.8 122 -2.5 0 0.0 121 -0.6 10 45
119 A 122 LEU L H H X 3 TS+ 0 0 -52.7 -47.7 179.3 57.8 111.2 22.4 115 -3.2 123 -2.7 0 0.0 0 0.0 9 58
120 A 123 SER S H H X 3 TS+ 0 0 -52.5 -39.1 179.8 42.9 111.1 30.2 116 -3.8 124 -1.9 0 0.0 0 0.0 11 64
121 A 124 ARG R H H X < TS+ 0 0 -73.4 -57.6 -178.3 49.8 111.7 11.5 117 -1.5 125 -2.0 118 -0.6 0 0.0 11 51
122 A 125 ARG R H H X TS+ 0 0 -49.7 -39.3 179.5 51.9 112.4 28.8 118 -2.5 126 -2.0 0 0.0 0 0.0 10 49
123 A 126 PHE F H H X > TS+ 0 0 -60.0 -64.3 -179.4 47.6 108.1 6.0 119 -2.7 127 -1.7 0 0.0 126 -0.9 10 57
124 A 127 PHE F H H < 3 TS+ 0 0 -50.3 -25.6 179.4 50.8 113.2 41.7 120 -1.9 0 0.0 0 0.0 0 0.0 11 63
125 A 128 ARG R H H < > TS+ 0 0 -80.3 -34.2 -179.3 53.3 107.5 30.5 121 -2.0 128 -0.7 0 0.0 0 0.0 9 50
126 A 129 GLU E H H < < TS+ 0 0 -70.1 -29.2 179.6 36.6 116.6 39.9 122 -2.0 0 0.0 123 -0.9 0 0.0 9 42
127 A 130 ILE I T h X > TS+ 0 0 -107.1 10.8 -179.6 105.1 85.5 76.6 123 -1.7 130 -0.9 0 0.0 131 -0.9 11 52
128 A 131 GLN Q G G 4 X TS+ 0 0 -55.5 -46.5 -179.5 66.0 70.0 24.4 125 -0.7 131 -1.3 0 0.0 0 0.0 9 50
129 A 132 VAL V G G 4 3 TS+ 0 0 -43.9 -40.3 -177.4 40.7 106.9 36.6 0 0.0 0 0.0 0 0.0 0 0.0 5 35
130 A 133 ILE I G G 4 < TS+ 0 0 -89.2 -16.0 -178.4 64.4 110.8 51.9 127 -0.9 0 0.0 0 0.0 0 0.0 8 44
131 A 134 ILE I g < < T + 0 0 -112.2 171.3 -179.1 139.7 46.5 127.3 128 -1.3 0 0.0 127 -0.9 0 0.0 11 58
132 A 135 GLY G B B > B > T - 136 0 171.8 166.4 -179.7 -86.4 64.7 155.9 136 -1.7 135 -1.6 0 0.0 136 -1.5 9 51
133 A 136 PRO P T T 4 3 TS+ 0 0 -68.2 -9.9 179.8 36.7 133.5 49.7 0 0.0 0 0.0 0 0.0 0 0.0 11 56
134 A 137 TYR Y T T 4 3 TS+ 0 0 -126.2 21.1 179.7 34.6 126.3 85.8 0 0.0 0 0.0 0 0.0 0 0.0 7 40
135 A 138 ASN N T e 4 < TS- 0 0 -135.7 -54.3 -178.8 -2.8 126.9 59.7 132 -1.6 64 -2.0 0 0.0 0 0.0 10 47
136 A 139 ASP D E E T - 0 0 -133.8 -142.4 179.9 -12.3 54.7 109.6 68 -1.0 144 -1.3 0 0.0 0 0.0 10 55
142 A 145 VAL V T T 3 TS+ 0 0 -70.7 126.8 178.6 1.6 132.7 120.0 0 0.0 70 -2.8 0 0.0 0 0.0 8 41
143 A 146 ASN N T T 3 TS+ 0 0 69.7 25.9 177.2 93.9 113.8 41.3 0 0.0 0 0.0 0 0.0 0 0.0 9 37
144 A 147 THR T t < T + 0 0 -142.8 153.0 -177.5 162.3 46.6 167.4 141 -1.3 0 0.0 0 0.0 0 0.0 12 49
145 A 148 ASN N h > T - 0 0 -154.5 -171.0 -178.6 -58.5 56.2 148.4 0 0.0 149 -3.2 0 0.0 0 0.0 10 41
146 A 149 ALA A H H > TS+ 0 0 -51.8 -30.2 -179.5 55.3 128.0 39.4 0 0.0 150 -1.4 0 0.0 0 0.0 10 45
147 A 150 ASP D H H > TS+ 0 0 -69.8 -51.0 179.2 39.1 112.6 17.9 0 0.0 151 -1.4 0 0.0 0 0.0 9 44
148 A 151 VAL V H H > TS+ 0 0 -64.5 -41.2 -178.5 55.5 114.2 26.9 0 0.0 152 -1.8 0 0.0 0 0.0 11 54
149 A 152 ILE I H H X TS+ 0 0 -63.0 -32.8 179.8 53.6 105.2 32.9 145 -3.2 153 -2.4 0 0.0 0 0.0 15 60
150 A 153 ALA A H H X TS+ 0 0 -72.2 -34.3 178.7 52.6 105.1 31.8 146 -1.4 154 -2.5 0 0.0 0 0.0 11 50
151 A 154 TRP W H H X TS+ 0 0 -66.5 -35.7 -180.0 52.2 109.2 27.5 147 -1.4 155 -2.7 0 0.0 0 0.0 11 47
152 A 155 TYR Y H H X TS+ 0 0 -61.5 -55.0 179.7 48.3 108.7 14.5 148 -1.8 156 -2.1 0 0.0 0 0.0 12 62
153 A 156 MET M H H X TS+ 0 0 -51.6 -48.9 179.8 47.0 114.7 22.6 149 -2.4 157 -2.2 0 0.0 0 0.0 12 58
154 A 157 ASP D H H X TS+ 0 0 -57.1 -65.3 179.5 50.8 108.6 10.4 150 -2.5 158 -2.4 0 0.0 0 0.0 8 43
155 A 158 GLU E H H X TS+ 0 0 -41.3 -39.2 -179.2 52.1 111.6 35.5 151 -2.7 159 -0.9 0 0.0 0 0.0 11 40
156 A 159 TYR Y H H X > TS+ 0 0 -66.7 -51.6 179.4 48.7 107.5 17.7 152 -2.1 160 -3.6 0 0.0 159 -0.9 13 45
157 A 160 GLU E H H X 3 TS+ 0 0 -55.0 -43.2 179.9 57.2 107.3 26.7 153 -2.2 161 -3.4 0 0.0 0 0.0 11 31
158 A 161 MET M H H < 3 TS+ 0 0 -58.7 -31.0 -179.1 34.7 116.8 36.8 154 -2.4 0 0.0 0 0.0 0 0.0 8 24
159 A 162 ASN N H H < < TS+ 0 0 -88.9 -50.7 -179.4 47.4 119.6 25.0 155 -0.9 0 0.0 156 -0.9 0 0.0 6 27
160 A 163 VAL V H H < TS- 0 0 -59.9 -39.9 178.8 -130.2 103.8 30.7 156 -3.6 0 0.0 0 0.0 0 0.0 6 28
161 A 164 GLY G S h < TS+ 0 0 103.6 -0.2 179.6 52.5 72.6 63.8 157 -3.4 0 0.0 0 0.0 0 0.0 6 18
162 A 165 HIS H S S S- 0 0 -160.2 163.6 -177.2 -71.7 95.0 170.5 0 0.0 0 0.0 0 0.0 0 0.0 6 20
163 A 166 THR T + 0 0 -66.5 125.5 178.6 157.8 50.4 114.1 0 0.0 0 0.0 0 0.0 0 0.0 5 29
164 A 167 VAL V + 0 0 -107.9 -78.4 178.4 164.7 3.9 46.3 0 0.0 0 0.0 0 0.0 0 0.0 9 42
165 A 168 LEU L + 0 0 72.3 1.9 177.2 79.9 65.5 61.4 0 0.0 0 0.0 0 0.0 0 0.0 9 55
166 A 169 GLY G + 0 0 -113.8 2.3 -178.4 90.6 67.7 72.8 0 0.0 0 0.0 0 0.0 0 0.0 10 58
167 A 170 ILE I S S S+ 0 0 -71.0 -23.6 178.8 14.0 98.6 43.8 0 0.0 0 0.0 0 0.0 0 0.0 13 65
168 A 171 VAL V - 0 0 -149.8 157.8 179.7 -142.1 69.2 168.8 0 0.0 0 0.0 0 0.0 0 0.0 14 74
169 A 172 THR T S S S+ 0 0 -117.3 169.9 -179.0 57.1 72.9 135.2 138 -1.6 0 0.0 0 0.0 0 0.0 14 68
170 A 173 GLY G S S S+ 0 0 79.6 27.5 179.9 154.0 72.1 39.0 0 0.0 0 0.0 0 0.0 0 0.0 14 57
171 A 174 LYS K - 0 0 -84.6 162.4 179.6 -80.8 56.4 114.3 0 0.0 0 0.0 0 0.0 0 0.0 14 52
172 A 175 PRO P g >>T - 0 0 -62.5 141.1 179.4 -118.8 42.2 114.1 0 0.0 175 -2.7 0 0.0 177 -1.5 11 37
173 A 176 VAL V G G >5TS+ 0 0 -46.0 -46.0 -178.7 57.4 114.5 28.3 0 0.0 176 -1.3 0 0.0 0 0.0 8 38
174 A 177 GLU E G G 35TS+ 0 0 -67.5 -1.6 -179.2 49.5 108.2 60.8 0 0.0 0 0.0 0 0.0 0 0.0 5 29
175 A 178 LEU L G G <5TS- 0 0 -130.1 36.2 178.5 -64.5 138.6 95.3 172 -2.7 0 0.0 0 0.0 0 0.0 8 37
176 A 179 GLY G T g <5TS+ 0 0 96.6 8.6 179.6 132.4 92.8 55.8 173 -1.3 0 0.0 0 0.0 0 0.0 10 46
177 A 180 GLY G t T - 0 0 -127.3 152.9 178.6 -112.7 19.6 156.7 0 0.0 181 -0.7 0 0.0 0 0.0 16 54
179 A 182 LYS K T T 3 TS+ 0 0 -78.4 157.8 179.8 37.6 97.3 115.1 0 0.0 0 0.0 0 0.0 0 0.0 9 44
180 A 183 GLY G T T > 3 TS+ 0 0 77.5 13.0 180.0 128.4 74.0 51.8 0 0.0 184 -0.7 0 0.0 0 0.0 10 48
181 A 184 ARG R T T 4 < TS+ 0 0 -65.8 -43.7 -179.2 47.8 71.2 25.1 178 -0.7 0 0.0 0 0.0 0 0.0 10 57
182 A 185 GLU E T T 4 TS+ 0 0 -62.9 -57.1 -179.1 38.1 117.2 16.1 0 0.0 0 0.0 0 0.0 0 0.0 6 50
183 A 186 GLU E T h > TS+ 0 0 -73.4 -8.7 -178.5 101.7 92.8 54.9 0 0.0 187 -3.2 0 0.0 0 0.0 10 55
184 A 187 ALA A H H X TS+ 0 0 -38.1 -81.2 -179.5 37.6 82.5 26.1 180 -0.7 188 -2.3 0 0.0 0 0.0 12 57
185 A 188 THR T H H > TS+ 0 0 -41.6 -53.1 179.7 50.5 118.5 30.3 0 0.0 189 -2.3 0 0.0 0 0.0 15 68
186 A 189 GLY G H H > TS+ 0 0 -55.2 -50.6 179.7 51.2 108.1 20.5 0 0.0 190 -3.0 0 0.0 0 0.0 18 65
187 A 190 ARG R H H X TS+ 0 0 -55.0 -40.1 178.9 54.3 108.7 27.0 183 -3.2 191 -3.0 0 0.0 0 0.0 13 64
188 A 191 GLY G H H X TS+ 0 0 -57.3 -53.0 178.7 46.7 108.7 16.0 184 -2.3 192 -2.3 0 0.0 0 0.0 16 67
189 A 192 VAL V H H X TS+ 0 0 -54.8 -46.5 178.8 52.7 111.8 23.8 185 -2.3 193 -3.3 0 0.0 0 0.0 15 79
190 A 193 LYS K H H X TS+ 0 0 -55.1 -55.8 -179.7 51.6 106.4 14.1 186 -3.0 194 -2.6 0 0.0 0 0.0 12 72
191 A 194 VAL V H H X TS+ 0 0 -47.8 -45.7 -179.8 45.2 114.3 25.7 187 -3.0 195 -2.4 0 0.0 0 0.0 11 64
192 A 195 CYS C H H X TS+ 0 0 -65.1 -51.4 179.2 54.8 107.5 19.3 188 -2.3 196 -3.3 0 0.0 0 0.0 14 76
193 A 196 ALA A H H X TS+ 0 0 -49.2 -43.6 179.0 47.0 112.2 25.3 189 -3.3 197 -2.3 0 0.0 0 0.0 11 76
194 A 197 GLY G H H X TS+ 0 0 -62.7 -57.3 -180.0 48.7 111.3 9.9 190 -2.6 198 -1.6 0 0.0 0 0.0 11 60
195 A 198 LEU L H H X TS+ 0 0 -50.8 -41.7 -179.7 49.9 112.0 29.2 191 -2.4 199 -2.2 0 0.0 0 0.0 10 54
196 A 199 ALA A H H X TS+ 0 0 -63.5 -43.7 -179.8 58.4 104.4 19.7 192 -3.3 200 -3.0 0 0.0 0 0.0 11 59
197 A 200 MET M H H < >TS+ 0 0 -52.9 -30.5 -179.8 51.9 107.2 33.5 193 -2.3 202 -2.4 0 0.0 0 0.0 11 47
198 A 201 ASP D H H < >5TS+ 0 0 -71.8 -60.5 -178.1 44.6 107.9 6.9 194 -1.6 201 -2.4 0 0.0 0 0.0 9 35
199 A 202 VAL V H H < 35TS+ 0 0 -55.1 -30.6 179.9 48.7 117.3 33.9 195 -2.2 0 0.0 0 0.0 0 0.0 7 35
200 A 203 LEU L T h < 35TS- 0 0 -85.6 -7.8 179.8 -125.6 110.7 56.9 196 -3.0 0 0.0 0 0.0 0 0.0 7 35
201 A 204 GLY G T T <5T + 0 0 71.7 22.9 179.0 146.0 58.4 42.1 198 -2.4 0 0.0 0 0.0 0 0.0 6 24
202 A 205 ILE I t > T - 0 0 -93.9 117.7 -179.7 -141.1 14.2 144.1 0 0.0 207 -2.6 0 0.0 206 -0.9 8 29
204 A 207 PRO P T T 4 3 TS+ 0 0 -43.7 -35.6 -178.9 48.5 102.9 38.8 0 0.0 0 0.0 0 0.0 0 0.0 10 41
205 A 208 LYS K T T 4 3 TS+ 0 0 -76.6 -36.2 -179.1 41.1 116.2 30.9 0 0.0 0 0.0 0 0.0 0 0.0 8 35
206 A 209 LYS K T T 4 < TS+ 0 0 -83.5 -21.8 -179.0 102.9 96.6 45.4 203 -0.9 0 0.0 0 0.0 0 0.0 8 33
207 A 210 ALA A e < T - 0 0 -62.5 156.6 179.0 -148.0 59.3 98.3 203 -2.6 232 -1.8 0 0.0 0 0.0 12 51
208 A 211 THR T E E Ce - 232 0 -128.7 137.0 -178.0 -159.5 12.5 172.2 0 0.0 285 -1.9 0 0.0 284 -1.3 11 58
209 A 212 VAL V E E Cef - 233 285 -123.9 148.3 178.4 -162.5 12.1 154.3 232 -2.6 234 -2.0 0 0.0 235 -1.0 14 72
210 A 213 ALA A E E Cef - 235 286 -128.3 117.4 -179.5 -163.4 11.1 169.3 285 -2.0 287 -2.6 0 0.0 212 -0.6 15 79
211 A 214 VAL V E E Cef - 236 287 -106.7 119.8 179.9 -151.2 7.5 153.7 235 -2.5 237 -0.9 0 0.0 213 -0.8 16 83
212 A 215 GLN Q E E C f + 0 288 -92.2 111.8 -178.8 18.4 68.3 141.0 287 -1.8 289 -1.9 210 -0.6 0 0.0 17 72
213 A 216 GLY G - 0 0 111.7 153.9 -180.0 -137.4 62.9 102.5 211 -0.8 0 0.0 0 0.0 0 0.0 13 63
214 A 217 PHE F + 0 0 -143.1 45.0 178.4 112.1 57.7 97.2 0 0.0 0 0.0 0 0.0 0 0.0 14 64
215 A 218 GLY G S h > TS- 0 0 -92.5 -148.1 180.0 -55.4 91.7 83.2 0 0.0 219 -2.3 0 0.0 0 0.0 7 49
216 A 219 ASN N H H > TS+ 0 0 -56.9 -61.5 -179.3 37.9 140.2 10.1 0 0.0 220 -2.2 0 0.0 0 0.0 9 54
217 A 220 VAL V H H > TS+ 0 0 -56.0 -52.4 -179.7 51.8 116.6 21.9 0 0.0 221 -2.8 0 0.0 0 0.0 13 56
218 A 221 GLY G H H > TS+ 0 0 -51.0 -56.2 -178.7 44.2 112.5 19.1 0 0.0 222 -2.7 0 0.0 0 0.0 15 70
219 A 222 GLN Q H H X TS+ 0 0 -55.9 -57.8 -179.3 40.9 118.1 19.4 215 -2.3 223 -3.3 0 0.0 0 0.0 12 60
220 A 223 PHE F H H X TS+ 0 0 -61.8 -39.8 179.0 53.5 113.9 27.5 216 -2.2 224 -3.2 0 0.0 0 0.0 12 63
221 A 224 ALA A H H X TS+ 0 0 -58.8 -49.1 -179.7 41.1 115.3 16.6 217 -2.8 225 -2.4 0 0.0 0 0.0 14 68
222 A 225 ALA A H H X TS+ 0 0 -64.2 -44.2 -178.9 50.9 116.0 23.7 218 -2.7 226 -1.7 0 0.0 0 0.0 12 75
223 A 226 LEU L H H X TS+ 0 0 -59.1 -57.1 -179.2 35.7 117.8 16.0 219 -3.3 227 -3.0 0 0.0 0 0.0 10 56
224 A 227 LEU L H H X >TS+ 0 0 -68.8 -40.6 179.0 54.8 113.7 28.8 220 -3.2 228 -1.7 0 0.0 229 -1.4 12 56
225 A 228 ILE I H H < 5TS+ 0 0 -60.3 -34.5 180.0 43.2 116.5 26.1 221 -2.4 231 -1.5 0 0.0 0 0.0 14 66
226 A 229 SER S H H X 5TS+ 0 0 -74.1 -54.6 -178.9 32.3 123.5 14.3 222 -1.7 230 -0.7 0 0.0 0 0.0 12 54
227 A 230 GLN Q H H < 5TS+ 0 0 -68.7 -58.4 -177.8 29.1 130.2 14.2 223 -3.0 0 0.0 0 0.0 0 0.0 8 37
228 A 231 GLU E T h < 5TS+ 0 0 -75.3 -37.6 -179.2 35.5 130.5 29.9 224 -1.7 0 0.0 0 0.0 0 0.0 6 40
229 A 232 LEU L T T 4 T - 0 0 174.5 92.9 -173.2 -164.3 21.9 108.6 234 -1.1 248 -1.9 0 0.0 0 0.0 11 42
246 A 249 PRO P T T 3 TS+ 0 0 -63.5 -19.6 179.6 67.3 91.5 44.3 0 0.0 0 0.0 0 0.0 0 0.0 6 34
247 A 250 GLU E T T 3 TS- 0 0 -68.0 -32.4 -179.6 -106.4 116.8 33.1 0 0.0 0 0.0 0 0.0 0 0.0 6 29
248 A 251 GLY G t < T - 0 0 113.0 138.8 179.6 -106.3 26.1 88.0 245 -1.9 0 0.0 0 0.0 0 0.0 9 46
249 A 252 PHE F - 0 0 -90.6 167.9 177.5 -123.1 20.3 114.5 233 -2.3 251 -0.8 0 0.0 0 0.0 10 52
250 A 253 ASP D h > > T - 0 0 -111.3 82.6 -178.9 -168.6 24.1 142.9 0 0.0 254 -2.3 0 0.0 253 -1.0 6 45
251 A 254 VAL V H H > 3 TS+ 0 0 -40.7 -39.9 179.3 64.1 83.5 34.7 249 -0.8 255 -2.4 0 0.0 0 0.0 11 57
252 A 255 GLU E H H > 3 TS+ 0 0 -49.6 -57.3 179.5 34.8 111.1 18.0 0 0.0 256 -1.4 0 0.0 0 0.0 7 36
253 A 256 GLU E H H > < TS+ 0 0 -61.6 -54.5 -179.4 59.8 112.8 17.3 250 -1.0 257 -2.5 0 0.0 0 0.0 7 35
254 A 257 LEU L H H X TS+ 0 0 -45.1 -36.9 -179.6 53.3 104.1 35.8 250 -2.3 258 -2.0 0 0.0 0 0.0 11 52
255 A 258 ILE I H H X TS+ 0 0 -66.8 -50.6 179.9 47.0 108.1 17.8 251 -2.4 259 -1.5 0 0.0 0 0.0 9 44
256 A 259 ARG R H H X > TS+ 0 0 -54.9 -49.9 -179.5 49.7 113.5 19.8 252 -1.4 260 -3.1 0 0.0 259 -0.6 8 29
257 A 260 TYR Y H H X 3 TS+ 0 0 -56.9 -42.7 -179.7 53.2 107.8 27.5 253 -2.5 261 -2.7 0 0.0 0 0.0 11 30
258 A 261 LYS K H H < 3 TS+ 0 0 -64.4 -27.3 -180.0 46.5 112.6 37.3 254 -2.0 0 0.0 0 0.0 0 0.0 10 39
259 A 262 LYS K H H < < TS+ 0 0 -77.9 -52.9 179.7 43.2 115.4 18.6 255 -1.5 0 0.0 256 -0.6 0 0.0 8 25
260 A 263 GLU E H H < TS+ 0 0 -56.4 -59.0 179.4 33.9 123.3 17.4 256 -3.1 0 0.0 0 0.0 0 0.0 6 18
261 A 264 HIS H S h < TS- 0 0 -104.4 133.2 -178.6 -112.4 94.7 151.4 257 -2.7 0 0.0 0 0.0 0 0.0 7 22
262 A 265 GLY G S S S+ 0 0 -34.6 -27.1 -178.2 27.4 91.9 51.0 0 0.0 0 0.0 0 0.0 0 0.0 6 23
263 A 266 THR T - 0 0 -141.1 172.3 179.5 -122.7 67.9 151.6 0 0.0 0 0.0 0 0.0 0 0.0 11 37
264 A 267 VAL V S t > TS+ 0 0 -83.2 -22.4 178.3 92.5 89.2 47.4 0 0.0 267 -1.2 0 0.0 0 0.0 15 50
265 A 268 VAL V T T 3 TS+ 0 0 -63.5 166.5 179.3 38.4 79.8 101.3 0 0.0 0 0.0 0 0.0 0 0.0 11 42
266 A 269 THR T T T 3 TS+ 0 0 75.0 -19.4 179.3 136.5 83.8 75.7 0 0.0 0 0.0 0 0.0 0 0.0 6 33
267 A 270 TYR Y t < T - 0 0 -61.1 123.0 -179.0 -125.7 56.5 115.6 264 -1.2 0 0.0 0 0.0 0 0.0 9 37
268 A 271 PRO P S S S+ 0 0 -64.6 174.6 179.7 45.9 89.6 94.3 0 0.0 0 0.0 0 0.0 0 0.0 4 31
269 A 272 LYS K S S S+ 0 0 58.4 37.9 179.7 102.5 96.1 28.6 0 0.0 0 0.0 0 0.0 0 0.0 5 26
270 A 273 GLY G S S S- 0 0 -157.5 122.5 179.5 -132.2 70.5 151.9 0 0.0 272 -0.8 0 0.0 0 0.0 8 36
271 A 274 GLU E E E CH - 244 0 -75.6 107.4 -179.1 -124.9 36.7 128.2 244 -2.1 244 -2.5 0 0.0 0 0.0 7 31
272 A 275 ARG R E E CH + 243 0 -55.9 136.9 179.5 165.5 39.6 102.5 270 -0.8 0 0.0 0 0.0 0 0.0 10 35
273 A 276 ILE I E E CH - 242 0 -147.7 163.8 -179.1 -100.7 34.2 161.0 242 -3.0 242 -2.8 0 0.0 0 0.0 10 36
274 A 277 THR T h > T - 0 0 -86.5 166.6 179.9 -113.6 30.7 112.7 0 0.0 278 -1.9 0 0.0 0 0.0 8 36
275 A 278 ASN N H H > TS+ 0 0 -63.5 -53.6 -179.4 48.2 118.1 15.3 0 0.0 279 -1.7 0 0.0 0 0.0 12 46
276 A 279 GLU E H H 4 TS+ 0 0 -59.6 -23.6 179.5 55.8 110.2 40.3 0 0.0 0 0.0 0 0.0 0 0.0 7 46
277 A 280 GLU E H H 4 > TS+ 0 0 -73.4 -42.7 179.8 55.3 102.0 25.4 0 0.0 280 -1.3 0 0.0 0 0.0 8 42
278 A 281 LEU L H H < > TS+ 0 0 -54.6 -48.8 179.9 60.2 99.5 23.5 274 -1.9 281 -2.4 0 0.0 0 0.0 14 56
279 A 282 LEU L T h < 3 TS+ 0 0 -52.7 -25.8 -178.8 47.3 107.5 43.1 275 -1.7 0 0.0 0 0.0 0 0.0 13 66
280 A 283 GLU E T T < TS+ 0 0 -101.1 6.5 -180.0 130.5 82.7 70.9 277 -1.3 0 0.0 0 0.0 0 0.0 11 46
281 A 284 LEU L t < T - 0 0 -56.6 159.4 178.3 -110.4 69.4 95.6 278 -2.4 283 -1.3 0 0.0 304 -0.6 10 48
282 A 285 ASP D S S S+ 0 0 -93.9 77.6 179.7 130.2 70.1 131.0 0 0.0 0 0.0 0 0.0 0 0.0 7 41
283 A 286 VAL V - 0 0 -125.3 166.6 180.0 -122.7 63.8 144.7 281 -1.3 0 0.0 0 0.0 0 0.0 12 51
284 A 287 ASP D S e S+ 0 0 -73.5 -52.9 -179.6 26.3 96.3 16.9 208 -1.3 307 -1.5 0 0.0 306 -1.5 11 57
285 A 288 ILE I E E Cfi - 209 307 -118.4 135.8 179.2 -165.3 63.5 159.7 208 -1.9 210 -2.0 0 0.0 287 -0.5 14 68
286 A 289 LEU L E E Cfi - 210 308 -121.0 118.9 -179.3 -162.8 5.3 168.3 307 -2.4 309 -1.2 0 0.0 0 0.0 14 77
287 A 290 VAL V E E Cf - 211 0 -104.2 91.0 179.5 -158.6 5.0 143.4 210 -2.6 212 -1.8 285 -0.5 289 -1.0 12 85
288 A 291 PRO P E E Cf + 212 0 -71.1 104.2 -179.3 159.4 26.8 124.4 0 0.0 312 -1.9 0 0.0 311 -1.2 16 79
289 A 292 ALA A e + 0 0 -125.7 62.1 -179.7 54.2 49.6 118.5 212 -1.9 0 0.0 287 -1.0 0 0.0 15 67
290 A 293 ALA A S S S- 0 0 -148.0 -99.0 -170.8 -2.2 95.6 87.6 0 0.0 0 0.0 0 0.0 0 0.0 13 52
291 A 294 LEU L S t > TS- 0 0 -111.5 167.9 178.2 -96.4 70.3 127.5 0 0.0 294 -0.6 0 0.0 0 0.0 11 40
292 A 295 GLU E T T 3 TS+ 0 0 -76.8 170.0 178.4 30.2 100.5 102.0 0 0.0 0 0.0 0 0.0 0 0.0 11 38
293 A 296 GLY G T T 3 TS+ 0 0 59.0 5.0 -179.8 136.5 73.6 59.1 314 -2.3 0 0.0 0 0.0 0 0.0 9 37
294 A 297 ALA A S t < TS+ 0 0 -45.1 -52.5 178.4 42.1 74.0 24.0 291 -0.6 296 -0.7 0 0.0 0 0.0 12 52
295 A 298 ILE I B B c S+ 316 0 -100.0 112.1 -178.6 147.9 89.8 154.5 315 -1.9 317 -2.3 0 0.0 0 0.0 13 58
296 A 299 HIS H h > > T - 0 0 -132.7 -172.8 -180.0 -70.0 63.0 133.2 294 -0.7 300 -2.6 0 0.0 299 -0.6 12 37
297 A 300 ALA A H H > 3 TS+ 0 0 -46.9 -53.8 -178.9 57.2 123.9 23.4 0 0.0 301 -0.6 0 0.0 0 0.0 10 28
298 A 301 GLY G H H 4 3 TS+ 0 0 -50.4 -42.7 -179.8 21.3 122.0 35.7 0 0.0 0 0.0 0 0.0 0 0.0 6 27
299 A 302 ASN N H H > X TS+ 0 0 -106.1 -8.9 -178.6 103.4 92.2 56.9 296 -0.6 302 -2.5 0 0.0 303 -1.3 9 38
300 A 303 ALA A H H < 3 TS+ 0 0 -40.4 -46.7 -179.0 44.5 87.7 31.4 296 -2.6 0 0.0 0 0.0 0 0.0 11 43
301 A 304 GLU E T h < 3 TS+ 0 0 -75.6 -16.1 -178.5 61.1 107.6 47.2 297 -0.6 0 0.0 0 0.0 0 0.0 8 36
302 A 305 ARG R T T 4 < TS+ 0 0 -83.0 -25.1 -178.2 109.9 73.1 41.3 299 -2.5 0 0.0 0 0.0 0 0.0 6 37
303 A 306 ILE I t < T - 0 0 -58.3 123.8 -179.2 -177.6 40.6 108.1 299 -1.3 0 0.0 0 0.0 0 0.0 10 51
304 A 307 LYS K + 0 0 -101.6 -0.1 -179.9 117.7 44.1 66.2 281 -0.6 0 0.0 0 0.0 0 0.0 9 42
305 A 308 ALA A - 0 0 -71.6 141.1 -179.8 -150.7 56.9 115.8 0 0.0 0 0.0 0 0.0 0 0.0 13 54
306 A 309 LYS K S e S+ 0 0 -81.3 -22.5 -179.3 27.9 85.1 44.4 284 -1.5 330 -1.7 0 0.0 0 0.0 11 52
307 A 310 ALA A E E Cij - 285 330 -143.6 138.8 179.4 -162.6 61.7 177.8 284 -1.5 286 -2.4 0 0.0 309 -0.5 12 67
308 A 311 VAL V E E Cij - 286 331 -123.9 105.3 179.6 -165.3 9.1 161.9 330 -2.3 332 -1.1 0 0.0 310 -0.9 13 82
309 A 312 VAL V E E C j - 0 332 -94.6 105.2 -178.5 -136.9 19.7 145.3 286 -1.2 311 -0.8 307 -0.5 0 0.0 16 79
310 A 313 GLU E e + 0 0 -67.1 102.3 179.3 167.4 32.6 117.7 332 -2.1 0 0.0 308 -0.9 0 0.0 17 75
311 A 314 GLY G + 0 0 -85.6 -23.7 -179.9 44.5 66.8 43.0 288 -1.2 0 0.0 309 -0.8 0 0.0 16 68
312 A 315 ALA A S S S- 0 0 -102.2 -160.9 -180.0 -80.7 100.9 98.2 288 -1.9 314 -0.5 0 0.0 0 0.0 13 62
313 A 316 ASN N S S S- 0 0 -114.2 120.8 179.5 -14.0 100.8 159.8 0 0.0 0 0.0 0 0.0 0 0.0 10 54
314 A 317 GLY G S S S+ 0 0 62.5 38.3 -180.0 157.1 75.6 30.1 312 -0.5 293 -2.3 0 0.0 0 0.0 10 46
315 A 318 PRO P + 0 0 -59.9 -40.9 -178.9 47.8 65.7 23.4 0 0.0 295 -1.9 0 0.0 0 0.0 14 51
316 A 319 THR T B B c S- 295 0 -106.6 137.8 -179.1 -131.8 85.7 148.5 0 0.0 0 0.0 0 0.0 0 0.0 11 55
317 A 320 THR T h > T - 0 0 -84.8 157.2 -179.9 -104.5 26.6 115.7 295 -2.3 321 -2.5 0 0.0 0 0.0 13 43
318 A 321 PRO P H H > TS+ 0 0 -44.2 -55.7 179.8 48.9 121.8 25.3 0 0.0 322 -2.1 0 0.0 0 0.0 7 41
319 A 322 GLU E H H > TS+ 0 0 -53.1 -46.3 -179.3 49.5 111.5 23.3 0 0.0 323 -2.4 0 0.0 0 0.0 8 32
320 A 323 ALA A H H > TS+ 0 0 -62.1 -33.7 179.3 59.5 105.7 31.7 0 0.0 324 -3.5 0 0.0 0 0.0 12 42
321 A 324 ASP D H H X TS+ 0 0 -56.3 -59.2 179.9 44.9 106.8 11.0 317 -2.5 325 -3.0 0 0.0 0 0.0 9 48
322 A 325 GLU E H H X TS+ 0 0 -49.7 -54.1 -179.6 46.7 116.0 22.4 318 -2.1 326 -2.8 0 0.0 0 0.0 8 37
323 A 326 ILE I H H X TS+ 0 0 -56.2 -50.7 -178.7 50.0 112.5 19.3 319 -2.4 327 -2.9 0 0.0 0 0.0 11 34
324 A 327 LEU L H H < >TS+ 0 0 -57.8 -46.0 -179.6 43.8 113.3 24.3 320 -3.5 329 -2.6 0 0.0 0 0.0 13 45
325 A 328 SER S H H < >5TS+ 0 0 -67.9 -37.6 178.6 56.7 110.7 25.3 321 -3.0 328 -1.8 0 0.0 0 0.0 11 40
326 A 329 ARG R H H < 35TS+ 0 0 -55.6 -50.6 179.8 47.5 107.7 16.6 322 -2.8 0 0.0 0 0.0 0 0.0 7 28
327 A 330 ARG R T h < 35TS- 0 0 -71.0 2.5 179.7 -115.4 120.9 62.7 323 -2.9 0 0.0 0 0.0 0 0.0 6 26
328 A 331 GLY G T T <5T + 0 0 65.6 43.0 179.0 154.9 60.2 24.8 325 -1.8 330 -0.6 0 0.0 0 0.0 7 32
329 A 332 ILE I t > T - 0 0 -66.7 150.7 179.6 -122.2 5.3 101.9 0 0.0 337 -3.4 0 0.0 336 -1.0 11 75
334 A 337 ASP D H H > 3 TS+ 0 0 -57.6 -51.4 -177.3 66.3 106.5 20.1 0 0.0 338 -1.9 0 0.0 0 0.0 13 73
335 A 338 ILE I H H 4 3 TS+ 0 0 -46.0 -25.5 178.8 25.8 120.1 39.0 0 0.0 0 0.0 0 0.0 0 0.0 11 70
336 A 339 LEU L H H 4 X TS+ 0 0 -100.6 -53.9 -178.7 50.2 122.8 30.6 333 -1.0 339 -1.3 0 0.0 0 0.0 14 75
337 A 340 ALA A H H < 3 TS+ 0 0 -53.6 -51.6 179.9 33.5 118.8 28.7 333 -3.4 0 0.0 0 0.0 0 0.0 14 79
338 A 341 ASN N T h < 3 TS+ 0 0 -104.0 44.0 178.6 99.3 88.6 100.1 334 -1.9 0 0.0 0 0.0 0 0.0 15 70
339 A 342 ALA A h > < T + 0 0 -105.6 8.4 178.8 103.4 48.6 76.0 336 -1.3 343 -1.9 0 0.0 0 0.0 14 74
340 A 343 GLY G H H > TS+ 0 0 -60.9 -27.6 178.3 54.2 79.0 38.7 0 0.0 344 -1.8 0 0.0 0 0.0 15 68
341 A 344 GLY G H H > TS+ 0 0 -70.2 -59.4 -179.5 47.6 105.5 9.7 0 0.0 345 -2.0 0 0.0 0 0.0 11 72
342 A 345 VAL V H H > TS+ 0 0 -50.0 -34.1 -179.1 55.7 112.1 32.4 0 0.0 346 -1.4 0 0.0 0 0.0 8 77
343 A 346 THR T H H X > TS+ 0 0 -66.6 -50.8 179.5 43.2 107.7 18.0 339 -1.9 347 -1.8 0 0.0 346 -0.6 11 70
344 A 347 VAL V H H X 3 TS+ 0 0 -67.3 -19.8 178.7 61.1 110.1 41.7 340 -1.8 348 -1.7 0 0.0 0 0.0 14 66
345 A 348 SER S H H X 3 TS+ 0 0 -72.6 -34.0 178.8 52.3 100.5 32.2 341 -2.0 349 -2.1 0 0.0 0 0.0 12 75
346 A 349 TYR Y H H X < TS+ 0 0 -66.0 -45.3 178.9 51.9 108.3 21.0 342 -1.4 350 -2.7 343 -0.6 0 0.0 9 71
347 A 350 PHE F H H X TS+ 0 0 -58.8 -41.2 179.2 52.9 106.8 26.1 343 -1.8 351 -3.4 0 0.0 0 0.0 10 59
348 A 351 GLU E H H X TS+ 0 0 -60.0 -48.2 178.4 47.0 110.4 18.2 344 -1.7 352 -2.1 0 0.0 0 0.0 13 59
349 A 352 TRP W H H X TS+ 0 0 -58.9 -43.9 179.7 48.1 114.5 23.0 345 -2.1 353 -2.5 0 0.0 0 0.0 11 60
350 A 353 VAL V H H X TS+ 0 0 -60.3 -58.9 179.9 50.0 110.0 8.5 346 -2.7 354 -1.7 0 0.0 0 0.0 8 43
351 A 354 GLN Q H H < >TS+ 0 0 -47.0 -37.0 -179.4 51.0 112.6 33.3 347 -3.4 356 -1.4 0 0.0 0 0.0 12 41
352 A 355 ASP D H H < >5TS+ 0 0 -68.6 -50.4 -178.9 58.2 101.2 17.2 348 -2.1 355 -2.4 0 0.0 0 0.0 12 39
353 A 356 LEU L H H < 35TS+ 0 0 -48.0 -41.0 -178.9 32.7 118.6 31.3 349 -2.5 0 0.0 0 0.0 0 0.0 7 32
354 A 357 GLN Q T h < 35TS- 0 0 -102.0 12.5 179.7 -132.6 102.4 77.2 350 -1.7 0 0.0 0 0.0 0 0.0 6 22
355 A 358 SER S T T <5TS+ 0 0 40.5 32.3 179.2 117.3 70.6 42.6 352 -2.4 0 0.0 0 0.0 0 0.0 6 29
356 A 359 PHE F t > T - 0 0 -92.0 161.8 -179.0 -90.6 36.5 122.2 0 0.0 363 -1.6 0 0.0 362 -1.5 7 29
360 A 363 LEU L H H > 3 TS+ 0 0 -31.5 -66.7 -178.6 57.1 121.5 33.7 0 0.0 364 -3.1 0 0.0 0 0.0 8 27
361 A 364 ASP D H H > 3 TS+ 0 0 -40.3 -43.8 179.0 47.1 110.1 33.2 0 0.0 365 -2.7 0 0.0 0 0.0 6 23
362 A 365 GLN Q H H > < TS+ 0 0 -64.1 -56.2 179.9 49.1 110.7 12.4 359 -1.5 366 -3.3 0 0.0 0 0.0 8 29
363 A 366 VAL V H H X TS+ 0 0 -50.5 -40.1 179.6 50.1 114.1 27.7 359 -1.6 367 -2.3 0 0.0 0 0.0 13 42
364 A 367 ARG R H H X TS+ 0 0 -61.9 -65.4 -178.9 44.0 111.6 3.9 360 -3.1 368 -2.9 0 0.0 0 0.0 9 43
365 A 368 ASN N H H X TS+ 0 0 -47.0 -49.0 -180.0 50.9 114.3 26.5 361 -2.7 369 -3.1 0 0.0 0 0.0 8 33
366 A 369 ALA A H H X TS+ 0 0 -56.9 -46.5 -179.8 48.0 111.7 21.6 362 -3.3 370 -2.1 0 0.0 0 0.0 8 43
367 A 370 LEU L H H X TS+ 0 0 -59.4 -54.2 179.9 44.3 114.6 15.5 363 -2.3 371 -2.2 0 0.0 0 0.0 13 54
368 A 371 GLU E H H X TS+ 0 0 -58.7 -42.1 179.8 56.5 110.3 25.3 364 -2.9 372 -2.8 0 0.0 0 0.0 11 50
369 A 372 LYS K H H X TS+ 0 0 -55.3 -50.1 -179.4 41.1 111.8 21.1 365 -3.1 373 -2.1 0 0.0 0 0.0 8 39
370 A 373 MET M H H X TS+ 0 0 -70.0 -33.2 179.2 54.0 113.0 33.9 366 -2.1 374 -2.7 0 0.0 0 0.0 9 47
371 A 374 MET M H H X TS+ 0 0 -64.2 -52.9 178.7 48.4 109.0 12.0 367 -2.2 375 -2.9 0 0.0 0 0.0 14 57
372 A 375 LYS K H H X TS+ 0 0 -49.3 -50.7 179.2 48.7 114.4 22.2 368 -2.8 376 -2.4 0 0.0 0 0.0 11 44
373 A 376 GLY G H H X TS+ 0 0 -53.6 -68.9 -179.7 46.3 110.6 11.0 369 -2.1 377 -3.0 0 0.0 0 0.0 8 40
374 A 377 ALA A H H X TS+ 0 0 -41.6 -49.7 -179.8 56.1 110.8 27.6 370 -2.7 378 -2.8 0 0.0 0 0.0 12 57
375 A 378 PHE F H H X TS+ 0 0 -49.3 -58.0 180.0 39.8 112.8 17.8 371 -2.9 379 -3.0 0 0.0 0 0.0 11 61
376 A 379 ASN N H H X TS+ 0 0 -60.0 -47.0 179.6 56.0 111.4 22.5 372 -2.4 380 -2.7 0 0.0 0 0.0 8 45
377 A 380 ASP D H H X TS+ 0 0 -53.8 -38.8 179.1 43.7 113.1 26.5 373 -3.0 381 -1.6 0 0.0 0 0.0 9 47
378 A 381 VAL V H H X TS+ 0 0 -70.4 -48.0 178.8 58.1 108.8 17.9 374 -2.8 382 -1.9 0 0.0 0 0.0 13 51
379 A 382 MET M H H X TS+ 0 0 -45.2 -52.8 -179.8 49.7 105.7 25.4 375 -3.0 383 -1.6 0 0.0 0 0.0 10 43
380 A 383 LYS K H H X > TS+ 0 0 -53.9 -59.3 -179.9 49.6 108.7 14.9 376 -2.7 384 -2.4 0 0.0 383 -0.7 8 31
381 A 384 VAL V H H X 3 TS+ 0 0 -50.3 -30.2 -178.7 63.1 105.8 34.7 377 -1.6 385 -0.5 0 0.0 0 0.0 12 38
382 A 385 LYS K H H X 3>TS+ 0 0 -61.2 -51.2 179.4 38.5 107.2 20.4 378 -1.9 386 -1.4 0 0.0 387 -1.3 14 38
383 A 386 GLU E H H < <5TS+ 0 0 -66.6 -41.0 180.0 63.6 108.8 27.4 379 -1.6 0 0.0 380 -0.7 0 0.0 8 26
384 A 387 LYS K H H < 5TS+ 0 0 -59.7 -13.0 -179.4 19.9 122.8 52.5 380 -2.4 0 0.0 0 0.0 0 0.0 6 25
385 A 388 TYR Y H H < 5TS- 0 0 -135.4 -5.3 -179.6 -131.2 95.1 66.1 381 -0.5 0 0.0 0 0.0 0 0.0 8 27
386 A 389 ASN N T h < 5T + 0 0 49.8 48.0 179.3 132.1 63.6 23.9 382 -1.4 0 0.0 0 0.0 0 0.0 6 30
387 A 390 VAL V t T - 0 0 -84.4 154.2 -178.8 -107.0 44.1 122.1 0 0.0 392 -2.8 0 0.0 0 0.0 9 53
389 A 392 MET M H H > TS+ 0 0 -49.2 -35.6 179.3 57.2 118.6 36.5 0 0.0 393 -2.5 0 0.0 0 0.0 13 62
390 A 393 ARG R H H > TS+ 0 0 -63.2 -51.2 179.3 41.4 111.0 12.6 0 0.0 394 -2.0 0 0.0 0 0.0 9 72
391 A 394 THR T H H > TS+ 0 0 -59.9 -45.8 178.7 55.8 112.4 19.8 0 0.0 395 -2.4 0 0.0 0 0.0 11 58
392 A 395 ALA A H H X TS+ 0 0 -50.8 -46.3 -179.8 51.1 106.9 22.5 388 -2.8 396 -2.8 0 0.0 0 0.0 15 51
393 A 396 ALA A H H X TS+ 0 0 -60.6 -42.1 -179.8 48.4 109.7 25.8 389 -2.5 397 -2.2 0 0.0 0 0.0 15 62
394 A 397 TYR Y H H X TS+ 0 0 -68.1 -32.4 -179.6 50.7 111.7 32.2 390 -2.0 398 -3.3 0 0.0 0 0.0 12 64
395 A 398 ILE I H H X TS+ 0 0 -66.5 -58.1 178.9 48.2 110.0 9.5 391 -2.4 399 -3.3 0 0.0 0 0.0 12 59
396 A 399 LEU L H H X TS+ 0 0 -46.8 -46.3 179.8 45.0 116.9 26.3 392 -2.8 400 -2.2 0 0.0 0 0.0 13 58
397 A 400 ALA A H H X TS+ 0 0 -63.9 -55.8 -179.7 47.3 113.3 13.5 393 -2.2 401 -2.2 0 0.0 0 0.0 12 66
398 A 401 ILE I H H X TS+ 0 0 -57.6 -28.5 179.4 56.6 111.2 36.8 394 -3.3 402 -1.6 0 0.0 0 0.0 11 68
399 A 402 ASP D H H X TS+ 0 0 -66.2 -61.6 -179.4 44.5 106.6 4.3 395 -3.3 403 -2.6 0 0.0 0 0.0 8 55
400 A 403 ARG R H H X TS+ 0 0 -50.0 -44.2 -179.7 50.7 113.6 30.6 396 -2.2 404 -2.1 0 0.0 0 0.0 9 49
401 A 404 VAL V H H X TS+ 0 0 -63.6 -40.1 -179.4 48.8 111.8 24.0 397 -2.2 405 -2.8 0 0.0 0 0.0 13 54
402 A 405 ALA A H H X TS+ 0 0 -64.3 -51.3 179.6 50.1 109.4 18.5 398 -1.6 406 -2.7 0 0.0 0 0.0 10 46
403 A 406 TYR Y H H X TS+ 0 0 -52.3 -50.5 -180.0 44.4 114.7 21.5 399 -2.6 407 -3.5 0 0.0 0 0.0 8 35
404 A 407 ALA A H H X TS+ 0 0 -60.4 -48.6 -179.7 52.3 112.3 18.0 400 -2.1 408 -1.9 0 0.0 0 0.0 10 33
405 A 408 THR T H H < TS+ 0 0 -55.2 -36.3 -179.0 45.1 114.3 30.1 401 -2.8 0 0.0 0 0.0 0 0.0 9 38
406 A 409 LYS K H H < TS+ 0 0 -73.7 -51.0 -179.3 54.6 106.8 21.1 402 -2.7 0 0.0 0 0.0 0 0.0 6 23
407 A 410 LYS K H H < T 0 0 -54.7 -31.9 -179.8 999.9 999.9 35.6 403 -3.5 0 0.0 0 0.0 0 0.0 5 14
408 A 411 ARG R h < T 0 0 -77.4 999.9 999.9 999.9 999.9 102.3 404 -1.9 0 0.0 0 0.0 0 0.0 4 16
2tmgA.pdb
2TMG OXIDOREDUCTASE MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand HHHHHHHHHHHHHHHTT HHHHHHHHS SEEEEEEEEEE TTS EEEEEEEEEEEE TTSSEE EEEESS HHHHHHHHHHHHHHHHHHT S EE Kabs/Sand
chirality +++++++++++++++-+--++++++++--++----+-----+-+-----+-+--+-+++----+----+-++--+++++++++++++++++-+-+--+- chirality
bends SSSSSSSSSSSSSSS SSSSSSSSS S SSS SSSS SS SSSSSSSSSSSSSSSSSS S bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTT TTTT TTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< 5-turns
3-turns >33< >33< >33< >33< >33< 3-turns
bridge-2 BBBBB*B a bridge-2
bridge-1 AAAAAAAAAA AAAAAAAAAA cc dddd BB bridge-1
sheets AAAAAAAAAA AAAAAAAAAAAA BB AAAA AA sheets
4-turns >>>>XXXXXXXXX<<<< >>>>XX<<<< >>>>XXXXXXXXXXXX<<<< 4-turns
summary hHHHHHHHHHHHHHHHhTthHHHHHHHHh SEEEEEEEEEEeTTteEEEEEEEEEEEEtTTtSEEeeEEEESS hHHHHHHHHHHHHHHHHHHhtS EE summary
sequence SLYEMAVEQFNRAASLMDLESDLAEVLRRPKRVLIVEFPVRMDDGHVEVFTGYRVQHNVARGPAKGGIRYHPDVTLDEVKALAFWMTWKTAVMNLPFGGG sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand EEEEE GGGS HHHHHHHHHHHHHHTGGG BTTTEE B TT HHHHHHHHHHHHHHHSS S SS GGGT TTTTTHHHHHHHHHHHHHHHHT Kabs/Sand
chirality -+--+--+++--+++++++++++++++++++-++-----+-+++-++++++++++++++-+-+++++-++--++-+--+++++++++++++++++++++- chirality
bends SSSS SSSSSSSSSSSSSSSSSS SSS SS SSSSSSSSSSSSSSSSS S SS SSSS SSSSSSSSSSSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >555 5-turns
3-turns >>3<< >33< >3><>X3<<>33< >33< >33< >>3<< >33< >33 3-turns
bridge-2 dddd B bridge-2
bridge-1 BBBB B cc a bridge-1
sheets AAAAA BB sheets
4-turns >>>>XXXXXXXX<<444< >>>>XXXXXXXXX<<<< >44>X>>XXXXXXXXXX<<<< 4-turns
summary EEEEEegGGGghHHHHHHHHHHHHHHhGGGgBTTeEE BtTTthHHHHHHHHHHHHHHHhS S SS gGGGgttTTTThHHHHHHHHHHHHHHHHh summary
sequence KGGVRVDPKKLSRRELERLSRRFFREIQVIIGPYNDIPAPDVNTNADVIAWYMDEYEMNVGHTVLGIVTGKPVELGGSKGREEATGRGVKVCAGLAMDVL sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand T TTT EEEEE SHHHHHHHHHHHHTT EEEEEE SS EEE TT HHHHHHHHHHSS STT SSSEEE HHHHTT S SEEEE SSTTSB HHHH Kabs/Sand
chirality +--+++-----+-+-+++++++++++++-+--+++---+----+-+----++++++++++-+-+++-++--+--++++++-+-+---++--++++-++++ chirality
bends SSS SSSSSSSSSSSSSSS SS SS SSSSSSSSSSSS SSS SSS SSSSSS S S SSSSSS SSSS bends
turns TTTTTTT TTTTTTTTTTTTTTTT TTTT TTTTTTTTTTTT TTTT TTTTTTTT TTTT TTTTT turns
5-turns 5< >5555< 5-turns
3-turns < >33< >33< >33< >33< >33< >>3<< >33< >33X3 3-turns
bridge-2 ffff GGG HHH ii bridge-2
bridge-1 eeee ee*ee GGG HHH ffff c bridge-1
sheets CCCCC CCCCCC CCC CCC CCCC sheets
4-turns >444< >>>>XXXXXX>>>XXXX<<<< >>44<< >>4>< 4-turns
summary TttTTTeEEEEE hHHHHHHHHHHHHhTt EEEEEEeSSeEEEeTTt hHHHHHHHHHHhS tTTtSSSEEEhHHHHhTtS eEEEEeStTTtBhHHHH summary
sequence GIDPKKATVAVQGFGNVGQFAALLISQELGSKVVAVSDSRGGIYNPEGFDVEELIRYKKEHGTVVTYPKGERITNEELLELDVDILVPAALEGAIHAGNA sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand TT SEEE SSS B HHHHHHHHHTT EEE HHHHT HHHHHHHHHHHHHHTT HHHHHHHHHHHHHHHHHHHHHHHHHHT HHHHHHHHHHHH Kabs/Sand
chirality ++-+-+---++--++--+++++++++-+-----++++++++++++++++++++-+----+++++++++++++++++++++++++-+--++++++++++++ chirality
bends SS S SSS S SSSSSSSSSS SSSSS SSSSSSSSSSSSSSSS SSSSSSSSSSSSSSSSSSSSSSSSSS SSSSSSSSSSSS bends
turns TTT TTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< >5555< 5-turns
3-turns 3< >33< >33X33< >33< >33< >33< >33< 3-turns
bridge-2 jjj bridge-2
bridge-1 ii c jjj bridge-1
sheets CCC CCC sheets
4-turns <4< >>>>XXX<<<< >>44<<>>>>XXXXXXXX<<<< >>>>XXXXXXXXXXXXXXXXXXXX<<<< >>>>XXXXXXXXX 4-turns
summary hTt eEEEe SSS BhHHHHHHHHHhTtEEEhHHHHhhHHHHHHHHHHHHHHhTt hHHHHHHHHHHHHHHHHHHHHHHHHHHhthHHHHHHHHHHHH summary
sequence ERIKAKAVVEGANGPTTPEADEILSRRGILVVPDILANAGGVTVSYFEWVQDLQSFFWDLDQVRNALEKMMKGAFNDVMKVKEKYNVDMRTAAYILAIDR sequence
310 320 330 340 350 360 370 380 390 400
author author
Kabs/Sand HHHHHHH Kabs/Sand
chirality ++++++ chirality
bends SSSSSS bends
turns TTTTTTTT turns
5-turns 5-turns
3-turns 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns XXXX<<<< 4-turns
summary HHHHHHHh summary
sequence VAYATKKR sequence