Secondary structure calculation program - copyright by David Keith Smith, 1989
1bvp1.pdb
1BVP COAT PROTEIN (VIRAL) BLUETONGUE VIRUS 10 (USA) VP7 (BTV-10 (USA) VP7) BLUETONGUE VIRUS
Sequence length - 349
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 1 1 MET M h > T 0 0 999.9 -37.9 175.9 999.9 999.9 999.9 0 0.0 5 -1.7 0 0.0 0 0.0 6 39
2 1 2 ASP D H H > T + 0 0 -72.6 -36.2 177.9 52.0 999.9 25.1 0 0.0 6 -2.6 0 0.0 0 0.0 8 46
3 1 3 THR T H H > TS+ 0 0 -64.2 -39.1 177.2 57.1 103.7 29.7 0 0.0 7 -2.6 0 0.0 0 0.0 9 43
4 1 4 ILE I H H > TS+ 0 0 -57.8 -47.2 -179.1 43.4 110.3 16.4 0 0.0 8 -2.4 0 0.0 0 0.0 11 53
5 1 5 ALA A H H X TS+ 0 0 -65.6 -42.9 178.0 54.7 110.7 22.0 1 -1.7 9 -2.6 0 0.0 0 0.0 11 60
6 1 6 ALA A H H X TS+ 0 0 -56.9 -38.4 177.0 48.1 110.6 27.4 2 -2.6 10 -2.2 0 0.0 0 0.0 14 54
7 1 7 ARG R H H X TS+ 0 0 -68.7 -47.7 179.7 48.8 110.0 19.8 3 -2.6 11 -2.9 0 0.0 0 0.0 14 61
8 1 8 ALA A H H X TS+ 0 0 -57.3 -45.2 179.1 47.8 114.2 19.8 4 -2.4 12 -2.6 0 0.0 0 0.0 13 71
9 1 9 LEU L H H X TS+ 0 0 -60.0 -46.9 178.3 50.7 111.1 27.3 5 -2.6 13 -2.5 0 0.0 0 0.0 12 65
10 1 10 THR T H H X TS+ 0 0 -58.0 -48.9 179.7 45.8 112.8 21.3 6 -2.2 14 -1.6 0 0.0 0 0.0 11 61
11 1 11 VAL V H H X TS+ 0 0 -63.7 -43.6 -180.0 49.2 112.9 26.9 7 -2.9 15 -2.1 0 0.0 0 0.0 13 76
12 1 12 MET M H H X TS+ 0 0 -65.6 -41.4 179.7 50.0 110.1 24.6 8 -2.6 16 -1.5 0 0.0 0 0.0 12 69
13 1 13 ARG R H H < TS+ 0 0 -66.2 -30.3 178.6 52.8 110.1 30.6 9 -2.5 0 0.0 0 0.0 0 0.0 10 53
14 1 14 ALA A H H < > TS+ 0 0 -68.7 -43.0 179.9 52.5 106.1 25.7 10 -1.6 17 -1.7 0 0.0 0 0.0 11 58
15 1 15 CYS C H H < > TS+ 0 0 -64.2 -29.1 -179.4 63.8 98.9 33.6 11 -2.1 18 -1.3 0 0.0 0 0.0 9 64
16 1 16 ALA A T h < 3 TS+ 0 0 -70.9 -5.2 179.0 68.6 91.9 58.6 12 -1.5 0 0.0 0 0.0 0 0.0 11 49
17 1 17 THR T T T < TS+ 0 0 -80.7 -28.5 -178.8 90.4 72.6 41.8 14 -1.7 19 -3.1 0 0.0 0 0.0 7 43
18 1 18 LEU L t < T + 0 0 -68.5 55.5 -177.7 146.3 46.2 101.4 15 -1.3 0 0.0 0 0.0 0 0.0 10 48
19 1 19 GLN Q + 0 0 -64.1 -38.5 -177.5 10.5 64.2 25.0 17 -3.1 0 0.0 0 0.0 0 0.0 8 33
20 1 20 GLU E S S S- 0 0 -140.0 176.2 -177.4 -108.4 72.5 138.7 0 0.0 0 0.0 0 0.0 0 0.0 5 29
21 1 21 ALA A S S S+ 0 0 -71.1 -53.4 -176.8 29.2 106.8 18.5 0 0.0 0 0.0 0 0.0 0 0.0 8 22
22 1 22 ARG R S S S+ 0 0 -94.5 -1.6 179.5 121.3 85.4 60.3 0 0.0 0 0.0 0 0.0 0 0.0 4 15
23 1 23 ILE I - 0 0 -56.2 157.5 178.8 -114.5 63.9 92.4 0 0.0 25 -0.5 0 0.0 0 0.0 6 20
24 1 24 VAL V - 0 0 -104.6 129.2 -178.5 -131.0 27.5 151.7 0 0.0 0 0.0 0 0.0 0 0.0 4 21
25 1 25 LEU L - 0 0 -76.7 147.0 175.2 -111.4 19.0 112.8 23 -0.5 0 0.0 0 0.0 0 0.0 6 25
26 1 26 GLU E h > T - 0 0 -67.0 142.9 -176.8 -119.7 37.8 118.8 0 0.0 30 -1.2 0 0.0 0 0.0 6 24
27 1 27 ALA A H H > TS+ 0 0 -55.9 -45.3 178.0 62.8 110.5 28.4 0 0.0 31 -2.3 0 0.0 0 0.0 6 21
28 1 28 ASN N H H > TS+ 0 0 -45.7 -47.7 179.4 51.5 102.7 23.3 0 0.0 32 -1.8 0 0.0 0 0.0 6 30
29 1 29 VAL V H H > TS+ 0 0 -61.0 -46.9 -179.6 48.0 109.1 28.6 0 0.0 33 -2.7 0 0.0 0 0.0 9 38
30 1 30 MET M H H X TS+ 0 0 -65.8 -36.4 179.1 55.5 107.8 30.1 26 -1.2 34 -2.2 0 0.0 0 0.0 9 34
31 1 31 GLU E H H X TS+ 0 0 -61.1 -42.6 -180.0 40.1 114.6 21.1 27 -2.3 35 -1.6 0 0.0 0 0.0 8 31
32 1 32 ILE I H H X TS+ 0 0 -71.4 -52.4 179.9 47.3 116.0 23.2 28 -1.8 36 -2.8 0 0.0 0 0.0 12 44
33 1 33 LEU L H H X TS+ 0 0 -58.9 -39.0 179.4 57.2 109.6 28.4 29 -2.7 37 -2.9 0 0.0 0 0.0 12 50
34 1 34 GLY G H H X TS+ 0 0 -55.9 -59.1 179.7 36.2 113.3 14.6 30 -2.2 38 -1.9 0 0.0 0 0.0 9 40
35 1 35 ILE I H H X TS+ 0 0 -60.5 -48.0 -177.9 48.0 120.2 24.8 31 -1.6 39 -2.7 0 0.0 0 0.0 10 41
36 1 36 ALA A H H X TS+ 0 0 -61.7 -50.3 -178.6 45.6 113.4 17.9 32 -2.8 40 -2.9 0 0.0 0 0.0 11 60
37 1 37 ILE I H H X TS+ 0 0 -64.0 -35.7 179.3 52.6 112.3 29.1 33 -2.9 41 -2.9 0 0.0 0 0.0 11 55
38 1 38 ASN N H H X TS+ 0 0 -65.8 -51.6 179.6 42.8 112.9 12.5 34 -1.9 42 -2.3 0 0.0 0 0.0 8 39
39 1 39 ARG R H H X TS+ 0 0 -58.0 -46.1 -179.2 50.3 116.6 18.6 35 -2.7 43 -2.3 0 0.0 0 0.0 9 42
40 1 40 TYR Y H H X TS+ 0 0 -57.1 -57.9 179.8 45.5 110.6 18.4 36 -2.9 44 -1.7 0 0.0 0 0.0 13 50
41 1 41 ASN N H H X TS+ 0 0 -57.4 -34.2 179.5 53.9 113.6 26.6 37 -2.9 45 -2.7 0 0.0 0 0.0 11 38
42 1 42 GLY G H H < TS+ 0 0 -67.5 -47.7 -179.1 34.3 115.0 24.0 38 -2.3 0 0.0 0 0.0 0 0.0 8 27
43 1 43 LEU L H H < TS+ 0 0 -81.2 -13.9 -175.2 36.2 130.4 50.6 39 -2.3 0 0.0 0 0.0 0 0.0 10 29
44 1 44 THR T H H < TS- 0 0 -110.0 -31.2 -179.1 -134.4 92.6 48.5 40 -1.7 0 0.0 0 0.0 0 0.0 9 34
45 1 45 LEU L h < T + 0 0 75.6 23.2 176.2 132.0 60.3 42.8 41 -2.7 0 0.0 0 0.0 0 0.0 7 27
46 1 46 ARG R - 0 0 -93.6 174.7 -178.0 -131.4 57.2 118.8 0 0.0 0 0.0 0 0.0 0 0.0 8 37
47 1 47 GLY G + 0 0 -130.4 66.0 -179.1 172.3 31.4 116.2 0 0.0 0 0.0 0 0.0 0 0.0 6 36
48 1 48 VAL V - 0 0 -72.4 136.9 178.2 -146.9 20.6 120.2 0 0.0 0 0.0 0 0.0 0 0.0 10 47
49 1 49 THR T - 0 0 -99.6 157.3 176.7 -130.5 14.6 140.7 0 0.0 0 0.0 0 0.0 0 0.0 8 42
50 1 50 MET M S S S+ 0 0 -77.6 -27.5 179.0 36.0 103.5 40.7 0 0.0 0 0.0 0 0.0 0 0.0 7 51
51 1 51 ARG R S S S- 0 0 -129.6 89.0 -179.5 -160.6 83.5 140.8 0 0.0 0 0.0 0 0.0 0 0.0 6 44
52 1 52 PRO P + 0 0 -68.1 137.7 178.3 160.4 22.8 114.8 0 0.0 0 0.0 0 0.0 0 0.0 10 42
53 1 53 THR T + 0 0 -122.5 -55.3 178.8 61.6 55.4 50.0 0 0.0 0 0.0 0 0.0 0 0.0 7 28
54 1 54 SER S S h > TS- 0 0 -72.7 162.8 177.6 -112.5 87.4 105.8 0 0.0 58 -1.8 0 0.0 0 0.0 6 26
55 1 55 LEU L H H > TS+ 0 0 -60.6 -39.9 -179.3 57.9 118.2 27.6 0 0.0 59 -2.9 0 0.0 0 0.0 9 30
56 1 56 ALA A H H > TS+ 0 0 -61.3 -34.3 179.9 47.0 107.4 27.4 0 0.0 60 -1.9 0 0.0 0 0.0 6 26
57 1 57 GLN Q H H > TS+ 0 0 -74.7 -35.0 178.1 51.0 111.1 32.8 0 0.0 61 -1.9 0 0.0 0 0.0 11 36
58 1 58 ARG R H H X TS+ 0 0 -67.4 -44.4 178.2 49.4 110.1 19.3 54 -1.8 62 -2.9 0 0.0 0 0.0 13 43
59 1 59 ASN N H H X TS+ 0 0 -59.1 -46.0 -178.6 52.0 110.0 19.8 55 -2.9 63 -3.1 0 0.0 0 0.0 12 47
60 1 60 GLU E H H X TS+ 0 0 -59.9 -41.2 179.2 45.1 111.7 26.6 56 -1.9 64 -1.3 0 0.0 0 0.0 11 51
61 1 61 MET M H H X TS+ 0 0 -69.8 -41.3 178.1 51.7 112.6 23.8 57 -1.9 65 -1.9 0 0.0 0 0.0 11 62
62 1 62 PHE F H H X TS+ 0 0 -60.4 -41.7 179.0 53.6 106.8 24.9 58 -2.9 66 -2.9 0 0.0 0 0.0 12 68
63 1 63 PHE F H H X TS+ 0 0 -63.1 -29.2 179.5 55.1 105.1 31.6 59 -3.1 67 -2.6 0 0.0 0 0.0 9 68
64 1 64 MET M H H X TS+ 0 0 -68.8 -40.9 178.9 45.7 110.1 24.7 60 -1.3 68 -2.0 0 0.0 0 0.0 10 69
65 1 65 CYS C H H X TS+ 0 0 -66.7 -43.4 177.3 52.2 111.1 22.4 61 -1.9 69 -2.9 0 0.0 0 0.0 13 78
66 1 66 LEU L H H X TS+ 0 0 -57.9 -45.5 179.2 49.6 110.1 19.9 62 -2.9 70 -2.8 0 0.0 0 0.0 9 81
67 1 67 ASP D H H X TS+ 0 0 -59.2 -43.4 -178.4 47.0 112.7 26.1 63 -2.6 71 -2.3 0 0.0 0 0.0 12 67
68 1 68 MET M H H X TS+ 0 0 -67.9 -40.0 177.6 50.0 111.5 28.7 64 -2.0 72 -2.2 0 0.0 0 0.0 12 70
69 1 69 MET M H H X TS+ 0 0 -63.8 -50.3 -179.8 46.4 113.3 12.4 65 -2.9 73 -2.2 0 0.0 0 0.0 13 71
70 1 70 LEU L H H X >TS+ 0 0 -61.4 -40.5 -179.9 49.0 113.1 25.7 66 -2.8 75 -1.9 0 0.0 74 -1.2 11 61
71 1 71 SER S H H < 5TS+ 0 0 -67.3 -40.2 179.8 47.0 112.2 23.1 67 -2.3 0 0.0 0 0.0 0 0.0 12 54
72 1 72 ALA A H H < 5TS+ 0 0 -68.3 -33.8 -179.5 47.4 115.0 31.7 68 -2.2 0 0.0 0 0.0 0 0.0 13 58
73 1 73 ALA A H H < 5TS- 0 0 -81.2 -15.3 178.8 -123.6 109.8 52.4 69 -2.2 0 0.0 0 0.0 0 0.0 11 56
74 1 74 GLY G T h < 5T + 0 0 79.6 21.8 -178.8 141.7 62.2 47.7 70 -1.2 0 0.0 0 0.0 0 0.0 6 45
75 1 75 ILE I t T - 0 0 -104.6 104.8 -179.1 -166.2 9.0 149.2 0 0.0 90 -1.9 0 0.0 0 0.0 7 44
88 1 88 MET M T T > TS+ 0 0 -61.2 -24.3 179.0 74.9 81.5 45.7 86 -0.8 91 -1.4 0 0.0 0 0.0 7 37
89 1 89 ALA A T h > > TS+ 0 0 -64.2 -13.9 -179.1 89.3 71.3 50.4 0 0.0 92 -1.6 0 0.0 93 -1.1 8 37
90 1 90 THR T H H > < TS+ 0 0 -54.8 -30.0 179.1 66.7 74.6 33.8 87 -1.9 94 -2.7 0 0.0 0 0.0 13 53
91 1 91 ILE I H H > < TS+ 0 0 -59.9 -35.2 178.9 51.5 99.3 28.9 88 -1.4 95 -1.1 0 0.0 0 0.0 11 44
92 1 92 GLY G H H 4 < TS+ 0 0 -69.2 -37.7 177.1 52.3 107.7 30.7 89 -1.6 0 0.0 0 0.0 0 0.0 8 39
93 1 93 VAL V H H < > TS+ 0 0 -60.6 -52.4 -178.7 47.0 110.6 13.5 89 -1.1 96 -1.7 0 0.0 0 0.0 11 51
94 1 94 LEU L H H < 3 TS+ 0 0 -64.9 -20.1 179.0 57.9 106.5 47.4 90 -2.7 0 0.0 0 0.0 0 0.0 12 53
95 1 95 ALA A T h < 3 TS+ 0 0 -90.6 3.5 -179.5 115.3 77.3 67.5 91 -1.1 0 0.0 0 0.0 0 0.0 9 39
96 1 96 THR T t X T - 0 0 -76.4 113.4 -179.7 -148.9 60.7 131.2 93 -1.7 99 -2.2 0 0.0 0 0.0 7 38
97 1 97 PRO P T T 3 TS+ 0 0 -61.2 -8.4 -179.7 70.1 89.6 53.4 0 0.0 0 0.0 0 0.0 0 0.0 5 29
98 1 98 GLU E T T 3 TS+ 0 0 -85.6 -16.8 177.5 86.6 76.0 48.8 0 0.0 0 0.0 0 0.0 0 0.0 5 28
99 1 99 ILE I S t < TS- 0 0 -82.2 117.6 -179.5 -142.6 78.1 139.9 96 -2.2 0 0.0 0 0.0 0 0.0 10 45
100 1 100 PRO P - 0 0 -81.3 155.8 176.4 -149.8 8.6 114.4 0 0.0 0 0.0 0 0.0 0 0.0 7 41
101 1 101 PHE F - 0 0 -119.7 151.1 -179.1 -111.0 22.4 155.0 0 0.0 0 0.0 0 0.0 0 0.0 11 44
102 1 102 THR T h > T - 0 0 -81.0 160.6 176.0 -114.3 21.4 116.2 0 0.0 106 -2.7 0 0.0 0 0.0 9 38
103 1 103 THR T H H > TS+ 0 0 -55.1 -42.8 178.2 53.6 117.6 25.2 0 0.0 107 -2.7 0 0.0 0 0.0 6 27
104 1 104 GLU E H H > TS+ 0 0 -58.8 -54.6 -178.8 43.7 110.9 14.7 0 0.0 108 -2.5 0 0.0 0 0.0 6 30
105 1 105 ALA A H H > TS+ 0 0 -60.2 -40.4 -177.5 50.9 114.2 23.2 0 0.0 109 -2.5 0 0.0 0 0.0 12 42
106 1 106 ALA A H H X TS+ 0 0 -62.0 -50.1 -179.2 45.6 112.5 20.1 102 -2.7 110 -2.1 0 0.0 0 0.0 11 34
107 1 107 ASN N H H X TS+ 0 0 -63.5 -35.1 177.2 53.9 110.5 30.6 103 -2.7 111 -1.7 0 0.0 0 0.0 8 28
108 1 108 GLU E H H X TS+ 0 0 -66.5 -43.3 178.2 45.9 110.5 18.4 104 -2.5 112 -2.4 0 0.0 0 0.0 9 41
109 1 109 ILE I H H X TS+ 0 0 -67.5 -36.1 179.8 56.7 108.4 28.3 105 -2.5 113 -2.9 0 0.0 0 0.0 11 44
110 1 110 ALA A H H X TS+ 0 0 -61.9 -38.5 177.4 49.2 108.2 26.7 106 -2.1 114 -3.2 0 0.0 0 0.0 9 35
111 1 111 ARG R H H X TS+ 0 0 -63.4 -53.8 180.0 49.3 109.4 15.8 107 -1.7 115 -2.7 0 0.0 0 0.0 9 38
112 1 112 VAL V H H X TS+ 0 0 -52.4 -46.0 -178.9 42.1 117.9 17.5 108 -2.4 116 -1.6 0 0.0 0 0.0 12 47
113 1 113 THR T H H X TS+ 0 0 -68.7 -45.7 -178.6 49.5 114.5 15.9 109 -2.9 117 -1.5 0 0.0 0 0.0 10 39
114 1 114 GLY G H H < TS+ 0 0 -60.9 -49.7 -177.4 36.7 117.1 21.6 110 -3.2 0 0.0 0 0.0 0 0.0 8 26
115 1 115 GLU E H H < > TS+ 0 0 -72.1 -38.3 -178.3 55.0 114.9 23.9 111 -2.7 118 -1.3 0 0.0 0 0.0 10 35
116 1 116 THR T H H < 3 TS+ 0 0 -64.3 -28.4 -176.1 53.9 104.3 41.8 112 -1.6 0 0.0 0 0.0 0 0.0 10 37
117 1 117 SER S T h < 3 TS+ 0 0 -92.8 0.4 179.4 35.3 113.6 64.4 113 -1.5 0 0.0 0 0.0 0 0.0 8 26
118 1 118 THR T S t < TS- 0 0 -132.9 -163.5 -178.3 -114.4 76.7 123.3 115 -1.3 0 0.0 0 0.0 0 0.0 6 24
119 1 119 TRP W + 0 0 -139.1 154.4 178.7 169.4 27.6 164.2 0 0.0 0 0.0 0 0.0 0 0.0 9 31
120 1 120 GLY G - 0 0 -163.1 155.2 179.9 -83.3 40.3 167.0 0 0.0 0 0.0 0 0.0 0 0.0 6 30
121 1 121 PRO P + 0 0 -65.4 139.1 178.3 172.3 47.8 114.0 0 0.0 0 0.0 0 0.0 0 0.0 9 31
122 1 122 ALA A E E AA - 252 0 -150.8 139.3 175.8 -106.3 39.9 172.9 252 -2.1 252 -2.0 0 0.0 0 0.0 10 34
123 1 123 ARG R E E AA - 251 0 -61.1 119.6 178.1 -133.3 43.9 119.9 0 0.0 0 0.0 0 0.0 0 0.0 9 34
124 1 124 GLN Q e - 0 0 -77.7 150.1 -178.4 -129.7 7.5 117.6 250 -2.1 0 0.0 0 0.0 0 0.0 10 40
125 1 125 PRO P S S S+ 0 0 -69.7 -37.6 -176.8 53.9 74.7 42.6 0 0.0 0 0.0 0 0.0 0 0.0 5 36
126 1 126 TYR Y S S S- 0 0 -105.1 175.3 -179.1 -70.7 94.1 120.3 0 0.0 0 0.0 0 0.0 0 0.0 5 34
127 1 127 GLY G t > T - 0 0 -62.6 142.3 -179.6 -122.7 40.8 108.6 0 0.0 130 -2.1 0 0.0 0 0.0 9 36
128 1 128 PHE F T T 3 TS+ 0 0 -54.7 -32.3 -179.3 39.4 113.2 35.4 0 0.0 0 0.0 0 0.0 0 0.0 10 48
129 1 129 PHE F T T > TS+ 0 0 -108.8 28.5 179.5 123.5 74.9 90.2 156 -3.4 132 -0.6 0 0.0 0 0.0 11 42
130 1 130 LEU L T T < T + 0 0 -57.5 -35.3 -176.9 59.0 69.6 29.6 127 -2.1 132 -1.0 0 0.0 0 0.0 8 33
131 1 131 GLU E T T 3 TS+ 0 0 -99.0 61.5 179.2 123.6 75.9 109.1 0 0.0 0 0.0 0 0.0 0 0.0 5 25
132 1 132 THR T t < T - 0 0 -116.0 142.7 -178.8 -152.8 50.0 154.2 130 -1.0 0 0.0 129 -0.6 0 0.0 7 24
133 1 133 GLU E S S S+ 0 0 -85.9 -24.3 -177.3 39.5 79.6 41.0 0 0.0 0 0.0 0 0.0 0 0.0 4 18
134 1 134 GLU E - 0 0 -128.0 150.5 176.9 -174.2 60.8 160.8 0 0.0 0 0.0 0 0.0 0 0.0 5 21
135 1 135 THR T - 0 0 -141.1 152.2 -179.3 -135.5 16.7 164.1 0 0.0 0 0.0 0 0.0 0 0.0 9 29
136 1 136 PHE F - 0 0 -111.0 138.8 179.2 -93.9 35.7 155.4 153 -2.2 0 0.0 0 0.0 0 0.0 9 36
137 1 137 GLN Q t > T - 0 0 -50.5 126.6 -179.8 -109.3 51.6 100.3 0 0.0 140 -1.3 0 0.0 0 0.0 6 34
138 1 138 PRO P T T 3 TS+ 0 0 -63.7 133.7 177.0 9.8 94.9 112.7 0 0.0 0 0.0 0 0.0 0 0.0 7 40
139 1 139 GLY G T T 3 TS+ 0 0 75.3 19.3 177.5 121.3 94.2 43.8 0 0.0 195 -2.7 0 0.0 0 0.0 10 44
140 1 140 ARG R B B a < T - 195 0 -118.2 129.2 -179.0 -111.5 66.5 169.4 137 -1.3 0 0.0 0 0.0 0 0.0 10 43
141 1 141 TRP W + 0 0 -56.4 142.8 178.0 169.4 39.7 101.1 195 -3.3 0 0.0 0 0.0 0 0.0 10 46
142 1 142 PHE F - 0 0 -164.7 117.5 -178.6 -179.9 8.7 144.3 0 0.0 0 0.0 0 0.0 0 0.0 7 42
143 1 143 MET M - 0 0 -124.0 127.7 -179.8 -127.8 27.2 170.9 0 0.0 0 0.0 0 0.0 0 0.0 9 38
144 1 144 ARG R t > T - 0 0 -75.2 136.9 -178.1 -85.9 47.1 125.2 0 0.0 147 -2.3 0 0.0 0 0.0 6 25
145 1 145 ALA A T T 3 TS+ 0 0 -47.4 125.2 179.1 10.0 111.8 100.9 0 0.0 0 0.0 0 0.0 0 0.0 4 15
146 1 146 ALA A T T 3 TS+ 0 0 87.1 -7.6 179.9 106.1 104.1 70.8 0 0.0 0 0.0 0 0.0 0 0.0 4 15
147 1 147 GLN Q t < T - 0 0 -103.4 159.2 178.8 -155.4 55.4 132.4 144 -2.3 0 0.0 0 0.0 0 0.0 7 26
148 1 148 ALA A S e S+ 0 0 -102.5 -20.8 176.6 36.5 86.9 58.4 0 0.0 164 -2.6 0 0.0 0 0.0 9 35
149 1 149 VAL V E E AB - 163 0 -132.8 133.6 178.6 -174.4 67.6 171.0 0 0.0 0 0.0 0 0.0 0 0.0 12 46
150 1 150 THR T E E AB - 162 0 -136.0 118.9 179.4 -163.0 6.2 165.2 162 -1.8 162 -2.6 0 0.0 0 0.0 11 49
151 1 151 ALA A E E AB + 161 0 -97.5 139.1 -177.1 170.6 17.8 147.4 0 0.0 0 0.0 0 0.0 0 0.0 10 58
152 1 152 VAL V E E AB - 160 0 -149.6 151.4 179.6 -106.6 34.9 167.7 160 -2.8 160 -2.4 0 0.0 0 0.0 10 50
153 1 153 VAL V E E AB + 159 0 -86.0 133.3 -180.0 169.6 33.1 137.0 0 0.0 136 -2.2 0 0.0 0 0.0 12 45
154 1 154 CYS C E E A* + 0 0 -122.9 10.5 179.8 9.4 62.8 75.5 158 -1.9 0 0.0 0 0.0 0 0.0 12 42
155 1 155 GLY G E E AB > TS- 158 0 -171.9 174.1 -179.7 -88.1 85.6 164.5 158 -1.2 158 -0.7 0 0.0 0 0.0 10 34
156 1 156 PRO P T T 3 TS+ 0 0 -69.3 -17.8 -178.6 22.6 131.4 42.9 0 0.0 129 -3.4 0 0.0 0 0.0 11 35
157 1 157 ASP D T e 3 TS+ 0 0 -133.8 22.6 -173.2 80.2 116.5 83.4 0 0.0 247 -2.7 0 0.0 0 0.0 12 46
158 1 158 MET M E E ABC< T - 155 246 -145.4 146.5 174.1 -179.7 41.0 164.7 155 -0.7 154 -1.9 0 0.0 155 -1.2 12 48
159 1 159 ILE I E E ABC - 153 245 -133.2 157.0 177.3 -157.4 12.6 159.0 245 -2.3 245 -3.1 0 0.0 0 0.0 12 57
160 1 160 GLN Q E E ABC - 152 244 -134.2 145.9 -178.9 -151.7 6.5 163.4 152 -2.4 152 -2.8 0 0.0 0 0.0 14 64
161 1 161 VAL V E E ABC - 151 243 -123.1 131.1 177.1 -151.1 3.5 172.6 243 -2.6 243 -2.3 0 0.0 0 0.0 12 66
162 1 162 SER S E E ABC - 150 242 -100.0 127.6 179.0 -165.8 16.7 154.2 150 -2.6 150 -1.8 0 0.0 0 0.0 14 65
163 1 163 LEU L E E ABC - 149 241 -119.9 129.6 175.1 -137.2 14.1 165.2 241 -3.3 241 -2.4 0 0.0 0 0.0 15 58
164 1 164 ASN N e > T - 0 0 -71.0 160.0 179.3 -71.8 53.4 111.0 148 -2.6 167 -2.2 0 0.0 0 0.0 11 43
165 1 165 ALA A T T 3 TS+ 0 0 -56.2 134.8 -179.1 5.2 122.5 107.8 0 0.0 0 0.0 0 0.0 0 0.0 11 35
166 1 166 GLY G T T 3 TS+ 0 0 71.0 -2.9 -178.6 144.1 99.8 69.0 237 -2.0 0 0.0 0 0.0 0 0.0 11 30
167 1 167 ALA A e < T - 0 0 -71.4 158.0 -179.6 -178.3 25.4 98.8 164 -2.2 235 -3.3 0 0.0 0 0.0 11 36
168 1 168 ARG R E E BD + 234 0 -153.6 146.4 -179.3 145.1 12.1 168.5 0 0.0 0 0.0 0 0.0 0 0.0 11 40
169 1 169 GLY G E E BD - 233 0 -174.2 168.3 -179.9 -93.0 45.0 170.2 233 -2.1 233 -2.2 0 0.0 0 0.0 8 41
170 1 170 ASP D E E BD - 232 0 -96.2 140.8 -175.5 -178.3 27.8 145.4 0 0.0 0 0.0 0 0.0 0 0.0 9 41
171 1 171 VAL V e > T + 0 0 -119.1 -6.7 -177.9 102.9 49.4 54.9 231 -3.4 174 -1.8 0 0.0 0 0.0 10 51
172 1 172 GLN Q G G > > T + 0 0 -51.5 -35.8 -177.2 71.6 65.8 45.1 0 0.0 175 -1.6 0 0.0 176 -0.7 12 48
173 1 173 GLN Q G G 4 3 TS+ 0 0 -60.1 -18.2 -179.5 67.1 85.9 45.6 0 0.0 0 0.0 0 0.0 0 0.0 6 35
174 1 174 ILE I G G 4 < TS+ 0 0 -69.4 -28.4 179.8 44.9 105.8 34.0 171 -1.8 0 0.0 0 0.0 0 0.0 7 50
175 1 175 PHE F T g 4 X TS+ 0 0 -86.2 -19.9 -175.9 96.5 98.1 52.7 172 -1.6 178 -0.6 0 0.0 0 0.0 7 51
176 1 176 GLN Q T T < 3 TS+ 0 0 -80.3 158.2 180.0 27.2 73.1 103.2 172 -0.7 0 0.0 0 0.0 0 0.0 7 35
177 1 177 GLY G T T 3 TS+ 0 0 80.1 -10.0 179.6 99.9 95.2 71.2 0 0.0 0 0.0 0 0.0 0 0.0 5 22
178 1 178 ARG R S t < TS- 0 0 -112.9 137.2 -179.9 -16.7 87.9 159.6 175 -0.6 0 0.0 0 0.0 0 0.0 6 34
179 1 179 ASN N S S S- 0 0 64.0 -163.8 -179.7 -100.6 80.0 99.9 0 0.0 0 0.0 0 0.0 0 0.0 6 38
180 1 180 ASP D - 0 0 -152.8 63.7 -178.7 -172.6 50.4 114.8 0 0.0 0 0.0 0 0.0 0 0.0 7 36
181 1 181 PRO P - 0 0 -65.5 152.3 177.9 -168.5 27.8 100.4 0 0.0 0 0.0 0 0.0 0 0.0 11 42
182 1 182 MET M S S S+ 0 0 -106.7 -32.2 178.5 5.7 84.1 54.8 251 -2.9 0 0.0 0 0.0 0 0.0 11 33
183 1 183 MET M E E AE - 251 0 -154.4 143.3 -178.9 -157.4 63.2 168.2 251 -1.2 251 -2.2 0 0.0 0 0.0 11 41
184 1 184 ILE I E E AEF - 250 225 -125.5 127.9 -178.5 -145.9 13.6 174.6 225 -2.8 225 -3.0 0 0.0 186 -0.7 14 51
185 1 185 TYR Y E E AEF - 249 224 -105.5 114.2 -176.2 -177.9 26.0 154.7 249 -2.3 248 -1.9 0 0.0 249 -1.0 12 49
186 1 186 LEU L E E AEF - 247 223 -107.6 155.3 168.5 -173.9 23.0 132.9 223 -2.3 223 -2.8 184 -0.7 0 0.0 13 53
187 1 187 VAL V E E AE - 246 0 -146.8 127.3 -179.1 -157.5 17.0 161.0 246 -1.5 246 -3.1 0 0.0 0 0.0 13 41
188 1 188 TRP W E E AE - 245 0 -110.3 143.6 -179.9 -174.2 9.1 155.4 0 0.0 220 -1.9 0 0.0 0 0.0 13 52
189 1 189 ARG R E E AE - 244 0 -133.0 154.0 174.7 -115.8 29.3 160.6 244 -2.9 244 -2.8 0 0.0 0 0.0 9 49
190 1 190 ARG R E E AE - 243 0 -82.7 129.5 175.9 -131.4 29.8 141.1 0 0.0 192 -1.2 0 0.0 0 0.0 12 48
191 1 191 ILE I e - 0 0 -84.6 100.3 -175.9 -166.7 24.8 143.7 242 -2.8 0 0.0 0 0.0 0 0.0 12 46
192 1 192 GLU E S e S+ 0 0 -62.3 -28.2 -179.2 25.7 70.9 42.9 190 -1.2 204 -0.7 0 0.0 0 0.0 8 36
193 1 193 ASN N E E CG S+ 203 0 -143.7 111.5 -180.0 162.2 77.0 159.3 0 0.0 0 0.0 0 0.0 0 0.0 9 31
194 1 194 PHE F E E CG - 202 0 -128.6 168.0 -179.0 -104.4 37.3 148.1 202 -2.4 202 -1.9 0 0.0 0 0.0 12 36
195 1 195 ALA A E E CGa - 201 140 -95.3 133.5 177.5 -141.5 26.7 140.6 139 -2.7 141 -3.3 0 0.0 0 0.0 12 33
196 1 196 MET M e > T - 0 0 -83.9 163.4 -177.8 -95.7 38.8 116.4 200 -2.5 199 -1.4 0 0.0 0 0.0 10 34
197 1 197 ALA A T T 3 TS+ 0 0 -50.3 -33.6 179.1 52.5 128.0 33.6 0 0.0 0 0.0 0 0.0 0 0.0 8 27
198 1 198 GLN Q T T 3 TS- 0 0 -74.5 -28.3 178.4 -104.1 122.6 40.8 0 0.0 0 0.0 0 0.0 0 0.0 5 15
199 1 199 GLY G S t < TS+ 0 0 123.8 -11.0 -177.7 125.3 77.4 74.5 196 -1.4 0 0.0 0 0.0 0 0.0 6 16
200 1 200 ASN N e - 0 0 -87.3 147.4 179.3 -105.7 62.3 121.1 0 0.0 196 -2.5 0 0.0 0 0.0 7 18
201 1 201 SER S E E CG - 195 0 -68.3 152.0 178.7 -176.8 35.1 108.8 0 0.0 0 0.0 0 0.0 0 0.0 8 24
202 1 202 GLN Q E E CG - 194 0 -146.3 151.7 -179.7 -133.1 16.2 164.1 194 -1.9 194 -2.4 0 0.0 0 0.0 9 32
203 1 203 GLN Q E E CG - 193 0 -108.6 155.2 175.8 -130.3 11.5 143.6 0 0.0 205 -0.6 0 0.0 0 0.0 10 35
204 1 204 THR T e - 0 0 -104.1 120.8 -179.3 -138.3 27.7 156.1 192 -0.7 0 0.0 0 0.0 0 0.0 12 43
205 1 205 GLN Q t > T - 0 0 -75.9 149.5 177.3 -102.1 25.6 123.0 203 -0.6 208 -0.7 0 0.0 0 0.0 9 31
206 1 206 ALA A T T 3 TS+ 0 0 -66.5 149.7 178.9 73.2 97.0 112.3 0 0.0 0 0.0 0 0.0 0 0.0 6 32
207 1 207 GLY G T T 3 T + 0 0 130.7 -17.9 178.6 128.8 58.2 76.9 0 0.0 0 0.0 0 0.0 0 0.0 7 34
208 1 208 VAL V t < T - 0 0 -67.7 144.4 179.2 -158.4 41.5 115.0 205 -0.7 0 0.0 0 0.0 0 0.0 12 46
209 1 209 THR T E E BH - 234 0 -132.0 151.1 176.9 -163.8 18.5 161.4 234 -2.7 234 -2.7 0 0.0 0 0.0 10 51
210 1 210 VAL V E E BHI - 233 217 -126.8 133.1 -179.9 -174.3 16.5 168.1 217 -0.6 217 -2.4 0 0.0 0 0.0 12 55
211 1 211 SER S E E BHI - 232 216 -134.2 144.8 -179.3 -150.7 14.6 172.2 232 -1.7 232 -2.7 0 0.0 213 -0.5 12 44
212 1 212 VAL V E E BHI> TS- 231 215 -117.4 121.4 -178.3 -16.4 82.3 168.1 215 -2.6 215 -2.0 0 0.0 0 0.0 12 39
213 1 213 GLY G T e 3 TS- 0 0 55.0 34.8 179.6 -51.8 130.5 31.2 230 -2.5 0 0.0 211 -0.5 0 0.0 8 29
214 1 214 GLY G T T 3 TS+ 0 0 90.2 -19.3 179.4 111.6 115.3 77.5 0 0.0 0 0.0 0 0.0 0 0.0 7 26
215 1 215 VAL V E E BI < TS- 212 0 -94.6 141.4 -177.0 -114.4 70.4 136.7 212 -2.0 212 -2.6 0 0.0 0 0.0 6 22
216 1 216 ASP D E E BI - 211 0 -78.0 128.4 179.8 -159.0 27.4 125.3 0 0.0 0 0.0 0 0.0 0 0.0 8 32
217 1 217 MET M E E BI - 210 0 -112.0 131.5 178.1 -128.9 13.0 151.5 210 -2.4 210 -0.6 0 0.0 0 0.0 9 34
218 1 218 ARG R t > T - 0 0 -68.5 156.6 179.1 -108.5 29.5 108.4 0 0.0 221 -0.6 0 0.0 0 0.0 8 33
219 1 219 ALA A T T 3 TS+ 0 0 -84.9 155.9 178.1 28.2 96.7 120.9 0 0.0 0 0.0 0 0.0 0 0.0 8 39
220 1 220 GLY G T T 3 TS+ 0 0 69.1 24.7 179.9 102.6 95.8 47.2 188 -1.9 0 0.0 0 0.0 0 0.0 7 27
221 1 221 ARG R S t < TS- 0 0 -136.6 141.0 179.4 -101.4 78.7 169.3 218 -0.6 0 0.0 0 0.0 0 0.0 7 26
222 1 222 ILE I - 0 0 -66.5 135.2 -179.7 -158.9 35.0 116.4 0 0.0 0 0.0 0 0.0 0 0.0 7 27
223 1 223 ILE I E E AF - 186 0 -120.1 130.7 177.6 -142.9 12.3 162.5 186 -2.8 186 -2.3 0 0.0 225 -0.9 9 40
224 1 224 ALA A E E AF - 185 0 -92.0 107.0 -178.2 -179.1 29.3 143.7 0 0.0 0 0.0 0 0.0 0 0.0 8 39
225 1 225 TRP W E E AF - 184 0 -115.7 131.7 179.5 -150.0 28.8 159.3 184 -3.0 184 -2.8 223 -0.9 0 0.0 11 44
226 1 226 ASP D - 0 0 -73.5 -5.5 179.4 -120.7 40.0 62.6 0 0.0 0 0.0 0 0.0 0 0.0 9 39
227 1 227 GLY G S S S+ 0 0 81.6 -4.2 -179.6 69.6 100.3 64.9 0 0.0 0 0.0 0 0.0 0 0.0 11 40
228 1 228 GLN Q S S S+ 0 0 -110.2 -49.0 -179.7 88.5 71.9 39.8 0 0.0 0 0.0 0 0.0 0 0.0 6 32
229 1 229 ALA A S S S- 0 0 -52.9 145.9 -178.9 -87.2 93.8 100.4 0 0.0 0 0.0 0 0.0 0 0.0 9 32
230 1 230 ALA A e - 0 0 -65.0 132.2 -179.8 -150.2 30.7 108.3 0 0.0 213 -2.5 0 0.0 232 -0.9 11 32
231 1 231 LEU L E E B H - 0 212 -104.4 99.4 -174.4 -171.0 24.7 152.2 0 0.0 171 -3.4 0 0.0 233 -0.6 11 50
232 1 232 HIS H E E BDH - 170 211 -107.4 117.6 178.5 -167.5 12.8 148.0 211 -2.7 211 -1.7 230 -0.9 0 0.0 14 51
233 1 233 VAL V E E BDH - 169 210 -101.5 137.8 -179.5 -173.5 7.3 143.8 169 -2.2 169 -2.1 231 -0.6 0 0.0 12 57
234 1 234 HIS H E E BDH - 168 209 -136.4 124.1 177.4 -166.5 15.0 170.5 209 -2.7 209 -2.7 0 0.0 0 0.0 12 52
235 1 235 ASN N e + 0 0 -106.4 92.2 -179.8 169.9 13.5 151.5 167 -3.3 0 0.0 0 0.0 0 0.0 15 46
236 1 236 PRO P + 0 0 -79.3 -4.4 -179.1 108.8 49.7 60.0 0 0.0 0 0.0 0 0.0 0 0.0 9 31
237 1 237 THR T S S S- 0 0 -71.1 155.9 -179.3 -127.7 77.1 103.6 0 0.0 166 -2.0 0 0.0 0 0.0 12 30
238 1 238 GLN Q S S S+ 0 0 -92.9 19.8 -179.3 57.7 88.4 77.6 0 0.0 0 0.0 0 0.0 0 0.0 6 24
239 1 239 GLN Q S S S- 0 0 -139.7 166.6 177.1 -77.9 98.6 150.9 0 0.0 0 0.0 0 0.0 0 0.0 9 34
240 1 240 ASN N - 0 0 -67.2 150.6 180.0 -164.5 50.0 110.6 0 0.0 0 0.0 0 0.0 0 0.0 13 49
241 1 241 ALA A E E AC - 163 0 -137.5 154.1 176.1 -160.6 13.7 159.6 163 -2.4 163 -3.3 0 0.0 0 0.0 16 54
242 1 242 MET M E E AC - 162 0 -135.0 133.7 176.4 -174.1 7.6 178.2 0 0.0 191 -2.8 0 0.0 0 0.0 15 63
243 1 243 VAL V E E ACE - 161 190 -126.0 144.1 173.8 -146.1 13.5 165.4 161 -2.3 161 -2.6 0 0.0 0 0.0 11 69
244 1 244 GLN Q E E ACE - 160 189 -105.9 140.8 178.0 -162.3 8.6 154.1 189 -2.8 189 -2.9 0 0.0 0 0.0 12 65
245 1 245 ILE I E E ACE - 159 188 -124.5 114.7 -179.0 -161.5 8.8 171.4 159 -3.1 159 -2.3 0 0.0 0 0.0 12 64
246 1 246 GLN Q E E ACE - 158 187 -99.7 131.8 175.1 -145.6 16.5 150.2 187 -3.1 187 -1.5 0 0.0 248 -1.1 10 51
247 1 247 VAL V E E A E - 0 186 -92.5 95.4 -178.9 -175.5 18.8 145.8 157 -2.7 0 0.0 0 0.0 0 0.0 13 54
248 1 248 VAL V E E A * - 0 0 -62.7 -34.8 173.6 -35.3 64.6 29.9 185 -1.9 0 0.0 246 -1.1 0 0.0 8 40
249 1 249 PHE F E E A E - 0 185 -177.7 158.1 178.7 -152.3 58.5 155.8 185 -1.0 185 -2.3 0 0.0 0 0.0 11 43
250 1 250 TYR Y E E A E - 0 184 -137.2 162.9 179.1 -134.3 10.6 158.4 0 0.0 124 -2.1 0 0.0 0 0.0 13 44
251 1 251 ILE I E E AAE + 123 183 -123.0 138.3 177.4 157.1 28.2 163.7 183 -2.2 182 -2.9 0 0.0 183 -1.2 12 39
252 1 252 SER S E E AA - 122 0 -142.3 -179.0 178.4 -100.3 51.8 144.2 122 -2.0 122 -2.1 0 0.0 0 0.0 14 39
253 1 253 MET M S S S+ 0 0 -95.3 24.4 176.7 117.1 79.6 87.8 0 0.0 0 0.0 0 0.0 0 0.0 11 33
254 1 254 ASP D S S S- 0 0 -89.4 142.6 -178.0 -107.5 74.3 136.1 0 0.0 0 0.0 0 0.0 0 0.0 8 36
255 1 255 LYS K - 0 0 -73.8 140.1 177.8 -168.1 37.2 119.4 0 0.0 0 0.0 0 0.0 0 0.0 11 43
256 1 256 THR T t > T - 0 0 -115.2 -178.8 -179.9 -91.7 41.8 124.7 0 0.0 259 -1.1 0 0.0 0 0.0 11 43
257 1 257 LEU L T T 3 TS+ 0 0 -74.7 -0.5 178.8 67.5 119.8 66.8 0 0.0 264 -0.5 0 0.0 0 0.0 8 42
258 1 258 ASN N T T 3 T + 0 0 -104.9 21.4 180.0 100.2 67.5 87.7 0 0.0 0 0.0 0 0.0 0 0.0 9 35
259 1 259 GLN Q S t < TS+ 0 0 -75.6 -24.3 -178.8 29.5 91.5 39.7 256 -1.1 0 0.0 0 0.0 0 0.0 8 45
260 1 260 TYR Y S t > TS- 0 0 -135.8 136.1 -179.7 -86.7 107.3 176.2 0 0.0 263 -2.2 0 0.0 0 0.0 9 44
261 1 261 PRO P T T 3 TS- 0 0 -50.3 123.8 -178.8 -12.1 106.7 99.3 0 0.0 0 0.0 0 0.0 0 0.0 5 32
262 1 262 ALA A T h > > TS+ 0 0 53.0 33.8 178.5 156.3 80.0 48.5 0 0.0 266 -1.8 0 0.0 265 -0.6 7 27
263 1 263 LEU L H H > < TS+ 0 0 -51.3 -40.5 -179.6 56.8 71.7 30.4 260 -2.2 267 -2.8 0 0.0 0 0.0 10 42
264 1 264 THR T H H > 3 TS+ 0 0 -59.9 -45.5 -179.9 50.2 104.1 22.6 257 -0.5 268 -2.9 0 0.0 0 0.0 8 35
265 1 265 ALA A H H > < TS+ 0 0 -63.4 -33.1 178.5 49.2 112.0 31.5 262 -0.6 269 -1.8 0 0.0 0 0.0 7 29
266 1 266 GLU E H H X TS+ 0 0 -69.7 -48.0 176.9 48.6 110.9 21.8 262 -1.8 270 -2.4 0 0.0 0 0.0 11 40
267 1 267 ILE I H H X TS+ 0 0 -55.4 -46.4 179.0 51.7 111.1 21.1 263 -2.8 271 -2.2 0 0.0 0 0.0 12 47
268 1 268 PHE F H H X TS+ 0 0 -57.3 -44.6 179.5 50.7 108.5 27.0 264 -2.9 272 -0.7 0 0.0 0 0.0 9 38
269 1 269 ASN N H H < > TS+ 0 0 -59.6 -46.8 179.3 49.8 110.1 24.2 265 -1.8 272 -0.7 0 0.0 0 0.0 9 38
270 1 270 VAL V H H < 3 TS+ 0 0 -60.5 -43.1 -178.0 45.7 113.0 28.6 266 -2.4 0 0.0 0 0.0 0 0.0 11 52
271 1 271 TYR Y H H < 3 TS+ 0 0 -85.4 -0.5 176.6 114.3 85.7 61.2 267 -2.2 0 0.0 0 0.0 0 0.0 11 49
272 1 272 SER S h < < T - 0 0 -66.9 154.7 -176.5 -129.9 68.1 110.0 269 -0.7 0 0.0 268 -0.7 0 0.0 7 45
273 1 273 PHE F + 0 0 -69.9 -58.8 -177.3 166.0 35.5 15.8 0 0.0 275 -2.3 0 0.0 0 0.0 8 46
274 1 274 ARG R S S S- 0 0 71.2 -72.1 176.6 -40.4 70.3 120.3 0 0.0 0 0.0 0 0.0 0 0.0 6 47
275 1 275 ASP D S h > TS- 0 0 -166.6 179.7 -178.1 -77.8 71.0 161.5 273 -2.3 279 -2.8 0 0.0 0 0.0 8 44
276 1 276 HIS H H H > TS+ 0 0 -62.2 -31.7 -179.7 52.7 123.6 38.0 0 0.0 280 -2.6 0 0.0 0 0.0 12 46
277 1 277 THR T H H > TS+ 0 0 -71.5 -47.0 -180.0 42.5 112.7 17.4 0 0.0 281 -3.4 0 0.0 0 0.0 12 51
278 1 278 TRP W H H > TS+ 0 0 -63.5 -44.6 179.3 51.0 115.5 20.6 0 0.0 282 -3.4 0 0.0 0 0.0 11 57
279 1 279 HIS H H H X TS+ 0 0 -56.9 -47.4 178.1 43.4 114.4 17.3 275 -2.8 283 -2.4 0 0.0 0 0.0 13 55
280 1 280 GLY G H H X TS+ 0 0 -63.7 -45.4 -179.3 46.7 116.5 22.7 276 -2.6 284 -2.6 0 0.0 0 0.0 10 52
281 1 281 LEU L H H X TS+ 0 0 -62.9 -49.7 179.7 48.4 112.9 22.9 277 -3.4 285 -2.6 0 0.0 0 0.0 9 67
282 1 282 ARG R H H X TS+ 0 0 -58.1 -50.0 177.3 49.2 112.5 19.0 278 -3.4 286 -3.0 0 0.0 0 0.0 13 66
283 1 283 THR T H H X TS+ 0 0 -54.1 -49.2 179.3 49.5 111.5 18.7 279 -2.4 287 -1.8 0 0.0 0 0.0 10 51
284 1 284 ALA A H H < TS+ 0 0 -59.2 -41.6 179.2 46.4 112.9 28.6 280 -2.6 0 0.0 0 0.0 0 0.0 11 49
285 1 285 ILE I H H < > TS+ 0 0 -68.7 -44.5 -179.0 50.5 111.7 19.8 281 -2.6 288 -1.6 0 0.0 0 0.0 11 55
286 1 286 LEU L H H < > TS+ 0 0 -66.5 -22.8 178.0 72.1 95.7 37.1 282 -3.0 289 -2.2 0 0.0 0 0.0 11 50
287 1 287 ASN N T h < 3 TS+ 0 0 -63.2 -16.0 -178.0 58.6 92.3 50.5 283 -1.8 0 0.0 0 0.0 0 0.0 10 35
288 1 288 ARG R T T < TS+ 0 0 -97.4 11.5 -178.7 59.0 106.4 78.3 285 -1.6 0 0.0 0 0.0 0 0.0 9 32
289 1 289 THR T S t < TS- 0 0 -130.0 -178.6 179.7 -107.7 90.5 136.0 286 -2.2 0 0.0 0 0.0 0 0.0 9 40
290 1 290 THR T S S S+ 0 0 -94.7 8.3 179.7 101.0 88.8 70.4 0 0.0 0 0.0 0 0.0 0 0.0 7 33
291 1 291 LEU L S S S- 0 0 -92.1 148.0 178.8 -98.0 87.2 124.7 0 0.0 0 0.0 0 0.0 0 0.0 9 39
292 1 292 PRO P - 0 0 -63.8 145.3 -177.2 -135.8 30.7 117.7 0 0.0 0 0.0 0 0.0 0 0.0 10 36
293 1 293 ASN N S S S+ 0 0 -82.0 -17.8 177.2 7.7 87.5 51.7 0 0.0 0 0.0 0 0.0 0 0.0 10 37
294 1 294 MET M S S S+ 0 0 -142.3 -2.3 177.2 54.7 117.8 57.9 0 0.0 0 0.0 0 0.0 0 0.0 8 40
295 1 295 LEU L S S S- 0 0 -133.2 139.0 179.6 -100.4 88.2 168.8 0 0.0 0 0.0 0 0.0 0 0.0 6 37
296 1 296 PRO P - 0 0 -53.7 145.9 179.5 -95.4 51.3 104.5 0 0.0 0 0.0 0 0.0 0 0.0 8 39
297 1 297 PRO P - 0 0 -61.7 157.5 -179.8 -135.0 20.8 98.0 0 0.0 0 0.0 0 0.0 0 0.0 8 35
298 1 298 ILE I S S S+ 0 0 -80.9 -43.9 178.9 39.9 94.3 25.3 0 0.0 0 0.0 0 0.0 0 0.0 4 25
299 1 299 PHE F S S S- 0 0 -107.4 141.2 179.9 -102.6 100.8 147.2 0 0.0 0 0.0 0 0.0 0 0.0 5 28
300 1 300 PRO P - 0 0 -60.5 140.6 179.8 -112.6 38.4 108.0 0 0.0 0 0.0 0 0.0 0 0.0 8 44
301 1 301 PRO P - 0 0 -67.5 161.4 -178.5 -168.2 27.8 110.4 0 0.0 0 0.0 0 0.0 0 0.0 9 44
302 1 302 ASN N + 0 0 -138.3 6.7 -180.0 84.2 49.6 66.3 0 0.0 0 0.0 0 0.0 0 0.0 8 44
303 1 303 ASP D S h > TS- 0 0 -113.4 155.9 179.3 -114.8 78.2 144.7 0 0.0 307 -2.0 0 0.0 0 0.0 8 39
304 1 304 ARG R H H > TS+ 0 0 -50.3 -49.1 -177.6 55.7 110.5 26.6 0 0.0 308 -3.0 0 0.0 0 0.0 10 42
305 1 305 ASP D H H > TS+ 0 0 -56.3 -49.3 -179.5 44.8 108.5 24.6 0 0.0 309 -3.0 0 0.0 0 0.0 7 44
306 1 306 SER S H H > TS+ 0 0 -62.2 -48.2 -179.3 47.1 115.6 20.1 0 0.0 310 -2.2 0 0.0 0 0.0 12 52
307 1 307 ILE I H H X TS+ 0 0 -59.4 -47.1 -179.9 47.4 114.4 19.5 303 -2.0 311 -2.6 0 0.0 0 0.0 11 60
308 1 308 LEU L H H X TS+ 0 0 -58.3 -51.4 179.5 51.6 110.3 22.2 304 -3.0 312 -3.5 0 0.0 0 0.0 10 63
309 1 309 THR T H H X TS+ 0 0 -55.2 -40.0 179.2 49.5 110.4 28.8 305 -3.0 313 -2.7 0 0.0 0 0.0 9 67
310 1 310 LEU L H H X TS+ 0 0 -65.9 -49.1 179.9 44.5 114.0 17.2 306 -2.2 314 -2.4 0 0.0 0 0.0 11 67
311 1 311 LEU L H H X TS+ 0 0 -59.5 -48.5 179.0 46.8 116.0 19.1 307 -2.6 315 -2.2 0 0.0 0 0.0 10 71
312 1 312 LEU L H H X TS+ 0 0 -60.3 -44.2 179.2 48.0 113.9 22.8 308 -3.5 316 -2.6 0 0.0 0 0.0 11 69
313 1 313 LEU L H H X TS+ 0 0 -66.7 -36.2 179.1 55.2 108.2 29.1 309 -2.7 317 -1.9 0 0.0 0 0.0 11 70
314 1 314 SER S H H X TS+ 0 0 -62.2 -45.5 176.9 46.0 110.0 21.9 310 -2.4 318 -1.6 0 0.0 0 0.0 12 61
315 1 315 THR T H H X TS+ 0 0 -62.5 -46.2 178.8 54.0 109.8 19.7 311 -2.2 319 -2.4 0 0.0 0 0.0 11 60
316 1 316 LEU L H H X TS+ 0 0 -57.7 -31.7 179.1 56.2 104.8 29.4 312 -2.6 320 -2.9 0 0.0 0 0.0 12 67
317 1 317 ALA A H H X TS+ 0 0 -66.9 -38.8 178.3 49.4 106.4 26.9 313 -1.9 321 -2.2 0 0.0 0 0.0 11 59
318 1 318 ASP D H H X TS+ 0 0 -65.4 -42.0 178.0 49.4 110.6 22.9 314 -1.6 322 -1.9 0 0.0 0 0.0 9 49
319 1 319 VAL V H H X TS+ 0 0 -60.1 -44.4 179.7 52.7 109.7 19.6 315 -2.4 323 -3.2 0 0.0 0 0.0 14 50
320 1 320 TYR Y H H X TS+ 0 0 -55.7 -45.9 -179.8 53.2 107.2 25.6 316 -2.9 324 -2.0 0 0.0 0 0.0 11 55
321 1 321 THR T H H < TS+ 0 0 -60.0 -42.0 179.1 37.4 115.5 27.8 317 -2.2 0 0.0 0 0.0 0 0.0 7 44
322 1 322 VAL V H H < TS+ 0 0 -80.2 -40.3 178.3 43.9 120.5 22.4 318 -1.9 0 0.0 0 0.0 0 0.0 10 41
323 1 323 LEU L H H < TS- 0 0 -73.4 -23.3 -179.3 -156.4 86.3 43.4 319 -3.2 0 0.0 0 0.0 0 0.0 12 46
324 1 324 ARG R h < T - 0 0 46.8 53.2 -179.7 -168.7 19.9 29.6 320 -2.0 0 0.0 0 0.0 0 0.0 7 42
325 1 325 PRO P - 0 0 -70.0 162.4 179.6 -152.7 12.7 98.4 0 0.0 0 0.0 0 0.0 0 0.0 9 46
326 1 326 GLU E + 0 0 -139.2 112.3 179.0 131.1 33.6 158.9 0 0.0 0 0.0 0 0.0 0 0.0 7 42
327 1 327 PHE F - 0 0 -153.0 171.5 -177.5 -94.3 49.7 161.3 0 0.0 0 0.0 0 0.0 0 0.0 8 43
328 1 328 ALA A - 0 0 -100.5 141.9 177.9 -166.5 23.6 138.2 0 0.0 83 -0.7 0 0.0 0 0.0 9 34
329 1 329 ILE I t > T - 0 0 -123.7 134.1 -178.7 -100.4 37.0 164.2 0 0.0 332 -2.1 0 0.0 0 0.0 12 34
330 1 330 HIS H T T 3 TS+ 0 0 -55.9 127.6 178.6 9.9 106.4 109.5 80 -2.7 0 0.0 0 0.0 0 0.0 7 27
331 1 331 GLY G T T 3 TS+ 0 0 85.4 -3.4 179.8 119.0 98.8 66.4 0 0.0 0 0.0 0 0.0 0 0.0 4 25
332 1 332 VAL V t < T - 0 0 -101.2 132.0 -179.1 -168.4 42.5 146.9 329 -2.1 0 0.0 0 0.0 0 0.0 9 33
333 1 333 ASN N - 0 0 -125.9 96.8 -179.4 -136.1 17.1 145.6 0 0.0 0 0.0 0 0.0 0 0.0 5 28
334 1 334 PRO P - 0 0 -53.0 140.6 178.4 -154.1 6.7 92.1 0 0.0 0 0.0 0 0.0 0 0.0 6 28
335 1 335 MET M - 0 0 -120.5 113.3 -180.0 -140.9 15.4 167.9 0 0.0 0 0.0 0 0.0 0 0.0 6 28
336 1 336 PRO P + 0 0 -42.6 -32.2 177.2 152.9 50.7 46.2 0 0.0 0 0.0 0 0.0 0 0.0 5 19
337 1 337 GLY G S S S- 0 0 91.6 -123.8 0.3 -128.5 72.2 132.3 0 0.0 0 0.0 0 0.0 0 0.0 5 19
338 1 338 PRO P - 0 0 -64.2 19.2 178.3 -118.3 64.7 161.9 0 0.0 0 0.0 0 0.0 0 0.0 4 14
339 1 339 LEU L - 0 0 82.2 123.3 -176.0 -166.9 34.1 48.6 0 0.0 0 0.0 0 0.0 0 0.0 9 22
340 1 340 THR T h > T - 0 0 -133.5 172.7 179.7 -99.7 39.2 142.8 0 0.0 344 -2.5 0 0.0 0 0.0 7 19
341 1 341 ARG R H H > TS+ 0 0 -63.1 -37.0 -179.8 55.3 122.1 24.5 0 0.0 345 -3.1 0 0.0 0 0.0 6 19
342 1 342 ALA A H H > TS+ 0 0 -61.4 -44.3 179.0 45.0 109.9 24.3 0 0.0 346 -1.9 0 0.0 0 0.0 6 19
343 1 343 ILE I H H > TS+ 0 0 -66.8 -41.6 178.8 50.1 113.6 26.8 0 0.0 347 -0.7 0 0.0 0 0.0 8 25
344 1 344 ALA A H H < > TS+ 0 0 -60.8 -51.9 -179.1 50.3 110.2 16.6 340 -2.5 347 -1.4 0 0.0 0 0.0 11 29
345 1 345 ARG R H H < > TS+ 0 0 -55.7 -40.5 -179.3 56.8 105.5 29.7 341 -3.1 348 -1.4 0 0.0 0 0.0 7 22
346 1 346 ALA A H H < 3 TS+ 0 0 -65.5 -21.8 -177.5 66.4 95.4 46.1 342 -1.9 0 0.0 0 0.0 0 0.0 7 24
347 1 347 ALA A T h < < TS+ 0 0 -76.3 -13.9 -178.8 80.1 79.8 49.6 344 -1.4 0 0.0 343 -0.7 0 0.0 8 33
348 1 348 TYR Y t < T 0 0 -88.9 42.8 -178.7 999.9 999.9 96.2 345 -1.4 0 0.0 0 0.0 0 0.0 6 31
349 1 349 VAL V 0 0 66.1 999.9 999.9 999.9 999.9 103.4 0 0.0 0 0.0 0 0.0 0 0.0 3 20
1bvp1.pdb
1BVP COAT PROTEIN (VIRAL) BLUETONGUE VIRUS 10 (USA) VP7 (BTV-10 (USA) VP7) BLUETONGUE VIRUS
author author
Kabs/Sand HHHHHHHHHHHHHHTT SSS HHHHHHHHHHHHHHHHHH SS SHHHHHHHHHHHHHHHHHHHT S SS TTHHHHHT TTS Kabs/Sand
chirality ++++++++++++++++++-++----+++++++++++++++++-+-+--+-++-++++++++++++++++++-+----++-++----++++++++-++-- chirality
bends SSSSSSSSSSSSSSS SSS SSSSSSSSSSSSSSSSSS SS SSSSSSSSSSSSSSSSSSSS S SS SSSSSSSS SSS bends
turns TTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTT turns
5-turns >5555< 5-turns
3-turns >>3<< >>><<<>33X33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>XXXXXXXX<<<< >>>>XXXXXXXXXXXX<<<< >>>>XXXXXXXXXXXXX<<<< >>>4<<< 4-turns
summary hHHHHHHHHHHHHHHhTt SSS hHHHHHHHHHHHHHHHHHHh SS hHHHHHHHHHHHHHHHHHHHht S SS tThHHHHHhtTTt summary
sequence MDTIAARALTVMRACATLQEARIVLEANVMEILGIAINRYNGLTLRGVTMRPTSLAQRNEMFFMCLDMMLSAAGINVGPISPDYTQHMATIGVLATPEIP sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand HHHHHHHHHHHHHHTS EE SS TTTT S TTB TT SEEEEEEETTEEEEEE TT EEE GGGTTTSS SEEEEEEEE SEEE TTS Kabs/Sand
chirality --+++++++++++++++-+-+---+--++++-+----++-+---++-+--+-++-++-------++-+--+++++++----+---------++---+-+- chirality
bends SSSSSSSSSSSSSSSS SS SS S S SS SS S SSS SS SSSSSSS S SS SSS bends
turns TTTTTTTTTTTTTTTTT TTTTTT TTTT TTTT TTTT TTTT TTTTTTTT TTTT turns
5-turns 5-turns
3-turns >33< >3><3< >33< >33< >33< >33< >>333< 3-turns
bridge-2 CCCCCC FFF a bridge-2
bridge-1 AA a BBBBB*B BBBBBB DDD EEEEEEEE GGG bridge-1
sheets AA AAAAAAA AAAAAA BBB AAAAAAAA CCC sheets
4-turns >>>>XXXXXXXX<<<< >444< 4-turns
summary hHHHHHHHHHHHHHHht EEeSStTTTTtS tTTB tTTteEEEEEEETeEEEEEEeTTeEEEeGGGgTTtS SEEEEEEEEeeEEEeTTte summary
sequence FTTEAANEIARVTGETSTWGPARQPYGFFLETEETFQPGRWFMRAAQAVTAVVCGPDMIQVSLNAGARGDVQQIFQGRNDPMMIYLVWRRIENFAMAQGN sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand EEE TT EEEETTEEE TTS EEE SSS EEEE SSS EEEEEEEEEEEESS TTSSTTHHHHHHHHH SSHHHHHHHHHHHTTSSS SSS SS Kabs/Sand
chirality -----++------+----++------++------++-+------------+-+---+++--++++++++++-+--+++++++++++++-+--++---+-- chirality
bends S SSSS SSS SSS SSS SS S SSSSSSSSSSSSS SSSSSSSSSSSSSSSSSS SSS SS bends
turns TTTT TTTT TTTT TTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTT turns
5-turns 5-turns
3-turns >33< >33< >33< >33<>3><3< >33< >>3<< 3-turns
bridge-2 III HHHH EEEEE*EEE bridge-2
bridge-1 GGG HHHH III FFF DDD CCCCCC AA bridge-1
sheets CCC BBBB BBB AAA BBBB AAAAAAAAAAAA sheets
4-turns >>>>XXX<<<< >>>>XXXXX<<<< 4-turns
summary EEEetTTtEEEEeTEEEtTTt EEE SSSeEEEEe SSS EEEEEEEEEEEESS tTTttThHHHHHHHHHh ShHHHHHHHHHHHhTtSS SSS SS summary
sequence SQQTQAGVTVSVGGVDMRAGRIIAWDGQAALHVHNPTQQNAMVQIQVVFYISMDKTLNQYPALTAEIFNVYSFRDHTWHGLRTAILNRTTLPNMLPPIFP sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand SHHHHHHHHHHHHHHHHHHHH TT S HHHHHHT Kabs/Sand
chirality -+-+++++++++++++++++++---+---++----+----+++++++ chirality
bends SSSSSSSSSSSSSSSSSSSSS SS S SSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTT TTTT TTTTTTTTT turns
5-turns 5-turns
3-turns >33< >>3<< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>XXXXXXXXXXXXXX<<<< >>>><<<< 4-turns
summary hHHHHHHHHHHHHHHHHHHHHh tTTt S hHHHHHHht summary
sequence PNDRDSILTLLLLSTLADVYTVLRPEFAIHGVNPMPGPLTRAIARAAYV sequence
310 320 330 340