Secondary structure calculation program - copyright by David Keith Smith, 1989
1hz4A.pdb
1HZ4 TRANSCRIPTION ACTIVATOR MOL_ID: 1; MOL_ID: 1;
Sequence length - 366
A A K K hydrogen bonding Ooi's
strk chain/ l amino u & S structure bridge dihedral angles donor acceptor donor acceptor N N
num seq.no t acids t S + patterns partners phi psi omega alpha kappa tco to/energy fr/energy to/energy fr/energy 8 14
1 A 1 GLU E 0 0 999.9 20.7 177.2 999.9 999.9 999.9 0 0.0 3 -0.5 0 0.0 0 0.0 2 9
2 A 2 ILE I + 0 0 -111.6 127.4 178.4 150.4 999.9 162.4 0 0.0 0 0.0 0 0.0 0 0.0 3 10
3 A 3 LYS K - 0 0 -144.3 173.4 178.0 -66.7 55.7 153.5 1 -0.5 0 0.0 0 0.0 0 0.0 7 11
4 A 4 ASP D h > > T - 0 0 -59.7 142.5 179.8 -122.9 48.1 114.1 0 0.0 8 -1.5 0 0.0 7 -0.9 6 12
5 A 5 ILE I H H > 3 TS+ 0 0 -57.5 -31.9 178.6 65.6 114.0 29.3 0 0.0 9 -2.6 0 0.0 0 0.0 6 18
6 A 6 ARG R H H > 3 TS+ 0 0 -53.8 -44.0 -178.8 49.1 100.3 25.6 0 0.0 10 -2.5 0 0.0 0 0.0 7 21
7 A 7 GLU E H H > < TS+ 0 0 -67.1 -35.9 179.3 52.6 108.8 30.9 4 -0.9 11 -2.0 0 0.0 0 0.0 8 19
8 A 8 ASP D H H X TS+ 0 0 -66.4 -41.6 -179.9 45.8 111.5 23.0 4 -1.5 12 -1.8 0 0.0 0 0.0 9 24
9 A 9 THR T H H X TS+ 0 0 -68.4 -38.5 177.9 52.8 110.8 26.3 5 -2.6 13 -2.0 0 0.0 0 0.0 11 34
10 A 10 MET M H H X TS+ 0 0 -63.7 -36.1 178.3 52.3 107.7 28.4 6 -2.5 14 -2.2 0 0.0 0 0.0 8 34
11 A 11 HIS H H H X TS+ 0 0 -66.5 -36.6 177.7 52.9 106.9 27.4 7 -2.0 15 -2.4 0 0.0 0 0.0 8 34
12 A 12 ALA A H H X TS+ 0 0 -64.0 -37.8 178.5 51.0 108.0 28.0 8 -1.8 16 -1.7 0 0.0 0 0.0 13 41
13 A 13 GLU E H H X TS+ 0 0 -65.6 -40.8 178.6 52.4 108.0 24.3 9 -2.0 17 -2.0 0 0.0 0 0.0 12 41
14 A 14 A PHE F H H X TS+ 0 0 -59.9 -42.4 179.8 54.9 105.9 21.6 10 -2.2 18 -3.1 0 0.0 0 0.0 10 38
15 A 15 ASN N H H X TS+ 0 0 -59.2 -37.2 179.3 53.1 105.3 27.7 11 -2.4 19 -2.2 0 0.0 0 0.0 12 44
16 A 16 ALA A H H X TS+ 0 0 -63.5 -43.5 -179.7 42.2 113.3 22.0 12 -1.7 20 -1.8 0 0.0 0 0.0 16 50
17 A 17 LEU L H H X TS+ 0 0 -73.2 -32.9 176.2 55.5 110.8 31.4 13 -2.0 21 -2.3 0 0.0 0 0.0 11 44
18 A 18 ARG R H H X TS+ 0 0 -62.8 -38.2 179.0 50.4 108.4 24.9 14 -3.1 22 -2.4 0 0.0 0 0.0 10 41
19 A 19 ALA A H H X TS+ 0 0 -65.1 -40.1 178.9 52.7 107.8 25.8 15 -2.2 23 -2.4 0 0.0 0 0.0 16 43
20 A 20 GLN Q H H X TS+ 0 0 -62.3 -43.1 179.3 44.9 111.7 23.5 16 -1.8 24 -1.8 0 0.0 0 0.0 13 48
21 A 21 VAL V H H X TS+ 0 0 -68.4 -37.2 -179.8 57.0 110.4 25.6 17 -2.3 25 -2.1 0 0.0 0 0.0 9 34
22 A 22 ALA A H H < >TS+ 0 0 -61.2 -44.4 -180.0 43.9 108.3 23.5 18 -2.4 27 -2.6 0 0.0 0 0.0 12 35
23 A 23 ILE I H H < >5TS+ 0 0 -69.7 -34.2 177.9 54.1 112.1 26.5 19 -2.4 26 -1.6 0 0.0 0 0.0 14 39
24 A 24 ASN N H H < 35TS+ 0 0 -63.8 -33.7 179.4 51.8 107.4 31.1 20 -1.8 0 0.0 0 0.0 0 0.0 7 37
25 A 25 ASP D T h < 35TS- 0 0 -84.9 8.4 178.9 -104.8 125.5 72.6 21 -2.1 0 0.0 0 0.0 0 0.0 6 26
26 A 26 GLY G T T <5TS+ 0 0 73.6 34.5 179.8 125.0 83.5 34.6 23 -1.6 0 0.0 0 0.0 0 0.0 6 33
27 A 27 ASN N h > TS+ 0 0 -59.5 -34.9 -179.3 57.0 72.0 35.1 0 0.0 32 -2.7 0 0.0 0 0.0 10 38
29 A 29 ASP D H H > TS+ 0 0 -65.1 -43.3 179.4 42.0 111.6 22.2 0 0.0 33 -2.2 0 0.0 0 0.0 7 32
30 A 30 GLU E H H > TS+ 0 0 -69.6 -39.2 179.0 54.4 113.3 26.6 0 0.0 34 -2.8 0 0.0 0 0.0 10 33
31 A 31 ALA A H H X TS+ 0 0 -60.1 -43.9 -179.9 46.5 110.2 23.1 27 -2.2 35 -2.6 0 0.0 0 0.0 17 42
32 A 32 GLU E H H X TS+ 0 0 -65.0 -43.6 -179.2 49.9 112.3 20.9 28 -2.7 36 -2.3 0 0.0 0 0.0 12 43
33 A 33 ARG R H H X TS+ 0 0 -59.4 -48.6 -178.4 41.7 116.4 19.6 29 -2.2 37 -2.0 0 0.0 0 0.0 9 37
34 A 34 LEU L H H X TS+ 0 0 -69.1 -40.5 179.8 52.0 112.5 29.0 30 -2.8 38 -2.3 0 0.0 0 0.0 12 45
35 A 35 ALA A H H X TS+ 0 0 -65.0 -39.2 178.4 48.4 111.5 26.7 31 -2.6 39 -2.4 0 0.0 0 0.0 16 48
36 A 36 LYS K H H X TS+ 0 0 -66.2 -42.6 178.9 50.9 110.2 23.9 32 -2.3 40 -1.9 0 0.0 0 0.0 10 42
37 A 37 LEU L H H X TS+ 0 0 -60.7 -39.6 -179.6 50.1 111.4 26.8 33 -2.0 41 -0.6 0 0.0 0 0.0 10 36
38 A 38 ALA A H H < > TS+ 0 0 -64.5 -52.0 -178.4 49.1 108.7 16.5 34 -2.3 41 -1.6 0 0.0 0 0.0 16 44
39 A 39 LEU L H H < > TS+ 0 0 -58.7 -33.4 179.8 60.3 104.3 33.3 35 -2.4 42 -0.9 0 0.0 0 0.0 12 44
40 A 40 GLU E H H < 3 TS+ 0 0 -65.8 -21.2 -177.0 35.9 114.8 42.5 36 -1.9 0 0.0 0 0.0 0 0.0 6 32
41 A 41 GLU E T h < < TS+ 0 0 -117.9 12.8 -179.9 100.5 91.6 76.9 38 -1.6 0 0.0 37 -0.6 0 0.0 8 35
42 A 42 LEU L t < T - 0 0 -106.4 108.6 -179.8 -160.6 54.6 149.2 39 -0.9 0 0.0 0 0.0 0 0.0 12 33
43 A 43 PRO P t > T - 0 0 -77.8 170.3 179.2 -76.6 38.0 102.5 0 0.0 46 -1.6 0 0.0 0 0.0 6 29
44 A 44 PRO P T T 3 TS+ 0 0 -63.7 151.0 -178.9 45.6 119.5 111.6 0 0.0 0 0.0 0 0.0 0 0.0 5 25
45 A 45 GLY G T T 3 TS+ 0 0 106.7 -42.0 180.0 85.9 89.9 102.6 0 0.0 47 -1.7 0 0.0 0 0.0 4 24
46 A 46 TRP W h > < T + 0 0 -90.7 64.5 -174.0 151.0 55.5 115.1 43 -1.6 50 -1.0 0 0.0 0 0.0 8 34
47 A 47 PHE F H H > T + 0 0 -69.2 -32.5 -175.9 62.6 52.6 40.4 45 -1.7 51 -2.0 0 0.0 0 0.0 8 40
48 A 48 TYR Y H H > TS+ 0 0 -64.4 -51.2 179.2 43.2 105.8 18.6 0 0.0 52 -2.4 0 0.0 0 0.0 6 45
49 A 49 SER S H H > TS+ 0 0 -63.7 -31.8 178.7 56.6 111.7 34.3 0 0.0 53 -2.9 0 0.0 0 0.0 13 51
50 A 50 A ARG R H H X TS+ 0 0 -67.6 -37.3 177.5 48.9 106.9 25.1 46 -1.0 54 -2.2 0 0.0 0 0.0 13 54
51 A 51 ILE I H H X TS+ 0 0 -63.9 -47.2 -179.6 48.1 113.2 17.7 47 -2.0 55 -2.6 0 0.0 0 0.0 12 57
52 A 52 VAL V H H X TS+ 0 0 -59.4 -49.8 -178.2 46.3 112.9 18.2 48 -2.4 56 -2.8 0 0.0 0 0.0 13 66
53 A 53 ALA A H H X TS+ 0 0 -63.0 -38.0 178.8 48.2 113.6 27.5 49 -2.9 57 -2.2 0 0.0 0 0.0 16 63
54 A 54 THR T H H X TS+ 0 0 -67.4 -40.7 179.4 49.9 112.1 23.3 50 -2.2 58 -1.8 0 0.0 0 0.0 14 63
55 A 55 SER S H H X TS+ 0 0 -62.8 -42.1 179.9 52.3 109.5 23.5 51 -2.6 59 -2.0 0 0.0 0 0.0 13 63
56 A 56 VAL V H H X TS+ 0 0 -62.1 -42.2 179.3 51.6 106.7 24.2 52 -2.8 60 -2.4 0 0.0 0 0.0 14 66
57 A 57 LEU L H H X TS+ 0 0 -63.8 -33.7 177.0 55.4 106.9 29.6 53 -2.2 61 -2.5 0 0.0 0 0.0 14 59
58 A 58 GLY G H H X TS+ 0 0 -62.3 -42.6 179.6 46.9 108.8 22.0 54 -1.8 62 -1.9 0 0.0 0 0.0 14 61
59 A 59 GLU E H H X TS+ 0 0 -65.5 -38.1 -180.0 53.3 110.6 28.1 55 -2.0 63 -2.4 0 0.0 0 0.0 10 61
60 A 60 VAL V H H X TS+ 0 0 -63.0 -47.1 -178.8 46.6 109.4 19.8 56 -2.4 64 -2.3 0 0.0 0 0.0 14 50
61 A 61 LEU L H H X >TS+ 0 0 -65.1 -33.7 178.7 54.6 110.0 30.3 57 -2.5 66 -2.2 0 0.0 65 -0.5 12 47
62 A 62 HIS H H H < >5TS+ 0 0 -62.6 -48.0 179.1 48.8 108.6 18.4 58 -1.9 65 -1.4 0 0.0 0 0.0 12 52
63 A 63 A CYS C H H < 35TS+ 0 0 -56.5 -43.6 -178.3 53.2 109.0 24.5 59 -2.4 0 0.0 0 0.0 0 0.0 10 48
64 A 64 LYS K H H < 35TS- 0 0 -70.8 -8.6 -178.9 -115.1 115.6 56.3 60 -2.3 0 0.0 0 0.0 0 0.0 7 40
65 A 65 GLY G T h < <5TS+ 0 0 83.4 10.2 178.4 133.7 75.4 52.9 62 -1.4 67 -1.6 61 -0.5 0 0.0 9 46
66 A 66 GLU E h > T + 0 0 -62.5 -38.8 -179.9 52.6 63.1 37.3 65 -1.6 71 -2.4 0 0.0 0 0.0 9 43
68 A 68 THR T H H > TS+ 0 0 -67.1 -45.8 178.3 41.0 115.8 19.8 0 0.0 72 -1.6 0 0.0 0 0.0 6 34
69 A 69 ARG R H H > TS+ 0 0 -68.6 -35.3 178.7 55.8 113.1 30.5 0 0.0 73 -2.1 0 0.0 0 0.0 9 30
70 A 70 SER S H H X TS+ 0 0 -61.6 -46.6 179.5 50.1 106.3 18.9 66 -2.3 74 -2.6 0 0.0 0 0.0 14 40
71 A 71 LEU L H H X TS+ 0 0 -58.9 -38.8 179.9 54.6 107.5 26.8 67 -2.4 75 -2.5 0 0.0 0 0.0 12 44
72 A 72 ALA A H H X TS+ 0 0 -61.8 -42.7 179.3 45.3 110.8 23.6 68 -1.6 76 -2.2 0 0.0 0 0.0 9 34
73 A 73 LEU L H H X TS+ 0 0 -69.4 -36.5 178.1 53.1 110.6 30.0 69 -2.1 77 -2.5 0 0.0 0 0.0 12 45
74 A 74 MET M H H X TS+ 0 0 -63.3 -41.3 179.3 49.1 109.9 23.3 70 -2.6 78 -2.7 0 0.0 0 0.0 15 49
75 A 75 GLN Q H H X TS+ 0 0 -63.5 -42.6 177.7 50.1 110.3 23.9 71 -2.5 79 -2.3 0 0.0 0 0.0 9 46
76 A 76 GLN Q H H X TS+ 0 0 -60.2 -43.3 179.9 49.0 112.2 23.1 72 -2.2 80 -2.3 0 0.0 0 0.0 9 40
77 A 77 THR T H H X TS+ 0 0 -62.4 -45.1 -179.3 51.4 109.2 24.2 73 -2.5 81 -2.6 0 0.0 0 0.0 15 48
78 A 78 GLU E H H X TS+ 0 0 -59.9 -44.5 -179.6 48.9 110.6 24.1 74 -2.7 82 -2.5 0 0.0 0 0.0 13 48
79 A 79 GLN Q H H X TS+ 0 0 -63.4 -45.9 178.9 46.0 113.0 21.6 75 -2.3 83 -2.4 0 0.0 0 0.0 9 36
80 A 80 MET M H H X TS+ 0 0 -63.9 -40.4 -179.9 50.9 112.8 25.6 76 -2.3 84 -1.4 0 0.0 0 0.0 9 37
81 A 81 ALA A H H < >TS+ 0 0 -63.8 -42.7 178.8 47.8 110.8 23.0 77 -2.6 86 -2.8 0 0.0 0 0.0 13 39
82 A 82 ARG R H H < >5TS+ 0 0 -63.0 -41.8 -179.5 57.8 107.0 23.4 78 -2.5 85 -1.5 0 0.0 0 0.0 10 35
83 A 83 GLN Q H H < 35TS+ 0 0 -57.6 -32.1 -178.3 35.0 116.3 34.4 79 -2.4 0 0.0 0 0.0 0 0.0 7 28
84 A 84 HIS H T h < 35TS- 0 0 -110.9 17.9 179.6 -113.5 111.1 80.4 80 -1.4 0 0.0 0 0.0 0 0.0 7 25
85 A 85 ASP D T T <5T + 0 0 55.7 33.2 179.1 150.5 62.9 35.8 82 -1.5 87 -1.5 0 0.0 0 0.0 6 28
86 A 86 VAL V h > > 3 T + 0 0 -59.7 -36.8 -179.7 60.1 66.3 36.3 85 -1.5 91 -2.7 0 0.0 0 0.0 9 43
88 A 88 HIS H H H > 3 TS+ 0 0 -63.9 -36.4 177.7 44.0 109.0 28.3 0 0.0 92 -2.3 0 0.0 0 0.0 7 47
89 A 89 TYR Y H H > < TS+ 0 0 -77.3 -28.6 176.9 52.2 112.5 34.5 86 -0.6 93 -1.9 0 0.0 0 0.0 13 52
90 A 90 ALA A H H X TS+ 0 0 -69.0 -42.2 179.2 43.4 114.1 21.6 86 -1.6 94 -2.0 0 0.0 0 0.0 13 58
91 A 91 LEU L H H X TS+ 0 0 -67.2 -44.8 179.5 51.3 113.0 22.3 87 -2.7 95 -2.3 0 0.0 0 0.0 13 58
92 A 92 TRP W H H X TS+ 0 0 -60.2 -37.8 179.4 52.9 109.2 26.1 88 -2.3 96 -2.3 0 0.0 0 0.0 9 61
93 A 93 SER S H H X TS+ 0 0 -63.2 -47.5 -179.9 48.0 108.6 20.6 89 -1.9 97 -2.3 0 0.0 0 0.0 13 61
94 A 94 LEU L H H X TS+ 0 0 -62.0 -37.5 178.4 53.0 110.1 29.0 90 -2.0 98 -2.2 0 0.0 0 0.0 14 58
95 A 95 ILE I H H X TS+ 0 0 -62.6 -46.4 179.8 46.1 111.3 18.9 91 -2.3 99 -2.4 0 0.0 0 0.0 13 56
96 A 96 GLN Q H H X TS+ 0 0 -64.6 -37.4 179.8 55.1 109.0 30.7 92 -2.3 100 -2.0 0 0.0 0 0.0 9 67
97 A 97 GLN Q H H X TS+ 0 0 -62.4 -43.1 179.4 48.6 108.6 22.6 93 -2.3 101 -2.4 0 0.0 0 0.0 12 58
98 A 98 A SER S H H X TS+ 0 0 -61.4 -45.4 -178.4 57.4 106.5 17.8 94 -2.2 102 -3.3 0 0.0 0 0.0 13 54
99 A 99 GLU E H H X TS+ 0 0 -52.7 -45.8 179.0 44.1 109.5 25.6 95 -2.4 103 -2.1 0 0.0 0 0.0 10 61
100 A 100 ILE I H H X TS+ 0 0 -65.1 -44.9 -179.0 50.8 113.5 20.0 96 -2.0 104 -2.1 0 0.0 0 0.0 11 56
101 A 101 LEU L H H < >TS+ 0 0 -60.2 -42.6 179.3 48.8 110.6 24.6 97 -2.4 106 -2.5 0 0.0 0 0.0 12 50
102 A 102 PHE F H H < >5TS+ 0 0 -63.2 -44.4 180.0 51.6 109.9 21.8 98 -3.3 105 -1.7 0 0.0 0 0.0 12 55
103 A 103 ALA A H H < 35TS+ 0 0 -60.5 -35.0 179.6 54.0 107.1 30.7 99 -2.1 288 -1.5 0 0.0 289 -0.6 11 60
104 A 104 GLN Q T h < 35TS- 0 0 -77.0 -3.6 -179.7 -112.2 119.7 59.4 100 -2.1 0 0.0 0 0.0 0 0.0 10 51
105 A 105 GLY G T T <5TS+ 0 0 82.9 13.4 179.8 130.4 78.6 51.4 102 -1.7 107 -1.2 0 0.0 0 0.0 11 50
106 A 106 PHE F h > T + 0 0 -66.0 -33.6 178.8 52.6 68.0 35.5 105 -1.2 111 -2.3 0 0.0 0 0.0 11 46
108 A 108 GLN Q H H > TS+ 0 0 -68.7 -41.0 179.4 46.8 112.2 22.4 0 0.0 112 -2.2 0 0.0 0 0.0 6 37
109 A 109 THR T H H > TS+ 0 0 -66.4 -37.4 178.5 52.5 111.0 26.8 0 0.0 113 -2.1 0 0.0 0 0.0 9 35
110 A 110 ALA A H H X TS+ 0 0 -63.8 -41.4 179.6 50.9 108.5 22.7 106 -2.3 114 -2.5 0 0.0 0 0.0 13 47
111 A 111 TRP W H H X TS+ 0 0 -60.6 -44.3 -179.3 49.4 109.9 22.7 107 -2.3 115 -2.3 0 0.0 0 0.0 11 45
112 A 112 GLU E H H X TS+ 0 0 -63.4 -36.5 179.9 49.8 111.0 31.6 108 -2.2 116 -1.6 0 0.0 0 0.0 8 33
113 A 113 THR T H H X TS+ 0 0 -70.3 -39.0 178.2 49.7 110.1 26.4 109 -2.1 117 -1.5 0 0.0 0 0.0 12 45
114 A 114 GLN Q H H X TS+ 0 0 -64.2 -37.1 179.7 57.3 107.0 26.2 110 -2.5 118 -2.3 0 0.0 0 0.0 13 47
115 A 115 GLU E H H X TS+ 0 0 -61.5 -37.6 177.9 53.2 102.4 28.9 111 -2.3 119 -2.4 0 0.0 0 0.0 8 40
116 A 116 LYS K H H X TS+ 0 0 -64.2 -36.3 180.0 51.6 108.6 28.2 112 -1.6 120 -2.4 0 0.0 0 0.0 9 42
117 A 117 ALA A H H X TS+ 0 0 -67.2 -42.0 178.3 48.0 109.3 23.6 113 -1.5 121 -2.4 0 0.0 0 0.0 12 49
118 A 118 PHE F H H X TS+ 0 0 -64.4 -37.0 178.8 52.7 110.9 27.4 114 -2.3 122 -2.2 0 0.0 0 0.0 8 44
119 A 119 GLN Q H H X TS+ 0 0 -62.2 -45.9 179.4 48.2 109.6 21.6 115 -2.4 123 -2.8 0 0.0 0 0.0 8 31
120 A 120 LEU L H H X TS+ 0 0 -60.5 -44.8 179.1 51.2 110.6 24.8 116 -2.4 124 -2.6 0 0.0 0 0.0 10 37
121 A 121 ILE I H H < >TS+ 0 0 -59.7 -42.0 -179.8 46.3 112.6 25.8 117 -2.4 126 -2.5 0 0.0 0 0.0 12 39
122 A 122 ASN N H H < >5TS+ 0 0 -67.6 -47.1 -179.2 47.4 113.8 19.1 118 -2.2 125 -0.8 0 0.0 0 0.0 9 23
123 A 123 GLU E H H < 35TS+ 0 0 -61.9 -42.4 -178.2 35.1 121.5 27.0 119 -2.8 0 0.0 0 0.0 0 0.0 7 22
124 A 124 GLN Q T h < 35TS- 0 0 -98.5 10.7 178.6 -118.4 108.3 73.5 120 -2.6 0 0.0 0 0.0 0 0.0 7 26
125 A 125 HIS H T T <5T + 0 0 53.9 54.9 -178.6 148.6 60.9 21.1 122 -0.8 0 0.0 0 0.0 0 0.0 6 23
126 A 126 LEU L t > > TS+ 0 0 -47.0 -39.2 -178.7 64.8 106.3 40.0 0 0.0 133 -1.7 0 0.0 134 -0.7 8 41
131 A 131 MET M H H > 3 TS+ 0 0 -63.1 -18.9 179.3 75.4 85.6 44.7 0 0.0 135 -1.8 0 0.0 0 0.0 9 49
132 A 132 HIS H H H > < TS+ 0 0 -61.5 -33.6 179.0 58.1 89.8 30.7 129 -2.2 136 -2.5 0 0.0 0 0.0 13 54
133 A 133 GLU E H H > < TS+ 0 0 -64.3 -39.8 -179.3 52.3 102.2 25.2 130 -1.7 137 -2.1 0 0.0 0 0.0 12 52
134 A 134 PHE F H H X TS+ 0 0 -62.2 -43.7 179.8 49.0 110.8 19.7 130 -0.7 138 -2.4 0 0.0 0 0.0 10 59
135 A 135 LEU L H H X TS+ 0 0 -62.3 -48.1 -179.6 45.5 112.3 19.9 131 -1.8 139 -2.2 0 0.0 0 0.0 11 63
136 A 136 VAL V H H X TS+ 0 0 -68.1 -24.5 178.3 56.4 111.0 33.9 132 -2.5 140 -2.2 0 0.0 0 0.0 12 62
137 A 137 ARG R H H X TS+ 0 0 -70.6 -45.6 179.5 41.6 110.4 20.1 133 -2.1 141 -2.0 0 0.0 0 0.0 14 63
138 A 138 ILE I H H X TS+ 0 0 -72.5 -26.0 175.6 54.7 113.0 33.9 134 -2.4 142 -1.9 0 0.0 0 0.0 9 68
139 A 139 ARG R H H X TS+ 0 0 -67.9 -40.7 178.3 50.2 108.3 22.5 135 -2.2 143 -2.7 0 0.0 0 0.0 12 62
140 A 140 ALA A H H X TS+ 0 0 -62.2 -39.3 -179.9 54.3 107.0 26.9 136 -2.2 144 -2.6 0 0.0 0 0.0 14 58
141 A 141 GLN Q H H X TS+ 0 0 -60.5 -43.3 -179.5 45.2 110.9 23.3 137 -2.0 145 -2.2 0 0.0 0 0.0 10 68
142 A 142 LEU L H H X TS+ 0 0 -67.3 -45.8 178.9 49.2 113.0 20.0 138 -1.9 146 -2.0 0 0.0 0 0.0 12 61
143 A 143 LEU L H H < >TS+ 0 0 -61.3 -37.2 179.2 53.7 109.9 28.4 139 -2.7 148 -2.9 0 0.0 0 0.0 12 53
144 A 144 TRP W H H < >5TS+ 0 0 -63.9 -45.8 179.7 53.0 104.7 19.9 140 -2.6 147 -2.1 0 0.0 328 -0.5 12 54
145 A 145 ALA A H H < 35TS+ 0 0 -54.4 -42.4 -178.6 48.4 110.8 23.0 141 -2.2 327 -2.3 0 0.0 328 -1.5 12 65
146 A 146 TRP W T h < 35TS- 0 0 -78.8 2.0 179.4 -116.8 116.9 68.1 142 -2.0 0 0.0 0 0.0 0 0.0 10 51
147 A 147 ALA A T T <5TS+ 0 0 66.3 28.6 176.9 139.5 70.1 40.6 144 -2.1 149 -1.3 0 0.0 0 0.0 9 47
148 A 148 ARG R h > T + 0 0 -66.1 -41.3 179.0 52.9 64.0 31.7 147 -1.3 153 -2.7 0 0.0 0 0.0 11 46
150 A 150 ASP D H H > TS+ 0 0 -62.0 -43.3 179.2 44.6 114.5 19.9 0 0.0 154 -2.3 0 0.0 0 0.0 6 34
151 A 151 GLU E H H > TS+ 0 0 -65.6 -42.4 179.8 51.6 112.4 23.9 0 0.0 155 -2.4 0 0.0 0 0.0 9 35
152 A 152 ALA A H H X TS+ 0 0 -60.6 -43.3 180.0 48.3 110.9 22.6 148 -2.4 156 -2.5 0 0.0 0 0.0 15 44
153 A 153 GLU E H H X TS+ 0 0 -63.3 -44.7 179.9 50.0 110.9 23.2 149 -2.7 157 -2.7 0 0.0 0 0.0 12 46
154 A 154 ALA A H H X TS+ 0 0 -62.2 -37.4 179.7 51.5 110.3 27.3 150 -2.3 158 -2.0 0 0.0 0 0.0 8 37
155 A 155 SER S H H X TS+ 0 0 -65.2 -45.3 179.1 47.6 110.6 20.3 151 -2.4 159 -1.6 0 0.0 0 0.0 12 48
156 A 156 ALA A H H X TS+ 0 0 -62.6 -40.8 -179.7 51.2 111.2 24.7 152 -2.5 160 -1.9 0 0.0 0 0.0 15 46
157 A 157 ARG R H H X TS+ 0 0 -67.0 -32.1 178.3 55.2 105.5 30.3 153 -2.7 161 -2.3 0 0.0 0 0.0 10 44
158 A 158 SER S H H X TS+ 0 0 -67.1 -32.3 177.8 52.7 106.6 29.1 154 -2.0 162 -2.4 0 0.0 0 0.0 10 42
159 A 159 GLY G H H X TS+ 0 0 -65.8 -43.2 178.1 50.1 107.6 24.7 155 -1.6 163 -1.6 0 0.0 0 0.0 15 46
160 A 160 ILE I H H < TS+ 0 0 -61.4 -40.1 179.7 50.0 111.2 24.8 156 -1.9 0 0.0 0 0.0 0 0.0 12 45
161 A 161 GLU E H H < > TS+ 0 0 -66.3 -42.6 178.7 56.8 104.6 22.8 157 -2.3 164 -2.0 0 0.0 0 0.0 7 35
162 A 162 VAL V H H < 3 TS+ 0 0 -55.0 -36.2 -178.4 41.8 113.3 29.1 158 -2.4 0 0.0 0 0.0 0 0.0 13 35
163 A 163 LEU L T h < > TS+ 0 0 -97.9 18.0 -177.0 117.6 78.7 78.3 159 -1.6 166 -1.8 0 0.0 0 0.0 11 32
164 A 164 SER S T T < TS+ 0 0 -58.5 -26.8 -179.5 52.4 74.1 40.7 161 -2.0 0 0.0 0 0.0 0 0.0 8 27
165 A 165 SER S T T 3 TS+ 0 0 -85.5 -10.3 -178.2 79.0 100.0 52.7 0 0.0 0 0.0 0 0.0 0 0.0 5 20
166 A 166 TYR Y S t < TS- 0 0 -95.2 169.1 -178.4 -71.8 98.5 116.0 163 -1.8 0 0.0 0 0.0 0 0.0 6 23
167 A 167 GLN Q g > T - 0 0 -58.7 146.1 -179.4 -114.9 45.9 102.7 0 0.0 170 -2.1 0 0.0 0 0.0 7 27
168 A 168 PRO P G G > TS+ 0 0 -53.0 -30.7 179.2 71.4 111.0 36.6 0 0.0 171 -2.1 0 0.0 0 0.0 8 33
169 A 169 GLN Q G G > TS+ 0 0 -57.3 -28.5 -179.8 68.6 85.0 38.5 0 0.0 172 -1.7 0 0.0 0 0.0 9 38
170 A 170 GLN Q G G < TS+ 0 0 -66.1 -16.2 -178.9 62.5 90.8 47.3 167 -2.1 0 0.0 0 0.0 0 0.0 8 45
171 A 171 GLN Q G h > < T + 0 0 -89.9 5.4 -176.9 109.8 69.4 67.7 168 -2.1 175 -2.6 0 0.0 0 0.0 11 54
172 A 172 LEU L H H > < TS+ 0 0 -48.9 -49.8 -176.9 42.6 79.3 27.4 169 -1.7 176 -2.2 0 0.0 0 0.0 13 55
173 A 173 GLN Q H H > TS+ 0 0 -71.6 -37.4 177.0 47.3 114.6 27.6 0 0.0 177 -1.8 0 0.0 0 0.0 11 62
174 A 174 CYS C H H > TS+ 0 0 -70.1 -31.1 177.7 52.5 112.4 30.1 0 0.0 178 -2.0 0 0.0 0 0.0 12 63
175 A 175 LEU L H H X TS+ 0 0 -67.3 -40.7 178.2 52.5 106.7 24.5 171 -2.6 179 -2.3 0 0.0 0 0.0 12 59
176 A 176 ALA A H H X TS+ 0 0 -60.6 -37.5 179.2 51.7 108.4 26.1 172 -2.2 180 -2.5 0 0.0 0 0.0 12 64
177 A 177 MET M H H X TS+ 0 0 -66.6 -39.0 178.2 53.3 105.9 26.8 173 -1.8 181 -2.1 0 0.0 0 0.0 13 70
178 A 178 LEU L H H X TS+ 0 0 -60.3 -42.9 178.9 46.8 111.4 22.7 174 -2.0 182 -2.2 0 0.0 0 0.0 12 63
179 A 179 ILE I H H X TS+ 0 0 -64.3 -41.1 179.6 56.2 107.4 24.2 175 -2.3 183 -2.8 0 0.0 0 0.0 13 59
180 A 180 GLN Q H H X TS+ 0 0 -58.8 -38.2 177.8 48.9 108.4 26.7 176 -2.5 184 -2.0 0 0.0 0 0.0 10 69
181 A 181 CYS C H H X TS+ 0 0 -66.4 -44.2 179.5 50.1 110.1 22.1 177 -2.1 185 -1.6 0 0.0 0 0.0 12 61
182 A 182 SER S H H X >TS+ 0 0 -61.3 -39.7 179.7 52.2 109.8 26.5 178 -2.2 187 -2.3 0 0.0 186 -1.0 12 58
183 A 183 LEU L H H < >5TS+ 0 0 -64.3 -42.7 179.6 50.4 107.5 24.2 179 -2.8 186 -0.6 0 0.0 0 0.0 14 54
184 A 184 ALA A H H < 35TS+ 0 0 -65.3 -28.7 179.1 50.2 111.2 35.7 180 -2.0 0 0.0 0 0.0 0 0.0 11 60
185 A 185 A ARG R H H < 35TS- 0 0 -80.5 -18.3 -178.2 -122.5 111.2 48.6 181 -1.6 0 0.0 0 0.0 0 0.0 9 47
186 A 186 GLY G T h < <5T + 0 0 81.3 19.2 -179.7 145.7 64.1 45.9 182 -1.0 188 -1.6 183 -0.6 0 0.0 8 44
187 A 187 ASP D h > T + 0 0 -67.9 -27.9 178.9 60.8 66.9 39.3 186 -1.6 192 -2.6 0 0.0 0 0.0 9 35
189 A 189 ASP D H H > TS+ 0 0 -64.5 -48.6 179.5 39.1 111.6 17.9 0 0.0 193 -2.0 0 0.0 0 0.0 6 24
190 A 190 ASN N H H > TS+ 0 0 -68.2 -38.3 178.5 55.0 113.9 26.3 0 0.0 194 -2.7 0 0.0 0 0.0 9 29
191 A 191 ALA A H H X TS+ 0 0 -58.9 -44.9 -178.9 48.0 109.5 21.0 187 -2.2 195 -2.8 0 0.0 0 0.0 13 40
192 A 192 ARG R H H X TS+ 0 0 -63.2 -42.3 179.9 48.6 111.9 24.9 188 -2.6 196 -1.7 0 0.0 0 0.0 8 39
193 A 193 SER S H H X TS+ 0 0 -64.1 -43.2 178.7 45.2 114.9 23.6 189 -2.0 197 -1.2 0 0.0 0 0.0 8 29
194 A 194 GLN Q H H X TS+ 0 0 -67.3 -38.0 178.4 55.9 109.6 28.5 190 -2.7 198 -2.4 0 0.0 0 0.0 11 45
195 A 195 LEU L H H X TS+ 0 0 -64.5 -30.4 178.0 61.7 98.6 34.7 191 -2.8 199 -3.0 0 0.0 0 0.0 10 46
196 A 196 ASN N H H X TS+ 0 0 -60.7 -42.1 -179.9 42.7 108.9 20.7 192 -1.7 200 -1.8 0 0.0 0 0.0 8 34
197 A 197 ARG R H H X TS+ 0 0 -69.4 -41.6 179.4 52.3 113.0 24.4 193 -1.2 201 -2.3 0 0.0 0 0.0 8 36
198 A 198 LEU L H H X TS+ 0 0 -59.8 -46.3 -179.5 47.7 110.3 21.6 194 -2.4 202 -2.7 0 0.0 0 0.0 12 45
199 A 199 GLU E H H X TS+ 0 0 -65.7 -35.0 177.1 53.3 109.5 28.9 195 -3.0 203 -1.8 0 0.0 0 0.0 8 43
200 A 200 ASN N H H < TS+ 0 0 -65.1 -40.4 179.0 47.2 110.8 23.7 196 -1.8 0 0.0 0 0.0 0 0.0 8 28
201 A 201 LEU L H H < > TS+ 0 0 -66.1 -42.2 179.8 54.9 108.8 20.6 197 -2.3 204 -2.0 0 0.0 0 0.0 11 35
202 A 202 LEU L H H < > TS+ 0 0 -58.7 -34.0 -179.5 51.1 106.7 32.8 198 -2.7 205 -0.5 0 0.0 0 0.0 10 37
203 A 203 GLY G T h < 3 TS+ 0 0 -85.1 6.6 -178.1 56.6 108.2 67.0 199 -1.8 0 0.0 0 0.0 0 0.0 6 28
204 A 204 ASN N T T < TS+ 0 0 -134.4 48.0 178.1 35.5 102.1 102.7 201 -2.0 0 0.0 0 0.0 0 0.0 7 21
205 A 205 GLY G S t < TS- 0 0 177.3 158.8 176.5 -113.4 70.5 157.2 202 -0.5 207 -0.7 0 0.0 0 0.0 7 24
206 A 206 LYS K - 0 0 -107.0 108.0 -177.1 -176.7 49.2 161.1 0 0.0 0 0.0 0 0.0 0 0.0 4 25
207 A 207 TYR Y - 0 0 -107.5 165.5 175.9 -91.5 31.6 129.5 205 -0.7 0 0.0 0 0.0 0 0.0 6 31
208 A 208 HIS H h > > T - 0 0 -68.0 148.5 -179.7 -115.0 41.3 113.3 0 0.0 212 -2.0 0 0.0 211 -0.6 6 34
209 A 209 A SER S H H > 3 TS+ 0 0 -55.9 -36.9 -179.2 55.4 115.0 32.5 0 0.0 213 -2.6 0 0.0 0 0.0 6 38
210 A 210 ASP D H H > 3 TS+ 0 0 -69.2 -31.5 177.2 50.7 106.1 32.5 0 0.0 214 -1.7 0 0.0 0 0.0 7 43
211 A 211 TRP W H H > < TS+ 0 0 -67.7 -43.6 -179.2 48.0 112.4 22.2 208 -0.6 215 -2.4 0 0.0 0 0.0 10 43
212 A 212 ILE I H H X TS+ 0 0 -64.2 -41.2 -179.9 50.2 110.4 25.5 208 -2.0 216 -2.9 0 0.0 0 0.0 10 48
213 A 213 SER S H H X TS+ 0 0 -67.9 -32.0 178.3 50.8 110.5 31.1 209 -2.6 217 -1.5 0 0.0 0 0.0 11 49
214 A 214 ASN N H H X TS+ 0 0 -69.7 -43.5 178.1 45.5 112.7 21.8 210 -1.7 218 -1.1 0 0.0 0 0.0 12 51
215 A 215 ALA A H H X TS+ 0 0 -64.3 -42.2 -179.1 49.9 113.5 21.6 211 -2.4 219 -1.5 0 0.0 0 0.0 12 59
216 A 216 ASN N H H X TS+ 0 0 -68.3 -25.0 178.5 69.5 98.4 36.4 212 -2.9 220 -2.9 0 0.0 0 0.0 9 63
217 A 217 LYS K H H X TS+ 0 0 -56.0 -48.0 -178.9 38.2 105.8 20.8 213 -1.5 221 -1.7 0 0.0 0 0.0 11 63
218 A 218 VAL V H H X TS+ 0 0 -76.3 -29.7 176.9 56.6 113.1 35.1 214 -1.1 222 -2.3 0 0.0 0 0.0 12 67
219 A 219 ARG R H H X TS+ 0 0 -64.8 -46.3 -180.0 45.8 109.5 17.8 215 -1.5 223 -2.6 0 0.0 0 0.0 9 65
220 A 220 VAL V H H X TS+ 0 0 -64.9 -38.5 177.8 51.5 111.6 27.5 216 -2.9 224 -2.6 0 0.0 0 0.0 12 59
221 A 221 ILE I H H X TS+ 0 0 -64.3 -40.7 178.4 49.2 110.8 21.3 217 -1.7 225 -2.7 0 0.0 0 0.0 10 68
222 A 222 TYR Y H H X TS+ 0 0 -63.1 -43.1 179.0 50.0 110.4 23.2 218 -2.3 226 -1.6 0 0.0 0 0.0 11 55
223 A 223 TRP W H H < >TS+ 0 0 -62.2 -39.8 178.4 50.5 110.7 24.5 219 -2.6 228 -2.6 0 0.0 0 0.0 12 50
224 A 224 GLN Q H H < >5TS+ 0 0 -61.9 -46.2 -178.9 49.5 110.2 18.1 220 -2.6 227 -1.2 0 0.0 0 0.0 12 54
225 A 225 MET M H H < 35TS+ 0 0 -65.0 -24.2 -179.5 39.3 118.1 41.4 221 -2.7 0 0.0 0 0.0 0 0.0 7 50
226 A 226 THR T T h < 35TS- 0 0 -108.0 9.0 180.0 -118.7 109.6 73.8 222 -1.6 0 0.0 0 0.0 0 0.0 6 37
227 A 227 GLY G T T <5T + 0 0 58.5 33.6 -178.7 164.5 52.3 35.2 224 -1.2 229 -1.9 0 0.0 0 0.0 7 34
228 A 228 ASP D h > TS+ 0 0 -63.4 -35.5 -180.0 58.7 70.6 31.2 227 -1.9 233 -2.7 0 0.0 0 0.0 10 29
230 A 230 ALA A H H > TS+ 0 0 -60.2 -49.3 -179.7 43.0 109.0 18.1 0 0.0 234 -2.3 0 0.0 0 0.0 6 27
231 A 231 ALA A H H > TS+ 0 0 -64.1 -41.7 -179.5 49.5 115.4 24.7 0 0.0 235 -2.4 0 0.0 0 0.0 8 35
232 A 232 ALA A H H X TS+ 0 0 -65.4 -40.8 179.8 49.1 111.2 26.3 228 -2.1 236 -2.8 0 0.0 0 0.0 13 42
233 A 233 ALA A H H X TS+ 0 0 -65.9 -43.4 178.9 47.1 112.3 24.1 229 -2.7 237 -2.1 0 0.0 0 0.0 10 34
234 A 234 ASN N H H X TS+ 0 0 -64.0 -42.8 179.3 48.0 114.6 21.9 230 -2.3 238 -1.3 0 0.0 0 0.0 8 26
235 A 235 TRP W H H X TS+ 0 0 -61.0 -48.3 -178.2 50.6 111.1 19.3 231 -2.4 239 -1.4 0 0.0 0 0.0 8 42
236 A 236 LEU L H H < TS+ 0 0 -59.8 -39.0 179.8 55.7 105.6 31.1 232 -2.8 0 0.0 0 0.0 0 0.0 10 42
237 A 237 ARG R H H < TS+ 0 0 -64.2 -32.9 -177.8 32.4 118.7 32.1 233 -2.1 0 0.0 0 0.0 0 0.0 6 26
238 A 238 HIS H H H < TS+ 0 0 -105.2 -2.7 -178.5 107.6 93.4 60.5 234 -1.3 0 0.0 0 0.0 0 0.0 6 24
239 A 239 THR T S h < TS- 0 0 -77.8 159.4 -179.7 -92.5 78.4 109.2 235 -1.4 0 0.0 0 0.0 0 0.0 6 39
240 A 240 ALA A - 0 0 -69.4 138.9 180.0 -171.5 33.8 116.5 0 0.0 0 0.0 0 0.0 0 0.0 4 35
241 A 241 LYS K - 0 0 -130.6 62.5 179.9 -178.5 8.8 120.0 0 0.0 0 0.0 0 0.0 0 0.0 6 35
242 A 242 PRO P - 0 0 -63.6 135.1 -179.5 -94.2 45.2 114.7 0 0.0 0 0.0 0 0.0 0 0.0 5 31
243 A 243 GLU E - 0 0 -51.7 127.0 -178.9 -140.5 31.5 106.2 0 0.0 0 0.0 0 0.0 0 0.0 4 26
244 A 244 PHE F t > T + 0 0 -56.8 -51.0 177.6 171.6 32.5 19.5 0 0.0 247 -1.5 0 0.0 0 0.0 9 38
245 A 245 ALA A T T 3 TS- 0 0 40.4 52.7 177.9 -58.7 75.1 34.1 0 0.0 0 0.0 0 0.0 0 0.0 4 28
246 A 246 ASN N T T 3 TS+ 0 0 51.3 38.3 180.0 145.0 95.6 35.0 0 0.0 248 -0.7 0 0.0 0 0.0 6 36
247 A 247 A ASN N g X T - 0 0 -107.9 103.1 -178.4 -162.8 36.9 154.0 244 -1.5 250 -2.2 0 0.0 0 0.0 10 42
248 A 248 HIS H G G > TS+ 0 0 -59.4 -24.0 179.6 69.1 85.8 41.3 246 -0.7 251 -1.6 0 0.0 0 0.0 11 50
249 A 249 PHE F G G 3 TS+ 0 0 -69.4 -11.5 179.5 56.9 96.0 50.1 0 0.0 0 0.0 0 0.0 0 0.0 6 57
250 A 250 LEU L G h > < TS+ 0 0 -99.9 6.0 179.0 96.9 75.6 70.1 247 -2.2 254 -2.0 0 0.0 0 0.0 9 50
251 A 251 GLN Q H H > < TS+ 0 0 -58.8 -45.3 -178.0 53.2 82.4 22.8 248 -1.6 255 -2.1 0 0.0 0 0.0 11 61
252 A 252 GLY G H H > TS+ 0 0 -59.0 -48.8 -179.1 44.7 109.4 23.6 0 0.0 256 -1.7 0 0.0 0 0.0 10 59
253 A 253 GLN Q H H > TS+ 0 0 -66.6 -37.8 179.3 50.8 113.5 27.2 0 0.0 257 -2.0 0 0.0 0 0.0 12 51
254 A 254 TRP W H H X TS+ 0 0 -71.2 -27.8 174.3 54.4 106.6 34.3 250 -2.0 258 -2.7 0 0.0 0 0.0 12 60
255 A 255 ARG R H H X TS+ 0 0 -67.7 -35.9 178.5 52.1 107.2 28.7 251 -2.1 259 -2.8 0 0.0 0 0.0 12 67
256 A 256 ASN N H H X TS+ 0 0 -62.2 -43.8 179.6 47.0 111.4 21.8 252 -1.7 260 -2.1 0 0.0 0 0.0 12 66
257 A 257 ILE I H H X TS+ 0 0 -62.9 -48.1 179.5 47.3 113.5 19.8 253 -2.0 261 -2.7 0 0.0 0 0.0 10 63
258 A 258 ALA A H H X TS+ 0 0 -61.8 -41.3 -179.7 52.6 110.2 25.1 254 -2.7 262 -2.9 0 0.0 0 0.0 14 63
259 A 259 ARG R H H X TS+ 0 0 -61.7 -40.8 179.2 46.2 111.6 23.7 255 -2.8 263 -2.2 0 0.0 0 0.0 13 68
260 A 260 ALA A H H X TS+ 0 0 -66.4 -44.1 179.3 51.2 112.0 21.5 256 -2.1 264 -2.0 0 0.0 0 0.0 13 57
261 A 261 GLN Q H H < >TS+ 0 0 -58.9 -44.6 180.0 50.1 109.8 22.7 257 -2.7 266 -2.8 0 0.0 0 0.0 13 52
262 A 262 ILE I H H < >5TS+ 0 0 -60.8 -45.1 179.3 51.7 108.3 22.2 258 -2.9 265 -1.9 0 0.0 0 0.0 13 55
263 A 263 LEU L H H < 35TS+ 0 0 -58.4 -36.9 -179.1 49.0 111.6 28.2 259 -2.2 0 0.0 0 0.0 0 0.0 11 50
264 A 264 LEU L T h < 35TS- 0 0 -86.2 7.1 179.9 -110.7 119.1 71.7 260 -2.0 0 0.0 0 0.0 0 0.0 9 40
265 A 265 GLY G T T <5TS+ 0 0 75.1 11.5 179.6 137.4 74.4 53.1 262 -1.9 267 -1.8 0 0.0 0 0.0 8 35
266 A 266 GLU E h > T + 0 0 -65.2 -42.4 -179.0 58.8 58.8 30.9 265 -1.8 271 -2.4 0 0.0 0 0.0 10 35
268 A 268 GLU E H H > TS+ 0 0 -57.4 -56.6 179.9 40.1 110.1 16.1 0 0.0 272 -1.9 0 0.0 0 0.0 6 31
269 A 269 PRO P H H > TS+ 0 0 -63.3 -34.9 179.8 53.5 115.3 26.9 0 0.0 273 -2.2 0 0.0 0 0.0 9 32
270 A 270 ALA A H H X TS+ 0 0 -66.0 -38.4 -179.8 51.0 106.8 27.6 266 -1.5 274 -2.7 0 0.0 0 0.0 14 45
271 A 271 GLU E H H X TS+ 0 0 -65.6 -39.9 178.9 51.0 109.6 23.1 267 -2.4 275 -2.5 0 0.0 0 0.0 11 45
272 A 272 ILE I H H X TS+ 0 0 -62.2 -41.8 178.9 49.2 111.1 23.5 268 -1.9 276 -1.9 0 0.0 0 0.0 8 36
273 A 273 VAL V H H X TS+ 0 0 -61.3 -52.7 -177.5 45.8 112.8 15.2 269 -2.2 277 -2.5 0 0.0 0 0.0 11 49
274 A 274 LEU L H H X TS+ 0 0 -62.5 -36.1 178.8 52.9 110.2 31.9 270 -2.7 278 -2.3 0 0.0 0 0.0 13 54
275 A 275 GLU E H H X TS+ 0 0 -66.7 -38.1 179.2 48.3 110.8 24.4 271 -2.5 279 -1.7 0 0.0 0 0.0 8 45
276 A 276 GLU E H H X TS+ 0 0 -66.9 -42.7 177.8 49.8 111.3 24.1 272 -1.9 280 -1.8 0 0.0 0 0.0 8 40
277 A 277 LEU L H H X TS+ 0 0 -62.8 -38.2 179.6 52.4 109.5 28.1 273 -2.5 281 -2.7 0 0.0 0 0.0 14 49
278 A 278 ASN N H H X TS+ 0 0 -68.9 -31.7 178.1 55.6 103.7 31.2 274 -2.3 282 -2.7 0 0.0 0 0.0 11 47
279 A 279 GLU E H H X TS+ 0 0 -62.9 -43.1 -179.7 43.7 112.8 19.5 275 -1.7 283 -2.0 0 0.0 0 0.0 8 35
280 A 280 ASN N H H X TS+ 0 0 -66.5 -46.0 -179.7 50.6 113.1 22.2 276 -1.8 284 -1.6 0 0.0 0 0.0 11 41
281 A 281 ALA A H H < >TS+ 0 0 -60.8 -42.6 179.8 47.0 112.0 23.9 277 -2.7 286 -2.6 0 0.0 0 0.0 13 47
282 A 282 ARG R H H < >5TS+ 0 0 -66.8 -37.9 -178.7 55.8 108.6 25.0 278 -2.7 285 -0.9 0 0.0 0 0.0 10 34
283 A 283 SER S H H < 35TS+ 0 0 -63.9 -31.1 -179.3 33.7 117.8 35.7 279 -2.0 0 0.0 0 0.0 0 0.0 7 29
284 A 284 LEU L T h < 35TS- 0 0 -107.0 8.0 -179.2 -118.2 109.1 72.8 280 -1.6 0 0.0 0 0.0 0 0.0 7 40
285 A 285 ARG R T T <5T + 0 0 57.1 38.2 179.3 164.4 52.4 31.6 282 -0.9 287 -1.8 0 0.0 0 0.0 7 40
286 A 286 LEU L h > TS+ 0 0 -61.1 -30.9 178.7 56.2 72.3 37.4 285 -1.8 291 -2.5 0 0.0 0 0.0 13 50
288 A 288 SER S H H > TS+ 0 0 -67.6 -47.1 177.4 44.9 110.0 18.9 103 -1.5 292 -2.2 0 0.0 0 0.0 11 61
289 A 289 ASP D H H > TS+ 0 0 -59.4 -45.9 -179.9 52.3 113.0 20.6 103 -0.6 293 -2.9 0 0.0 0 0.0 11 64
290 A 290 LEU L H H X TS+ 0 0 -56.8 -45.2 -179.7 49.8 108.8 22.3 286 -2.5 294 -2.7 0 0.0 0 0.0 12 57
291 A 291 ASN N H H X TS+ 0 0 -62.5 -41.0 179.2 45.9 113.1 26.7 287 -2.5 295 -1.4 0 0.0 0 0.0 13 57
292 A 292 ARG R H H X TS+ 0 0 -67.0 -42.3 -178.1 49.5 113.6 23.8 288 -2.2 296 -1.7 0 0.0 0 0.0 9 72
293 A 293 ASN N H H X TS+ 0 0 -65.4 -40.1 179.5 53.5 107.4 27.8 289 -2.9 297 -2.4 0 0.0 0 0.0 12 67
294 A 294 LEU L H H X TS+ 0 0 -64.5 -33.9 179.6 52.8 107.3 30.2 290 -2.7 298 -2.3 0 0.0 0 0.0 12 60
295 A 295 LEU L H H X TS+ 0 0 -70.4 -34.7 177.2 47.8 109.4 28.6 291 -1.4 299 -2.0 0 0.0 0 0.0 13 69
296 A 296 LEU L H H X TS+ 0 0 -70.3 -37.4 177.9 51.7 110.9 27.3 292 -1.7 300 -2.5 0 0.0 0 0.0 12 71
297 A 297 LEU L H H X TS+ 0 0 -63.6 -39.4 178.8 52.9 108.1 26.2 293 -2.4 301 -2.9 0 0.0 0 0.0 12 61
298 A 298 ASN N H H X TS+ 0 0 -60.4 -45.3 -179.8 47.8 109.4 19.7 294 -2.3 302 -2.8 0 0.0 0 0.0 13 60
299 A 299 GLN Q H H X TS+ 0 0 -60.7 -42.8 179.9 51.1 111.9 23.9 295 -2.0 303 -2.9 0 0.0 0 0.0 12 64
300 A 300 LEU L H H X TS+ 0 0 -59.3 -56.0 -179.3 42.6 113.4 14.9 296 -2.5 304 -2.0 0 0.0 0 0.0 13 51
301 A 301 TYR Y H H X >TS+ 0 0 -59.8 -42.5 -179.8 51.3 115.2 24.4 297 -2.9 306 -2.6 0 0.0 305 -0.5 12 46
302 A 302 TRP W H H < >5TS+ 0 0 -60.6 -49.4 -179.4 44.2 112.2 19.0 298 -2.8 305 -1.3 0 0.0 0 0.0 11 45
303 A 303 GLN Q H H < 35TS+ 0 0 -65.9 -28.1 -180.0 54.3 112.3 36.9 299 -2.9 0 0.0 0 0.0 0 0.0 9 42
304 A 304 ALA A H H < 35TS- 0 0 -82.8 -5.8 179.8 -117.0 115.1 59.7 300 -2.0 0 0.0 0 0.0 0 0.0 8 30
305 A 305 GLY G T h < <5T + 0 0 79.0 15.0 179.4 141.6 68.7 48.5 302 -1.3 307 -1.5 301 -0.5 0 0.0 6 27
306 A 306 ARG R h > TS+ 0 0 -57.5 -45.3 -178.4 50.2 70.8 31.3 305 -1.5 311 -2.5 0 0.0 0 0.0 8 25
308 A 308 SER S H H > TS+ 0 0 -63.2 -47.3 179.7 44.7 114.0 19.6 0 0.0 312 -2.5 0 0.0 0 0.0 6 23
309 A 309 ASP D H H > TS+ 0 0 -63.2 -41.1 179.4 53.0 112.3 26.2 0 0.0 313 -2.4 0 0.0 0 0.0 9 30
310 A 310 ALA A H H X TS+ 0 0 -60.4 -46.7 179.8 45.1 111.7 20.3 306 -2.5 314 -2.0 0 0.0 0 0.0 14 40
311 A 311 GLN Q H H X TS+ 0 0 -62.9 -45.0 -179.0 54.3 110.9 22.6 307 -2.5 315 -2.6 0 0.0 0 0.0 10 42
312 A 312 ARG R H H X TS+ 0 0 -56.5 -49.7 -178.3 40.5 113.0 21.0 308 -2.5 316 -1.8 0 0.0 0 0.0 8 34
313 A 313 VAL V H H X TS+ 0 0 -74.2 -27.7 177.3 56.5 111.5 35.2 309 -2.4 317 -2.7 0 0.0 0 0.0 12 44
314 A 314 LEU L H H X TS+ 0 0 -66.7 -41.9 177.9 48.4 108.3 22.7 310 -2.0 318 -2.6 0 0.0 0 0.0 11 57
315 A 315 LEU L H H X TS+ 0 0 -62.6 -38.9 178.4 49.7 112.0 25.6 311 -2.6 319 -2.2 0 0.0 0 0.0 8 54
316 A 316 ASP D H H X TS+ 0 0 -64.1 -43.2 -179.5 49.4 111.3 22.4 312 -1.8 320 -2.7 0 0.0 0 0.0 9 45
317 A 317 ALA A H H X TS+ 0 0 -63.6 -42.1 179.0 49.0 110.7 25.9 313 -2.7 321 -2.0 0 0.0 0 0.0 11 59
318 A 318 LEU L H H < TS+ 0 0 -64.5 -39.6 179.7 48.8 112.5 25.7 314 -2.6 0 0.0 0 0.0 0 0.0 11 60
319 A 319 LYS K H H < > TS+ 0 0 -65.5 -44.1 -179.7 49.9 110.7 20.6 315 -2.2 322 -1.6 0 0.0 0 0.0 9 42
320 A 320 LEU L H H X > TS+ 0 0 -63.0 -33.7 179.3 64.7 100.9 31.6 316 -2.7 323 -2.1 0 0.0 324 -2.0 10 48
321 A 321 ALA A H H X 3 TS+ 0 0 -65.2 -14.3 176.5 74.6 83.9 47.6 317 -2.0 325 -2.2 0 0.0 0 0.0 11 52
322 A 322 ASN N H H 4 < TS+ 0 0 -65.7 -24.5 178.9 31.5 109.9 37.8 319 -1.6 0 0.0 0 0.0 0 0.0 9 40
323 A 323 ARG R H H 4 < TS+ 0 0 -99.0 -40.0 -179.5 41.1 125.3 36.4 320 -2.1 0 0.0 0 0.0 0 0.0 8 37
324 A 324 THR T H H < TS- 0 0 -80.6 -25.5 -177.7 -139.7 90.3 40.9 320 -2.0 0 0.0 0 0.0 0 0.0 12 50
325 A 325 GLY G h < T + 0 0 76.2 10.1 -178.9 167.3 39.9 54.9 321 -2.2 0 0.0 0 0.0 0 0.0 9 50
326 A 326 PHE F + 0 0 -63.3 136.4 176.3 146.4 14.3 108.1 0 0.0 0 0.0 0 0.0 0 0.0 11 60
327 A 327 ILE I h > > T + 0 0 -130.6 -55.7 -177.0 53.5 65.7 59.1 145 -2.3 331 -1.7 0 0.0 330 -1.6 12 60
328 A 328 SER S H H > 3 TS+ 0 0 -60.1 -29.1 179.8 65.6 98.1 37.9 145 -1.5 332 -2.1 144 -0.5 0 0.0 12 63
329 A 329 HIS H H H 4 3 TS+ 0 0 -63.9 -26.8 177.5 42.6 108.1 35.9 0 0.0 0 0.0 0 0.0 0 0.0 10 74
330 A 330 PHE F H H 4 X TS+ 0 0 -81.3 -41.7 -177.7 58.7 109.5 28.5 327 -1.6 333 -1.6 0 0.0 0 0.0 11 71
331 A 331 VAL V H H < > TS+ 0 0 -57.8 -38.9 -179.3 62.0 94.8 32.8 327 -1.7 334 -1.9 0 0.0 0 0.0 13 59
332 A 332 ILE I T h < 3 TS+ 0 0 -66.2 -12.4 179.3 72.8 88.4 48.4 328 -2.1 0 0.0 0 0.0 0 0.0 10 61
333 A 333 GLU E T h > X TS+ 0 0 -81.5 3.0 174.7 179.8 83.8 64.0 330 -1.6 337 -1.2 0 0.0 336 -0.8 9 66
334 A 334 GLY G H H > < T + 0 0 44.3 -131.5 -177.4 6.0 52.8 85.8 331 -1.9 338 -2.9 0 0.0 0 0.0 9 48
335 A 335 GLU E H H > 3 TS+ 0 0 -56.4 -40.5 178.9 55.0 128.5 32.8 0 0.0 339 -2.9 0 0.0 0 0.0 7 37
336 A 336 ALA A H H > < TS+ 0 0 -60.8 -40.9 179.3 42.6 114.0 24.2 333 -0.8 340 -1.9 0 0.0 0 0.0 9 47
337 A 337 MET M H H X TS+ 0 0 -70.0 -42.6 -179.5 52.8 113.0 22.1 333 -1.2 341 -2.9 0 0.0 0 0.0 10 54
338 A 338 ALA A H H X TS+ 0 0 -60.0 -43.7 179.6 48.7 109.3 25.5 334 -2.9 342 -2.6 0 0.0 0 0.0 11 44
339 A 339 A GLN Q H H X TS+ 0 0 -61.3 -49.8 -178.5 47.1 113.3 16.3 335 -2.9 343 -2.3 0 0.0 0 0.0 8 37
340 A 340 GLN Q H H X TS+ 0 0 -60.1 -42.4 -180.0 46.9 114.2 26.5 336 -1.9 344 -2.1 0 0.0 0 0.0 9 54
341 A 341 LEU L H H X TS+ 0 0 -68.7 -38.0 179.1 53.8 108.7 28.0 337 -2.9 345 -2.9 0 0.0 0 0.0 11 54
342 A 342 ARG R H H X TS+ 0 0 -60.1 -42.4 179.7 49.8 110.0 21.4 338 -2.6 346 -2.6 0 0.0 0 0.0 9 37
343 A 343 A GLN Q H H X TS+ 0 0 -60.8 -45.9 179.7 45.8 112.8 25.2 339 -2.3 347 -1.3 0 0.0 0 0.0 8 30
344 A 344 LEU L H H < >TS+ 0 0 -65.5 -42.3 180.0 48.7 113.5 26.4 340 -2.1 349 -0.7 0 0.0 0 0.0 10 40
345 A 345 ILE I H H < >5TS+ 0 0 -65.2 -42.4 -179.7 52.9 109.3 23.9 341 -2.9 348 -1.3 0 0.0 0 0.0 12 30
346 A 346 GLN Q H H < 35TS+ 0 0 -64.9 -28.7 179.8 63.1 99.1 38.9 342 -2.6 0 0.0 0 0.0 0 0.0 6 21
347 A 347 LEU L T h < 35TS- 0 0 -70.3 -17.5 178.1 -145.6 95.0 46.8 343 -1.3 0 0.0 0 0.0 0 0.0 7 20
348 A 348 ASN N T T <5T + 0 0 60.9 27.4 -178.5 107.7 67.4 42.7 345 -1.3 0 0.0 0 0.0 0 0.0 6 20
349 A 349 THR T t T - 0 0 -65.8 157.5 -177.8 -100.5 40.1 109.3 0 0.0 355 -2.6 0 0.0 0 0.0 6 25
352 A 352 GLU E H H > TS+ 0 0 -49.0 -47.8 -178.5 49.7 118.8 31.0 0 0.0 356 -2.5 0 0.0 0 0.0 6 23
353 A 353 LEU L H H > TS+ 0 0 -61.2 -50.6 179.8 42.5 115.0 18.3 0 0.0 357 -2.1 0 0.0 0 0.0 7 29
354 A 354 GLU E H H > TS+ 0 0 -64.6 -35.8 179.2 54.8 112.5 29.8 0 0.0 358 -2.8 0 0.0 0 0.0 11 41
355 A 355 GLN Q H H X TS+ 0 0 -62.5 -45.1 -179.9 49.2 108.5 20.4 351 -2.6 359 -2.4 0 0.0 0 0.0 10 37
356 A 356 HIS H H H X TS+ 0 0 -61.6 -42.6 -179.8 45.7 113.1 25.6 352 -2.5 360 -2.1 0 0.0 0 0.0 8 35
357 A 357 ARG R H H X TS+ 0 0 -68.8 -40.0 178.9 53.9 110.5 24.0 353 -2.1 361 -2.8 0 0.0 0 0.0 10 45
358 A 358 ALA A H H X TS+ 0 0 -58.0 -44.0 179.6 47.5 110.4 22.7 354 -2.8 362 -2.5 0 0.0 0 0.0 11 55
359 A 359 GLN Q H H X TS+ 0 0 -64.3 -41.2 178.9 50.6 111.2 26.3 355 -2.4 363 -1.6 0 0.0 0 0.0 10 43
360 A 360 ARG R H H X TS+ 0 0 -61.7 -46.2 -180.0 47.7 111.8 22.3 356 -2.1 364 -2.1 0 0.0 0 0.0 8 42
361 A 361 ILE I H H X TS+ 0 0 -61.7 -45.8 -179.7 53.0 108.6 22.0 357 -2.8 365 -2.5 0 0.0 0 0.0 13 51
362 A 362 LEU L H H X TS+ 0 0 -60.1 -31.3 178.6 50.8 110.1 31.7 358 -2.5 366 -2.2 0 0.0 0 0.0 12 39
363 A 363 ARG R H H < TS+ 0 0 -71.5 -41.9 179.4 50.5 108.1 26.4 359 -1.6 0 0.0 0 0.0 0 0.0 7 35
364 A 364 GLU E H H < TS+ 0 0 -61.6 -41.2 -179.6 46.6 114.1 25.8 360 -2.1 0 0.0 0 0.0 0 0.0 8 40
365 A 365 ILE I H H < T 0 0 -68.9 -45.8 -179.7 999.9 999.9 24.8 361 -2.5 0 0.0 0 0.0 0 0.0 12 37
366 A 366 ASN N h < T 0 0 -69.8 999.9 999.9 999.9 999.9 14.7 362 -2.2 0 0.0 0 0.0 0 0.0 4 29
1hz4A.pdb
1HZ4 TRANSCRIPTION ACTIVATOR MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand HHHHHHHHHHHHHHHHHHHHTT HHHHHHHHHHHHHT TT HHHHHHHHHHHHHHHHHHT HHHHHHHHHHHHHHHHHTT HHHHHHHHHHHHHH Kabs/Sand
chirality +--++++++++++++++++++++-++++++++++++++++--++++++++++++++++++++-+++++++++++++++++++-++++++++++++++++ chirality
bends SSSSSSSSSSSSSSSSSSSSSS SSSSSSSSSSSSSS SS SSSSSSSSSSSSSSSSSS SSSSSSSSSSSSSSSSS SSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< >5555< 5-turns
3-turns >33< >33< >>3<<>33< >33< >33<>33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>XXXXXXXXXXXXXX<<<< >>>>XXXXXXX<<<< >>>>XXXXXXXXXXXX<<<<>>>>XXXXXXXXXXX<<<< >>>>XXXXXXXXXXX 4-turns
summary hHHHHHHHHHHHHHHHHHHHHhThHHHHHHHHHHHHHhttTThHHHHHHHHHHHHHHHHHHhhHHHHHHHHHHHHHHHHHhThHHHHHHHHHHHHHH summary
sequence EIKDIREDTMHAEFNALRAQVAINDGNPDEAERLAKLALEELPPGWFYSRIVATSVLGEVLHCKGELTRSLALMQQTEQMARQHDVWHYALWSLIQQSEI sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand HHHTT HHHHHHHHHHHHHHHHHTT TTSTHHHHHHHHHHHHHHHTT HHHHHHHHHHHHHHTTTS GGGGHHHHHHHHHHHHHHT HHHHHHHHHHHHH Kabs/Sand
chirality +++-+++++++++++++++++++-++++-++++++++++++++++-+++++++++++++++++++--+++++++++++++++++-+++++++++++++++ chirality
bends SSSSS SSSSSSSSSSSSSSSSS SSSSSSSSSSSSSSSSSSSSS SSSSSSSSSSSSSSSSS SSS SSSSSSSSSSSSSS SSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< >5555< >5555< 5-turns
3-turns >33< >33<>33X>3<< >33< >3><3<>>><<< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns <<<< >>>>XXXXXXXXXXX<<<< >>>>XXXXXXXXX<<<< >>>>XXXXXXXX<<<< >>>>XXXXXXXX<<<<>>>>XXXXXXXXX< 4-turns
summary HHHhThHHHHHHHHHHHHHHHHHhTtTTthHHHHHHHHHHHHHHHhThHHHHHHHHHHHHHHhTTtgGGGhHHHHHHHHHHHHHHhhHHHHHHHHHHHHH summary
sequence LFAQGFLQTAWETQEKAFQLINEQHLEQLPMHEFLVRIRAQLLWAWARLDEAEASARSGIEVLSSYQPQQQLQCLAMLIQCSLARGDLDNARSQLNRLEN sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand HHTTS HHHHHHHHHHHHHHHHHTT HHHHHHHHHHS TT GGGHHHHHHHHHHHHHTT HHHHHHHHHHHHHHHHHTT HHHHHHHHHHHHHH Kabs/Sand
chirality ++++----+++++++++++++++++-++++++++++++-----+-+-++++++++++++++++-+++++++++++++++++++-++++++++++++++++ chirality
bends SSSSS SSSSSSSSSSSSSSSSSS SSSSSSSSSSS SS SSSSSSSSSSSSSSSSSS SSSSSSSSSSSSSSSSS SSSSSSSSSSSSSS bends
turns TTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< >5555< 5-turns
3-turns >>3<< >33< >33< >33X>3<< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns <<< >>>>XXXXXXXXXXX<<<< >>>>XXXX<<<< >>>>XXXXXXX<<<< >>>>XXXXXXXXXXX<<<< >>>>XXXXXXXXXXX 4-turns
summary HHhTt hHHHHHHHHHHHHHHHHHhThHHHHHHHHHHh tTTgGGhHHHHHHHHHHHHHhThHHHHHHHHHHHHHHHHHhThHHHHHHHHHHHHHH summary
sequence LLGNGKYHSDWISNANKVRVIYWQMTGDKAAAANWLRHTAKPEFANNHFLQGQWRNIARAQILLGEFEPAEIVLEELNENARSLRLMSDLNRNLLLLNQL sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand HHHHT HHHHHHHHHHHHHHHHHH HHHHTTHHHHHHHHHHHHHTT S HHHHHHHHHHHHHH Kabs/Sand
chirality +++-+++++++++++++++++++-++++++++++++++++++++++-++--+++++++++++++ chirality
bends SSSS SSSSSSSSSSSSSSSSSS SSSSSS SSSSSSSSSSSSS S SSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< 5-turns
3-turns >33< >>3<< >33X>3X<3< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns X<<<<>>>>XXXXXXXX<>44<<>>>>XXXXXXX<<<< >>>>XXXXXXXX<<<< 4-turns
summary HHHHhhHHHHHHHHHHHHHHHHHHh hHHHHhhHHHHHHHHHHHHHhTtShHHHHHHHHHHHHHHh summary
sequence YWQAGRKSDAQRVLLDALKLANRTGFISHFVIEGEAMAQQLRQLIQLNTLPELEQHRAQRILREIN sequence
310 320 330 340 350 360