Secondary structure calculation program - copyright by David Keith Smith, 1989
1k6xA.pdb
1K6X TRANSCRIPTION MOL_ID: 1; MOL_ID: 1;
Sequence length - 324
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 3 GLN Q 0 0 999.9 28.0 179.4 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 13
2 A 4 GLN Q - 0 0 -68.9 133.3 -178.3 -99.4 999.9 118.7 0 0.0 0 0.0 0 0.0 0 0.0 3 20
3 A 5 LYS K - 0 0 -56.5 127.4 -177.7 -125.7 42.6 106.8 0 0.0 0 0.0 0 0.0 0 0.0 8 35
4 A 6 LYS K - 0 0 -79.2 153.1 -178.4 -101.8 21.8 112.0 0 0.0 0 0.0 0 0.0 0 0.0 9 44
5 A 7 THR T e - 0 0 -77.7 130.2 -178.4 -152.9 35.7 125.4 0 0.0 73 -2.7 0 0.0 74 -1.9 12 52
6 A 8 ILE I E E Aab - 74 30 -108.8 131.4 177.1 -153.7 2.8 154.1 29 -2.4 31 -2.7 0 0.0 0 0.0 13 68
7 A 9 ALA A E E Aab + 75 31 -101.3 136.5 -179.7 167.6 22.7 147.6 74 -2.5 76 -2.4 0 0.0 0 0.0 15 72
8 A 10 VAL V E E Aab - 76 32 -144.8 156.6 176.4 -146.9 21.3 166.3 31 -2.3 33 -2.5 0 0.0 0 0.0 15 75
9 A 11 VAL V S e S+ 0 0 -119.0 169.9 -179.9 32.1 78.3 139.0 76 -0.7 0 0.0 0 0.0 0 0.0 12 70
10 A 12 ASN N S t > TS+ 0 0 47.9 50.5 -176.9 178.9 70.8 23.5 0 0.0 13 -2.0 0 0.0 0 0.0 12 57
11 A 13 ALA A T T 3 TS+ 0 0 -55.7 -29.1 -179.2 56.7 70.7 43.3 33 -2.7 0 0.0 0 0.0 0 0.0 12 62
12 A 14 THR T T T 3 TS+ 0 0 -84.3 -6.4 177.9 101.9 85.7 57.0 0 0.0 0 0.0 0 0.0 0 0.0 9 51
13 A 15 GLY G S h > < TS- 0 0 -74.3 152.9 -178.2 -108.7 87.7 115.7 10 -2.0 17 -3.0 0 0.0 0 0.0 7 48
14 A 16 ARG R H H > TS+ 0 0 -51.1 -41.5 -179.8 47.4 113.7 34.7 0 0.0 18 -1.7 0 0.0 0 0.0 8 51
15 A 17 GLN Q H H > TS+ 0 0 -67.2 -54.6 -179.0 40.0 117.5 13.1 0 0.0 19 -1.8 0 0.0 0 0.0 11 60
16 A 18 ALA A H H > TS+ 0 0 -61.0 -46.1 -179.2 53.2 114.4 22.0 0 0.0 20 -2.9 0 0.0 0 0.0 16 63
17 A 19 ALA A H H X TS+ 0 0 -58.3 -42.0 178.9 53.5 106.4 25.9 13 -3.0 21 -2.3 0 0.0 0 0.0 14 59
18 A 20 SER S H H X TS+ 0 0 -58.3 -46.2 -179.9 43.6 112.7 21.7 14 -1.7 22 -1.6 0 0.0 0 0.0 15 54
19 A 21 LEU L H H X TS+ 0 0 -65.1 -44.6 -178.0 54.0 111.6 22.7 15 -1.8 23 -2.9 0 0.0 0 0.0 13 67
20 A 22 ILE I H H X TS+ 0 0 -59.5 -45.1 -179.4 50.7 106.7 23.9 16 -2.9 24 -2.4 0 0.0 0 0.0 13 64
21 A 23 ARG R H H X TS+ 0 0 -60.3 -51.5 -178.0 36.1 118.2 18.0 17 -2.3 25 -1.7 0 0.0 0 0.0 10 51
22 A 24 VAL V H H X TS+ 0 0 -72.4 -35.0 179.2 54.3 116.1 28.3 18 -1.6 26 -1.1 0 0.0 0 0.0 10 47
23 A 25 ALA A H H < >>TS+ 0 0 -61.4 -49.3 -179.9 46.1 110.5 18.2 19 -2.9 28 -2.4 0 0.0 26 -0.7 13 50
24 A 26 ALA A H H < >5TS+ 0 0 -61.8 -39.4 -179.1 58.1 107.6 26.6 20 -2.4 27 -1.5 0 0.0 0 0.0 13 43
25 A 27 ALA A H H < 35TS+ 0 0 -65.3 -23.8 178.6 46.2 108.2 40.7 21 -1.7 0 0.0 0 0.0 0 0.0 7 31
26 A 28 VAL V T h < <5TS- 0 0 -101.7 10.7 175.9 -86.9 130.9 73.8 22 -1.1 0 0.0 23 -0.7 0 0.0 7 30
27 A 29 GLY G T T <5TS+ 0 0 108.7 -6.0 -179.7 138.9 77.7 66.9 24 -1.5 0 0.0 0 0.0 0 0.0 8 31
28 A 30 HIS H t TS- 0 0 104.2 150.6 -178.2 -80.0 88.1 90.1 0 0.0 43 -2.7 0 0.0 0 0.0 6 21
40 A 42 LEU L H H > TS+ 0 0 -51.8 -51.4 -178.3 43.4 125.0 28.1 0 0.0 44 -2.2 0 0.0 0 0.0 6 23
41 A 43 ILE I H H > TS+ 0 0 -65.3 -48.5 178.9 48.5 114.5 21.0 0 0.0 45 -2.8 0 0.0 0 0.0 8 34
42 A 44 ALA A H H > TS+ 0 0 -57.3 -45.9 179.5 47.5 113.9 22.0 0 0.0 46 -2.4 0 0.0 0 0.0 13 40
43 A 45 GLU E H H X TS+ 0 0 -63.0 -39.3 178.5 50.8 111.8 26.0 39 -2.7 47 -1.2 0 0.0 0 0.0 10 30
44 A 46 GLU E H H < TS+ 0 0 -62.3 -48.1 -178.5 45.9 112.5 18.9 40 -2.2 0 0.0 0 0.0 0 0.0 8 33
45 A 47 LEU L H H < > TS+ 0 0 -65.3 -37.1 -179.9 56.6 107.4 29.9 41 -2.8 48 -1.5 0 0.0 0 0.0 12 47
46 A 48 GLN Q H H < 3 TS+ 0 0 -65.6 -26.0 -178.9 61.2 100.2 36.8 42 -2.4 0 0.0 0 0.0 0 0.0 10 37
47 A 49 ALA A T h < 3 TS+ 0 0 -79.0 -5.5 178.3 95.4 81.6 56.3 43 -1.2 0 0.0 0 0.0 0 0.0 7 28
48 A 50 ILE I S t X TS- 0 0 -86.5 117.1 -179.6 -146.3 71.8 139.9 45 -1.5 51 -1.9 0 0.0 0 0.0 8 33
49 A 51 PRO P T T 3 TS+ 0 0 -51.3 -42.2 -179.9 54.3 95.7 32.6 0 0.0 0 0.0 0 0.0 0 0.0 6 25
50 A 52 ASN N T e 3 TS+ 0 0 -71.9 -5.2 -178.8 84.4 98.1 59.6 0 0.0 30 -2.8 0 0.0 0 0.0 9 37
51 A 53 VAL V E E Ac < T - 30 0 -104.9 136.2 175.9 -173.2 55.0 147.7 48 -1.9 0 0.0 0 0.0 0 0.0 14 49
52 A 54 THR T E E Ac - 31 0 -124.9 123.1 -179.7 -150.6 15.0 174.4 30 -2.5 32 -2.9 0 0.0 0 0.0 10 49
53 A 55 LEU L E E Ac - 32 0 -96.8 145.4 178.9 -163.4 7.5 137.8 0 0.0 0 0.0 0 0.0 0 0.0 11 51
54 A 56 PHE F E E Ac - 33 0 -127.6 104.4 -177.0 -152.6 17.1 161.0 32 -2.8 34 -1.6 0 0.0 0 0.0 10 45
55 A 57 GLN Q E E Ac + 34 0 -85.3 140.5 179.0 79.8 42.4 124.8 0 0.0 0 0.0 0 0.0 0 0.0 9 40
56 A 58 GLY G S e S- 0 0 150.0 168.7 179.9 -61.7 74.4 142.3 34 -2.2 0 0.0 0 0.0 0 0.0 9 34
57 A 59 PRO P - 0 0 -79.3 154.2 177.0 -152.5 23.9 117.0 0 0.0 0 0.0 0 0.0 0 0.0 8 40
58 A 60 LEU L t > T + 0 0 -90.1 -35.9 -179.1 103.1 68.9 38.8 0 0.0 61 -1.7 0 0.0 0 0.0 10 48
59 A 61 LEU L T T 3 TS- 0 0 -53.1 119.1 -179.9 -16.5 106.5 107.1 0 0.0 0 0.0 0 0.0 0 0.0 7 35
60 A 62 ASN N T T 3 TS+ 0 0 48.6 45.5 -179.7 115.9 107.5 29.4 0 0.0 0 0.0 0 0.0 0 0.0 6 30
61 A 63 ASN N h > X T + 0 0 -140.3 62.2 179.1 154.2 21.7 116.6 58 -1.7 65 -1.2 0 0.0 64 -0.7 8 33
62 A 64 VAL V H H > 3 TS+ 0 0 -59.1 -34.6 179.6 67.1 71.5 31.4 0 0.0 66 -2.5 0 0.0 0 0.0 10 34
63 A 65 PRO P H H > 3 TS+ 0 0 -54.4 -39.8 179.8 49.8 99.3 27.0 0 0.0 67 -2.1 0 0.0 0 0.0 6 27
64 A 66 LEU L H H > < TS+ 0 0 -66.3 -37.3 179.1 52.2 109.7 26.3 61 -0.7 68 -2.8 0 0.0 0 0.0 10 41
65 A 67 MET M H H X TS+ 0 0 -65.1 -41.6 178.8 49.6 108.2 26.4 61 -1.2 69 -2.1 0 0.0 0 0.0 13 55
66 A 68 ASP D H H X TS+ 0 0 -63.3 -41.2 178.8 48.8 112.7 23.0 62 -2.5 70 -0.8 0 0.0 0 0.0 11 45
67 A 69 THR T H H < > TS+ 0 0 -61.6 -47.9 -178.9 53.1 109.0 19.0 63 -2.1 70 -1.0 0 0.0 0 0.0 7 43
68 A 70 LEU L H H < 3 TS+ 0 0 -54.9 -47.0 -177.9 44.0 111.7 26.6 64 -2.8 0 0.0 0 0.0 0 0.0 13 52
69 A 71 PHE F H H < > TS+ 0 0 -79.3 -8.4 -178.8 120.5 81.7 56.1 65 -2.1 72 -2.1 0 0.0 0 0.0 13 52
70 A 72 GLU E T h < < TS- 0 0 -62.6 115.8 179.9 -2.1 92.4 114.8 67 -1.0 0 0.0 66 -0.8 0 0.0 7 39
71 A 73 GLY G T T 3 TS+ 0 0 83.1 1.2 178.8 130.7 102.5 61.6 0 0.0 0 0.0 0 0.0 0 0.0 7 37
72 A 74 ALA A t < T - 0 0 -87.9 149.8 179.6 -178.2 34.5 127.7 69 -2.1 0 0.0 0 0.0 0 0.0 14 52
73 A 75 HIS H S e S+ 0 0 -119.0 -15.7 -179.2 39.4 70.6 59.1 5 -2.7 104 -3.2 0 0.0 105 -0.8 12 48
74 A 76 LEU L E E Aad - 6 105 -134.1 153.1 179.1 -164.3 65.4 160.7 5 -1.9 7 -2.5 0 0.0 0 0.0 13 65
75 A 77 ALA A E E Aad - 7 106 -143.4 141.6 174.3 -171.7 14.3 179.1 105 -2.1 107 -2.9 0 0.0 0 0.0 12 77
76 A 78 PHE F E E Aad - 8 107 -130.6 112.1 -176.1 -172.7 20.6 161.6 7 -2.4 9 -0.7 0 0.0 0 0.0 13 84
77 A 79 ILE I E E A d + 0 108 -117.1 123.7 179.5 167.1 15.2 158.5 107 -3.1 109 -2.7 0 0.0 0 0.0 12 77
78 A 80 ASN N - 0 0 -133.6 111.6 179.9 -168.9 16.7 166.0 0 0.0 0 0.0 0 0.0 0 0.0 12 70
79 A 81 THR T - 0 0 -95.7 176.6 178.7 -149.4 6.1 112.7 0 0.0 0 0.0 0 0.0 0 0.0 10 60
80 A 82 THR T - 0 0 -138.9 168.7 -178.6 -126.8 22.4 152.9 0 0.0 0 0.0 0 0.0 0 0.0 8 53
81 A 83 SER S S t > TS+ 0 0 -96.0 -8.1 -179.0 105.4 80.2 59.3 0 0.0 84 -1.9 0 0.0 0 0.0 8 42
82 A 84 GLN Q T T 3 TS+ 0 0 -35.6 -64.2 -179.4 36.6 86.7 30.4 0 0.0 0 0.0 0 0.0 0 0.0 4 37
83 A 85 ALA A T T 3 TS- 0 0 -70.8 -9.5 -176.4 -130.4 109.9 53.8 0 0.0 0 0.0 0 0.0 0 0.0 7 30
84 A 86 GLY G S t < TS+ 0 0 77.0 176.8 178.4 81.5 85.2 104.6 81 -1.9 0 0.0 0 0.0 0 0.0 6 32
85 A 87 ASP D h > T + 0 0 61.2 30.4 -179.7 152.9 48.7 35.1 0 0.0 89 -2.7 0 0.0 0 0.0 8 31
86 A 88 GLU E H H > TS+ 0 0 -61.3 -36.9 179.9 51.1 71.4 29.1 0 0.0 90 -2.7 0 0.0 0 0.0 12 43
87 A 89 ILE I H H > TS+ 0 0 -65.9 -45.8 -179.8 46.0 112.0 19.4 0 0.0 91 -2.0 0 0.0 0 0.0 10 41
88 A 90 ALA A H H > TS+ 0 0 -64.0 -40.5 179.3 47.6 115.0 26.0 0 0.0 92 -2.5 0 0.0 0 0.0 7 36
89 A 91 ILE I H H X TS+ 0 0 -67.0 -45.1 179.6 50.4 110.7 22.2 85 -2.7 93 -2.9 0 0.0 0 0.0 12 50
90 A 92 GLY G H H X TS+ 0 0 -61.2 -35.9 178.8 46.0 114.2 29.7 86 -2.7 94 -1.9 0 0.0 0 0.0 11 61
91 A 93 LYS K H H X TS+ 0 0 -73.0 -42.1 177.6 50.7 111.5 26.4 87 -2.0 95 -2.5 0 0.0 0 0.0 11 50
92 A 94 ASP D H H X TS+ 0 0 -59.2 -47.1 179.7 49.3 111.4 21.4 88 -2.5 96 -2.4 0 0.0 0 0.0 10 49
93 A 95 LEU L H H X TS+ 0 0 -58.5 -48.1 -179.6 48.6 111.0 21.1 89 -2.9 97 -2.3 0 0.0 0 0.0 10 68
94 A 96 ALA A H H X TS+ 0 0 -60.5 -43.3 178.8 48.6 112.4 24.2 90 -1.9 98 -2.3 0 0.0 0 0.0 10 65
95 A 97 ASP D H H X TS+ 0 0 -63.3 -39.9 -179.8 51.6 110.2 28.0 91 -2.5 99 -2.6 0 0.0 0 0.0 9 48
96 A 98 ALA A H H X TS+ 0 0 -64.6 -36.8 -179.9 50.8 109.5 28.7 92 -2.4 100 -1.7 0 0.0 0 0.0 12 52
97 A 99 ALA A H H X TS+ 0 0 -66.4 -47.5 -179.4 45.2 112.1 21.0 93 -2.3 101 -0.8 0 0.0 103 -0.6 14 57
98 A 100 LYS K H H < > TS+ 0 0 -62.8 -41.7 -179.4 55.2 110.8 22.5 94 -2.3 101 -1.2 0 0.0 0 0.0 12 42
99 A 101 ARG R H H < 3 TS+ 0 0 -59.8 -36.4 -179.8 62.6 97.5 32.1 95 -2.6 0 0.0 0 0.0 0 0.0 6 35
100 A 102 ALA A H H < 3 TS- 0 0 -60.2 -28.6 179.4 -152.3 91.0 37.6 96 -1.7 0 0.0 0 0.0 0 0.0 11 36
101 A 103 GLY G S h < < TS+ 0 0 75.7 -13.5 -177.8 83.5 74.9 77.5 98 -1.2 0 0.0 97 -0.8 0 0.0 6 32
102 A 104 THR T + 0 0 -101.4 -1.9 -179.5 111.4 53.3 64.6 0 0.0 104 -0.8 0 0.0 0 0.0 9 36
103 A 105 ILE I + 0 0 -82.0 111.2 -178.4 174.7 35.2 131.9 97 -0.6 0 0.0 0 0.0 0 0.0 14 48
104 A 106 GLN Q S S S+ 0 0 -85.9 -20.7 -175.1 20.7 71.6 49.3 73 -3.2 0 0.0 102 -0.8 0 0.0 9 48
105 A 107 HIS H E E Ad - 74 0 -158.4 114.7 -178.4 -167.0 64.9 151.1 73 -0.8 75 -2.1 0 0.0 107 -0.6 15 58
106 A 108 TYR Y E E Ade - 75 143 -110.2 110.8 178.6 -166.6 5.8 157.3 142 -2.6 144 -2.0 0 0.0 108 -0.6 14 71
107 A 109 ILE I E E Ade - 76 144 -100.0 123.2 178.7 -169.6 5.2 151.7 75 -2.9 77 -3.1 105 -0.6 0 0.0 11 76
108 A 110 TYR Y E E Ade - 77 145 -112.9 135.4 -179.9 -131.0 22.3 158.9 144 -2.4 146 -1.8 106 -0.6 110 -0.9 12 75
109 A 111 SER S E E A e - 0 146 -87.2 106.4 -176.1 -179.9 40.5 138.4 77 -2.7 0 0.0 0 0.0 0 0.0 13 75
110 A 112 SER S E E A e - 0 147 -105.8 172.1 177.5 -160.2 18.5 120.3 146 -2.1 148 -0.6 108 -0.9 0 0.0 14 62
111 A 113 MET M - 0 0 -145.6 161.5 -178.9 -90.2 28.9 164.4 0 0.0 0 0.0 0 0.0 0 0.0 10 60
112 A 114 PRO P - 0 0 -76.3 159.7 174.4 -140.7 14.4 105.4 0 0.0 114 -0.6 0 0.0 0 0.0 11 52
113 A 115 ASP D g > T - 0 0 -115.0 95.9 -177.8 -166.4 18.8 158.4 0 0.0 116 -1.8 0 0.0 0 0.0 12 43
114 A 116 HIS H G G > > TS+ 0 0 -57.6 -28.5 -179.3 72.7 78.3 39.4 112 -0.6 117 -1.9 0 0.0 118 -0.8 12 44
115 A 117 SER S G G 4 3 TS+ 0 0 -66.3 -5.5 179.6 62.4 90.1 56.0 0 0.0 0 0.0 0 0.0 0 0.0 9 35
116 A 118 LEU L G G 4 < TS+ 0 0 -93.6 -8.9 -174.7 40.1 107.7 56.0 113 -1.8 0 0.0 0 0.0 0 0.0 5 29
117 A 119 TYR Y T g 4 < TS- 0 0 -120.0 -5.4 -178.7 -9.2 121.4 60.5 114 -1.9 0 0.0 0 0.0 0 0.0 9 29
118 A 120 GLY G S t < TS- 0 0 -172.0 -175.8 -179.7 -60.8 90.6 162.7 114 -0.8 120 -2.1 0 0.0 0 0.0 6 27
119 A 121 PRO P S S S+ 0 0 -80.5 52.8 -176.3 118.8 94.3 107.3 0 0.0 0 0.0 0 0.0 0 0.0 5 24
120 A 122 TRP W - 0 0 -124.9 154.3 179.3 -113.7 66.7 150.5 118 -2.1 0 0.0 0 0.0 0 0.0 10 33
121 A 123 PRO P - 0 0 -81.3 155.2 176.6 -102.1 39.9 117.3 0 0.0 0 0.0 0 0.0 0 0.0 9 36
122 A 124 ALA A - 0 0 -74.3 137.3 176.5 -120.4 33.7 127.6 0 0.0 0 0.0 0 0.0 0 0.0 10 42
123 A 125 VAL V t > > T - 0 0 -79.2 116.3 -177.5 -135.4 28.5 139.9 0 0.0 127 -2.6 0 0.0 126 -2.1 12 47
124 A 126 PRO P T T 4 3 TS+ 0 0 -49.1 -28.3 178.3 44.9 96.9 53.2 0 0.0 0 0.0 0 0.0 0 0.0 10 43
125 A 127 MET M T T 4 3 TS+ 0 0 -100.3 5.1 179.5 41.3 121.2 69.5 0 0.0 0 0.0 0 0.0 0 0.0 9 47
126 A 128 TRP W T h > X TS+ 0 0 -113.2 -52.4 -177.9 59.9 102.0 40.1 123 -2.1 129 -1.1 0 0.0 130 -0.9 12 55
127 A 129 ALA A H H X > TS+ 0 0 -50.3 -44.0 179.8 61.3 97.5 31.1 123 -2.6 131 -1.4 0 0.0 130 -0.8 13 51
128 A 130 PRO P H H > 3 TS+ 0 0 -53.8 -38.1 179.7 57.1 99.3 28.9 0 0.0 132 -1.7 0 0.0 0 0.0 11 44
129 A 131 LYS K H H > < TS+ 0 0 -62.0 -36.3 -179.9 56.8 100.5 30.1 126 -1.1 133 -2.7 0 0.0 0 0.0 15 51
130 A 132 PHE F H H X < TS+ 0 0 -64.0 -35.3 177.4 54.6 103.5 27.6 126 -0.9 134 -2.5 127 -0.8 0 0.0 12 54
131 A 133 THR T H H X TS+ 0 0 -61.3 -44.8 178.3 47.1 109.1 20.6 127 -1.4 135 -1.9 0 0.0 0 0.0 9 43
132 A 134 VAL V H H X TS+ 0 0 -62.6 -42.8 177.7 54.9 109.4 24.6 128 -1.7 136 -3.1 0 0.0 0 0.0 12 50
133 A 135 GLU E H H X TS+ 0 0 -55.7 -47.7 -178.9 49.9 106.9 20.5 129 -2.7 137 -2.3 0 0.0 0 0.0 11 53
134 A 136 ASN N H H X TS+ 0 0 -59.9 -39.4 179.6 47.7 112.6 25.8 130 -2.5 138 -0.8 0 0.0 0 0.0 8 44
135 A 137 TYR Y H H < > TS+ 0 0 -66.0 -47.4 179.9 51.3 109.9 18.9 131 -1.9 138 -1.1 0 0.0 0 0.0 9 39
136 A 138 VAL V H H < > TS+ 0 0 -56.7 -40.8 179.7 61.4 102.1 29.0 132 -3.1 139 -1.9 0 0.0 0 0.0 10 50
137 A 139 ARG R H H < 3 TS+ 0 0 -56.2 -30.2 -178.8 55.3 100.4 40.1 133 -2.3 0 0.0 0 0.0 0 0.0 9 39
138 A 140 GLN Q T h < < TS+ 0 0 -83.5 -6.8 -179.9 98.4 88.9 61.3 135 -1.1 0 0.0 134 -0.8 0 0.0 6 30
139 A 141 LEU L S t < TS- 0 0 -85.4 148.5 -177.9 -113.2 85.1 125.1 136 -1.9 141 -2.0 0 0.0 0 0.0 9 36
140 A 142 GLY G S S S+ 0 0 -81.7 60.1 177.6 79.7 86.7 110.2 0 0.0 0 0.0 0 0.0 0 0.0 6 31
141 A 143 LEU L S S S- 0 0 -156.6 147.2 -179.7 -89.8 89.5 164.1 139 -2.0 0 0.0 0 0.0 0 0.0 9 44
142 A 144 PRO P e + 0 0 -63.2 137.4 -179.8 178.1 49.9 111.8 0 0.0 106 -2.6 0 0.0 0 0.0 11 45
143 A 145 SER S E E Ae - 106 0 -144.4 149.8 -179.3 -167.8 17.3 173.4 0 0.0 211 -3.0 0 0.0 0 0.0 15 57
144 A 146 THR T E E Ae - 107 0 -135.4 146.9 -177.7 -142.0 15.0 165.6 106 -2.0 108 -2.4 0 0.0 0 0.0 15 57
145 A 147 PHE F E E Aef - 108 213 -120.4 125.2 179.3 -162.7 9.3 163.3 212 -2.9 214 -3.0 0 0.0 0 0.0 13 65
146 A 148 VAL V E E Aef - 109 214 -107.2 138.5 -179.1 -154.4 6.0 151.2 108 -1.8 110 -2.1 0 0.0 148 -0.6 12 70
147 A 149 TYR Y E E Aef - 110 215 -113.4 108.4 -177.6 -138.1 18.7 160.8 214 -2.7 216 -2.6 0 0.0 0 0.0 11 69
148 A 150 ALA A E E A f - 0 216 -73.2 132.5 177.0 -139.4 10.3 117.1 146 -0.6 0 0.0 110 -0.6 0 0.0 12 68
149 A 151 GLY G e - 0 0 -76.0 177.1 179.9 -66.1 47.9 101.5 216 -2.4 0 0.0 0 0.0 0 0.0 10 63
150 A 152 ILE I E E Bg - 187 0 -68.4 132.0 -178.6 -111.7 61.6 120.0 186 -2.7 188 -2.2 0 0.0 0 0.0 10 57
151 A 153 TYR Y E E Bg > T - 188 0 -69.7 128.3 176.9 -145.1 11.0 118.5 0 0.0 154 -1.9 0 0.0 0 0.0 10 53
152 A 154 ASN N G e > TS+ 0 0 -54.8 -42.8 -176.3 57.4 101.3 23.5 188 -3.0 155 -1.6 0 0.0 0 0.0 11 58
153 A 155 ASN N G G 3 TS+ 0 0 -82.0 20.2 171.9 90.6 75.0 76.2 0 0.0 0 0.0 0 0.0 0 0.0 9 53
154 A 156 ASN N G G < TS+ 0 0 -72.8 -28.4 -177.3 101.2 71.2 38.0 151 -1.9 0 0.0 0 0.0 0 0.0 7 47
155 A 157 PHE F g < T + 0 0 -63.9 133.6 179.7 147.1 44.2 108.9 152 -1.6 0 0.0 0 0.0 0 0.0 9 57
156 A 158 THR T B B a - 164 0 -157.4 154.6 176.5 -132.6 50.6 166.3 163 -1.5 165 -2.3 0 0.0 0 0.0 13 50
157 A 159 SER S S S S+ 0 0 -91.6 -2.6 176.2 106.4 78.3 60.4 0 0.0 0 0.0 0 0.0 0 0.0 11 48
158 A 160 LEU L S S S- 0 0 -66.7 153.7 -179.2 -98.4 94.6 115.6 0 0.0 160 -2.2 0 0.0 0 0.0 6 37
159 A 161 PRO P S S S+ 0 0 -72.4 47.7 179.5 141.2 74.5 99.4 0 0.0 0 0.0 0 0.0 0 0.0 9 30
160 A 162 TYR Y - 0 0 -90.0 146.6 -178.9 -90.0 55.6 131.4 158 -2.2 0 0.0 0 0.0 0 0.0 11 33
161 A 163 PRO P S S S- 0 0 -61.5 153.0 174.7 -6.0 88.2 94.1 0 0.0 163 -2.1 0 0.0 0 0.0 10 44
162 A 164 LEU L S S S+ 0 0 66.3 -40.1 -179.1 54.3 124.8 98.0 0 0.0 0 0.0 0 0.0 0 0.0 10 53
163 A 165 PHE F + 0 0 -119.6 45.3 179.2 141.6 68.4 102.8 161 -2.1 156 -1.5 0 0.0 165 -0.6 11 56
164 A 166 GLN Q B e a - 156 0 -92.6 122.2 177.1 -159.8 38.4 140.4 0 0.0 166 -1.4 0 0.0 176 -0.6 13 50
165 A 167 MET M E E CH - 175 0 -94.8 83.9 -177.2 -149.7 31.9 142.3 156 -2.3 0 0.0 163 -0.6 0 0.0 11 64
166 A 168 GLU E E E CH - 174 0 -68.3 128.0 178.1 -137.2 7.1 115.7 174 -2.2 174 -2.0 164 -1.4 168 -0.6 11 49
167 A 169 LEU L E E CH - 173 0 -83.6 119.2 -180.0 -148.8 23.7 138.4 0 0.0 0 0.0 0 0.0 0 0.0 9 40
168 A 170 MET M e > T - 0 0 -88.4 161.4 -180.0 -104.2 26.7 120.4 172 -3.8 171 -2.5 166 -0.6 0 0.0 8 27
169 A 171 PRO P T T 3 TS+ 0 0 -50.7 -36.6 -179.0 54.6 120.9 33.2 0 0.0 0 0.0 0 0.0 0 0.0 5 16
170 A 172 ASP D T T 3 TS- 0 0 -85.1 10.6 178.6 -101.8 122.6 72.2 0 0.0 0 0.0 0 0.0 0 0.0 4 17
171 A 173 GLY G S t < TS+ 0 0 87.9 -4.7 178.1 122.1 84.4 64.1 168 -2.5 0 0.0 0 0.0 0 0.0 8 24
172 A 174 THR T e - 0 0 -87.7 164.1 179.8 -130.9 55.3 120.0 0 0.0 168 -3.8 0 0.0 0 0.0 10 30
173 A 175 PHE F E E CHi - 167 238 -117.3 147.3 177.6 -171.7 18.6 153.0 237 -2.9 239 -1.9 0 0.0 0 0.0 12 46
174 A 176 GLU E E E CHi - 166 239 -138.5 136.1 177.4 -157.4 10.5 178.4 166 -2.0 166 -2.2 0 0.0 176 -0.5 12 48
175 A 177 TRP W E E CHi - 165 240 -115.1 117.3 179.4 -168.1 13.5 166.7 239 -2.1 241 -2.7 0 0.0 0 0.0 13 53
176 A 178 HIS H E E C i + 0 241 -107.5 127.0 178.5 136.1 23.8 159.1 164 -0.6 0 0.0 174 -0.5 0 0.0 14 48
177 A 179 ALA A E E C i - 0 242 -159.6 166.8 -179.9 -109.0 60.3 167.0 241 -1.7 243 -2.1 0 0.0 0 0.0 14 56
178 A 180 PRO P S S S+ 0 0 -78.1 -13.8 -179.6 113.5 78.6 49.8 0 0.0 0 0.0 0 0.0 0 0.0 13 43
179 A 181 PHE F S S S- 0 0 -60.0 140.0 178.2 -100.0 81.5 106.7 0 0.0 0 0.0 0 0.0 0 0.0 11 51
180 A 182 ASP D t > T - 0 0 -60.4 134.1 -179.6 -125.8 30.2 111.6 0 0.0 183 -0.6 0 0.0 0 0.0 11 40
181 A 183 PRO P T T 3 TS+ 0 0 -52.2 -30.5 -174.3 34.2 103.2 37.6 0 0.0 224 -2.0 0 0.0 0 0.0 10 39
182 A 184 ASP D T T 3 TS+ 0 0 -110.9 -6.3 179.1 101.8 85.8 56.7 0 0.0 0 0.0 0 0.0 0 0.0 8 32
183 A 185 ILE I S t < TS- 0 0 -81.1 128.1 -180.0 -117.1 75.6 131.9 180 -0.6 0 0.0 0 0.0 0 0.0 9 35
184 A 186 PRO P - 0 0 -67.6 134.9 178.6 -161.1 29.0 115.0 0 0.0 0 0.0 0 0.0 0 0.0 8 42
185 A 187 LEU L E E B J - 0 221 -113.0 153.8 179.6 -110.4 22.9 145.0 221 -2.2 221 -2.4 0 0.0 0 0.0 11 53
186 A 188 PRO P E E B J - 0 220 -88.1 129.7 179.8 -167.5 38.1 139.7 0 0.0 150 -2.7 0 0.0 0 0.0 12 58
187 A 189 TRP W E E BgJ - 150 219 -114.7 166.9 -177.8 -167.4 8.4 136.3 219 -2.7 218 -1.4 0 0.0 219 -0.8 14 58
188 A 190 LEU L E E Bg - 151 0 -157.0 132.2 175.4 -140.6 26.6 164.4 150 -2.2 152 -3.0 0 0.0 190 -1.4 16 61
189 A 191 ASP D h > >T - 0 0 -90.1 89.3 -177.5 -174.7 31.6 141.0 0 0.0 193 -2.9 0 0.0 194 -0.5 15 56
190 A 192 ALA A H H > 5TS+ 0 0 -53.8 -52.2 -178.1 50.8 73.2 23.3 188 -1.4 194 -1.4 0 0.0 0 0.0 12 56
191 A 193 GLU E H H 4 5TS+ 0 0 -57.2 -46.8 -177.2 26.7 122.9 24.7 0 0.0 0 0.0 0 0.0 0 0.0 10 52
192 A 194 HIS H H H 4 5TS+ 0 0 -90.0 -32.1 -173.0 34.6 128.4 31.8 0 0.0 0 0.0 0 0.0 0 0.0 10 52
193 A 195 ASP D H H X 5TS+ 0 0 -104.6 -18.0 178.3 68.0 98.1 46.7 189 -2.9 197 -1.5 0 0.0 0 0.0 14 56
194 A 196 VAL V H H X TS+ 0 0 -53.4 -57.0 -179.9 45.4 110.9 21.7 0 0.0 199 -2.5 0 0.0 0 0.0 17 63
196 A 198 PRO P H H > TS+ 0 0 -58.0 -38.1 179.8 49.8 114.3 28.2 0 0.0 200 -1.7 0 0.0 0 0.0 13 50
197 A 199 ALA A H H X TS+ 0 0 -66.4 -45.8 179.1 48.4 111.2 19.9 193 -1.5 201 -1.8 0 0.0 0 0.0 12 59
198 A 200 LEU L H H X TS+ 0 0 -60.0 -42.7 179.7 53.4 109.4 25.4 194 -2.6 202 -2.2 0 0.0 0 0.0 9 74
199 A 201 LEU L H H X TS+ 0 0 -61.7 -36.2 -179.3 51.9 106.9 28.9 195 -2.5 203 -2.2 0 0.0 0 0.0 10 65
200 A 202 GLN Q H H X TS+ 0 0 -69.0 -35.7 177.8 53.7 106.3 29.0 196 -1.7 204 -2.9 0 0.0 0 0.0 10 49
201 A 203 ILE I H H X TS+ 0 0 -61.9 -44.3 178.6 46.2 111.4 20.0 197 -1.8 205 -1.9 0 0.0 0 0.0 10 54
202 A 204 PHE F H H < TS+ 0 0 -64.9 -37.7 179.3 50.2 112.5 27.9 198 -2.2 0 0.0 0 0.0 0 0.0 10 61
203 A 205 LYS K H H < TS+ 0 0 -65.4 -44.7 179.2 52.7 108.3 21.8 199 -2.2 0 0.0 0 0.0 0 0.0 6 42
204 A 206 ASP D H H < TS- 0 0 -58.0 -41.1 177.6 -144.3 109.1 28.3 200 -2.9 0 0.0 0 0.0 0 0.0 8 33
205 A 207 GLY G h X T - 0 0 99.1 163.5 -179.6 -68.5 19.0 94.7 201 -1.9 209 -1.6 0 0.0 0 0.0 9 35
206 A 208 PRO P H H > TS+ 0 0 -63.3 -36.3 -179.2 61.2 119.3 36.2 0 0.0 210 -2.7 0 0.0 0 0.0 12 37
207 A 209 GLN Q H H 4 TS+ 0 0 -62.4 -41.5 179.0 40.8 110.8 21.5 0 0.0 0 0.0 0 0.0 0 0.0 6 25
208 A 210 LYS K H H 4 TS+ 0 0 -71.6 -37.8 -174.6 28.3 129.0 25.8 0 0.0 0 0.0 0 0.0 0 0.0 6 28
209 A 211 TRP W H H < > TS+ 0 0 -107.3 -2.6 -179.3 129.3 78.3 60.6 205 -1.6 212 -2.1 0 0.0 0 0.0 11 39
210 A 212 ASN N T h < 3 TS+ 0 0 -56.6 130.6 178.4 7.5 85.9 107.9 206 -2.7 0 0.0 0 0.0 0 0.0 10 38
211 A 213 GLY G T T 3 TS+ 0 0 80.0 -3.1 -178.8 133.7 101.0 67.4 143 -3.0 0 0.0 0 0.0 0 0.0 9 38
212 A 214 HIS H e < T - 0 0 -85.3 150.7 175.0 -147.5 47.8 119.2 209 -2.1 145 -2.9 0 0.0 0 0.0 8 44
213 A 215 ARG R E E Af - 145 0 -112.0 130.3 -179.8 -167.3 17.3 163.2 0 0.0 0 0.0 0 0.0 0 0.0 8 56
214 A 216 ILE I E E Af - 146 0 -125.0 125.4 178.4 -136.2 18.3 170.0 145 -3.0 147 -2.7 0 0.0 216 -0.7 10 63
215 A 217 ALA A E E Af - 147 0 -80.5 114.0 179.1 -150.4 13.8 135.7 0 0.0 217 -1.7 0 0.0 0 0.0 13 60
216 A 218 LEU L E E Af + 148 0 -86.6 77.1 178.7 113.6 57.1 127.9 147 -2.6 149 -2.4 214 -0.7 0 0.0 13 68
217 A 219 THR T - 0 0 -146.5 136.9 -177.2 -172.8 42.7 168.8 215 -1.7 0 0.0 0 0.0 0 0.0 14 59
218 A 220 PHE F S S S+ 0 0 -113.2 -5.0 179.4 21.8 71.5 61.0 187 -1.4 0 0.0 0 0.0 0 0.0 14 53
219 A 221 GLU E E E BJ - 187 0 -160.2 144.5 177.9 -144.8 62.0 167.3 187 -0.8 187 -2.7 0 0.0 0 0.0 9 53
220 A 222 THR T E E BJ + 186 0 -114.8 138.1 -178.7 168.4 25.3 161.8 0 0.0 0 0.0 0 0.0 0 0.0 10 48
221 A 223 LEU L E E BJ - 185 0 -149.2 138.5 175.5 -127.4 31.1 171.0 185 -2.4 185 -2.2 0 0.0 0 0.0 12 43
222 A 224 SER S h > T - 0 0 -77.0 163.0 179.5 -103.9 39.6 112.4 0 0.0 226 -2.4 0 0.0 0 0.0 12 46
223 A 225 PRO P H H > TS+ 0 0 -55.4 -39.6 178.9 53.0 125.7 24.2 0 0.0 227 -2.3 0 0.0 0 0.0 14 52
224 A 226 VAL V H H > TS+ 0 0 -61.4 -41.3 179.5 47.5 109.7 23.7 181 -2.0 228 -2.1 0 0.0 0 0.0 11 38
225 A 227 GLN Q H H > TS+ 0 0 -69.9 -31.9 178.0 55.2 108.3 35.1 0 0.0 229 -1.8 0 0.0 0 0.0 9 41
226 A 228 VAL V H H X TS+ 0 0 -64.3 -47.5 179.4 46.8 109.6 18.6 222 -2.4 230 -2.2 0 0.0 0 0.0 10 62
227 A 229 CYS C H H X TS+ 0 0 -62.1 -39.2 178.1 53.8 109.4 27.6 223 -2.3 231 -2.4 0 0.0 0 0.0 12 55
228 A 230 ALA A H H X TS+ 0 0 -63.5 -35.5 179.7 50.9 108.0 28.6 224 -2.1 232 -2.3 0 0.0 0 0.0 10 37
229 A 231 ALA A H H X TS+ 0 0 -68.1 -40.7 178.2 47.0 111.1 23.7 225 -1.8 233 -2.3 0 0.0 0 0.0 11 43
230 A 232 PHE F H H X TS+ 0 0 -65.4 -36.7 -180.0 53.8 111.4 29.0 226 -2.2 234 -2.8 0 0.0 0 0.0 15 50
231 A 233 SER S H H X >TS+ 0 0 -64.7 -44.5 178.7 42.9 111.5 23.4 227 -2.4 235 -1.7 0 0.0 236 -0.9 11 39
232 A 234 ARG R H H < 5TS+ 0 0 -67.1 -40.3 -178.5 48.7 117.0 27.7 228 -2.3 0 0.0 0 0.0 0 0.0 9 27
233 A 235 ALA A H H < 5TS+ 0 0 -66.2 -44.7 -175.9 28.8 123.3 23.7 229 -2.3 0 0.0 0 0.0 0 0.0 10 32
234 A 236 LEU L H H < 5TS- 0 0 -97.5 -7.9 -178.7 -128.3 96.0 58.0 230 -2.8 0 0.0 0 0.0 0 0.0 8 40
235 A 237 ASN N T h < 5TS+ 0 0 55.3 52.8 179.1 112.3 72.2 17.3 231 -1.7 0 0.0 0 0.0 0 0.0 7 29
236 A 238 ARG R S t > T - 0 0 -63.3 144.2 -178.0 -117.5 42.0 111.8 0 0.0 257 -1.7 0 0.0 256 -0.9 6 22
254 A 256 VAL V H H > 3 TS+ 0 0 -55.5 -37.4 179.4 59.5 113.7 31.5 0 0.0 258 -2.4 0 0.0 0 0.0 6 21
255 A 257 GLY G H H > 3 TS+ 0 0 -59.8 -36.9 -179.6 48.4 105.8 28.0 0 0.0 259 -1.5 0 0.0 0 0.0 7 28
256 A 258 TYR Y H H > < TS+ 0 0 -70.9 -37.1 178.9 54.6 108.0 29.2 253 -0.9 260 -2.5 0 0.0 0 0.0 8 33
257 A 259 ARG R H H X TS+ 0 0 -60.7 -42.9 -179.5 48.9 108.5 23.8 253 -1.7 261 -2.3 0 0.0 0 0.0 9 29
258 A 260 GLU E H H X TS+ 0 0 -66.7 -32.7 177.5 53.8 108.7 32.8 254 -2.4 262 -1.9 0 0.0 0 0.0 9 33
259 A 261 GLN Q H H X TS+ 0 0 -64.7 -47.3 -178.2 46.6 110.4 21.0 255 -1.5 263 -1.9 0 0.0 0 0.0 11 46
260 A 262 LEU L H H X TS+ 0 0 -65.0 -36.0 179.8 53.8 109.6 29.9 256 -2.5 264 -2.0 0 0.0 0 0.0 10 44
261 A 263 GLU E H H X TS+ 0 0 -66.8 -38.6 178.3 49.0 108.3 26.1 257 -2.3 265 -1.6 0 0.0 0 0.0 10 38
262 A 264 ALA A H H X TS+ 0 0 -66.8 -37.0 179.2 54.2 109.1 28.8 258 -1.9 266 -3.3 0 0.0 0 0.0 12 45
263 A 265 ILE I H H X >TS+ 0 0 -65.0 -38.3 177.7 54.4 103.8 29.0 259 -1.9 267 -2.5 0 0.0 268 -1.4 11 52
264 A 266 GLU E H H < >TS+ 0 0 -60.6 -43.1 179.2 40.8 115.6 21.4 260 -2.0 269 -2.5 0 0.0 0 0.0 13 41
265 A 267 VAL V H H < >TS+ 0 0 -68.8 -53.4 -178.7 40.8 120.6 15.4 261 -1.6 270 -2.5 0 0.0 0 0.0 11 37
266 A 268 VAL V H H < 5TS+ 0 0 -62.7 -49.2 -178.7 16.4 134.9 23.0 262 -3.3 272 -2.6 0 0.0 0 0.0 13 45
267 A 269 PHE F T h < 5TS+ 0 0 -95.5 -39.4 -179.3 43.9 131.0 34.0 263 -2.5 0 0.0 0 0.0 0 0.0 14 50
268 A 270 GLY G T T > TS- 0 0 -69.0 144.1 179.9 -118.6 76.1 114.7 0 0.0 280 -1.9 0 0.0 281 -0.5 8 40
278 A 280 PRO P G G 4 > TS+ 0 0 -49.0 -42.4 -178.6 54.8 112.9 30.2 0 0.0 281 -1.2 0 0.0 0 0.0 5 26
279 A 281 GLU E G G 4 3 TS+ 0 0 -70.5 -14.1 179.9 51.3 106.1 52.1 0 0.0 0 0.0 0 0.0 0 0.0 4 29
280 A 282 PHE F G G 4 < T 0 0 -102.2 0.6 179.3 999.9 999.9 66.1 277 -1.9 0 0.0 0 0.0 0 0.0 9 41
281!A 283 SER S g < < T 0 0 -62.4 999.9 999.9 999.9 999.9 16.3 278 -1.2 0 0.0 277 -0.5 0 0.0 9 33
282!A 310 GLY G 0 0 999.9 108.6 -178.8 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 4
283 A 311 GLY G + 0 0 84.4 -17.2 179.5 137.4 999.9 78.7 0 0.0 0 0.0 0 0.0 0 0.0 3 5
284 A 312 VAL V - 0 0 -66.5 123.6 -178.4 -178.3 30.4 118.4 0 0.0 0 0.0 0 0.0 0 0.0 4 6
285 A 313 ILE I - 0 0 -131.3 118.6 178.6 -147.7 16.1 166.2 0 0.0 0 0.0 0 0.0 0 0.0 4 10
286 A 314 SER S - 0 0 -85.6 141.0 -178.8 -107.3 28.8 129.1 0 0.0 0 0.0 0 0.0 0 0.0 4 14
287 A 315 GLN Q - 0 0 -67.8 131.5 178.1 -141.4 30.4 115.9 0 0.0 0 0.0 0 0.0 0 0.0 5 24
288 A 316 ARG R t > T - 0 0 -93.5 151.3 -177.2 -112.1 23.8 134.0 0 0.0 291 -2.1 0 0.0 0 0.0 7 33
289 A 317 VAL V T T 3 TS+ 0 0 -52.7 -28.5 -179.2 49.7 117.0 41.6 0 0.0 0 0.0 0 0.0 0 0.0 9 40
290 A 318 THR T T h > 3 TS+ 0 0 -90.2 -7.3 -178.4 93.3 85.3 60.1 0 0.0 294 -2.4 0 0.0 0 0.0 12 45
291 A 319 ASP D H H > < TS+ 0 0 -53.0 -56.9 -178.0 42.3 86.2 22.1 288 -2.1 295 -1.7 0 0.0 0 0.0 9 35
292 A 320 GLU E H H > TS+ 0 0 -61.6 -44.9 -180.0 49.9 114.7 22.4 0 0.0 296 -2.1 0 0.0 0 0.0 9 45
293 A 321 ALA A H H > TS+ 0 0 -60.1 -49.2 179.8 49.4 110.8 19.7 0 0.0 297 -2.3 0 0.0 0 0.0 13 50
294 A 322 ARG R H H < TS+ 0 0 -61.3 -30.6 178.4 50.9 110.5 33.8 290 -2.4 0 0.0 0 0.0 0 0.0 10 40
295 A 323 LYS K H H < TS+ 0 0 -73.4 -34.4 177.9 50.1 110.7 30.6 291 -1.7 0 0.0 0 0.0 0 0.0 7 33
296 A 324 LEU L H H < TS+ 0 0 -67.8 -38.7 -177.3 15.6 128.7 29.6 292 -2.1 0 0.0 0 0.0 0 0.0 10 40
297 A 325 TRP W h < > T - 0 0 -146.1 105.2 -178.8 -177.4 58.2 149.9 293 -2.3 300 -0.7 0 0.0 0 0.0 11 40
298 A 326 SER S T T 3 TS+ 0 0 -74.9 -17.8 -177.4 70.9 77.5 50.3 0 0.0 0 0.0 0 0.0 0 0.0 6 28
299 A 327 GLY G T T 3 T + 0 0 -91.2 22.3 179.9 143.6 67.9 82.3 0 0.0 0 0.0 0 0.0 0 0.0 5 33
300 A 328 TRP W t < T - 0 0 -61.4 152.7 -179.4 -131.0 43.2 100.0 297 -0.7 0 0.0 0 0.0 0 0.0 10 44
301 A 329 ARG R - 0 0 -110.6 139.0 -179.0 -137.6 16.3 151.8 0 0.0 0 0.0 0 0.0 0 0.0 10 47
302 A 330 ASP D h > T - 0 0 -90.6 177.2 -177.8 -99.1 28.5 103.7 0 0.0 306 -1.9 0 0.0 0 0.0 10 50
303 A 331 MET M H H > TS+ 0 0 -61.4 -40.4 -179.4 56.5 119.2 30.2 0 0.0 307 -3.0 0 0.0 0 0.0 12 52
304 A 332 GLU E H H > TS+ 0 0 -61.1 -42.7 179.0 48.2 107.6 25.3 0 0.0 308 -2.1 0 0.0 0 0.0 10 40
305 A 333 GLU E H H > >TS+ 0 0 -64.7 -41.7 179.1 49.8 112.5 24.6 0 0.0 309 -2.9 0 0.0 310 -0.6 10 40
306 A 334 TYR Y H H X >TS+ 0 0 -60.5 -52.5 -178.6 47.9 111.3 13.8 302 -1.9 311 -2.7 0 0.0 310 -2.1 13 45
307 A 335 ALA A H H < 5TS+ 0 0 -56.1 -41.1 -177.0 35.9 121.3 29.2 303 -3.0 0 0.0 0 0.0 0 0.0 13 54
308 A 336 ARG R H H < 5TS+ 0 0 -84.8 -34.7 -176.0 27.5 129.3 32.9 304 -2.1 0 0.0 0 0.0 0 0.0 11 37
309 A 337 GLU E H H < 5TS+ 0 0 -101.8 -29.8 -176.0 18.0 132.4 38.6 305 -2.9 0 0.0 0 0.0 0 0.0 8 31
310 A 338 VAL V T h X > 3 3 TS+ 0 0 -61.6 -34.1 -180.0 45.3 112.7 29.5 0 0.0 316 -2.1 0 0.0 0 0.0 10 40
313 A 341 ILE I H H > < TS+ 0 0 -75.2 -43.7 177.7 47.7 113.1 23.7 310 -0.9 317 -2.8 0 0.0 0 0.0 8 29
314 A 342 GLU E H H X TS+ 0 0 -61.1 -41.8 178.7 49.8 114.1 24.3 310 -2.6 318 -1.2 0 0.0 0 0.0 8 34
315 A 343 GLU E H H < >TS+ 0 0 -62.8 -47.6 178.5 46.8 111.4 21.4 311 -2.7 320 -2.2 0 0.0 0 0.0 12 35
316 A 344 GLU E H H < >5TS+ 0 0 -62.4 -40.6 178.7 54.2 109.5 24.4 312 -2.1 319 -1.9 0 0.0 0 0.0 10 24
317 A 345 ALA A H H < 35TS+ 0 0 -63.1 -24.9 178.2 54.8 105.8 39.6 313 -2.8 0 0.0 0 0.0 0 0.0 7 21
318 A 346 ASN N T h < 35TS- 0 0 -88.8 3.7 178.4 -102.5 126.4 67.5 314 -1.2 0 0.0 0 0.0 0 0.0 6 25
319 A 347 GLY G T T <5TS+ 0 0 94.2 -2.6 -179.2 144.4 72.5 66.2 316 -1.9 0 0.0 0 0.0 0 0.0 6 18
320 A 348 LEU L t T + 0 0 -122.4 -2.2 -178.2 103.4 57.2 64.0 0 0.0 324 -2.1 0 0.0 0 0.0 7 26
322 A 350 TRP W T T 3 TS+ 0 0 -55.7 -26.5 -178.3 52.7 85.6 39.2 0 0.0 0 0.0 0 0.0 0 0.0 5 33
323 A 351 MET M T T 3 T 0 0 -88.2 -3.9 -178.8 999.9 999.9 59.2 0 0.0 0 0.0 0 0.0 0 0.0 6 33
324 A 352 LEU L t < T 0 0 -74.6 999.9 999.9 999.9 999.9 34.9 321 -2.1 0 0.0 0 0.0 0 0.0 3 16
1k6xA.pdb
1K6X TRANSCRIPTION MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand EEESSTTSHHHHHHHHHHHHTT EEEEES S SHHHHHHHTSTTEEEEES TT HHHHHHHHTT SEEEE STTS HHHHHHHHHHHHHHH Kabs/Sand
chirality -----+-++++-++++++++++++-+-----+---++-++++++++-++----+--+-++++++++++-+-+---+---++-++++++++++++++++- chirality
bends SSSSSSSSSSSSSSSSSSS S S SSSSSSSSSSSS S SS SSSSSSSSSS S SSSS SSSSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTT TTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< 5-turns
3-turns >33< >>3<< >33X33< >33X33< >3><3< >33< >33 3-turns
bridge-2 bbb ccccc dddd bridge-2
bridge-1 aaa bbb ccccc aaa bridge-1
sheets AAA AAAAA AAAAA AAAA sheets
4-turns >>>>XXXXXX<<<< >>>>X<<<< >>>>XX<<<< >>>>XXXXXXXXX<<< 4-turns
summary eEEEetTThHHHHHHHHHHHHhTteEEEEES S hHHHHHHHhtTeEEEEEe tTThHHHHHHHHhTteEEEE tTTthHHHHHHHHHHHHHHH summary
sequence QQKKTIAVVNATGRQAASLIRVAAAVGHHVRAQVHSLKGLIAEELQAIPNVTLFQGPLLNNVPLMDTLFEGAHLAFINTTSQAGDEIAIGKDLADAAKRA sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand S SEEEEEE GGGTSS TTTHHHHHHHHHHHTSSS EEEEEE EEGGG BSSS SS BEEE TTS EEEEESS TTS EEEE HHHHHHHHHHH Kabs/Sand
chirality ++++---------+++--+----+++++++++++++++-+-+---------++++-+-+--++-----+-+----+-+--++-------+++++++++++ chirality
bends S S SSSSSS SSSSSSSSSSSSSSSSSS SSS SSS SS SSS SS SSS SSSSSSSSSSS bends
turns T TTTTTT TTTTTTTTTTTTTTTTT TTTTT TTTT TTTT TTTTTTTTTTTT turns
5-turns >5555< 5-turns
3-turns < >>3<< >33X>3<< >>3<< >>3<< >33< >33< 3-turns
bridge-2 eeeee ffff iiiii JJJ bridge-2
bridge-1 dddd eeeee gg a aHHH HHH gg bridge-1
sheets AAAAAA AAAAAA BB CCC CCCCC BBBB sheets
4-turns < >444< >44>X>>XXXXX<<<< >>44XX>>XXXX 4-turns
summary h SEEEEEE gGGGgtS tTThHHHHHHHHHHHhtSSeEEEEEEeEEeGGgBSSS SS eEEEeTTteEEEEESStTTt EEEEhHHHHHHHHHHH summary
sequence GTIQHYIYSSMPDHSLYGPWPAVPMWAPKFTVENYVRQLGLPSTFVYAGIYNNNFTSLPYPLFQMELMPDGTFEWHAPFDPDIPLPWLDAEHDVGPALLQ sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand HHHH HHHHTT EEEE SEEE HHHHHHHHHHHHTS EEEEE SS S HHHHHHHHHHHHHTTTS SS SGGG TTHHHHHH TT Kabs/Sand
chirality +++--++++++----+-+-+--+++++++++++-+-++-----+---++----++++++++++++++++-+--+++-++ +-----++++++++-++- chirality
bends SSSS SSSSSS S SSSSSSSSSSSSSS SS S SSSSSSSSSSSSSSSSS SS SSS SSSSSSSS S bends
turns TTTTTTTTTTTT TTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTT TTTTT TTTTTTTTTTTTT turns
5-turns >5555< >>>55<<< 5-turns
3-turns >33< >33< >>3<< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 ffff JJJ iiiii bridge-1
sheets AAAA BBB CCCCC sheets
4-turns X<<44<< >>>>XXXXXX<<<< >>>>XXXXXXX<<<< >444< >>>><<<< 4-turns
summary HHHHhHHHHhTeEEEE SEEEhHHHHHHHHHHHHhteEEEEEeSS S hHHHHHHHHHHHHHhTTt SS gGGGg tThHHHHHHhTTt summary
sequence IFKDGPQKWNGHRIALTFETLSPVQVCAAFSRALNRRVTYVQVPKVEIKVNIPVGYREQLEAIEVVFGEHKAPYFPLPEFSGGVISQRVTDEARKLWSGW sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand HHHHHHHTHHHHHHHTT TT Kabs/Sand
chirality --+++++++++++++++-+-++ chirality
bends SSSSSSSSSSSSSSSSS S bends
turns TTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >>555<< >5555< 5-turns
3-turns >33< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>X<<>>X<<<< 4-turns
summary hHHHHHHHhHHHHHHHhTttTTt summary
sequence RDMEEYAREVFPIEEEANGLDWML sequence
310 320
Messages
chain break between 281(A 283 ) and 282(A 310 )