Secondary structure calculation program - copyright by David Keith Smith, 1989
1kmoA.pdb
1KMO MEMBRANE PROTEIN MOL_ID: 1; MOL_ID: 1
Sequence length - 661
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 81 ALA A 0 0 999.9 64.9 -178.6 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 18
2 A 82 LEU L + 0 0 24.7 102.6 178.6 179.0 999.9 34.8 0 0.0 0 0.0 0 0.0 0 0.0 8 30
3 A 83 THR T - 0 0 -128.2 123.1 -180.0 -125.8 28.0 175.3 0 0.0 0 0.0 0 0.0 0 0.0 7 32
4 A 84 VAL V - 0 0 -68.4 136.1 179.2 -164.5 16.2 118.2 270 -3.5 0 0.0 0 0.0 0 0.0 12 42
5 A 85 VAL V + 0 0 -84.6 -53.3 -179.6 170.3 21.1 24.3 0 0.0 7 -0.9 0 0.0 0 0.0 5 49
6 A 86 GLY G + 0 0 82.9 -106.9 -178.2 36.2 59.3 135.2 0 0.0 8 -0.9 0 0.0 0 0.0 9 55
7 A 87 ASP D + 0 0 -89.1 104.2 -180.0 179.1 58.8 135.0 5 -0.9 0 0.0 0 0.0 0 0.0 5 60
8 A 88 TRP W S S S+ 0 0 -80.2 -3.8 179.3 52.5 79.8 61.3 6 -0.9 0 0.0 0 0.0 0 0.0 8 56
9 A 89 LEU L S t > TS+ 0 0 -90.2 -72.1 177.8 103.6 79.7 28.6 0 0.0 12 -3.2 0 0.0 0 0.0 9 58
10 A 90 GLY G T T 3 TS- 0 0 32.0 -120.7 -179.0 -6.5 100.3 83.4 0 0.0 0 0.0 0 0.0 0 0.0 9 51
11 A 91 ASP D T T 3 TS- 0 0 -90.9 21.3 177.7 -108.6 98.1 82.9 0 0.0 0 0.0 0 0.0 0 0.0 7 44
12 A 92 ALA A t < T - 0 0 53.4 55.3 -179.7 -157.3 42.4 20.7 9 -3.2 0 0.0 0 0.0 0 0.0 12 44
13 A 93 ARG R h > T - 0 0 -64.1 138.5 -178.4 -123.5 20.5 112.1 0 0.0 17 -2.0 0 0.0 0 0.0 9 34
14 A 94 GLU E H H > TS+ 0 0 -50.5 -45.5 -178.7 50.7 109.8 27.4 0 0.0 18 -2.5 0 0.0 0 0.0 6 39
15 A 95 ASN N H H > TS+ 0 0 -64.9 -39.6 178.6 52.1 106.4 30.5 0 0.0 19 -2.4 0 0.0 0 0.0 6 37
16 A 96 ASP D H H 4 TS+ 0 0 -65.1 -35.9 179.1 48.3 112.5 27.5 0 0.0 0 0.0 0 0.0 0 0.0 10 43
17 A 97 VAL V H H < > TS+ 0 0 -68.8 -45.5 -179.0 47.5 111.5 19.6 13 -2.0 20 -1.3 0 0.0 0 0.0 11 52
18 A 98 PHE F H H < 3 TS+ 0 0 -61.1 -37.7 -179.2 44.9 116.9 25.0 14 -2.5 0 0.0 0 0.0 0 0.0 8 53
19 A 99 GLU E T h < 3 TS+ 0 0 -86.0 2.1 -179.6 125.2 85.3 69.4 15 -2.4 0 0.0 0 0.0 0 0.0 8 55
20 A 100 HIS H t < T - 0 0 -70.3 123.4 -179.5 -143.0 58.1 120.9 17 -1.3 22 -1.9 0 0.0 0 0.0 11 67
21 A 101 ALA A S S S+ 0 0 -84.5 61.6 179.5 35.6 77.1 111.8 0 0.0 0 0.0 0 0.0 0 0.0 13 64
22 A 102 GLY G S S S- 0 0 171.4 169.2 179.1 -51.5 107.5 156.3 20 -1.9 0 0.0 0 0.0 0 0.0 15 72
23 A 103 ALA A e + 0 0 -64.1 123.4 180.0 154.0 66.1 116.5 0 0.0 117 -2.1 0 0.0 116 -0.6 12 74
24 A 104 ARG R E E AA + 115 0 -155.5 129.5 178.5 179.9 17.3 161.3 0 0.0 0 0.0 0 0.0 0 0.0 11 76
25 A 105 ASP D E E AA - 114 0 -134.1 141.3 178.4 -166.7 5.6 173.7 114 -2.5 114 -2.8 0 0.0 0 0.0 9 70
26 A 106 VAL V E E AA - 113 0 -124.5 142.9 173.4 -164.6 6.4 163.2 0 0.0 0 0.0 0 0.0 0 0.0 10 62
27 A 107 ILE I E E AA - 112 0 -125.6 122.8 -177.5 -148.6 21.1 174.1 112 -2.0 112 -1.8 0 0.0 0 0.0 11 61
28 A 108 ARG R E E AA > T - 111 0 -93.2 157.6 -177.3 -103.8 27.4 123.2 0 0.0 31 -2.4 0 0.0 0 0.0 9 46
29 A 109 ARG R G e > > TS+ 0 0 -45.7 -37.0 -179.6 68.7 115.1 37.4 110 -2.8 32 -1.6 0 0.0 33 -0.6 9 50
30 A 110 GLU E G G 4 3 TS+ 0 0 -54.7 -35.2 -178.8 41.1 104.8 34.8 0 0.0 0 0.0 0 0.0 0 0.0 5 44
31 A 111 ASP D G G 4 < TS+ 0 0 -98.5 6.3 -178.9 90.1 89.5 67.0 28 -2.4 0 0.0 0 0.0 0 0.0 7 51
32 A 112 PHE F T g 4 X>TS+ 0 0 -64.9 -45.9 -174.4 51.0 85.9 21.1 29 -1.6 37 -1.1 0 0.0 35 -0.9 12 55
33 A 113 ALA A G G < >5TS+ 0 0 -68.5 -22.4 -176.4 85.5 84.2 46.1 29 -0.6 36 -2.0 0 0.0 0 0.0 9 65
34 A 114 LYS K G G 35TS+ 0 0 -56.8 -25.3 177.4 32.1 102.2 44.5 0 0.0 0 0.0 0 0.0 0 0.0 8 61
35 A 115 THR T G G <5TS- 0 0 -113.8 13.5 179.2 -103.0 118.6 75.9 32 -0.9 0 0.0 0 0.0 0 0.0 12 64
36 A 116 GLY G T g <5T + 0 0 75.9 20.5 -179.0 172.9 60.6 45.8 33 -2.0 0 0.0 0 0.0 0 0.0 13 66
37 A 117 ALA A t TS- 0 0 -121.4 158.7 179.1 -116.6 83.3 147.6 0 0.0 43 -1.1 0 0.0 0 0.0 8 72
40 A 120 MET M H H > > TS+ 0 0 -57.2 -43.9 -176.9 56.2 113.2 22.5 0 0.0 44 -2.8 0 0.0 43 -0.9 10 68
41 A 121 ARG R H H > 3 TS+ 0 0 -62.4 -32.9 -179.6 58.7 99.3 32.3 0 0.0 45 -2.1 0 0.0 0 0.0 12 62
42 A 122 GLU E H H 4 3 TS+ 0 0 -66.6 -29.3 178.7 37.6 114.0 35.1 0 0.0 0 0.0 0 0.0 0 0.0 10 65
43 A 123 VAL V H H < X TS+ 0 0 -86.3 -41.6 179.3 56.2 112.5 28.0 39 -1.1 46 -1.9 40 -0.9 0 0.0 12 57
44 A 124 LEU L H H < > TS+ 0 0 -56.1 -34.7 -179.9 62.4 100.3 31.0 40 -2.8 47 -1.6 0 0.0 0 0.0 12 69
45 A 125 ASN N T h < 3 TS+ 0 0 -66.8 -18.0 178.5 63.7 92.2 48.2 41 -2.1 0 0.0 0 0.0 0 0.0 11 68
46 A 126 ARG R T T < TS+ 0 0 -86.5 7.0 -179.1 90.4 88.4 68.0 43 -1.9 0 0.0 0 0.0 0 0.0 10 67
47 A 127 ILE I S t X TS- 0 0 -107.1 128.4 -179.7 -113.0 85.1 153.0 44 -1.6 50 -1.7 0 0.0 0 0.0 11 70
48 A 128 PRO P T T 3 TS+ 0 0 -59.7 138.2 178.3 19.2 99.6 105.8 0 0.0 0 0.0 0 0.0 0 0.0 13 69
49 A 129 GLY G T e 3 TS+ 0 0 82.3 3.5 -179.7 109.4 101.9 59.3 0 0.0 70 -3.3 0 0.0 0 0.0 13 75
50 A 130 VAL V E E BB < T - 69 0 -117.1 129.4 177.9 -173.6 44.7 164.1 47 -1.7 0 0.0 0 0.0 0 0.0 12 77
51 A 131 SER S E E BB + 68 0 -123.6 120.2 -178.0 178.0 4.2 170.6 68 -2.7 68 -2.5 0 0.0 0 0.0 14 69
52 A 132 ALA A - 0 0 -125.1 88.9 -179.0 -151.4 20.5 146.4 0 0.0 0 0.0 0 0.0 0 0.0 12 68
53 A 133 PRO P - 0 0 -59.4 154.5 177.5 -95.2 24.5 95.6 0 0.0 0 0.0 0 0.0 0 0.0 10 72
54 A 134 GLU E - 0 0 -65.8 157.0 -178.9 -65.1 66.5 106.0 0 0.0 0 0.0 0 0.0 0 0.0 8 70
55 A 135 ASN N S S S+ 0 0 -47.0 131.4 178.7 143.7 76.3 98.7 0 0.0 0 0.0 0 0.0 0 0.0 9 70
56 A 136 ASN N B B A > T + 59 0 -165.9 160.9 178.5 0.3 43.3 167.1 59 -0.9 59 -0.8 0 0.0 0 0.0 14 73
57 A 137 GLY G T T > TS- 0 0 58.5 -141.8 179.3 -8.9 126.8 99.2 0 0.0 60 -1.7 0 0.0 0 0.0 14 69
58 A 138 THR T T T 3 TS+ 0 0 -54.0 -41.9 179.3 51.1 144.0 21.3 0 0.0 60 -0.5 0 0.0 0 0.0 9 64
59 A 139 GLY G B B A < TS+ 56 0 -90.3 41.6 -179.9 136.5 70.1 99.4 56 -0.8 61 -1.5 0 0.0 56 -0.9 14 66
60 A 140 SER S t < T + 0 0 -83.0 50.4 -179.3 54.0 61.9 105.7 57 -1.7 0 0.0 58 -0.5 0 0.0 11 77
61 A 141 HIS H S t > TS- 0 0 -172.2 165.0 -178.7 -97.8 93.0 166.4 59 -1.5 64 -1.0 0 0.0 0 0.0 13 76
62 A 142 ASP D T T 3 TS+ 0 0 -70.7 -14.4 -179.4 69.2 108.9 53.6 0 0.0 0 0.0 0 0.0 0 0.0 9 71
63 A 143 LEU L T T 3 TS+ 0 0 -76.5 -22.7 179.8 68.1 94.8 42.0 0 0.0 102 -3.4 0 0.0 0 0.0 16 70
64 A 144 ALA A S t < TS- 0 0 -88.2 168.9 175.5 -140.9 75.0 111.4 61 -1.0 0 0.0 0 0.0 0 0.0 12 68
65 A 145 MET M - 0 0 -134.5 129.9 179.5 -173.1 14.9 174.6 99 -1.7 0 0.0 0 0.0 0 0.0 14 65
66 A 146 ASN N + 0 0 -125.9 122.0 175.6 126.1 24.9 168.5 0 0.0 0 0.0 0 0.0 0 0.0 15 58
67 A 147 PHE F - 0 0 -168.1 150.3 177.7 -162.7 29.4 159.9 74 -1.4 0 0.0 0 0.0 0 0.0 15 73
68 A 148 GLY G E E BB - 51 0 -137.3 146.5 179.9 -135.9 16.3 170.2 51 -2.5 51 -2.7 0 0.0 0 0.0 17 65
69 A 149 ILE I E E BB > TS- 50 0 -104.6 135.1 177.6 -11.0 81.2 149.7 0 0.0 72 -2.1 0 0.0 0 0.0 15 79
70 A 150 ARG R T e 3 TS- 0 0 49.0 40.6 177.4 -47.0 132.2 33.6 49 -3.3 0 0.0 0 0.0 0 0.0 15 79
71 A 151 GLY G T T 3 TS+ 0 0 85.0 1.2 177.1 143.4 96.3 56.4 0 0.0 0 0.0 0 0.0 0 0.0 16 70
72 A 152 LEU L S t < TS- 0 0 -72.8 152.2 -177.6 -71.2 72.2 118.9 69 -2.1 0 0.0 0 0.0 0 0.0 11 76
73 A 153 ASN N - 0 0 -45.7 120.0 179.9 -163.4 46.5 99.6 0 0.0 0 0.0 0 0.0 0 0.0 13 69
74 A 154 PRO P g > T + 0 0 -84.0 -16.4 -176.3 119.2 49.2 45.6 0 0.0 77 -2.2 0 0.0 67 -1.4 16 66
75 A 155 ARG R G G > TS- 0 0 -57.3 115.4 179.1 -14.8 97.3 107.3 0 0.0 78 -0.6 0 0.0 0 0.0 10 59
76 A 156 LEU L G G 3 TS- 0 0 63.2 22.5 173.5 -93.9 104.8 46.7 0 0.0 99 -3.2 0 0.0 0 0.0 13 60
77 A 157 ALA A G G < TS+ 0 0 44.3 55.4 -176.1 147.8 75.1 32.5 74 -2.2 0 0.0 0 0.0 0 0.0 14 70
78 A 158 SER S g < T + 0 0 -100.8 -1.1 -176.7 66.9 51.5 62.3 75 -0.6 0 0.0 0 0.0 0 0.0 13 64
79 A 159 ARG R S S S+ 0 0 -105.5 11.7 178.5 61.1 92.3 72.9 0 0.0 129 -2.8 0 0.0 0 0.0 14 79
80 A 160 SER S S S S- 0 0 -129.2 159.2 179.5 -105.4 91.0 153.3 0 0.0 82 -0.8 0 0.0 0 0.0 14 74
81 A 161 THR T E E Ac - 131 0 -89.7 110.9 -177.4 -155.8 41.0 142.8 130 -2.7 132 -2.8 0 0.0 83 -0.5 15 65
82 A 162 VAL V E E Ac + 132 0 -98.2 126.4 -176.8 167.0 20.2 143.8 80 -0.8 89 -2.2 0 0.0 0 0.0 10 70
83 A 163 LEU L E E AcD - 133 88 -135.9 160.2 175.9 -152.0 32.5 156.7 132 -3.2 134 -2.8 81 -0.5 0 0.0 12 68
84 A 164 MET M E E AcD> TS- 134 87 -132.2 118.1 -175.5 -17.4 95.8 172.0 87 -2.1 87 -2.9 0 0.0 0 0.0 12 68
85 A 165 ASP D T e 3 TS- 0 0 48.1 42.0 -179.2 -55.7 129.8 27.9 134 -1.9 0 0.0 0 0.0 0 0.0 10 65
86 A 166 GLY G T T 3 TS+ 0 0 77.1 -9.4 -179.9 124.6 113.5 68.9 0 0.0 0 0.0 0 0.0 0 0.0 9 69
87 A 167 ILE I E E AD < TS- 84 0 -86.0 139.6 179.9 -99.0 72.9 131.2 84 -2.9 84 -2.1 0 0.0 0 0.0 7 71
88 A 168 PRO P E E AD - 83 0 -59.4 126.5 177.6 -168.1 30.7 108.5 0 0.0 0 0.0 0 0.0 0 0.0 10 71
89 A 169 VAL V e + 0 0 -82.9 -37.3 -180.0 89.6 60.8 34.2 82 -2.2 0 0.0 0 0.0 0 0.0 11 78
90 A 170 PRO P S S S- 0 0 -60.4 146.8 176.8 -136.4 75.9 108.1 0 0.0 0 0.0 0 0.0 0 0.0 11 75
91 A 171 PHE F S S S+ 0 0 -77.6 -10.4 177.5 23.2 107.5 52.7 0 0.0 0 0.0 0 0.0 0 0.0 14 69
92 A 172 ALA A S t > TS+ 0 0 -152.4 72.8 -179.1 178.9 74.7 119.5 0 0.0 96 -2.0 0 0.0 0 0.0 13 69
93 A 173 PRO P T T 4 TS+ 0 0 -45.2 -41.0 -178.6 30.7 82.5 36.5 0 0.0 0 0.0 0 0.0 0 0.0 10 72
94 A 174 TYR Y T T 4 TS+ 0 0 -88.2 -63.8 -176.3 27.2 129.6 17.3 0 0.0 0 0.0 0 0.0 0 0.0 12 72
95 A 175 GLY G T T 4 TS+ 0 0 -76.3 -27.1 -178.9 14.8 135.9 41.4 0 0.0 440 -2.7 0 0.0 0 0.0 14 74
96 A 176 GLN Q t < T + 0 0 -148.5 75.0 -179.3 163.4 62.9 124.1 92 -2.0 0 0.0 0 0.0 0 0.0 11 64
97 A 177 PRO P + 0 0 -76.4 0.1 179.3 124.0 35.6 62.8 0 0.0 0 0.0 0 0.0 0 0.0 12 72
98 A 178 GLN Q - 0 0 -65.2 122.3 -179.0 -140.0 60.7 117.7 0 0.0 100 -1.8 0 0.0 0 0.0 9 60
99 A 179 LEU L + 0 0 -84.7 62.9 177.2 147.0 47.8 111.7 76 -3.2 65 -1.7 0 0.0 0 0.0 13 63
100 A 180 SER S S S S+ 0 0 -63.8 -23.3 174.9 32.0 87.2 38.9 98 -1.8 0 0.0 0 0.0 0 0.0 11 65
101 A 181 LEU L S S S- 0 0 -131.8 123.3 -179.1 -176.9 76.0 174.6 0 0.0 0 0.0 0 0.0 0 0.0 10 71
102 A 182 ALA A - 0 0 -124.7 89.3 -178.9 -160.8 11.0 145.7 63 -3.4 104 -2.5 0 0.0 0 0.0 10 77
103 A 183 PRO P + 0 0 -76.6 65.6 177.8 99.1 53.5 107.5 0 0.0 0 0.0 0 0.0 0 0.0 10 77
104 A 184 VAL V - 0 0 -140.6 154.5 -179.9 -153.6 53.2 164.2 102 -2.5 0 0.0 0 0.0 0 0.0 10 76
105 A 185 SER S g > T - 0 0 -140.2 130.2 178.2 -140.9 19.9 171.4 0 0.0 108 -2.2 0 0.0 0 0.0 10 72
106 A 186 LEU L G G > TS+ 0 0 -48.6 -43.9 179.8 66.7 103.1 29.5 0 0.0 109 -2.4 0 0.0 0 0.0 9 68
107 A 187 GLY G G G 3 TS+ 0 0 -52.3 -25.7 -178.1 50.9 99.3 41.9 0 0.0 0 0.0 0 0.0 0 0.0 11 68
108 A 188 ASN N G e < TS+ 0 0 -97.7 10.9 -176.4 96.2 96.9 69.6 105 -2.2 137 -2.2 0 0.0 0 0.0 13 65
109 A 189 MET M E E A E< T - 0 136 -111.1 147.0 175.7 -170.7 48.9 139.8 106 -2.4 0 0.0 0 0.0 0 0.0 12 67
110 A 190 ASP D E E A * S- 0 0 -97.4 -20.1 179.8 -8.0 82.1 52.9 135 -3.3 29 -2.8 0 0.0 0 0.0 10 58
111 A 191 ALA A E E AAE - 28 135 -169.2 163.6 175.9 -132.6 51.4 171.1 135 -1.4 135 -2.4 0 0.0 0 0.0 14 54
112 A 192 ILE I E E AAE - 27 134 -125.5 124.1 -174.9 -163.6 24.8 178.0 27 -1.8 27 -2.0 0 0.0 114 -0.6 14 63
113 A 193 ASP D E E AAE - 26 133 -118.9 105.3 -177.7 -169.6 3.3 159.6 133 -2.5 133 -2.5 0 0.0 115 -0.8 14 67
114 A 194 VAL V E E AAE - 25 132 -102.3 107.8 -178.9 -175.0 2.5 149.9 25 -2.8 25 -2.5 112 -0.6 116 -0.9 11 69
115 A 195 VAL V E E AAE + 24 131 -105.7 86.1 -179.1 170.1 10.0 142.1 131 -3.5 131 -2.6 113 -0.8 0 0.0 13 74
116 A 196 ARG R e + 0 0 -68.7 -26.6 178.5 26.4 67.9 39.4 114 -0.9 0 0.0 23 -0.6 0 0.0 13 83
117 A 197 GLY G S S S+ 0 0 -140.8 151.3 178.6 30.3 108.5 171.4 23 -2.1 0 0.0 0 0.0 0 0.0 14 83
118 A 198 GLY G S S S+ 0 0 89.0 2.0 -179.8 89.2 90.8 63.7 0 0.0 0 0.0 0 0.0 0 0.0 15 76
119 A 199 GLY G t > T + 0 0 -111.0 4.2 -178.5 99.1 51.6 66.5 0 0.0 123 -2.1 0 0.0 0 0.0 11 77
120 A 200 ALA A T T 4 TS+ 0 0 -67.3 -11.6 178.9 51.8 83.1 53.1 0 0.0 0 0.0 0 0.0 0 0.0 17 71
121 A 201 VAL V T T 4 TS+ 0 0 -88.5 -46.2 -178.0 33.7 117.9 27.4 0 0.0 0 0.0 0 0.0 0 0.0 17 67
122 A 202 ARG R T T 4 TS+ 0 0 -85.2 -17.8 -178.3 48.0 119.0 47.4 0 0.0 0 0.0 0 0.0 0 0.0 8 74
123 A 203 TYR Y S t < TS- 0 0 -132.8 144.7 178.4 -152.8 72.4 164.5 119 -2.1 0 0.0 0 0.0 0 0.0 9 74
124 A 204 GLY G + 0 0 -172.9 172.0 -0.1 33.0 36.0 161.1 0 0.0 0 0.0 0 0.0 0 0.0 9 78
125 A 205 PRO P S S S+ 0 0 -91.8 -168.3 -178.8 22.0 110.4 53.0 0 0.0 0 0.0 0 0.0 0 0.0 10 79
126 A 206 GLN Q S g > TS+ 0 0 61.9 39.7 -176.6 150.4 77.7 29.1 435 -1.1 129 -0.6 0 0.0 0 0.0 16 79
127 A 207 SER S G G > T + 0 0 -85.1 2.8 -179.3 96.5 36.6 65.9 435 -1.3 130 -2.0 0 0.0 0 0.0 16 78
128 A 208 VAL V G G 3 TS+ 0 0 -58.3 -40.9 179.1 45.5 89.9 23.1 0 0.0 0 0.0 0 0.0 0 0.0 14 77
129 A 209 GLY G G G < TS- 0 0 -90.2 26.3 179.4 -120.0 117.0 86.1 79 -2.8 0 0.0 126 -0.6 0 0.0 13 81
130 A 210 GLY G e < T - 0 0 71.0 -159.8 -179.7 -56.7 43.5 107.7 127 -2.0 81 -2.7 0 0.0 0 0.0 16 75
131 A 211 VAL V E E AcE - 81 115 -126.5 140.5 177.3 -163.1 36.8 163.4 115 -2.6 115 -3.5 0 0.0 0 0.0 16 68
132 A 212 VAL V E E AcE - 82 114 -123.6 119.5 -178.3 -172.7 14.2 169.8 81 -2.8 83 -3.2 0 0.0 0 0.0 13 81
133 A 213 ASN N E E AcE - 83 113 -119.2 129.1 178.4 -150.2 15.5 162.2 113 -2.5 113 -2.5 0 0.0 135 -0.7 12 70
134 A 214 PHE F E E AcE - 84 112 -98.5 116.9 -178.5 -150.4 16.3 150.1 83 -2.8 85 -1.9 0 0.0 136 -0.6 13 58
135 A 215 VAL V E E A E - 0 111 -92.7 118.3 -179.8 -134.8 12.8 142.1 111 -2.4 110 -3.3 133 -0.7 111 -1.4 14 56
136 A 216 THR T E E A E - 0 109 -70.1 154.0 179.7 -80.6 36.7 106.8 134 -0.6 0 0.0 0 0.0 0 0.0 10 64
137 A 217 ARG R e - 0 0 -53.1 141.2 -179.0 -106.9 52.7 101.6 108 -2.2 0 0.0 0 0.0 0 0.0 9 64
138 A 218 ALA A - 0 0 -71.2 153.0 176.8 -108.8 29.4 107.1 0 0.0 0 0.0 0 0.0 0 0.0 6 50
139 A 219 ILE I - 0 0 -77.9 127.3 -179.9 -109.0 45.4 134.4 0 0.0 0 0.0 0 0.0 0 0.0 13 47
140 A 220 PRO P - 0 0 -58.0 143.7 179.8 -131.3 17.4 107.9 0 0.0 0 0.0 0 0.0 0 0.0 10 36
141 A 221 GLN Q S S S+ 0 0 -60.1 -44.9 177.9 11.6 95.8 24.6 0 0.0 0 0.0 0 0.0 0 0.0 7 29
142 A 222 ASP D S S S- 0 0 -131.2 148.7 -177.2 -49.8 123.4 162.1 0 0.0 0 0.0 0 0.0 0 0.0 8 27
143 A 223 PHE F + 0 0 -21.7 132.8 178.9 175.0 64.4 70.2 0 0.0 0 0.0 0 0.0 0 0.0 9 31
144 A 224 GLY G E E CF - 171 0 -151.0 141.6 177.9 -170.1 19.0 174.9 171 -3.4 171 -2.4 0 0.0 0 0.0 11 34
145 A 225 ILE I E E CFG + 170 661 -133.6 123.8 179.0 168.9 13.9 171.1 661 -1.5 661 -3.6 0 0.0 0 0.0 10 37
146 A 226 GLU E E E CFG + 169 660 -134.9 142.7 -179.7 173.8 2.9 172.2 169 -2.8 169 -2.8 0 0.0 0 0.0 11 45
147 A 227 ALA A E E CFG + 168 659 -149.0 146.9 -179.9 172.4 1.6 175.6 659 -2.6 659 -3.1 0 0.0 0 0.0 11 46
148 A 228 GLY G E E CFG - 167 658 -151.7 165.1 179.9 -169.2 9.9 167.8 167 -2.1 167 -2.4 0 0.0 0 0.0 11 54
149 A 229 VAL V E E CFG - 166 657 -156.1 146.4 175.7 -165.4 4.3 171.1 657 -2.4 657 -2.5 0 0.0 0 0.0 11 51
150 A 230 GLU E E E CFG - 165 656 -133.7 136.5 177.3 -162.3 8.5 174.5 165 -2.1 165 -2.4 0 0.0 0 0.0 13 53
151 A 231 GLY G E E CFG - 164 655 -119.7 138.1 -179.4 -170.6 9.6 167.8 655 -2.4 655 -1.8 0 0.0 0 0.0 11 46
152 A 232 GLN Q E E CFG + 163 654 -129.2 150.7 177.5 176.4 9.2 160.6 163 -2.5 163 -1.8 0 0.0 0 0.0 11 53
153 A 233 LEU L E E C G - 0 653 -151.1 141.8 179.9 -145.1 22.8 171.7 653 -2.3 653 -2.5 0 0.0 0 0.0 13 45
154 A 234 SER S t > T - 0 0 -110.7 98.1 -179.1 -167.9 15.1 150.6 0 0.0 157 -1.5 0 0.0 0 0.0 14 45
155 A 235 PRO P T T 3 TS+ 0 0 -53.7 -41.8 -179.5 51.2 83.4 37.6 0 0.0 0 0.0 0 0.0 0 0.0 9 35
156 A 236 THR T T T 3 TS+ 0 0 -78.1 -6.5 178.7 92.6 95.6 57.8 0 0.0 0 0.0 0 0.0 0 0.0 6 34
157 A 237 SER S S t < TS- 0 0 -85.4 156.3 177.2 -134.4 77.6 122.5 154 -1.5 0 0.0 0 0.0 0 0.0 10 40
158 A 238 SER S S S S+ 0 0 -76.5 -18.5 -179.6 100.8 84.7 45.0 0 0.0 160 -0.6 0 0.0 0 0.0 10 31
159 A 239 GLN Q + 0 0 -71.7 113.5 -177.4 173.9 47.1 123.5 0 0.0 0 0.0 0 0.0 0 0.0 12 37
160 A 240 ASN N + 0 0 -100.7 -8.0 177.1 99.6 45.9 59.7 158 -0.6 0 0.0 0 0.0 0 0.0 8 31
161 A 241 ASN N - 0 0 -76.4 139.2 179.5 -137.8 69.5 128.4 0 0.0 0 0.0 0 0.0 0 0.0 8 35
162 A 242 PRO P e - 0 0 -90.3 175.9 177.2 -122.9 8.1 112.7 0 0.0 190 -1.6 0 0.0 0 0.0 12 41
163 A 243 LYS K E E CFH - 152 189 -118.2 126.6 -179.4 -170.5 27.8 170.4 152 -1.8 152 -2.5 0 0.0 0 0.0 12 50
164 A 244 GLU E E E CFH - 151 188 -121.4 134.3 177.8 -175.5 6.7 164.7 188 -3.6 188 -2.5 0 0.0 0 0.0 11 48
165 A 245 THR T E E CFH + 150 187 -128.7 129.7 179.3 177.3 9.6 175.3 150 -2.4 150 -2.1 0 0.0 0 0.0 12 54
166 A 246 HIS H E E CFH - 149 186 -130.0 159.6 177.5 -164.3 9.6 154.6 186 -2.5 186 -2.6 0 0.0 0 0.0 12 50
167 A 247 ASN N E E CFH - 148 185 -144.2 149.5 -179.4 -166.3 1.5 174.0 148 -2.4 148 -2.1 0 0.0 0 0.0 13 53
168 A 248 LEU L E E CFH - 147 184 -136.9 137.7 176.8 -177.5 4.1 178.3 184 -3.4 184 -2.6 0 0.0 0 0.0 13 50
169 A 249 MET M E E CFH + 146 183 -135.1 121.3 177.1 164.1 10.7 170.9 146 -2.8 146 -2.8 0 0.0 0 0.0 13 49
170 A 250 VAL V E E CFH + 145 182 -140.5 120.0 179.9 104.5 25.4 159.8 182 -2.0 182 -2.9 0 0.0 0 0.0 11 41
171 A 251 GLY G E E CFH + 144 181 -173.1 -178.4 -179.4 173.0 25.5 170.2 144 -2.4 144 -3.4 0 0.0 0 0.0 14 40
172 A 252 GLY G E E C H - 0 180 176.3 -178.8 -179.8 -101.6 33.3 164.4 180 -2.0 180 -2.3 0 0.0 0 0.0 13 33
173 A 253 THR T E E C H - 0 179 -133.7 126.0 179.6 -131.7 28.4 172.0 0 0.0 0 0.0 0 0.0 0 0.0 14 34
174 A 254 ALA A e > T - 0 0 -69.2 160.2 179.6 -105.3 31.8 106.7 178 -3.2 177 -2.1 0 0.0 0 0.0 8 23
175 A 255 ASP D T T 3 TS+ 0 0 -57.7 -24.9 179.8 70.5 117.3 39.4 0 0.0 0 0.0 0 0.0 0 0.0 5 20
176 A 256 ASN N T T 3 TS- 0 0 -74.9 4.3 179.0 -104.5 120.6 64.3 0 0.0 0 0.0 0 0.0 0 0.0 6 21
177 A 257 GLY G S e < TS+ 0 0 90.2 -2.8 178.6 127.8 82.0 65.2 174 -2.1 210 -1.8 0 0.0 179 -0.6 11 29
178 A 258 PHE F E E C I + 0 209 -92.4 123.7 179.5 173.2 32.5 143.3 0 0.0 174 -3.2 0 0.0 0 0.0 12 33
179 A 259 GLY G E E CHI + 173 208 -130.1 151.5 178.4 169.2 8.1 159.7 208 -3.4 208 -3.2 177 -0.6 0 0.0 13 38
180 A 260 THR T E E CHI - 172 207 -157.5 150.7 177.9 -164.2 11.3 168.4 172 -2.3 172 -2.0 0 0.0 0 0.0 12 45
181 A 261 ALA A E E CHI - 171 206 -138.9 142.9 176.2 -138.9 16.7 172.3 206 -2.6 206 -2.9 0 0.0 183 -0.5 14 46
182 A 262 LEU L E E CHI - 170 205 -99.9 127.2 179.1 -167.3 21.7 154.1 170 -2.9 170 -2.0 0 0.0 184 -0.5 12 48
183 A 263 LEU L E E CHI + 169 204 -121.1 114.3 178.6 173.4 10.8 165.5 204 -3.0 204 -2.6 181 -0.5 0 0.0 15 58
184 A 264 TYR Y E E CHI + 168 203 -124.6 135.1 177.3 173.1 6.6 166.7 168 -2.6 168 -3.4 182 -0.5 0 0.0 13 49
185 A 265 SER S E E CHI - 167 202 -136.4 139.0 179.3 -179.5 8.8 174.9 202 -1.7 202 -2.6 0 0.0 0 0.0 16 56
186 A 266 GLY G E E CHI - 166 201 -141.8 154.4 177.7 -160.3 14.9 168.4 166 -2.6 166 -2.5 0 0.0 0 0.0 12 51
187 A 267 THR T E E CHI + 165 200 -130.9 139.9 176.6 173.7 12.3 172.0 200 -2.1 200 -2.4 0 0.0 0 0.0 12 54
188 A 268 ARG R E E CHI + 164 199 -143.1 137.6 177.4 34.4 40.5 172.5 164 -2.5 164 -3.6 0 0.0 0 0.0 11 43
189 A 269 GLY G E E CHI S- 163 198 125.9 -174.3 -178.5 -66.8 72.0 132.6 198 -1.7 198 -2.2 0 0.0 0 0.0 12 42
190 A 270 SER S e - 0 0 -124.0 160.3 178.4 -140.1 30.3 147.6 162 -1.6 0 0.0 0 0.0 0 0.0 14 53
191 A 271 ASP D - 0 0 -97.9 -146.4 -178.0 -63.7 56.0 85.1 0 0.0 0 0.0 0 0.0 0 0.0 13 60
192 A 272 TRP W S S S+ 0 0 -82.7 -5.2 179.7 79.5 113.1 57.2 0 0.0 0 0.0 0 0.0 0 0.0 12 60
193 A 273 ARG R S S S- 0 0 -102.3 148.8 175.8 -116.4 84.1 140.0 0 0.0 0 0.0 0 0.0 0 0.0 15 62
194 A 274 GLU E S S S+ 0 0 -71.9 161.2 178.5 34.4 98.6 113.3 244 -3.2 0 0.0 0 0.0 0 0.0 13 51
195 A 275 HIS H S S S+ 0 0 57.5 50.9 179.1 112.7 82.7 23.6 0 0.0 0 0.0 0 0.0 0 0.0 11 51
196 A 276 SER S + 0 0 -131.4 9.9 179.7 153.1 33.5 77.1 0 0.0 0 0.0 0 0.0 0 0.0 13 62
197 A 277 ALA A e - 0 0 -47.7 123.3 -175.3 -174.7 26.2 102.0 0 0.0 229 -2.2 0 0.0 0 0.0 11 47
198 A 278 THR T E E CIJ - 189 228 -132.8 149.7 174.4 -175.2 27.9 155.9 189 -2.2 189 -1.7 0 0.0 0 0.0 13 53
199 A 279 ARG R E E CIJ + 188 227 -140.5 126.1 175.3 171.6 11.7 168.7 227 -2.6 227 -2.3 0 0.0 0 0.0 11 47
200 A 280 ILE I E E CIJ - 187 226 -135.9 131.3 176.2 -177.8 7.6 173.5 187 -2.4 187 -2.1 0 0.0 0 0.0 13 56
201 A 281 ASP D E E CIJ - 186 225 -125.6 122.4 -179.2 -179.6 2.8 175.8 225 -2.3 225 -2.8 0 0.0 0 0.0 11 50
202 A 282 ASP D E E CIJ + 185 224 -127.7 97.4 -178.0 177.9 6.6 148.7 185 -2.6 185 -1.7 0 0.0 0 0.0 15 56
203 A 283 LEU L E E CIJ + 184 223 -105.1 128.3 -179.6 175.9 3.5 149.5 223 -2.8 223 -3.4 0 0.0 0 0.0 11 46
204 A 284 MET M E E CIJ - 183 222 -132.2 150.0 178.4 -157.5 21.5 167.0 183 -2.6 183 -3.0 0 0.0 206 -0.5 11 54
205 A 285 LEU L E E CIJ - 182 221 -128.7 111.2 -178.5 -169.8 16.2 166.1 221 -2.4 221 -2.2 0 0.0 0 0.0 11 49
206 A 286 LYS K E E CIJ - 181 220 -106.8 129.1 -178.4 -177.7 8.2 153.3 181 -2.9 181 -2.6 204 -0.5 0 0.0 13 58
207 A 287 SER S E E CIJ - 180 219 -130.0 154.3 179.5 -173.6 12.6 158.5 219 -2.3 219 -2.4 0 0.0 0 0.0 12 46
208 A 288 LYS K E E CIJ - 179 218 -146.5 135.6 179.6 -169.2 3.4 174.2 179 -3.2 179 -3.4 0 0.0 0 0.0 13 47
209 A 289 TYR Y E E CIJ + 178 217 -132.1 110.7 179.6 164.3 14.0 160.3 217 -3.2 217 -3.2 0 0.0 0 0.0 10 38
210 A 290 ALA A e + 0 0 -123.6 75.0 -179.6 173.2 2.8 133.5 177 -1.8 0 0.0 0 0.0 0 0.0 11 32
211 A 291 PRO P S S S- 0 0 -55.5 -21.5 179.2 -7.6 76.0 43.2 0 0.0 0 0.0 0 0.0 0 0.0 9 24
212 A 292 ASP D S S S- 0 0 -156.4 -171.4 -179.1 -83.7 87.8 148.6 215 -0.8 0 0.0 0 0.0 0 0.0 7 23
213 A 293 GLU E S S S+ 0 0 -88.1 4.9 -178.0 52.0 119.0 65.9 0 0.0 0 0.0 0 0.0 0 0.0 7 25
214 A 294 VAL V S e S+ 0 0 -105.9 -42.6 -178.5 48.1 103.9 33.9 0 0.0 267 -2.4 0 0.0 0 0.0 10 24
215 A 295 HIS H E E C K + 0 266 -106.8 136.2 179.9 177.2 59.0 147.9 0 0.0 212 -0.8 0 0.0 0 0.0 11 29
216 A 296 THR T E E C K - 0 265 -141.8 126.5 178.7 -168.0 7.4 170.4 265 -1.9 265 -2.8 0 0.0 0 0.0 13 35
217 A 297 PHE F E E CJK - 209 264 -112.1 146.1 178.6 -176.3 8.1 152.0 209 -3.2 209 -3.2 0 0.0 0 0.0 11 38
218 A 298 ASN N E E CJK - 208 263 -139.5 153.8 178.0 -179.1 3.1 165.4 263 -2.2 263 -2.6 0 0.0 0 0.0 11 50
219 A 299 SER S E E CJK - 207 262 -150.8 155.4 178.3 -166.5 11.0 173.0 207 -2.4 207 -2.3 0 0.0 0 0.0 11 50
220 A 300 LEU L E E CJK - 206 261 -145.7 123.4 178.2 -177.8 7.4 164.6 261 -1.9 261 -1.7 0 0.0 0 0.0 12 54
221 A 301 LEU L E E CJK - 205 260 -118.7 144.5 179.5 -177.7 10.8 159.8 205 -2.2 205 -2.4 0 0.0 0 0.0 11 49
222 A 302 GLN Q E E CJK - 204 259 -150.2 138.2 175.1 -171.2 22.9 170.1 259 -2.0 259 -2.1 0 0.0 0 0.0 12 54
223 A 303 TYR Y E E CJK + 203 258 -126.0 111.4 178.6 179.8 17.6 166.4 203 -3.4 203 -2.8 0 0.0 0 0.0 11 45
224 A 304 TYR Y E E CJK + 202 257 -113.1 130.1 -179.6 169.6 5.0 162.8 257 -2.5 257 -2.6 0 0.0 0 0.0 13 54
225 A 305 ASP D E E CJK + 201 256 -146.1 124.0 178.6 150.3 6.8 162.7 201 -2.8 201 -2.3 0 0.0 0 0.0 11 45
226 A 306 GLY G E E CJK - 200 255 -150.3 168.5 177.7 -167.7 21.7 165.4 255 -2.8 255 -2.4 0 0.0 0 0.0 12 50
227 A 307 GLU E E E CJK + 199 254 -152.1 149.5 -179.4 178.3 12.7 170.2 199 -2.3 199 -2.6 0 0.0 0 0.0 12 51
228 A 308 ALA A E E CJK - 198 253 -160.5 135.5 173.9 -129.3 28.7 161.6 253 -3.2 253 -3.0 0 0.0 0 0.0 14 57
229 A 309 ASP D E E C K - 0 252 -74.6 153.5 -178.4 -133.0 34.3 122.6 197 -2.2 0 0.0 0 0.0 0 0.0 12 55
230 A 310 MET M e - 0 0 -116.6 115.3 -179.9 -158.3 10.6 161.8 251 -2.5 0 0.0 0 0.0 0 0.0 12 64
231 A 311 PRO P - 0 0 -56.0 -51.3 -179.2 -174.1 31.0 23.3 0 0.0 0 0.0 0 0.0 0 0.0 16 65
232 A 312 GLY G - 0 0 77.6 178.7 -177.8 -46.9 29.2 95.2 0 0.0 0 0.0 0 0.0 0 0.0 15 64
233 A 313 GLY G - 0 0 -90.5 160.1 178.6 -140.7 44.1 115.6 642 -2.2 0 0.0 0 0.0 0 0.0 18 66
234 A 314 LEU L B B B - 645 0 -115.5 150.6 176.0 -118.4 19.4 151.4 645 -1.9 645 -3.0 0 0.0 0 0.0 16 53
235 A 315 SER S h > T - 0 0 -73.1 168.4 179.1 -104.4 39.6 109.6 0 0.0 239 -2.5 0 0.0 0 0.0 12 42
236 A 316 ARG R H H > TS+ 0 0 -64.3 -40.2 179.8 53.0 122.3 20.1 591 -2.5 240 -2.6 0 0.0 0 0.0 12 38
237 A 317 ALA A H H > TS+ 0 0 -58.7 -49.4 -179.2 42.1 113.5 17.5 591 -0.6 241 -1.8 0 0.0 0 0.0 8 25
238 A 318 ASP D H H > TS+ 0 0 -65.1 -39.2 178.7 53.6 112.9 29.2 0 0.0 242 -2.6 0 0.0 0 0.0 9 33
239 A 319 TYR Y H H < TS+ 0 0 -62.9 -42.6 179.0 48.9 108.9 25.0 235 -2.5 0 0.0 0 0.0 0 0.0 12 41
240 A 320 ASP D H H < TS+ 0 0 -66.5 -34.6 179.4 47.9 113.0 28.9 236 -2.6 0 0.0 0 0.0 0 0.0 7 28
241 A 321 ALA A H H < TS- 0 0 -71.4 -40.9 -178.9 -15.9 140.9 22.1 237 -1.8 0 0.0 0 0.0 0 0.0 6 24
242 A 322 ASP D h < T - 0 0 -165.1 106.4 -177.9 -169.3 56.5 138.0 238 -2.6 0 0.0 0 0.0 0 0.0 7 35
243 A 323 ARG R S S S+ 0 0 -81.4 -6.3 179.7 60.6 84.8 53.6 0 0.0 647 -0.5 0 0.0 0 0.0 11 47
244 A 324 TRP W S S S+ 0 0 -86.3 -28.8 -176.1 95.6 86.4 41.5 0 0.0 194 -3.2 0 0.0 0 0.0 12 54
245 A 325 GLN Q - 0 0 -62.1 167.0 177.0 -136.2 66.4 89.1 0 0.0 0 0.0 0 0.0 0 0.0 11 47
246 A 326 SER S - 0 0 -124.7 136.7 176.5 -173.3 15.7 169.5 0 0.0 0 0.0 0 0.0 0 0.0 12 52
247 A 327 THR T S S S+ 0 0 -113.6 24.2 -179.5 80.2 75.4 87.4 0 0.0 0 0.0 0 0.0 0 0.0 8 46
248 A 328 ARG R t > T + 0 0 -127.9 63.9 -178.0 161.9 51.5 120.8 0 0.0 251 -1.0 0 0.0 0 0.0 11 53
249 A 329 PRO P T T 3 TS+ 0 0 -61.1 -18.3 -179.3 49.1 71.8 51.3 0 0.0 0 0.0 0 0.0 0 0.0 7 41
250 A 330 TYR Y T T 3 TS+ 0 0 -96.2 -18.1 -175.1 111.2 81.5 47.6 0 0.0 0 0.0 0 0.0 0 0.0 8 50
251 A 331 ASP D e < T + 0 0 -66.9 118.8 -178.4 147.6 37.7 112.7 248 -1.0 230 -2.5 0 0.0 0 0.0 13 59
252 A 332 ARG R E E CKL - 229 288 -148.6 150.5 -179.0 -160.0 25.6 172.9 288 -1.9 288 -1.2 0 0.0 0 0.0 11 56
253 A 333 PHE F E E CKL + 228 287 -134.8 150.0 175.8 166.5 13.0 165.2 228 -3.0 228 -3.2 0 0.0 0 0.0 14 61
254 A 334 TRP W E E CKL + 227 286 -155.6 163.0 179.9 155.8 2.2 171.9 286 -2.8 286 -3.0 0 0.0 0 0.0 13 51
255 A 335 GLY G E E CKL - 226 285 -178.6 165.0 179.8 -149.7 19.3 165.1 226 -2.4 226 -2.8 0 0.0 0 0.0 13 54
256 A 336 ARG R E E CKL - 225 284 -148.3 150.7 -179.7 -161.6 6.9 171.7 284 -2.4 284 -2.6 0 0.0 0 0.0 12 51
257 A 337 ARG R E E CKL - 224 283 -137.2 137.9 174.9 -165.5 4.6 177.6 224 -2.6 224 -2.5 0 0.0 0 0.0 13 54
258 A 338 LYS K E E CKL - 223 282 -120.1 129.4 -180.0 -177.5 19.2 171.9 282 -2.6 282 -2.4 0 0.0 0 0.0 11 44
259 A 339 LEU L E E CKL - 222 281 -133.0 140.9 178.0 -177.8 13.7 172.0 222 -2.1 222 -2.0 0 0.0 0 0.0 12 54
260 A 340 ALA A E E CKL + 221 280 -135.5 132.2 178.9 176.0 8.0 178.1 280 -2.7 280 -2.6 0 0.0 0 0.0 11 43
261 A 341 SER S E E CKL - 220 279 -138.9 138.7 179.7 -178.9 4.5 177.5 220 -1.7 220 -1.9 0 0.0 0 0.0 11 46
262 A 342 LEU L E E CKL + 219 278 -140.2 131.7 -179.7 175.6 8.3 176.4 278 -2.4 278 -3.2 0 0.0 0 0.0 11 41
263 A 343 GLY G E E CKL - 218 277 -136.8 162.0 -179.7 -159.3 13.6 159.3 218 -2.6 218 -2.2 0 0.0 0 0.0 11 43
264 A 344 TYR Y E E CKL - 217 276 -142.9 138.2 177.4 -163.1 3.0 178.8 276 -2.9 276 -2.6 0 0.0 0 0.0 11 40
265 A 345 GLN Q E E CKL - 216 275 -127.3 131.5 178.2 -168.3 1.8 171.3 216 -2.8 216 -1.9 0 0.0 267 -0.5 12 43
266 A 346 PHE F E E CKL + 215 274 -117.7 112.5 178.8 168.5 12.8 165.4 274 -2.5 274 -3.1 0 0.0 0 0.0 10 35
267 A 347 GLN Q e + 0 0 -127.6 98.3 -179.7 175.0 8.5 150.7 214 -2.4 0 0.0 265 -0.5 0 0.0 11 34
268 A 348 PRO P S S S- 0 0 -66.9 -44.3 179.4 -11.5 73.5 24.0 0 0.0 0 0.0 0 0.0 0 0.0 7 27
269 A 349 ASP D S t > TS- 0 0 -143.7 -174.9 -178.0 -81.6 84.7 142.7 0 0.0 272 -1.0 0 0.0 0 0.0 7 26
270 A 350 SER S T T 3 TS+ 0 0 -77.6 2.3 179.7 54.3 121.6 65.1 0 0.0 4 -3.5 0 0.0 0 0.0 9 30
271 A 351 GLN Q T e 3 TS+ 0 0 -113.1 -3.7 -179.9 53.1 104.0 66.9 0 0.0 314 -2.0 0 0.0 0 0.0 11 33
272 A 352 HIS H E E C M< T + 0 313 -137.3 135.0 179.4 172.0 54.0 173.7 269 -1.0 0 0.0 0 0.0 0 0.0 12 38
273 A 353 LYS K E E C M - 0 312 -146.8 119.5 177.7 -168.9 9.2 161.3 312 -2.8 312 -2.5 0 0.0 0 0.0 15 40
274 A 354 PHE F E E CLM - 266 311 -106.2 136.7 179.6 -177.2 11.2 155.7 266 -3.1 266 -2.5 0 0.0 0 0.0 11 40
275 A 355 ASN N E E CLM + 265 310 -137.5 131.0 175.0 178.4 10.6 174.8 310 -2.9 310 -3.6 0 0.0 0 0.0 11 50
276 A 356 ILE I E E CLM - 264 309 -131.7 132.1 -179.0 -175.9 7.1 179.0 264 -2.6 264 -2.9 0 0.0 0 0.0 11 41
277 A 357 GLN Q E E CLM - 263 308 -128.4 135.2 178.6 -171.8 2.0 171.2 308 -1.5 308 -3.0 0 0.0 0 0.0 11 48
278 A 358 GLY G E E CLM + 262 307 -124.4 148.5 178.9 176.0 10.1 159.7 262 -3.2 262 -2.4 0 0.0 0 0.0 11 40
279 A 359 PHE F E E CLM - 261 306 -154.0 159.2 178.2 -170.4 18.1 176.7 306 -2.7 306 -2.5 0 0.0 0 0.0 13 47
280 A 360 TYR Y E E CLM - 260 305 -148.1 131.7 176.4 -177.8 8.9 167.7 260 -2.6 260 -2.7 0 0.0 0 0.0 11 48
281 A 361 THR T E E CLM - 259 304 -131.8 146.3 177.8 -167.2 7.9 169.6 304 -2.4 304 -2.5 0 0.0 0 0.0 13 54
282 A 362 GLN Q E E CLM - 258 303 -130.2 132.1 -177.7 -175.7 16.3 174.5 258 -2.4 258 -2.6 0 0.0 0 0.0 12 45
283 A 363 THR T E E CLM - 257 302 -138.6 138.5 175.1 -171.0 19.1 174.3 302 -2.6 302 -2.6 0 0.0 0 0.0 12 54
284 A 364 LEU L E E CLM + 256 301 -123.0 127.2 176.2 173.2 14.2 174.5 256 -2.6 256 -2.4 0 0.0 0 0.0 11 50
285 A 365 ARG R E E CLM + 255 300 -136.9 129.7 -176.1 142.2 15.4 171.2 300 -2.5 300 -2.3 0 0.0 0 0.0 14 58
286 A 366 SER S E E CL + 254 0 -152.5 180.0 177.8 155.9 12.2 152.9 254 -3.0 254 -2.8 0 0.0 0 0.0 11 56
287 A 367 GLY G E E CL - 253 0 164.0 167.7 178.0 -86.8 39.5 155.0 0 0.0 298 -2.0 0 0.0 0 0.0 12 57
288 A 368 TYR Y E E CLN + 252 297 -96.4 146.3 179.9 178.5 39.5 139.3 252 -1.2 252 -1.9 0 0.0 0 0.0 14 57
289 A 369 LEU L E E C N - 0 296 -152.3 128.6 177.6 -129.8 28.4 164.3 296 -1.9 296 -3.3 0 0.0 0 0.0 11 56
290 A 370 GLU E E E C N + 0 295 -77.5 126.1 179.3 177.8 30.4 132.0 0 0.0 0 0.0 0 0.0 0 0.0 14 49
291 A 371 GLN Q E E C N> T - 0 294 -134.9 101.3 -179.7 -61.7 55.1 152.4 294 -3.7 294 -2.0 0 0.0 0 0.0 8 39
292 A 372 GLY G T T 3 TS- 0 0 65.3 -123.1 179.9 -11.9 120.3 114.8 0 0.0 0 0.0 0 0.0 0 0.0 5 25
293 A 373 LYS K T e 3 TS+ 0 0 -94.9 14.4 -179.9 70.7 130.7 77.8 0 0.0 344 -2.9 0 0.0 345 -0.6 8 26
294 A 374 ARG R E E CNO< T - 291 343 -129.6 161.1 174.8 -144.4 66.6 149.4 291 -2.0 291 -3.7 0 0.0 0 0.0 11 34
295 A 375 ILE I E E CNO - 290 342 -121.0 129.5 -179.5 -157.0 28.9 172.8 342 -1.9 342 -1.7 0 0.0 0 0.0 16 45
296 A 376 THR T E E CNO - 289 341 -110.1 161.8 177.4 -151.4 15.4 135.7 289 -3.3 289 -1.9 0 0.0 0 0.0 15 49
297 A 377 LEU L E E CNO - 288 340 -128.6 122.6 -176.0 -169.5 15.7 176.3 340 -2.3 340 -2.7 0 0.0 0 0.0 14 49
298 A 378 SER S e - 0 0 -123.5 75.8 179.7 -178.9 6.0 126.9 287 -2.0 0 0.0 0 0.0 0 0.0 12 50
299 A 379 PRO P e - 0 0 -74.0 128.0 178.9 -179.3 7.1 122.7 0 0.0 338 -2.1 0 0.0 0 0.0 11 47
300 A 380 ARG R E E CMP - 285 337 -131.2 129.0 -178.1 -164.7 6.4 176.8 285 -2.3 285 -2.5 0 0.0 0 0.0 11 55
301 A 381 ASN N E E CMP - 284 336 -116.5 145.0 -178.6 -172.5 6.3 152.5 336 -2.6 336 -1.6 0 0.0 0 0.0 11 50
302 A 382 TYR Y E E CMP - 283 335 -142.3 147.9 177.8 -170.0 14.7 175.0 283 -2.6 283 -2.6 0 0.0 0 0.0 14 54
303 A 383 TRP W E E CMP + 282 334 -134.8 126.8 178.5 179.2 11.6 177.9 334 -2.1 334 -2.4 0 0.0 0 0.0 13 48
304 A 384 VAL V E E CMP + 281 333 -129.5 134.2 177.2 177.1 1.1 174.6 281 -2.5 281 -2.4 0 0.0 0 0.0 14 51
305 A 385 ARG R E E CMP + 280 332 -137.0 140.4 179.5 172.7 7.6 174.5 332 -2.6 332 -3.0 0 0.0 0 0.0 11 47
306 A 386 GLY G E E CMP - 279 331 -148.7 154.1 177.7 -166.0 19.3 176.4 279 -2.5 279 -2.7 0 0.0 0 0.0 11 50
307 A 387 ILE I E E CMP - 278 330 -140.3 130.0 -177.1 -179.0 11.5 174.3 330 -2.3 330 -2.5 0 0.0 0 0.0 11 40
308 A 388 GLU E E E CM - 277 0 -138.8 100.4 178.8 -171.9 7.1 145.5 277 -3.0 277 -1.5 0 0.0 0 0.0 11 47
309 A 389 PRO P E E CM - 276 0 -88.2 142.5 179.2 -178.6 13.8 135.8 0 0.0 328 -2.2 0 0.0 0 0.0 11 42
310 A 390 ARG R E E CMQ - 275 327 -137.3 151.6 179.7 -164.4 9.0 165.5 275 -3.6 275 -2.9 0 0.0 0 0.0 11 48
311 A 391 TYR Y E E CMQ - 274 326 -143.7 133.7 178.9 -178.5 5.6 173.7 326 -2.8 326 -2.5 0 0.0 0 0.0 12 44
312 A 392 SER S E E CMQ + 273 325 -132.5 139.7 178.3 168.9 5.5 173.2 273 -2.5 273 -2.8 0 0.0 0 0.0 14 46
313 A 393 GLN Q E E CMQ - 272 324 -149.0 141.4 179.7 -151.9 17.3 173.1 324 -1.8 324 -2.5 0 0.0 0 0.0 12 41
314 A 394 ILE I E E C Q + 0 323 -118.6 136.4 179.1 157.1 23.9 162.6 271 -2.0 0 0.0 0 0.0 0 0.0 13 41
315 A 395 PHE F E E C Q - 0 322 -147.3 166.9 178.9 -108.0 37.1 158.5 322 -2.2 322 -3.0 0 0.0 0 0.0 9 31
316 A 396 MET M E E C Q - 0 321 -102.3 142.2 175.4 -174.1 18.8 144.6 0 0.0 0 0.0 0 0.0 0 0.0 8 26
317 A 397 ILE I E E C Q> TS- 0 320 -131.7 89.8 -178.7 -54.5 72.6 148.0 320 -2.4 320 -1.2 0 0.0 0 0.0 7 19
318 A 398 GLY G T T 3 TS- 0 0 75.3 -135.1 -179.9 -19.1 118.6 124.6 0 0.0 0 0.0 0 0.0 0 0.0 5 14
319 A 399 PRO P T T 3 TS+ 0 0 -80.2 -16.9 -177.7 84.5 121.8 48.7 0 0.0 0 0.0 0 0.0 0 0.0 6 20
320 A 400 SER S E E CQ < TS- 317 0 -94.7 140.1 179.4 -138.8 70.1 133.1 317 -1.2 317 -2.4 0 0.0 0 0.0 10 26
321 A 401 ALA A E E CQR - 316 376 -96.2 135.5 -179.2 -160.9 16.2 142.7 376 -2.3 376 -2.8 0 0.0 0 0.0 14 35
322 A 402 HIS H E E CQR - 315 375 -120.5 119.5 176.0 -169.4 8.6 167.9 315 -3.0 315 -2.2 0 0.0 324 -0.7 12 40
323 A 403 GLU E E E CQR - 314 374 -107.7 105.9 -179.5 -161.5 15.2 157.5 374 -2.0 374 -2.7 0 0.0 0 0.0 12 45
324 A 404 VAL V E E CQR - 313 373 -91.5 129.5 178.6 -171.1 6.8 139.6 313 -2.5 313 -1.8 322 -0.7 0 0.0 11 47
325 A 405 GLY G E E CQR + 312 372 -120.5 133.7 178.0 176.8 6.2 165.8 372 -3.4 372 -2.7 0 0.0 0 0.0 13 51
326 A 406 VAL V E E CQR + 311 371 -132.0 147.4 -179.8 171.2 8.0 166.9 311 -2.5 311 -2.8 0 0.0 0 0.0 11 45
327 A 407 GLY G E E CQR - 310 370 -156.2 159.0 179.9 -166.5 16.5 174.6 370 -2.3 370 -2.4 0 0.0 0 0.0 12 47
328 A 408 TYR Y E E C R - 0 369 -147.2 140.1 176.3 -169.8 4.0 175.8 309 -2.2 0 0.0 0 0.0 0 0.0 11 43
329 A 409 ARG R E E C R - 0 368 -138.5 128.6 175.7 -168.1 7.0 169.3 368 -2.6 368 -2.6 0 0.0 331 -0.5 12 47
330 A 410 TYR Y E E CPR + 307 367 -107.2 125.0 178.9 178.5 19.5 164.5 307 -2.5 307 -2.3 0 0.0 0 0.0 11 44
331 A 411 LEU L E E CPR - 306 366 -133.8 135.5 179.5 -173.1 11.4 175.5 366 -2.1 366 -3.2 329 -0.5 0 0.0 12 53
332 A 412 ASN N E E CPR - 305 365 -128.3 128.1 178.1 -178.7 5.2 173.9 305 -3.0 305 -2.6 0 0.0 0 0.0 11 47
333 A 413 GLU E E E CPR - 304 364 -127.0 148.2 -179.0 -174.2 2.9 163.1 364 -2.7 364 -2.2 0 0.0 0 0.0 13 52
334 A 414 SER S E E CPR - 303 363 -138.3 146.8 -179.3 -171.7 7.5 170.1 303 -2.4 303 -2.1 0 0.0 0 0.0 12 47
335 A 415 THR T E E CP - 302 0 -138.9 166.5 175.8 -166.7 17.9 153.9 362 -2.8 0 0.0 0 0.0 0 0.0 12 51
336 A 416 HIS H E E CP - 301 0 -153.5 116.4 -180.0 -176.7 14.7 151.9 301 -1.6 301 -2.6 0 0.0 0 0.0 11 43
337 A 417 GLU E E E CPS + 300 360 -120.4 134.5 176.0 172.0 5.0 165.0 360 -3.2 360 -2.3 0 0.0 0 0.0 12 47
338 A 418 MET M E E C S - 0 359 -136.1 155.7 178.0 -157.6 15.9 166.5 299 -2.1 0 0.0 0 0.0 0 0.0 12 42
339 A 419 ARG R E E C S - 0 358 -139.5 114.1 178.1 -174.4 8.8 157.9 358 -1.7 357 -2.1 0 0.0 358 -0.7 12 41
340 A 420 TYR Y E E COS - 297 356 -97.4 158.9 -179.6 -172.4 12.7 130.9 297 -2.7 297 -2.3 0 0.0 0 0.0 15 36
341 A 421 TYR Y E E CO - 296 0 -153.2 160.3 176.4 -171.4 19.0 169.2 355 -2.1 0 0.0 0 0.0 0 0.0 15 38
342 A 422 THR T E E CO - 295 0 -141.9 162.5 176.7 -94.0 42.7 157.7 295 -1.7 295 -1.9 0 0.0 0 0.0 13 34
343 A 423 ALA A E E CO > T - 294 0 -79.8 135.5 179.2 -139.5 27.1 131.4 0 0.0 346 -1.5 0 0.0 0 0.0 8 28
344 A 424 THR T T e 3 TS+ 0 0 -61.2 -37.0 -179.2 71.8 99.9 27.1 293 -2.9 0 0.0 0 0.0 0 0.0 9 28
345 A 425 SER S T T 3 TS+ 0 0 -53.1 -18.5 178.2 68.4 92.9 48.4 293 -0.6 0 0.0 0 0.0 0 0.0 6 18
346 A 426 SER S S t < TS- 0 0 -90.5 178.3 175.5 -120.0 90.9 110.7 343 -1.5 0 0.0 0 0.0 0 0.0 6 20
347 A 427 GLY G S S S+ 0 0 -90.4 -141.3 177.1 76.1 75.9 84.2 0 0.0 0 0.0 0 0.0 0 0.0 5 19
348 A 428 GLN Q S S S- 0 0 43.9 129.2 177.4 -116.7 74.8 35.1 0 0.0 0 0.0 0 0.0 0 0.0 5 26
349 A 429 LEU L - 0 0 -82.3 158.8 179.6 -89.7 46.6 116.5 0 0.0 0 0.0 0 0.0 0 0.0 10 36
350 A 430 PRO P + 0 0 -68.9 159.6 177.4 175.6 54.7 111.6 0 0.0 0 0.0 0 0.0 0 0.0 13 37
351 A 431 SER S t > T - 0 0 -146.6 -173.3 179.1 -72.9 51.2 147.3 0 0.0 354 -2.2 0 0.0 0 0.0 8 33
352 A 432 GLY G T T 3 TS+ 0 0 -62.1 -13.6 -179.9 56.7 129.6 48.4 0 0.0 0 0.0 0 0.0 0 0.0 5 26
353 A 433 SER S T T 3 TS+ 0 0 -97.8 0.5 -179.7 95.9 88.3 64.0 0 0.0 0 0.0 0 0.0 0 0.0 5 20
354 A 434 SER S S t < TS- 0 0 -85.9 162.5 178.9 -94.3 86.5 115.3 351 -2.2 0 0.0 0 0.0 0 0.0 9 27
355 A 435 PRO P e - 0 0 -70.9 160.7 179.0 -145.0 42.3 111.5 0 0.0 341 -2.1 0 0.0 0 0.0 7 26
356 A 436 TYR Y E E CS - 340 0 -132.6 144.7 -178.8 -169.8 22.8 167.6 0 0.0 0 0.0 0 0.0 0 0.0 9 33
357 A 437 ASP D E E C* S+ 0 0 -114.1 11.4 175.8 54.6 74.2 77.7 339 -2.1 0 0.0 0 0.0 0 0.0 9 32
358 A 438 ARG R E E CS + 339 0 -147.3 133.3 177.9 154.1 44.1 166.2 339 -0.7 339 -1.7 0 0.0 0 0.0 9 36
359 A 439 ASP D E E CS + 338 0 -157.8 93.6 -179.6 150.5 22.7 131.5 0 0.0 398 -2.5 0 0.0 399 -0.6 12 37
360 A 440 THR T E E CST - 337 397 -128.0 156.3 178.4 -162.3 26.1 154.7 337 -2.3 337 -3.2 0 0.0 0 0.0 12 41
361 A 441 ARG R E E C T + 0 396 -139.6 130.9 -178.6 175.4 16.4 175.6 396 -2.4 396 -3.9 0 0.0 0 0.0 12 47
362 A 442 SER S E E C T + 0 395 -129.7 172.4 178.9 173.7 1.8 143.2 0 0.0 335 -2.8 0 0.0 0 0.0 13 51
363 A 443 GLY G E E CRT - 334 394 -174.4 162.7 -179.6 -150.1 15.2 165.8 394 -1.8 394 -2.3 0 0.0 0 0.0 12 52
364 A 444 THR T E E CRT - 333 393 -145.3 148.0 176.9 -160.5 4.7 172.4 333 -2.2 333 -2.7 0 0.0 0 0.0 14 55
365 A 445 GLU E E E CRT - 332 392 -126.0 118.4 -178.4 -171.9 24.3 177.0 392 -2.3 392 -2.3 0 0.0 0 0.0 11 47
366 A 446 ALA A E E CRT - 331 391 -125.7 130.4 178.1 -168.3 17.4 163.7 331 -3.2 331 -2.1 0 0.0 368 -0.6 12 54
367 A 447 HIS H E E CRT - 330 390 -113.5 118.2 179.6 -178.2 13.9 162.5 390 -2.8 390 -3.0 0 0.0 0 0.0 11 45
368 A 448 ALA A E E CRT - 329 389 -118.9 129.9 179.6 -178.4 3.3 164.6 329 -2.6 329 -2.6 366 -0.6 0 0.0 11 54
369 A 449 TRP W E E CRT - 328 388 -122.6 148.8 177.7 -178.0 5.0 157.6 388 -2.9 388 -2.5 0 0.0 0 0.0 11 43
370 A 450 TYR Y E E CRT - 327 387 -150.7 148.1 -179.5 -179.1 10.3 176.1 327 -2.4 327 -2.3 0 0.0 0 0.0 14 50
371 A 451 LEU L E E CRT + 326 386 -146.9 128.9 176.3 161.1 11.4 169.1 386 -2.1 386 -1.9 0 0.0 0 0.0 12 48
372 A 452 ASP D E E CRT - 325 385 -144.5 163.5 -179.4 -153.0 22.7 163.6 325 -2.7 325 -3.4 0 0.0 0 0.0 12 53
373 A 453 ASP D E E CR - 324 0 -142.6 111.4 179.3 -153.1 8.9 159.1 384 -1.7 375 -0.9 0 0.0 0 0.0 12 49
374 A 454 LYS K E E CR - 323 0 -87.2 106.6 -176.9 -162.0 21.0 141.5 323 -2.7 323 -2.0 0 0.0 376 -0.7 12 57
375 A 455 ILE I E E CRU - 322 382 -103.1 111.1 179.1 -162.0 9.0 145.6 382 -3.9 382 -2.4 373 -0.9 377 -0.7 12 43
376 A 456 ASP D E E CRU + 321 381 -91.4 114.0 177.7 160.3 21.1 142.4 321 -2.8 321 -2.3 374 -0.7 0 0.0 11 41
377 A 457 ILE I E E C U> T - 0 380 -134.5 112.6 -178.3 -50.0 65.5 162.0 380 -2.0 380 -2.5 375 -0.7 0 0.0 9 28
378 A 458 GLY G T T 3 TS- 0 0 61.0 -131.3 179.9 -18.8 123.7 115.1 0 0.0 0 0.0 0 0.0 0 0.0 5 24
379 A 459 ASN N T e 3 TS+ 0 0 -88.4 5.6 180.0 97.2 121.7 70.2 0 0.0 420 -2.4 0 0.0 0 0.0 8 28
380 A 460 TRP W E E CUV< T - 377 419 -99.4 149.8 175.8 -173.3 49.0 135.3 377 -2.5 377 -2.0 0 0.0 0 0.0 11 35
381 A 461 THR T E E CUV - 376 418 -136.9 110.1 -176.2 -175.5 17.5 162.6 418 -2.1 418 -3.1 0 0.0 0 0.0 11 48
382 A 462 ILE I E E CUV - 375 417 -118.3 128.0 -177.9 -172.2 8.6 163.6 375 -2.4 375 -3.9 0 0.0 0 0.0 12 43
383 A 463 THR T E E C V - 0 416 -127.1 91.2 178.3 -175.6 3.6 143.0 416 -3.2 416 -1.9 0 0.0 0 0.0 11 55
384 A 464 PRO P E E C V + 0 415 -75.7 148.8 -179.2 175.0 23.0 123.9 0 0.0 373 -1.7 0 0.0 0 0.0 11 46
385 A 465 GLY G E E CTV - 372 414 -155.3 162.0 -178.5 -160.6 23.3 172.2 414 -2.9 414 -3.1 0 0.0 0 0.0 12 50
386 A 466 MET M E E CTV - 371 413 -151.8 128.1 176.6 -170.8 2.2 164.4 371 -1.9 371 -2.1 0 0.0 0 0.0 12 45
387 A 467 ARG R E E CTV - 370 412 -116.1 145.4 176.3 -173.5 5.8 156.5 412 -2.2 412 -3.4 0 0.0 0 0.0 15 54
388 A 468 PHE F E E CTV - 369 411 -139.9 125.2 177.8 -174.2 1.1 166.7 369 -2.5 369 -2.9 0 0.0 0 0.0 11 47
389 A 469 GLU E E E CTV - 368 410 -120.2 138.4 174.7 -164.1 11.3 163.0 410 -1.2 410 -2.3 0 0.0 391 -0.5 11 52
390 A 470 HIS H E E CTV - 367 409 -117.0 120.4 -175.2 -170.1 21.5 170.7 367 -3.0 367 -2.8 0 0.0 0 0.0 11 40
391 A 471 ILE I E E CTV - 366 408 -123.7 130.0 179.3 -177.6 17.1 160.1 408 -3.1 408 -2.4 389 -0.5 0 0.0 12 52
392 A 472 GLU E E E CTV + 365 407 -125.6 119.0 -178.7 168.6 15.5 167.4 365 -2.3 365 -2.3 0 0.0 0 0.0 11 46
393 A 473 SER S E E CTV - 364 406 -129.4 155.2 178.8 -175.1 9.2 156.6 406 -2.1 406 -2.3 0 0.0 0 0.0 13 55
394 A 474 TYR Y E E CTV - 363 405 -144.4 161.0 174.6 -153.7 14.2 162.2 363 -2.3 363 -1.8 0 0.0 0 0.0 13 46
395 A 475 GLN Q E E CTV - 362 404 -138.2 123.9 179.6 -165.1 10.2 167.7 404 -2.3 404 -2.5 0 0.0 397 -0.6 13 47
396 A 476 ASN N E E CTV - 361 403 -113.8 117.1 -179.2 -160.7 3.9 162.8 361 -3.9 361 -2.4 0 0.0 398 -0.7 11 35
397 A 477 ASN N E E >CT T - 360 0 -101.0 110.0 -178.8 -168.2 3.8 150.1 402 -2.7 401 -2.0 395 -0.6 0 0.0 11 32
398 A 478 ALA A T e 4 TS+ 0 0 -70.5 -20.8 179.6 48.8 85.8 44.8 359 -2.5 0 0.0 396 -0.7 0 0.0 9 22
399 A 479 ILE I T T 4 TS+ 0 0 -86.0 -49.9 -180.0 30.2 121.1 19.5 359 -0.6 0 0.0 0 0.0 0 0.0 8 22
400 A 480 THR T T T 4 TS- 0 0 -79.5 -21.0 -179.7 -130.6 100.0 42.1 0 0.0 0 0.0 0 0.0 0 0.0 5 18
401 A 481 GLY G t < T + 0 0 83.7 7.8 179.8 145.4 56.3 56.0 397 -2.0 0 0.0 0 0.0 0 0.0 7 18
402 A 482 THR T e - 0 0 -81.6 146.5 178.5 -169.6 30.6 121.2 0 0.0 397 -2.7 0 0.0 0 0.0 7 26
403 A 483 HIS H E E CV - 396 0 -138.3 113.9 -178.0 -179.7 11.6 162.3 0 0.0 0 0.0 0 0.0 0 0.0 8 32
404 A 484 GLU E E E CV - 395 0 -121.3 146.1 -178.4 -175.4 4.3 156.4 395 -2.5 395 -2.3 0 0.0 0 0.0 10 37
405 A 485 GLU E E E CV - 394 0 -137.4 154.1 175.8 -167.3 8.1 161.0 0 0.0 0 0.0 0 0.0 0 0.0 10 44
406 A 486 VAL V E E CV - 393 0 -141.4 144.2 178.8 -168.9 1.2 174.6 393 -2.3 393 -2.1 0 0.0 0 0.0 12 43
407 A 487 SER S E E CV + 392 0 -132.8 124.5 -178.4 149.2 25.2 174.4 0 0.0 0 0.0 0 0.0 0 0.0 9 40
408 A 488 TYR Y E E CV - 391 0 -155.2 165.3 -177.0 -132.1 31.4 170.3 391 -2.4 391 -3.1 0 0.0 0 0.0 10 41
409 A 489 ASN N E E CV - 390 0 -124.3 155.6 178.8 -156.6 0.9 149.6 0 0.0 0 0.0 0 0.0 0 0.0 10 41
410 A 490 ALA A E E CV - 389 0 -132.4 91.5 179.1 -172.5 9.4 143.7 389 -2.3 389 -1.2 0 0.0 0 0.0 10 52
411 A 491 PRO P E E CV - 388 0 -82.3 128.0 -177.5 -175.7 10.1 137.8 0 0.0 0 0.0 0 0.0 0 0.0 9 45
412 A 492 LEU L E E CV - 387 0 -133.6 90.3 179.8 -174.2 4.5 141.8 387 -3.4 387 -2.2 0 0.0 0 0.0 12 55
413 A 493 PRO P E E CV + 386 0 -82.9 141.4 -179.1 175.4 13.1 128.1 0 0.0 0 0.0 0 0.0 0 0.0 11 43
414 A 494 ALA A E E CV - 385 0 -144.9 161.1 176.5 -167.8 22.5 165.4 385 -3.1 385 -2.9 0 0.0 0 0.0 13 51
415 A 495 LEU L E E CVW - 384 431 -149.3 117.1 174.6 -177.7 10.3 158.0 431 -2.3 431 -1.5 0 0.0 0 0.0 11 47
416 A 496 ASN N E E CVW - 383 430 -118.3 150.4 -178.0 -163.5 6.2 158.3 383 -1.9 383 -3.2 0 0.0 0 0.0 15 57
417 A 497 VAL V E E CVW - 382 429 -133.9 131.5 177.5 -171.1 6.3 173.5 429 -3.3 429 -2.1 0 0.0 0 0.0 12 47
418 A 498 LEU L E E CVW - 381 428 -120.0 137.4 177.7 -168.3 5.2 163.8 381 -3.1 381 -2.1 0 0.0 0 0.0 14 50
419 A 499 TYR Y E E CVW - 380 427 -127.9 123.4 179.6 -140.6 16.7 173.2 427 -2.9 427 -2.2 0 0.0 421 -1.1 10 36
420 A 500 HIS H E E C W + 0 426 -86.3 99.1 177.7 175.6 21.9 136.5 379 -2.4 0 0.0 0 0.0 0 0.0 10 37
421 A 501 LEU L E E C * S- 0 0 -64.0 -53.1 178.1 -18.5 73.7 16.2 425 -1.5 0 0.0 419 -1.1 0 0.0 9 28
422 A 502 THR T E E C W> TS- 0 425 -143.4 178.3 179.9 -84.7 81.7 148.5 425 -1.9 425 -1.5 0 0.0 0 0.0 6 23
423 A 503 ASP D T T 3 TS+ 0 0 -67.1 -2.3 -179.1 32.2 132.0 60.3 0 0.0 0 0.0 0 0.0 0 0.0 6 25
424 A 504 SER S T e 3 TS+ 0 0 -139.6 19.8 -177.8 67.2 111.7 79.7 0 0.0 467 -2.4 0 0.0 0 0.0 8 29
425 A 505 TRP W E E CWX< T - 422 466 -149.8 113.4 179.4 -179.6 55.6 154.8 422 -1.5 422 -1.9 0 0.0 421 -1.5 11 37
426 A 506 ASN N E E CWX - 420 465 -113.6 158.8 178.2 -157.7 12.5 142.1 465 -2.7 465 -1.9 0 0.0 0 0.0 15 45
427 A 507 LEU L E E CWX - 419 464 -127.9 143.9 178.4 -175.9 17.3 161.9 419 -2.2 419 -2.9 0 0.0 0 0.0 13 43
428 A 508 TYR Y E E CWX + 418 463 -145.1 156.6 177.5 176.3 13.0 170.9 463 -3.0 463 -2.3 0 0.0 0 0.0 15 54
429 A 509 ALA A E E CWX + 417 462 -150.1 155.7 178.0 159.2 14.7 164.8 417 -2.1 417 -3.3 0 0.0 0 0.0 13 50
430 A 510 ASN N E E CWX - 416 461 -170.7 166.6 173.9 -153.9 26.5 172.9 461 -2.0 461 -2.1 0 0.0 0 0.0 16 53
431 A 511 THR T E E CWX + 415 460 -148.2 141.8 -177.8 179.5 21.6 164.4 415 -1.5 415 -2.3 0 0.0 0 0.0 12 54
432 A 512 GLU E E E C X - 0 459 -145.3 155.7 177.9 -124.9 29.2 170.7 459 -1.9 459 -2.6 0 0.0 434 -0.5 16 58
433 A 513 GLY G E E C X - 0 458 -102.3 128.3 -178.3 -177.0 37.4 152.4 0 0.0 0 0.0 0 0.0 0 0.0 14 59
434 A 514 SER S E E C X - 0 457 -124.9 158.8 179.8 -160.9 4.0 150.6 457 -3.3 457 -2.9 432 -0.5 0 0.0 13 68
435 A 515 PHE F E E C X - 0 456 -153.3 154.3 176.7 -158.4 21.3 171.4 0 0.0 127 -1.3 0 0.0 126 -1.1 14 68
436 A 516 GLY G E E C X - 0 455 -115.0 148.9 -179.9 -126.1 34.0 150.0 455 -2.5 455 -2.8 0 0.0 0 0.0 13 77
437 A 517 THR T - 0 0 -88.7 176.6 174.2 -95.8 27.2 108.6 0 0.0 439 -1.0 0 0.0 0 0.0 10 73
438 A 518 VAL V - 0 0 -90.1 105.7 -178.9 -140.2 53.1 148.9 0 0.0 0 0.0 0 0.0 0 0.0 14 68
439 A 519 GLN Q g > > T - 0 0 -69.2 153.3 -179.8 -108.2 17.9 110.4 437 -1.0 442 -2.8 0 0.0 443 -0.8 9 63
440 A 520 TYR Y G G 4 > TS+ 0 0 -47.9 -45.9 179.7 54.4 120.4 25.6 95 -2.7 443 -1.4 0 0.0 0 0.0 11 61
441 A 521 SER S G G 4 3 TS+ 0 0 -66.4 -6.4 -178.5 49.9 109.3 53.8 0 0.0 0 0.0 0 0.0 0 0.0 7 51
442 A 522 GLN Q G h > < TS+ 0 0 -110.1 -3.7 179.9 91.4 81.7 61.2 439 -2.8 446 -3.1 0 0.0 0 0.0 9 54
443 A 523 ILE I H H X < TS+ 0 0 -58.1 -38.6 179.4 53.5 85.6 30.5 440 -1.4 447 -2.5 439 -0.8 0 0.0 14 50
444 A 524 GLY G H H > TS+ 0 0 -62.1 -47.5 -179.4 43.5 112.8 17.6 0 0.0 448 -2.5 0 0.0 0 0.0 8 42
445 A 525 LYS K H H > TS+ 0 0 -63.7 -43.0 -179.4 52.6 113.0 23.9 0 0.0 449 -2.7 0 0.0 0 0.0 10 40
446 A 526 ALA A H H < TS+ 0 0 -62.5 -43.0 179.8 41.0 114.0 28.1 442 -3.1 0 0.0 0 0.0 0 0.0 14 43
447 A 527 VAL V H H < > TS+ 0 0 -72.3 -42.5 -179.3 51.6 115.5 21.5 443 -2.5 450 -0.7 0 0.0 0 0.0 12 35
448 A 528 GLN Q H H < 3 TS+ 0 0 -59.7 -46.6 -179.6 46.4 110.5 25.2 444 -2.5 0 0.0 0 0.0 0 0.0 8 28
449 A 529 SER S T h < 3 TS- 0 0 -74.6 -8.4 178.9 -127.2 109.5 52.9 445 -2.7 0 0.0 0 0.0 0 0.0 8 27
450 A 530 GLY G S t < TS+ 0 0 82.3 -12.3 -180.0 112.3 74.6 72.6 447 -0.7 452 -0.6 0 0.0 0 0.0 6 25
451 A 531 ASN N + 0 0 -104.9 118.8 179.0 172.3 35.6 149.4 0 0.0 453 -0.6 0 0.0 0 0.0 7 34
452 A 532 VAL V + 0 0 -121.2 93.2 179.6 129.3 28.2 152.1 450 -0.6 0 0.0 0 0.0 0 0.0 10 43
453 A 533 GLU E - 0 0 -141.7 153.3 180.0 -99.9 59.1 166.6 451 -0.6 0 0.0 0 0.0 0 0.0 8 50
454 A 534 PRO P - 0 0 -68.7 167.7 177.1 -96.3 43.1 102.2 0 0.0 456 -0.6 0 0.0 0 0.0 13 60
455 A 535 GLU E E E CX - 436 0 -82.8 123.5 -174.7 -150.3 54.5 141.0 436 -2.8 436 -2.5 0 0.0 0 0.0 13 62
456 A 536 LYS K E E CXY + 435 483 -111.7 136.2 176.9 176.5 22.7 147.5 483 -1.0 483 -3.6 454 -0.6 0 0.0 12 57
457 A 537 ALA A E E CXY - 434 482 -132.4 152.0 178.4 -161.4 15.0 163.9 434 -2.9 434 -3.3 0 0.0 0 0.0 12 63
458 A 538 ARG R E E CXY - 433 481 -130.6 122.4 -178.6 -165.4 20.5 176.4 481 -1.7 481 -1.9 0 0.0 0 0.0 11 52
459 A 539 THR T E E CXY - 432 480 -115.0 149.5 178.7 -168.9 10.6 147.2 432 -2.6 432 -1.9 0 0.0 0 0.0 14 62
460 A 540 TRP W E E CXY - 431 479 -135.2 137.0 177.2 -179.6 7.8 175.7 479 -2.5 479 -2.1 0 0.0 0 0.0 11 52
461 A 541 GLU E E E CXY - 430 478 -136.7 155.0 176.9 -179.2 10.2 166.3 430 -2.1 430 -2.0 0 0.0 0 0.0 15 56
462 A 542 LEU L E E CXY + 429 477 -147.5 134.5 -179.9 126.9 29.4 164.6 477 -1.8 477 -4.1 0 0.0 0 0.0 12 41
463 A 543 GLY G E E CXY - 428 476 -175.1 179.3 -179.2 -126.7 40.5 172.8 428 -2.3 428 -3.0 0 0.0 0 0.0 13 50
464 A 544 THR T E E CXY - 427 475 -145.5 150.6 179.8 -157.4 9.5 170.0 475 -2.5 475 -2.2 0 0.0 0 0.0 11 48
465 A 545 ARG R E E CXY - 426 474 -131.3 140.3 -177.0 -173.9 13.8 172.6 426 -1.9 426 -2.7 0 0.0 0 0.0 12 51
466 A 546 TYR Y E E CXY + 425 473 -140.7 143.3 -179.3 164.8 13.9 172.4 473 -3.1 473 -2.3 0 0.0 0 0.0 11 42
467 A 547 ASP D E E C Y + 0 472 -160.9 100.9 177.9 158.6 11.5 136.0 424 -2.4 0 0.0 0 0.0 0 0.0 10 34
468 A 548 ASP D e - 0 0 -107.4 16.1 -179.8 -103.0 67.6 81.0 471 -2.1 0 0.0 0 0.0 0 0.0 7 26
469 A 549 GLY G S S S+ 0 0 92.7 -39.5 179.5 53.5 118.0 96.9 0 0.0 0 0.0 0 0.0 0 0.0 5 28
470 A 550 ALA A S e S+ 0 0 -97.0 -28.5 -179.3 35.0 116.5 45.9 0 0.0 513 -2.2 0 0.0 0 0.0 8 28
471 A 551 LEU L E E C Z + 0 512 -131.8 129.7 174.9 179.6 60.9 173.3 0 0.0 468 -2.1 0 0.0 0 0.0 11 34
472 A 552 THR T E E CYZ + 467 511 -125.2 135.5 -179.6 147.9 22.5 172.1 511 -2.6 511 -2.9 0 0.0 0 0.0 12 39
473 A 553 ALA A E E CYZ - 466 510 -160.6 163.0 178.5 -174.7 20.9 167.5 466 -2.3 466 -3.1 0 0.0 0 0.0 11 44
474 A 554 GLU E E E CYZ - 465 509 -157.8 157.7 176.3 -174.2 1.2 165.7 509 -1.8 509 -1.4 0 0.0 0 0.0 11 54
475 A 555 MET M E E CYZ + 464 508 -158.2 131.1 178.9 167.6 12.4 155.9 464 -2.2 464 -2.5 0 0.0 0 0.0 11 48
476 A 556 GLY G E E CYZ - 463 507 -145.7 160.3 177.3 -141.5 23.7 167.4 507 -2.6 507 -2.5 0 0.0 0 0.0 12 55
477 A 557 LEU L E E CYZ - 462 506 -114.9 157.8 178.4 -170.7 21.3 144.9 462 -4.1 462 -1.8 0 0.0 0 0.0 11 44
478 A 558 PHE F E E CYZ - 461 505 -148.0 155.6 177.6 -168.3 14.0 171.0 505 -1.6 505 -1.5 0 0.0 0 0.0 12 59
479 A 559 LEU L E E CYZ - 460 504 -145.2 127.7 177.6 -176.3 8.1 166.0 460 -2.1 460 -2.5 0 0.0 0 0.0 11 51
480 A 560 ILE I E E CYZ - 459 503 -128.5 126.8 174.4 -169.8 9.0 175.1 503 -2.5 503 -2.4 0 0.0 482 -0.6 12 63
481 A 561 ASN N E E CYZ - 458 502 -114.0 113.2 -175.3 -172.3 12.8 166.7 458 -1.9 458 -1.7 0 0.0 483 -0.6 11 49
482 A 562 PHE F E E CYZ + 457 501 -114.8 108.4 -175.8 177.0 10.8 156.6 501 -2.6 501 -2.0 480 -0.6 0 0.0 13 57
483 A 563 ASN N E E CY* + 456 0 -109.7 170.3 176.8 26.1 48.5 124.5 456 -3.6 456 -1.0 481 -0.6 0 0.0 11 50
484 A 564 ASN N E E C * + 0 0 50.4 41.5 -180.0 173.4 68.2 36.5 0 0.0 0 0.0 0 0.0 0 0.0 11 52
485 A 565 GLN Q E E C Z - 0 499 -79.8 133.6 -178.8 -142.5 32.7 128.5 499 -2.5 499 -3.1 0 0.0 0 0.0 13 58
486 A 566 TYR Y S S S+ 0 0 -69.1 -21.8 176.0 75.8 90.2 39.6 0 0.0 488 -0.9 0 0.0 0 0.0 12 54
487 A 567 ASP D S S S- 0 0 -89.1 109.8 178.9 -147.5 83.7 143.4 0 0.0 0 0.0 0 0.0 0 0.0 7 60
488 A 568 SER S - 0 0 -74.0 150.6 176.7 -144.0 10.3 117.7 486 -0.9 0 0.0 0 0.0 0 0.0 13 51
489 A 569 ASN N + 0 0 -96.0 8.8 178.7 111.5 67.0 73.1 0 0.0 0 0.0 0 0.0 0 0.0 13 50
490 A 570 GLN Q S S S- 0 0 -76.2 162.4 -178.6 -114.2 83.5 110.4 0 0.0 0 0.0 0 0.0 0 0.0 12 39
491 A 571 THR T S S S+ 0 0 -66.0 -29.0 -179.3 40.7 110.5 31.5 0 0.0 493 -0.5 0 0.0 0 0.0 8 37
492 A 572 ASN N S S S- 0 0 -122.7 110.4 179.7 -144.6 84.2 162.4 0 0.0 0 0.0 0 0.0 0 0.0 5 25
493 A 573 ASP D - 0 0 -75.6 138.3 179.9 -174.7 22.1 122.1 491 -0.5 0 0.0 0 0.0 0 0.0 9 34
494 A 574 THR T t > T - 0 0 -129.5 162.7 -177.3 -101.7 38.6 151.7 0 0.0 497 -0.7 0 0.0 0 0.0 6 31
495 A 575 VAL V T T 3 TS+ 0 0 -54.6 -39.8 -179.2 37.5 119.7 33.7 0 0.0 0 0.0 0 0.0 0 0.0 8 29
496 A 576 THR T T T 3 TS+ 0 0 -91.1 -12.1 -179.2 109.5 90.9 53.9 0 0.0 0 0.0 0 0.0 0 0.0 6 34
497 A 577 ALA A t < T - 0 0 -66.4 146.1 178.0 -169.6 46.5 110.0 494 -0.7 0 0.0 0 0.0 0 0.0 8 40
498 A 578 ARG R - 0 0 -136.2 130.8 179.8 -121.6 21.3 175.7 0 0.0 0 0.0 0 0.0 0 0.0 12 50
499 A 579 GLY G E E CZ - 485 0 -73.6 149.6 178.4 -175.1 26.7 114.6 485 -3.1 485 -2.5 0 0.0 0 0.0 15 59
500 A 580 LYS K E E C* + 0 0 -145.7 122.0 -178.5 168.1 8.3 162.2 0 0.0 538 -2.8 0 0.0 539 -0.8 14 53
501 A 581 THR T E E CZA - 482 537 -136.1 156.5 -179.7 -148.8 21.7 159.4 482 -2.0 482 -2.6 0 0.0 0 0.0 13 58
502 A 582 ARG R E E CZA - 481 536 -128.1 133.8 -177.7 -165.6 9.8 172.6 536 -2.2 536 -2.7 0 0.0 0 0.0 13 54
503 A 583 HIS H E E CZA + 480 535 -125.2 118.5 179.6 161.7 16.9 168.9 480 -2.4 480 -2.5 0 0.0 0 0.0 14 58
504 A 584 THR T E E CZA + 479 534 -132.6 156.1 178.7 103.0 15.5 158.5 534 -1.7 534 -3.4 0 0.0 0 0.0 12 52
505 A 585 GLY G E E CZA - 478 533 166.2 -166.8 -177.8 -78.7 54.1 176.2 478 -1.5 478 -1.6 0 0.0 0 0.0 12 48
506 A 586 LEU L E E CZA - 477 532 -134.8 134.4 179.2 -166.8 26.6 173.5 532 -2.1 532 -2.7 0 0.0 0 0.0 11 50
507 A 587 GLU E E E CZA + 476 531 -123.9 140.5 -178.5 155.9 19.1 165.7 476 -2.5 476 -2.6 0 0.0 0 0.0 13 57
508 A 588 THR T E E CZA + 475 530 -158.6 155.4 174.5 169.8 13.0 174.4 530 -2.7 530 -3.1 0 0.0 0 0.0 12 51
509 A 589 GLN Q E E CZA - 474 529 -161.7 159.2 -179.9 -177.3 7.5 164.9 474 -1.4 474 -1.8 0 0.0 0 0.0 12 50
510 A 590 ALA A E E CZA - 473 528 -159.8 155.1 178.1 -159.4 12.4 168.7 528 -2.3 528 -2.0 0 0.0 0 0.0 11 45
511 A 591 ARG R E E CZA - 472 527 -139.4 136.7 -177.2 -172.8 15.3 174.0 472 -2.9 472 -2.6 0 0.0 0 0.0 11 45
512 A 592 TYR Y E E CZA - 471 526 -141.8 133.0 178.4 -133.2 25.4 174.4 526 -2.6 526 -2.4 0 0.0 514 -0.9 10 34
513 A 593 ASP D E E C A> T - 0 525 -82.4 103.7 -179.7 -167.9 16.0 137.0 470 -2.2 516 -1.8 0 0.0 0 0.0 12 31
514 A 594 LEU L G e > > TS+ 0 0 -67.3 -15.1 -180.0 81.7 78.6 47.1 524 -1.8 517 -2.6 512 -0.9 518 -1.0 12 29
515 A 595 GLY G G G 4 3 TS+ 0 0 -64.2 -14.7 179.0 69.2 78.1 46.7 524 -0.8 0 0.0 0 0.0 0 0.0 12 24
516 A 596 THR T G G 4 < TS+ 0 0 -75.5 -13.5 -178.9 48.6 100.8 49.7 513 -1.8 0 0.0 0 0.0 0 0.0 8 21
517 A 597 LEU L T g 4 < TS- 0 0 -94.8 -33.6 -179.3 -16.0 130.1 36.1 514 -2.6 0 0.0 0 0.0 0 0.0 6 18
518 A 598 THR T g < > T - 0 0 -169.2 141.2 179.8 -123.0 54.0 155.9 514 -1.0 521 -2.2 0 0.0 0 0.0 8 16
519 A 599 PRO P G G > TS+ 0 0 -64.1 -16.2 178.7 76.8 108.3 43.8 0 0.0 522 -2.0 0 0.0 0 0.0 7 17
520 A 600 THR T G G 3 TS+ 0 0 -60.5 -26.6 -179.8 41.9 101.0 35.3 0 0.0 0 0.0 0 0.0 0 0.0 5 15
521 A 601 LEU L G G X TS+ 0 0 -108.5 26.8 179.0 149.1 83.4 90.6 518 -2.2 524 -1.9 0 0.0 0 0.0 9 23
522 A 602 ASP D T g < TS+ 0 0 -64.0 141.7 -179.8 12.4 73.2 112.5 519 -2.0 0 0.0 0 0.0 0 0.0 11 25
523 A 603 ASN N T e 3 TS+ 0 0 67.5 12.5 177.6 127.6 97.8 52.3 0 0.0 563 -2.1 0 0.0 525 -0.6 11 32
524 A 604 VAL V E E C B< T + 0 562 -101.1 122.2 179.1 179.2 35.6 154.8 521 -1.9 514 -1.8 0 0.0 515 -0.8 12 34
525 A 605 SER S E E CAB - 513 561 -124.2 141.2 179.8 -161.6 10.4 165.6 561 -2.7 561 -2.6 523 -0.6 0 0.0 12 40
526 A 606 ILE I E E CAB + 512 560 -123.3 144.0 -179.2 171.2 14.8 161.8 512 -2.4 512 -2.6 0 0.0 0 0.0 12 41
527 A 607 TYR Y E E CAB - 511 559 -146.3 167.5 177.9 -178.2 11.8 159.8 559 -2.5 559 -2.3 0 0.0 0 0.0 11 44
528 A 608 ALA A E E CAB - 510 558 -163.4 151.9 177.2 -161.8 8.1 164.8 510 -2.0 510 -2.3 0 0.0 0 0.0 11 48
529 A 609 SER S E E CAB + 509 557 -136.8 148.4 -178.2 168.9 19.0 167.3 557 -2.7 557 -2.0 0 0.0 0 0.0 14 52
530 A 610 TYR Y E E CAB - 508 556 -161.1 144.9 174.2 -172.2 15.5 168.2 508 -3.1 508 -2.7 0 0.0 0 0.0 13 52
531 A 611 ALA A E E CAB - 507 555 -142.1 138.4 173.7 -154.5 13.9 174.1 555 -1.6 555 -1.5 0 0.0 533 -0.6 14 55
532 A 612 TYR Y E E CAB - 506 554 -105.4 121.0 -178.5 -178.3 27.1 165.4 506 -2.7 506 -2.1 0 0.0 0 0.0 11 46
533 A 613 VAL V E E CA - 505 0 -127.8 123.4 178.2 -172.7 16.9 169.4 553 -2.3 535 -0.6 531 -0.6 0 0.0 15 56
534 A 614 ASN N E E CA + 504 0 -118.3 99.9 -178.8 179.9 8.7 150.5 504 -3.4 504 -1.7 0 0.0 536 -0.7 13 48
535 A 615 ALA A E E CA + 503 0 -103.9 111.5 -177.4 178.8 12.1 151.1 533 -0.6 548 -2.9 0 0.0 0 0.0 15 62
536 A 616 GLU E E E CAC - 502 547 -117.9 152.9 179.7 -121.2 31.5 143.8 502 -2.7 502 -2.2 534 -0.7 538 -0.6 11 50
537 A 617 ILE I E E CA + 501 0 -91.5 119.5 178.2 171.6 28.9 144.2 546 -2.7 545 -2.6 0 0.0 0 0.0 15 53
538 A 618 ARG R e + 0 0 -113.4 17.9 177.2 121.9 36.2 82.5 500 -2.8 0 0.0 536 -0.6 0 0.0 11 41
539 A 619 GLU E S S S- 0 0 -80.0 124.9 178.9 -117.2 70.7 134.2 500 -0.8 0 0.0 0 0.0 0 0.0 13 40
540 A 620 LYS K S S S+ 0 0 -63.0 134.1 -178.4 69.8 77.3 115.6 0 0.0 0 0.0 0 0.0 0 0.0 6 33
541 A 621 GLY G S t > TS- 0 0 149.4 -165.8 -176.8 -30.6 102.3 162.1 0 0.0 544 -1.7 0 0.0 0 0.0 6 31
542 A 622 ASP D T T 3 TS+ 0 0 -69.2 4.0 177.7 41.6 133.1 68.2 0 0.0 0 0.0 0 0.0 0 0.0 7 29
543 A 623 THR T T T > TS+ 0 0 -131.7 14.2 179.4 142.3 75.2 78.0 0 0.0 546 -2.3 0 0.0 0 0.0 13 35
544 A 624 TYR Y T T < TS+ 0 0 -57.3 124.7 179.0 17.9 76.6 111.4 541 -1.7 0 0.0 0 0.0 0 0.0 9 31
545 A 625 GLY G T T 3 TS+ 0 0 95.7 -10.5 179.2 124.4 98.8 71.7 537 -2.6 0 0.0 0 0.0 0 0.0 7 31
546 A 626 ASN N t < T - 0 0 -78.0 169.5 179.4 -101.7 66.6 106.4 543 -2.3 537 -2.7 0 0.0 0 0.0 11 41
547 A 627 LEU L B B C - 536 0 -93.8 141.3 178.2 -107.9 35.8 135.9 0 0.0 0 0.0 0 0.0 0 0.0 12 51
548 A 628 VAL V t > T - 0 0 -63.1 141.0 179.6 -103.8 46.7 114.4 535 -2.9 551 -0.6 0 0.0 0 0.0 15 64
549 A 629 PRO P T T 3 TS+ 0 0 -67.9 156.0 177.8 19.7 96.7 106.9 0 0.0 0 0.0 0 0.0 0 0.0 11 62
550 A 630 PHE F T T 3 TS+ 0 0 54.5 44.8 180.0 122.7 88.6 35.0 580 -2.9 0 0.0 0 0.0 0 0.0 10 68
551 A 631 SER S t < T - 0 0 -135.9 91.4 179.2 -155.6 48.6 146.1 548 -0.6 0 0.0 0 0.0 0 0.0 16 67
552 A 632 PRO P - 0 0 -66.7 135.1 179.2 -144.5 11.1 121.0 0 0.0 0 0.0 0 0.0 0 0.0 12 60
553 A 633 LYS K S e S+ 0 0 -69.6 -31.0 -178.9 37.2 87.8 34.8 578 -0.6 533 -2.3 0 0.0 0 0.0 13 52
554 A 634 HIS H E E CB S+ 532 0 -126.8 130.2 -179.4 150.5 71.2 170.0 0 0.0 577 -2.3 0 0.0 0 0.0 11 50
555 A 635 LYS K E E CBC + 531 576 -158.0 138.2 178.3 105.8 14.1 165.7 531 -1.5 531 -1.6 0 0.0 0 0.0 15 52
556 A 636 GLY G E E CBC - 530 575 -178.8 -160.4 -178.7 -106.1 43.9 163.9 575 -2.3 575 -2.2 0 0.0 0 0.0 15 56
557 A 637 THR T E E CBC - 529 574 -151.2 158.7 174.7 -166.8 14.9 165.9 529 -2.0 529 -2.7 0 0.0 0 0.0 12 52
558 A 638 LEU L E E CBC + 528 573 -145.4 152.0 -179.5 151.0 21.2 166.0 573 -1.5 573 -2.8 0 0.0 0 0.0 11 43
559 A 639 GLY G E E CBC - 527 572 -171.3 171.6 178.5 -133.7 33.6 174.8 527 -2.3 527 -2.5 0 0.0 0 0.0 11 48
560 A 640 VAL V E E CBC - 526 571 -141.1 131.8 178.8 -162.2 13.7 174.2 571 -2.1 571 -1.7 0 0.0 0 0.0 11 41
561 A 641 ASP D E E CBC - 525 570 -116.0 129.2 -179.9 -169.2 5.9 166.0 525 -2.6 525 -2.7 0 0.0 0 0.0 12 46
562 A 642 TYR Y E E CBC + 524 569 -122.8 121.1 -176.8 180.0 5.6 168.0 569 -3.0 569 -2.3 0 0.0 0 0.0 11 40
563 A 643 LYS K e + 0 0 -122.9 70.8 179.4 171.8 4.7 125.0 523 -2.1 0 0.0 0 0.0 0 0.0 10 37
564 A 644 PRO P t > T - 0 0 -78.0 133.5 179.1 -45.6 68.2 130.1 0 0.0 567 -2.5 0 0.0 0 0.0 8 26
565 A 645 GLY G T T 3 TS- 0 0 49.8 -118.0 179.8 -15.3 126.0 100.9 0 0.0 0 0.0 0 0.0 0 0.0 4 21
566 A 646 ASN N T e 3 TS+ 0 0 -98.2 2.3 -179.8 99.0 115.6 68.9 0 0.0 611 -2.0 0 0.0 0 0.0 9 26
567 A 647 TRP W E E C D< T - 0 610 -89.7 155.6 174.3 -163.5 51.7 123.9 564 -2.5 0 0.0 0 0.0 0 0.0 11 34
568 A 648 THR T E E C D - 0 609 -137.1 124.7 178.2 -175.7 5.8 171.0 609 -2.0 609 -3.0 0 0.0 0 0.0 12 45
569 A 649 PHE F E E CCD - 562 608 -121.5 122.7 179.2 -170.7 9.4 174.5 562 -2.3 562 -3.0 0 0.0 0 0.0 11 43
570 A 650 ASN N E E CCD - 561 607 -118.8 143.0 175.7 -180.0 12.9 158.5 607 -2.6 607 -2.0 0 0.0 0 0.0 13 51
571 A 651 LEU L E E CCD + 560 606 -134.3 134.2 -178.8 169.4 18.5 171.0 560 -1.7 560 -2.1 0 0.0 0 0.0 11 46
572 A 652 ASN N E E CCD - 559 605 -150.9 154.0 178.1 -158.7 20.6 175.3 605 -2.5 605 -2.7 0 0.0 0 0.0 12 51
573 A 653 SER S E E CCD - 558 604 -134.7 142.6 176.7 -163.8 1.5 173.3 558 -2.8 558 -1.5 0 0.0 0 0.0 11 50
574 A 654 ASP D E E CCD + 557 603 -121.2 134.4 -179.7 171.0 20.4 167.3 603 -1.3 603 -3.3 0 0.0 0 0.0 11 61
575 A 655 PHE F E E CCD + 556 602 -144.0 154.0 176.8 165.5 9.1 169.0 556 -2.2 556 -2.3 0 0.0 0 0.0 12 56
576 A 656 GLN Q E E CCD - 555 601 -163.3 153.1 -179.2 -122.0 28.9 162.1 601 -1.9 601 -2.1 0 0.0 0 0.0 12 52
577 A 657 SER S e - 0 0 -89.2 -173.1 -178.2 -64.0 49.1 103.1 554 -2.3 0 0.0 0 0.0 0 0.0 11 43
578 A 658 SER S - 0 0 -68.0 170.0 177.1 -163.0 45.3 91.3 0 0.0 553 -0.6 0 0.0 0 0.0 11 46
579 A 659 GLN Q B B D - 598 0 -150.5 157.0 175.6 -120.3 17.8 167.8 598 -2.1 598 -3.0 0 0.0 0 0.0 13 55
580 A 660 PHE F - 0 0 -96.6 155.7 -178.3 -149.2 11.5 138.4 0 0.0 550 -2.9 0 0.0 0 0.0 17 55
581 A 661 ALA A S S S+ 0 0 -99.1 -11.9 -178.0 35.2 74.3 52.9 0 0.0 0 0.0 0 0.0 0 0.0 16 58
582 A 662 ASP D S t > TS- 0 0 -142.5 161.4 -179.5 -110.2 80.5 160.7 0 0.0 585 -2.0 0 0.0 0 0.0 11 56
583 A 663 ASN N T T 3 TS+ 0 0 -59.3 -29.1 179.9 60.4 117.1 39.9 0 0.0 0 0.0 0 0.0 0 0.0 13 52
584 A 664 ALA A T T 3 TS- 0 0 -74.9 -11.2 -179.2 -135.8 103.0 53.2 0 0.0 0 0.0 0 0.0 0 0.0 9 42
585 A 665 ASN N t < T - 0 0 56.9 46.3 178.9 -168.3 28.0 22.7 582 -2.0 0 0.0 0 0.0 0 0.0 12 43
586 A 666 THR T - 0 0 -69.2 132.4 -178.0 -166.8 11.3 120.0 0 0.0 0 0.0 0 0.0 0 0.0 11 36
587 A 667 VAL V + 0 0 -85.1 -45.6 -177.4 75.3 63.1 26.2 0 0.0 597 -2.1 0 0.0 0 0.0 8 29
588 A 668 LYS K S S S- 0 0 -76.2 135.5 -178.1 -111.2 87.5 119.9 0 0.0 0 0.0 0 0.0 0 0.0 7 27
589 A 669 GLU E - 0 0 -70.0 134.2 176.9 -131.6 23.2 113.9 0 0.0 0 0.0 0 0.0 0 0.0 10 37
590 A 670 SER S t > T - 0 0 -78.0 155.9 -178.3 -114.6 25.1 120.3 595 -1.9 593 -1.9 0 0.0 0 0.0 9 34
591 A 671 ALA A T T 3 TS+ 0 0 -62.9 -33.7 179.5 55.0 117.8 31.7 0 0.0 236 -2.5 0 0.0 237 -0.6 8 29
592 A 672 ASP D T T 3 TS- 0 0 -79.1 3.0 177.0 -127.6 109.8 65.6 0 0.0 0 0.0 0 0.0 0 0.0 11 40
593 A 673 GLY G S t < TS+ 0 0 66.2 8.1 -179.2 118.2 76.3 60.2 590 -1.9 0 0.0 0 0.0 0 0.0 15 47
594 A 674 SER S S S S+ 0 0 -77.6 -24.2 -179.4 34.2 73.1 48.1 0 0.0 0 0.0 0 0.0 0 0.0 17 49
595 A 675 THR T S S S+ 0 0 -135.0 162.5 -177.8 80.5 73.2 156.5 0 0.0 590 -1.9 0 0.0 0 0.0 17 44
596 A 676 GLY G S S S- 0 0 123.6 155.7 180.0 -44.3 81.4 112.4 0 0.0 0 0.0 0 0.0 0 0.0 14 43
597 A 677 ARG R - 0 0 -52.5 139.0 178.1 -144.0 49.3 100.4 587 -2.1 0 0.0 0 0.0 0 0.0 13 43
598 A 678 ILE I B B D - 579 0 -109.9 114.8 -179.4 -128.6 21.9 161.3 579 -3.0 579 -2.1 0 0.0 0 0.0 11 52
599 A 679 PRO P - 0 0 -61.3 153.4 176.9 -121.5 16.0 100.5 0 0.0 0 0.0 0 0.0 0 0.0 9 41
600 A 680 GLY G - 0 0 -81.2 -177.9 -178.4 -169.1 32.6 102.9 0 0.0 0 0.0 0 0.0 0 0.0 11 40
601 A 681 PHE F E E CD - 576 0 -167.2 165.1 179.4 -140.3 21.4 167.2 576 -2.1 576 -1.9 0 0.0 0 0.0 10 42
602 A 682 MET M E E CD - 575 0 -141.5 115.3 -177.9 -170.3 24.5 161.9 0 0.0 0 0.0 0 0.0 0 0.0 9 43
603 A 683 LEU L E E CD - 574 0 -107.0 157.9 176.1 -151.2 8.5 134.6 574 -3.3 574 -1.3 0 0.0 0 0.0 12 46
604 A 684 TRP W E E CD + 573 0 -128.2 146.7 177.8 174.7 15.1 166.3 0 0.0 628 -3.1 0 0.0 0 0.0 12 44
605 A 685 GLY G E E CD - 572 0 -142.2 163.2 179.5 -173.3 4.7 159.1 572 -2.7 572 -2.5 0 0.0 0 0.0 13 48
606 A 686 ALA A E E CDE - 571 625 -155.3 163.4 -177.9 -171.7 2.1 167.1 625 -2.2 625 -3.0 0 0.0 0 0.0 13 48
607 A 687 ARG R E E CDE - 570 624 -159.5 148.0 178.4 -154.0 11.7 169.2 570 -2.0 570 -2.6 0 0.0 0 0.0 15 47
608 A 688 VAL V E E CDE + 569 623 -127.7 130.6 -179.1 175.2 23.8 175.6 623 -2.5 623 -2.0 0 0.0 0 0.0 11 40
609 A 689 ALA A E E CDE - 568 622 -135.8 160.9 178.8 -160.4 16.7 158.6 568 -3.0 568 -2.0 0 0.0 0 0.0 11 45
610 A 690 TYR Y E E CDE - 567 621 -144.8 134.6 178.6 -152.4 9.9 175.1 621 -2.5 621 -2.5 0 0.0 612 -0.7 10 34
611 A 691 ASP D E E C E - 0 620 -105.8 103.4 -179.7 -141.4 23.9 156.7 566 -2.0 0 0.0 0 0.0 0 0.0 11 36
612 A 692 PHE F e - 0 0 -68.4 135.0 -179.5 -35.7 67.9 119.5 619 -2.4 0 0.0 610 -0.7 0 0.0 9 26
613 A 693 GLY G t > >T - 0 0 11.8 91.5 180.0 -131.1 66.7 50.1 0 0.0 617 -0.6 0 0.0 618 -0.5 9 21
614 A 694 PRO P T T 4 5TS+ 0 0 -34.5 -25.0 178.5 62.1 95.6 43.7 0 0.0 0 0.0 0 0.0 0 0.0 8 23
615 A 695 GLN Q T T 4 >5TS+ 0 0 -87.6 -163.9 -178.6 46.1 87.2 91.8 0 0.0 617 -2.7 0 0.0 618 -1.0 6 18
616 A 696 MET M T T 4 35TS- 0 0 66.5 -72.3 -179.4 -20.1 139.3 111.6 0 0.0 0 0.0 0 0.0 0 0.0 5 16
617 A 697 ALA A T T < 35TS- 0 0 -156.1 25.1 179.8 -119.4 78.5 81.1 615 -2.7 660 -1.5 613 -0.6 0 0.0 9 21
618 A 698 ASP D t < TS- 0 0 53.3 60.7 -179.2 -169.8 75.5 14.2 0 0.0 630 -2.2 0 0.0 0 0.0 13 49
628 A 708 ILE I T T 3 TS+ 0 0 -47.7 -42.4 -178.2 46.1 80.7 34.4 604 -3.1 0 0.0 0 0.0 0 0.0 12 39
629 A 709 PHE F T T 3 TS- 0 0 -87.8 6.2 -178.6 -121.9 107.7 68.6 0 0.0 0 0.0 0 0.0 0 0.0 7 29
630 A 710 ASP D t < T - 0 0 51.5 47.3 178.0 -169.5 38.9 24.4 627 -2.2 0 0.0 0 0.0 0 0.0 7 34
631 A 711 GLN Q - 0 0 -68.2 123.6 179.3 -129.6 17.0 122.6 0 0.0 0 0.0 0 0.0 0 0.0 11 32
632 A 712 ASP D + 0 0 -77.5 141.8 175.4 141.0 44.2 121.9 0 0.0 0 0.0 0 0.0 0 0.0 7 40
633 A 713 TYR Y e - 0 0 -164.6 172.1 -179.5 -167.8 22.5 158.9 0 0.0 648 -2.8 0 0.0 0 0.0 10 51
634 A 714 PHE F E E DG - 647 0 -159.4 169.8 176.4 -145.1 11.1 161.6 0 0.0 0 0.0 0 0.0 0 0.0 10 62
635 A 715 ILE I E E DG - 646 0 -133.6 171.8 -179.5 -133.4 21.0 144.5 646 -1.6 646 -2.5 0 0.0 0 0.0 12 68
636 A 716 ARG R E E DG - 645 0 -131.8 152.6 170.9 -145.8 7.5 160.9 0 0.0 638 -0.5 0 0.0 0 0.0 15 65
637 A 717 SER S E E DG - 644 0 -110.2 131.3 -176.7 -178.1 23.4 168.4 644 -1.8 644 -2.3 0 0.0 0 0.0 16 60
638 A 718 TYR Y + 0 0 -94.3 -49.2 -172.4 23.8 67.6 27.1 636 -0.5 0 0.0 0 0.0 0 0.0 11 54
639 A 719 ASP D S S S+ 0 0 -100.2 -22.1 -177.6 92.2 93.7 55.6 0 0.0 0 0.0 0 0.0 0 0.0 7 50
640 A 720 ASP D S t > TS- 0 0 -78.7 166.4 -178.9 -105.4 85.4 109.1 0 0.0 643 -1.2 0 0.0 0 0.0 8 46
641 A 721 ASN N T T 3 TS+ 0 0 -62.8 -21.9 179.1 54.5 120.3 45.4 0 0.0 0 0.0 0 0.0 0 0.0 9 46
642 A 722 ASN N T T 3 TS+ 0 0 -103.3 36.6 -179.8 156.5 84.4 98.4 0 0.0 233 -2.2 0 0.0 0 0.0 11 57
643 A 723 LYS K t < T + 0 0 -58.6 160.3 179.9 75.0 20.9 93.3 640 -1.2 0 0.0 0 0.0 0 0.0 16 52
644 A 724 GLY G E E DG S- 637 0 135.0 -165.4 -178.6 -22.9 80.9 151.2 637 -2.3 637 -1.8 0 0.0 0 0.0 16 56
645 A 725 ILE I E E DGB - 636 234 -89.3 137.9 179.7 -164.5 45.2 132.3 234 -3.0 234 -1.9 0 0.0 0 0.0 16 64
646 A 726 TYR Y E E DG - 635 0 -122.6 111.2 -179.5 -126.7 22.8 165.8 635 -2.5 635 -1.6 0 0.0 0 0.0 13 66
647 A 727 ALA A E E DG - 634 0 -57.1 144.6 178.0 -121.6 26.2 104.8 243 -0.5 0 0.0 0 0.0 0 0.0 11 62
648 A 728 GLY G e - 0 0 -83.6 159.6 -179.6 -73.0 45.2 119.2 633 -2.8 0 0.0 0 0.0 0 0.0 9 62
649 A 729 GLN Q - 0 0 -54.8 123.6 179.6 -151.6 55.1 107.3 0 0.0 0 0.0 0 0.0 0 0.0 8 65
650 A 730 PRO P - 0 0 -85.6 -175.8 177.3 -42.8 49.9 99.8 0 0.0 0 0.0 0 0.0 0 0.0 13 49
651 A 731 ARG R S S S- 0 0 -49.5 126.3 -178.5 -171.0 72.4 108.7 0 0.0 0 0.0 0 0.0 0 0.0 14 47
652 A 732 THR T E E C F - 0 626 -131.7 130.9 -179.7 -154.2 14.2 174.2 626 -2.4 626 -2.9 0 0.0 0 0.0 13 51
653 A 733 LEU L E E CGF + 153 625 -103.2 141.5 179.3 174.3 20.0 145.9 153 -2.5 153 -2.3 0 0.0 0 0.0 12 49
654 A 734 TYR Y E E CGF - 152 624 -145.3 158.1 176.5 -155.0 20.5 166.6 624 -2.3 624 -2.7 0 0.0 0 0.0 12 51
655 A 735 MET M E E CGF - 151 623 -130.8 145.8 178.5 -161.2 12.9 167.5 151 -1.8 151 -2.4 0 0.0 0 0.0 11 46
656 A 736 GLN Q E E CGF + 150 622 -128.4 148.7 177.5 179.1 8.9 162.6 622 -2.8 622 -2.2 0 0.0 0 0.0 13 55
657 A 737 GLY G E E CGF + 149 621 -146.6 139.1 177.6 174.9 3.7 172.0 149 -2.5 149 -2.4 0 0.0 0 0.0 11 45
658 A 738 SER S E E CGF - 148 620 -147.1 149.0 177.6 -165.0 9.8 176.6 620 -1.9 620 -2.2 0 0.0 0 0.0 12 48
659 A 739 LEU L E E CG - 147 0 -132.4 148.9 179.5 -168.0 0.9 167.2 147 -3.1 147 -2.6 0 0.0 0 0.0 11 35
660 A 740 LYS K E E CG 146 0 -140.1 122.1 179.1 999.9 999.9 169.4 617 -1.5 0 0.0 0 0.0 0 0.0 10 37
661 A 741 PHE F E E CG 145 0 -119.5 999.9 999.9 999.9 999.9 132.8 145 -3.6 145 -1.5 0 0.0 0 0.0 7 28
1kmoA.pdb
1KMO MEMBRANE PROTEIN MOL_ID: 1; MOL_ID: 1
author author
Kabs/Sand SSTT HHHHHT SS EEEEEGGGTGGGT SHHHHHTTSTTEE SBTTB STTS EETTS GGG SSEEEETTEE SSSTTT S Kabs/Sand
chirality +--+++++----++++++-+-++----++++++-+++-+++++++-++-+---++-+++-++--+----+--+--+++--+---+--+-+++++++-++ chirality
bends SSSS SSSSSS SS SSSSSSS SSSSSSSSSSS S SSS SSSS SSSS SSS SS SSSS SSSSSS S bends
turns TTTTTTTTTTTT TTTTTTTTTT TTTTTTTTTTTT TTTTTTTTT TTTT TTTTT TTTT TTTTT turns
5-turns >5555< 5-turns
3-turns >33< >33< >>33<< >33X>3>3<<>33< >33< >>3<< >33< 3-turns
bridge-2 DD bridge-2
bridge-1 AAAAA BB A A BB cccc DD bridge-1
sheets AAAAA BB BB AAAA AA sheets
4-turns >>>4<<< >444< >>>4<<< >444< 4-turns
summary StTTthHHHHHhtSSeEEEEEeGGgGGGgt hHHHHHhTtTeEE SBTTBttTTt EEeTt gGGGgSSEEEEeTEEeSStTTTt S summary
sequence ALTVVGDWLGDARENDVFEHAGARDVIRREDFAKTGATTMREVLNRIPGVSAPENNGTGSHDLAMNFGIRGLNPRLASRSTVLMDGIPVPFAPYGQPQLS sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand S GGGEEEEEEE SS TTTS SSGGG EEEEEE SS EEEEEEEEEE TTSS EEEEEEEEEEE TTSEEEEEEEEEEEE SSSS EEE Kabs/Sand
chirality --+--+++------++++++++-+++++------------+-+-+++----+--++-+++----+---+++---+-+++---++--++---+-+++--+- chirality
bends S SSS S SS SSSS SS SS SS SSSS SSS S SSSS bends
turns TTTTT TTTTT TTTTT TTTT TTTT turns
5-turns 5-turns
3-turns >>3<< >>3<< >33< >33< 3-turns
bridge-2 E*EEEEE EEEEEE GGGGGGGGG HHHHHHHHHHH IIIIIIIIIIII JJJ bridge-2
bridge-1 AAAAA cccc FFFFFFFFF FFFFFFFFF HHHHHHHHHHH III bridge-1
sheets AAAAAAA AAAAAA CCCCCCCCCC CCCCCCCCCCC CCCCCCCCCCCC CCC sheets
4-turns >444< 4-turns
summary S gGGeEEEEEEEeSStTTTt SgGGGeEEEEEEe SS EEEEEEEEEEtTTtS eEEEEEEEEEEEeTTeEEEEEEEEEEEEe SSSS eEEE summary
sequence LAPVSLGNMDAIDVVRGGGAVRYGPQSVGGVVNFVTRAIPQDFGIEAGVEGQLSPTSSQNNPKETHNLMVGGTADNGFGTALLYSGTRGSDWREHSATRI sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand EEEEEEEEE SSSSEEEEEEEEEEEEEEE B HHHHHH SS S TT EEEEEEEEEEEEEEE SSTTEEEEEEEEEEEEEEEEEEEETTEEEE E Kabs/Sand
chirality -++-----++--+++-------+++-+--------+++++--++--+++++-++-----+-+---++--+++--+--+-----+++-+-+--+------- chirality
bends SSSS SSSSSS SS S SS SSSS SS bends
turns TTTTTTTT TTTT TTTT TTTT turns
5-turns 5-turns
3-turns >33< >33< >33< 3-turns
bridge-2 JJJJJJJJJ KKKKKKKKKKKKKKK LLLLLLLLLLLLLLL MMMMMMMMMMMMMM NNNN OOOO P bridge-2
bridge-1 IIIIIIIII JJJJJJJJJJJJ B KKKKKKKKKKKKKKK LLLLLLLLLLLLLLL NNNN M bridge-1
sheets CCCCCCCCC CCCCCCCCCCCCCCC CCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCC CCCC C sheets
4-turns >>>><<<< 4-turns
summary EEEEEEEEEeSSSeEEEEEEEEEEEEEEEe BhHHHHHHhSS StTTeEEEEEEEEEEEEEEEeStTeEEEEEEEEEEEEEEEEEEEETeEEEEeeE summary
sequence DDLMLKSKYAPDEVHTFNSLLQYYDGEADMPGGLSRADYDADRWQSTRPYDRFWGRRKLASLGYQFQPDSQHKFNIQGFYTQTLRSGYLEQGKRITLSPR sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand EEEEEEEEEEEEEEEEETTEEEEEEEEEEEEEEEEEEEEEEEETTSSS TTS EEEEEEEEEEEEEEEEEEEEEETTEEEEEEEEEEEEEEEEEETTT Kabs/Sand
chirality --+++------+-+----+-----++---+------+------++-+--+-++---+++-++--------+----+--+----+-------+-----++- chirality
bends SSSS SSSSS SSS S SS SSS bends
turns TTTT TTTT TTTT TTTT TTTT turns
5-turns 5-turns
3-turns >33< >33< >33< >33< 3-turns
bridge-2 PPPPPPP QQQQQQQQ RRRRRRRRRRRRRR SSSS TTTTTTTTTTTTT UUU VVVVVVVVVVVVVVVVV bridge-2
bridge-1 MMMMMMMMMMMMM QQQQQQQQ PPPPPPPP OOOO S*SSS RRRRRRRRRRRRRR UUU TTTTTTTTTTTTT bridge-1
sheets CCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCC sheets
4-turns >444 4-turns
summary EEEEEEEEEEEEEEEEETTEEEEEEEEEEEEEEEEEEEEEEEEeTtSS tTTteEEEEEEEEEEEEEEEEEEEEEETeEEEEEEEEEEEEEEEEEEeTT summary
sequence NYWVRGIEPRYSQIFMIGPSAHEVGVGYRYLNESTHEMRYYTATSSGQLPSGSSPYDRDTRSGTEAHAWYLDDKIDIGNWTITPGMRFEHIESYQNNAIT sequence
310 320 330 340 350 360 370 380 390 400
author author
Kabs/Sand EEEEEEEEEEEEEEEEEEEETTEEEEEEEEEEEE GGGHHHHHHTS EEEEEEEEEEEEE SSEEEEEEEEEEEEEEESS SSS TT EE Kabs/Sand
chirality +-----+-----+------+--++---++-+--------+++++++++-+++---+-----+---++-++++--+------+++-+--+-+---++---+ chirality
bends SSSS SSSSSSSSSSS SS SS SSS SS bends
turns T TTTT TTTTTTTTTTTT TTTT turns
5-turns 5-turns
3-turns >33< >>3<< >33< >33< 3-turns
bridge-2 WWWWWW*W XXXXXXXXXXXX YYYYYYYYYYYY ZZZZZZZZZZZZ**Z bridge-2
bridge-1 VVVVVVVVVVVVVVVVV WWWWWWW XXXXXXXXXXXX YYYYYYYYYYYY Z* bridge-1
sheets CCCCCCCCCCCCCCCCCCCC CCCCCCCCCCCC CCCCCCCCCCCCC CCCCCCCCCCCCCCC CC sheets
4-turns < >44>X>><<<< 4-turns
summary teEEEEEEEEEEEEEEEEEEEETeEEEEEEEEEEEE gGGhHHHHHHht EEEEEEEEEEEEEeSeEEEEEEEEEEEEEEESS SSS tTTt EE summary
sequence GTHEEVSYNAPLPALNVLYHLTDSWNLYANTEGSFGTVQYSQIGKAVQSGNVEPEKARTWELGTRYDDGALTAEMGLFLINFNNQYDSNQTNDTVTARGK sequence
410 420 430 440 450 460 470 480 490 500
author author
Kabs/Sand EEEEEEEEEEEEEGGGT GGGTTEEEEEEEEEEEEEE SSSTTTT B TT SEEEEEEEEE TTEEEEEEEEEE B SSTT S TTSSSS B Kabs/Sand
chirality --++--++-----+++--++++++-+--+----++-++-+-++++---++--+++--+---++--+----+--++-----+-+---+---+-+++----- chirality
bends SSSS SSSSS SSSSSSS SS SS SS SSSS S SSSSSS bends
turns TTTTTTTTTTTT TTTTTT TTTT TTTT TTTT TTTT turns
5-turns 5-turns
3-turns >>3<<>>3X<3< >3><3< >33< >33< >33< >33< 3-turns
bridge-2 AAAAAAAAAAAAA BBBBBBBBB C CCCCCCCC DDDDDDDDDD bridge-2
bridge-1 ZZZZZZZZZZZZ AAAAAAAAAAAAA C BBBBBBBBB CCCCCCCC D D bridge-1
sheets CCCCCCCCCCCCC CCCCCCCCCCCCCC CCCCCCCCC CCCCCCCCCC sheets
4-turns >444< 4-turns
summary EEEEEEEEEEEEEeGGggGGGgeEEEEEEEEEEEEEEeSStTTTTtBtTTt eEEEEEEEEEetTeEEEEEEEEEEe B StTTt S tTTtSSS B summary
sequence TRHTGLETQARYDLGTLTPTLDNVSIYASYAYVNAEIREKGDTYGNLVPFSPKHKGTLGVDYKPGNWTFNLNSDFQSSQFADNANTVKESADGSTGRIPG sequence
510 520 530 540 550 560 570 580 590 600
author author
Kabs/Sand EEEEEEEEEEE TTTT EEEEEEESTT EEEE SSTT EEEE SEEEEEEEEEE Kabs/Sand
chirality ---+---+-----++-----+-+--+-+---+-----++-+++---------+--++-- chirality
bends SSSS SSSS SSSS S S bends
turns TTTTTT TTTT TTTT turns
5-turns >5555< 5-turns
3-turns >33< >33< >33< 3-turns
bridge-2 EEEEEE FFFFFFF B FFFFFFF bridge-2
bridge-1 DDDDDDDDDD EEEEEE GGGG GGGG GGGGGGGGG bridge-1
sheets CCCCCCCCCCC CCCCCCC DDDD DDDD CCCCCCCCCC sheets
4-turns >444< 4-turns
summary EEEEEEEEEEEetTTTTteEEEEEEEtTTt eEEEE StTTtEEEEe SEEEEEEEEEE summary
sequence FMLWGARVAYDFGPQMADLNLAFGVKNIFDQDYFIRSYDDNNKGIYAGQPRTLYMQGSLKF sequence
610 620 630 640 650 660
Messages
there are 32 strands. Labels have restarted