Secondary structure calculation program - copyright by David Keith Smith, 1989
1nglA.pdb
1NGL TRANSPORT PROTEIN MOL_ID: 1; MOL_ID: 1;
Sequence length - 179
A A K K hydrogen bonding Ooi's
strk chain/ l amino u & S structure bridge dihedral angles donor acceptor donor acceptor N N
num seq.no t acids t S + patterns partners phi psi omega alpha kappa tco to/energy fr/energy to/energy fr/energy 8 14
1 A 1 MET M 0 0 999.9 -139.6 -178.2 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 4 6
2 A 2 GLN Q + 0 0 57.2 40.0 179.4 83.8 999.9 24.9 0 0.0 0 0.0 0 0.0 0 0.0 3 6
3 A 3 ASP D S S S- 0 0 -155.8 178.6 179.4 -38.8 96.9 158.7 0 0.0 0 0.0 0 0.0 0 0.0 4 7
4 A 4 SER S S S S+ 0 0 -47.3 128.1 -175.2 170.9 73.0 100.4 0 0.0 0 0.0 0 0.0 0 0.0 5 8
5 A 5 THR T - 0 0 -132.1 -165.8 -174.5 -77.5 42.0 122.5 0 0.0 7 -0.7 0 0.0 0 0.0 5 8
6 A 6 SER S S S S+ 0 0 -106.3 75.3 172.4 113.9 78.0 121.3 0 0.0 0 0.0 0 0.0 0 0.0 4 13
7 A 7 ASP D + 0 0 -121.2 30.3 -172.1 118.2 39.0 97.9 5 -0.7 0 0.0 0 0.0 0 0.0 4 16
8 A 8 LEU L + 0 0 -67.2 -40.0 -169.0 97.7 43.1 35.2 0 0.0 0 0.0 0 0.0 0 0.0 4 16
9 A 9 ILE I - 0 0 -62.9 138.7 179.3 -143.3 64.4 111.1 0 0.0 0 0.0 0 0.0 0 0.0 6 17
10 A 10 PRO P - 0 0 -84.6 -175.6 177.0 -56.2 46.6 100.7 0 0.0 0 0.0 0 0.0 0 0.0 4 16
11 A 11 ALA A - 0 0 -66.8 124.8 -179.8 -123.3 61.1 118.7 0 0.0 0 0.0 0 0.0 0 0.0 4 19
12 A 12 PRO P - 0 0 -73.4 127.5 -179.6 -137.7 25.6 123.1 0 0.0 0 0.0 0 0.0 0 0.0 8 22
13 A 13 PRO P g > T - 0 0 -76.9 175.2 -179.8 -97.0 29.0 98.3 0 0.0 16 -0.9 0 0.0 0 0.0 6 18
14 A 14 LEU L G G > TS+ 0 0 -71.8 0.0 -174.3 112.0 92.6 64.7 0 0.0 17 -2.5 0 0.0 0 0.0 6 25
15 A 15 SER S G G 3 TS+ 0 0 -49.9 -28.4 175.6 47.0 80.5 31.7 0 0.0 0 0.0 0 0.0 0 0.0 7 26
16 A 16 LYS K G G < TS+ 0 0 -93.9 27.0 -168.6 66.5 106.9 95.1 13 -0.9 0 0.0 0 0.0 0 0.0 9 39
17 A 17 VAL V g < T + 0 0 -145.0 39.6 179.1 142.9 62.8 91.8 14 -2.5 0 0.0 0 0.0 0 0.0 7 39
18 A 18 PRO P - 0 0 -78.2 174.9 -175.0 -134.7 37.8 97.9 0 0.0 0 0.0 0 0.0 0 0.0 8 33
19 A 19 LEU L - 0 0 -138.0 150.5 -174.7 -94.3 21.8 164.6 0 0.0 0 0.0 0 0.0 0 0.0 9 34
20 A 20 GLN Q - 0 0 -63.8 146.5 177.4 -120.5 40.8 109.3 111 -1.7 0 0.0 0 0.0 0 0.0 11 34
21 A 21 GLN Q - 0 0 -63.1 -150.0 -177.3 -55.6 60.6 64.9 0 0.0 0 0.0 0 0.0 0 0.0 6 26
22 A 22 ASN N S S S+ 0 0 -85.6 33.0 -178.6 163.9 78.8 90.4 0 0.0 0 0.0 0 0.0 0 0.0 6 25
23 A 23 PHE F - 0 0 -50.6 153.3 -172.1 -116.6 35.6 92.1 0 0.0 0 0.0 0 0.0 0 0.0 8 29
24 A 24 GLN Q h > T - 0 0 -101.4 156.1 177.6 -139.3 4.3 135.7 0 0.0 28 -1.0 0 0.0 0 0.0 7 34
25 A 25 ASP D H H > TS+ 0 0 -73.3 -37.4 -167.4 68.5 96.0 38.8 0 0.0 29 -1.2 0 0.0 0 0.0 9 40
26 A 26 ASN N H H 4 TS+ 0 0 -64.1 -24.2 179.6 22.7 116.6 36.8 0 0.0 0 0.0 0 0.0 0 0.0 6 27
27 A 27 GLN Q H H 4 TS+ 0 0 -112.8 -17.5 -176.6 70.9 111.7 55.2 0 0.0 0 0.0 0 0.0 0 0.0 6 30
28 A 28 PHE F H H < T + 0 0 -70.0 -29.3 -172.8 106.0 69.7 39.9 24 -1.0 0 0.0 0 0.0 0 0.0 8 47
29 A 29 GLN Q h < T + 0 0 -59.8 123.8 -173.1 115.1 50.9 110.9 25 -1.2 0 0.0 0 0.0 0 0.0 11 45
30 A 30 GLY G e - 0 0 -164.1 -156.6 -175.6 -78.9 65.2 142.3 0 0.0 57 -2.5 0 0.0 0 0.0 9 41
31 A 31 LYS K E E AA - 56 0 -135.3 107.6 -176.7 -171.7 39.3 155.9 0 0.0 0 0.0 0 0.0 0 0.0 9 49
32 A 32 TRP W E E AA - 55 0 -97.5 163.1 172.4 -124.2 23.4 131.0 55 -2.3 55 -1.5 0 0.0 34 -0.5 11 49
33 A 33 TYR Y E E AAB - 54 140 -103.0 122.9 -176.2 -121.1 29.8 149.9 140 -1.1 140 -2.2 0 0.0 0 0.0 12 54
34 A 34 VAL V E E A B + 0 139 -67.6 120.5 -167.4 166.1 42.1 117.5 53 -2.0 0 0.0 32 -0.5 0 0.0 13 58
35 A 35 VAL V E E A * + 0 0 -124.6 -3.3 172.7 8.7 54.7 58.5 138 -2.6 0 0.0 0 0.0 0 0.0 13 58
36 A 36 GLY G E E A B - 0 138 -170.2 160.7 -173.7 -156.7 54.5 172.2 138 -1.0 138 -0.8 0 0.0 0 0.0 13 55
37 A 37 LEU L E E ACB + 168 137 -150.3 123.3 -179.6 157.5 18.2 157.6 168 -1.8 168 -1.6 0 0.0 0 0.0 13 59
38 A 38 ALA A E E ACB + 167 136 -146.7 135.6 172.9 133.0 11.4 165.4 136 -2.0 136 -4.1 0 0.0 0 0.0 13 50
39 A 39 GLY G E E ACB> T - 166 135 -170.4 169.3 -177.1 -108.2 57.1 172.3 166 -1.6 166 -1.2 0 0.0 42 -0.7 12 43
40 A 40 ASN N T e 3 TS+ 0 0 -77.1 -25.4 -177.8 38.1 120.5 40.2 134 -1.0 0 0.0 0 0.0 0 0.0 11 30
41 A 41 ALA A T T 3 TS+ 0 0 -109.4 19.6 -174.8 115.8 92.8 86.3 134 -0.7 0 0.0 0 0.0 0 0.0 9 28
42 A 42 ILE I t < T - 0 0 -96.2 137.4 -176.9 -137.2 61.1 138.9 39 -0.7 44 -1.1 0 0.0 0 0.0 10 36
43 A 43 LEU L + 0 0 -97.4 94.9 172.3 171.0 27.2 133.5 0 0.0 45 -0.9 0 0.0 0 0.0 5 30
44 A 44 ARG R + 0 0 -99.7 105.6 178.5 173.4 10.2 143.5 42 -1.1 0 0.0 0 0.0 0 0.0 11 30
45 A 45 GLU E - 0 0 -113.0 135.3 176.3 -145.1 34.6 156.8 43 -0.9 0 0.0 48 -0.8 0 0.0 6 22
46 A 46 ASP D S S S+ 0 0 -60.0 -40.1 179.1 52.6 105.8 22.7 0 0.0 0 0.0 0 0.0 0 0.0 5 18
47 A 47 LYS K S S S+ 0 0 -61.9 -40.1 -175.5 31.2 121.2 28.2 0 0.0 0 0.0 0 0.0 0 0.0 4 10
48 A 48 ASP D S S S- 0 0 -126.2 82.1 179.6 -172.0 79.8 133.8 0 0.0 45 -0.8 0 0.0 0 0.0 6 16
49 A 49 PRO P - 0 0 -70.0 150.2 -179.0 -114.4 27.5 109.6 0 0.0 51 -0.6 0 0.0 0 0.0 8 24
50 A 50 GLN Q - 0 0 -91.3 125.2 174.2 -132.6 21.9 140.3 0 0.0 0 0.0 0 0.0 0 0.0 7 32
51 A 51 LYS K - 0 0 -69.0 140.3 -178.9 -117.1 29.2 116.2 49 -0.6 0 0.0 0 0.0 0 0.0 7 37
52 A 52 MET M - 0 0 -77.8 152.4 175.1 -177.5 35.8 120.0 0 0.0 0 0.0 0 0.0 0 0.0 12 46
53 A 53 TYR Y e - 0 0 -130.4 -161.5 -178.0 -108.6 20.5 120.9 0 0.0 34 -2.0 0 0.0 0 0.0 11 47
54 A 54 ALA A E E AAD - 33 70 -135.0 154.8 179.9 -164.3 18.9 163.1 70 -2.4 70 -4.1 0 0.0 0 0.0 11 52
55 A 55 THR T E E AAD - 32 69 -143.3 133.8 -177.2 -152.7 7.2 173.4 32 -1.5 32 -2.3 0 0.0 0 0.0 12 52
56 A 56 ILE I E E AAD - 31 68 -110.1 131.2 -178.4 -147.1 8.8 153.9 68 -3.7 68 -2.4 0 0.0 58 -0.7 12 48
57 A 57 TYR Y E E A D + 0 67 -99.7 113.5 -176.5 178.8 20.3 147.1 30 -2.5 59 -0.6 0 0.0 0 0.0 12 51
58 A 58 GLU E E E A D - 0 66 -119.3 113.5 -179.9 -154.2 12.8 158.7 66 -1.2 66 -3.2 56 -0.7 0 0.0 10 36
59 A 59 LEU L E E A D - 0 65 -79.9 160.5 175.4 -147.3 7.1 117.0 57 -0.6 0 0.0 0 0.0 0 0.0 12 34
60 A 60 LYS K E E >A D T - 0 64 -125.2 154.7 -176.7 -96.8 35.0 152.1 64 -2.6 62 -3.1 0 0.0 64 -0.8 8 26
61 A 61 GLU E T T 4 TS+ 0 0 -63.1 38.3 176.2 69.4 114.8 83.2 0 0.0 0 0.0 0 0.0 0 0.0 5 19
62 A 62 ASP D T T 4 TS- 0 0 -149.1 59.1 -177.3 -94.1 117.8 110.2 60 -3.1 0 0.0 0 0.0 0 0.0 5 22
63 A 63 LYS K T T 4 TS+ 0 0 25.9 60.2 177.2 111.1 93.0 35.5 0 0.0 0 0.0 0 0.0 0 0.0 9 32
64 A 64 SER S E E TS- 0 0 -148.0 176.7 -179.7 -66.7 94.2 153.2 0 0.0 92 -1.2 0 0.0 0 0.0 6 26
90 A 90 PRO P T T 3 TS+ 0 0 -74.5 138.6 -173.4 44.7 113.3 116.8 0 0.0 0 0.0 0 0.0 0 0.0 11 35
91 A 91 GLY G T T 3 TS+ 0 0 111.4 -24.6 178.7 72.3 104.6 87.0 0 0.0 0 0.0 0 0.0 0 0.0 12 42
92 A 92 GLU E e < T + 0 0 -126.9 130.3 178.1 158.2 55.5 167.2 89 -1.2 87 -3.9 0 0.0 0 0.0 12 41
93 A 93 PHE F E E AFG - 86 109 -138.5 168.8 174.1 -146.6 22.2 158.9 109 -2.7 109 -4.2 0 0.0 0 0.0 13 48
94 A 94 THR T E E AFG - 85 108 -131.5 169.9 -178.1 -124.5 15.5 146.4 85 -3.5 85 -2.4 0 0.0 0 0.0 13 44
95 A 95 LEU L E E AF > T - 84 0 -116.5 144.2 171.7 -18.8 66.9 158.4 107 -0.9 98 -0.7 0 0.0 0 0.0 12 47
96 A 96 GLY G T e 3 TS- 0 0 74.6 -126.5 173.6 -62.0 104.5 122.4 83 -1.2 0 0.0 0 0.0 0 0.0 9 37
97 A 97 ASN N T T > > T + 0 0 -151.6 56.1 -166.4 171.6 59.9 117.6 0 0.0 100 -1.5 0 0.0 101 -1.0 7 29
98 A 98 ILE I T T 4 < TS+ 0 0 -54.2 -19.3 173.2 59.7 79.3 35.1 95 -0.7 0 0.0 0 0.0 0 0.0 12 30
99 A 99 LYS K T T 4 3 TS+ 0 0 -68.6 -42.5 -177.9 29.1 117.9 23.3 0 0.0 0 0.0 0 0.0 0 0.0 6 23
100 A 100 SER S T T 4 < TS+ 0 0 -93.8 -0.6 -168.2 107.4 104.0 72.5 97 -1.5 0 0.0 0 0.0 0 0.0 5 16
101 A 101 TYR Y t < T - 0 0 -92.2 149.5 -179.5 -151.7 56.1 130.1 97 -1.0 0 0.0 0 0.0 0 0.0 9 20
102 A 102 PRO P S S S+ 0 0 -76.5 -77.0 -173.1 15.7 91.1 11.4 0 0.0 0 0.0 0 0.0 0 0.0 7 18
103 A 103 GLY G S e S+ 0 0 -88.8 5.3 173.0 90.6 108.0 61.0 0 0.0 129 -3.2 0 0.0 0 0.0 6 20
104 A 104 LEU L E E A H + 0 128 -100.1 123.0 -167.3 175.5 51.9 145.4 0 0.0 0 0.0 0 0.0 0 0.0 10 26
105 A 105 THR T E E A * - 0 0 -101.3 -46.6 -177.1 -8.9 59.5 31.7 127 -3.0 0 0.0 0 0.0 0 0.0 13 25
106 A 106 SER S E E A H + 0 127 -159.6 108.2 -177.6 178.8 55.2 140.5 127 -1.9 127 -1.9 0 0.0 108 -0.6 9 34
107 A 107 TYR Y E E A H + 0 126 -117.9 105.5 179.0 167.1 11.5 151.8 0 0.0 95 -0.9 0 0.0 0 0.0 12 42
108 A 108 LEU L E E AGH - 94 125 -119.1 137.0 -179.3 -166.4 12.9 160.0 125 -2.7 125 -2.0 106 -0.6 0 0.0 11 42
109 A 109 VAL V E E AGH + 93 124 -122.4 135.4 176.0 168.5 12.0 165.2 93 -4.2 93 -2.7 0 0.0 0 0.0 13 51
110 A 110 ARG R E E A H - 0 123 -146.1 104.4 177.0 -142.5 25.9 142.4 123 -1.7 123 -1.2 0 0.0 0 0.0 12 48
111 A 111 VAL V E E A H - 0 122 -62.3 140.2 -175.8 -150.1 13.0 108.9 0 0.0 20 -1.7 0 0.0 0 0.0 14 58
112 A 112 VAL V E E A * - 0 0 -80.4 -69.8 176.9 -22.5 65.4 15.6 121 -2.7 0 0.0 0 0.0 0 0.0 12 40
113 A 113 SER S E E A * - 0 0 -145.6 129.8 -178.2 -152.2 61.4 169.0 0 0.0 121 -1.8 0 0.0 0 0.0 11 40
114 A 114 THR T E E A H - 0 120 -101.5 148.1 171.3 -176.7 15.1 144.0 0 0.0 0 0.0 0 0.0 0 0.0 9 47
115 A 115 ASN N E E >A H> T - 0 119 -131.6 64.3 -164.9 -174.4 10.9 131.9 119 -2.2 118 -4.8 0 0.0 119 -0.8 7 38
116 A 116 TYR Y T T 4 3 TS+ 0 0 -49.5 -7.9 173.8 58.3 81.9 47.7 0 0.0 0 0.0 0 0.0 0 0.0 9 38
117 A 117 ASN N T T 4 3 TS- 0 0 -93.2 -6.8 178.8 -2.6 133.7 54.0 0 0.0 0 0.0 0 0.0 0 0.0 6 25
118 A 118 GLN Q T T 4 < TS- 0 0 -141.6 -69.0 -173.9 -24.3 120.9 64.0 115 -4.8 0 0.0 0 0.0 0 0.0 11 30
119 A 119 HIS H E E T - 104 131 -98.5 167.9 -174.7 -65.0 60.2 120.2 131 -1.8 131 -2.0 0 0.0 0 0.0 10 27
129 A 129 GLN Q T e 3 TS- 0 0 -19.8 -50.1 175.7 -10.0 132.3 40.2 103 -3.2 0 0.0 0 0.0 0 0.0 8 20
130 A 130 ASN N T T 3 TS+ 0 0 -146.2 39.5 175.5 100.5 114.8 90.1 0 0.0 0 0.0 0 0.0 0 0.0 6 18
131 A 131 ARG R E E A I< T - 0 128 -126.2 137.5 -177.5 -160.5 48.5 165.4 128 -2.0 128 -1.8 0 0.0 133 -0.6 6 21
132 A 132 GLU E E E A I + 0 127 -120.8 111.7 179.4 146.1 26.3 156.2 0 0.0 0 0.0 0 0.0 0 0.0 8 22
133 A 133 TYR Y E E A I - 0 126 -140.9 150.1 176.7 -170.5 20.6 174.1 126 -1.9 126 -1.9 131 -0.6 0 0.0 11 32
134 A 134 PHE F E E A I - 0 125 -140.7 151.5 -176.0 -164.5 3.4 167.4 0 0.0 40 -1.0 0 0.0 41 -0.7 11 42
135 A 135 LYS K E E ABI - 39 124 -137.2 143.7 177.0 -158.8 6.1 174.4 124 -3.2 124 -3.9 0 0.0 0 0.0 13 47
136 A 136 ILE I E E ABI - 38 123 -123.5 130.0 -175.6 -177.5 18.2 165.6 38 -4.1 38 -2.0 0 0.0 0 0.0 11 58
137 A 137 THR T E E ABI - 37 122 -126.0 159.1 171.7 -153.5 19.0 158.4 122 -1.7 122 -3.1 0 0.0 0 0.0 13 63
138 A 138 LEU L E E ABI + 36 121 -128.3 130.1 -177.0 169.6 24.6 170.7 36 -0.8 35 -2.6 0 0.0 36 -1.0 13 64
139 A 139 TYR Y E E ABI - 34 120 -134.9 175.4 -174.8 -114.4 32.6 141.7 120 -1.7 120 -1.6 0 0.0 141 -0.6 12 60
140 A 140 GLY G E E AB - 33 0 -120.9 108.0 178.1 -175.5 15.9 152.1 33 -2.2 33 -1.1 0 0.0 0 0.0 15 53
141 A 141 ARG R S S S+ 0 0 -77.7 1.8 177.0 70.5 73.6 59.5 139 -0.6 0 0.0 0 0.0 0 0.0 13 46
142 A 142 THR T S S S- 0 0 -110.8 172.8 179.6 -107.9 97.0 129.5 0 0.0 0 0.0 0 0.0 0 0.0 11 34
143 A 143 LYS K S S S+ 0 0 -69.9 -27.4 179.7 14.6 103.8 34.3 0 0.0 0 0.0 0 0.0 0 0.0 5 31
144 A 144 GLU E - 0 0 -144.0 154.4 176.4 -169.6 63.9 173.6 0 0.0 0 0.0 0 0.0 0 0.0 6 31
145 A 145 LEU L - 0 0 -118.1 -143.5 179.0 -68.8 42.0 98.6 0 0.0 0 0.0 0 0.0 0 0.0 9 34
146 A 146 THR T t > T - 0 0 -117.1 147.0 179.2 -134.1 24.1 154.0 0 0.0 149 -1.1 0 0.0 0 0.0 7 28
147 A 147 SER S T T > TS+ 0 0 -69.8 -19.6 173.6 60.8 110.4 35.0 0 0.0 150 -0.9 0 0.0 0 0.0 5 24
148 A 148 GLU E T h > 3 TS+ 0 0 -70.0 -28.2 -174.1 80.2 83.6 39.4 0 0.0 152 -2.9 0 0.0 0 0.0 6 20
149 A 149 LEU L H H > < TS+ 0 0 -54.4 -24.5 -178.9 59.7 86.6 38.3 146 -1.1 153 -1.8 0 0.0 0 0.0 8 40
150 A 150 LYS K H H > < TS+ 0 0 -69.8 -59.9 178.3 31.4 113.7 6.2 147 -0.9 154 -1.6 0 0.0 0 0.0 9 36
151 A 151 GLU E H H > TS+ 0 0 -62.8 -40.0 -176.6 57.4 118.9 27.0 0 0.0 155 -3.1 0 0.0 0 0.0 7 26
152 A 152 ASN N H H X TS+ 0 0 -62.1 -40.2 179.1 50.6 104.3 24.5 148 -2.9 156 -2.3 0 0.0 0 0.0 8 33
153 A 153 PHE F H H X TS+ 0 0 -65.7 -39.8 179.3 42.4 116.1 21.6 149 -1.8 157 -1.7 0 0.0 0 0.0 11 49
154 A 154 ILE I H H X TS+ 0 0 -70.1 -49.0 -174.5 47.1 115.9 20.8 150 -1.6 158 -3.1 0 0.0 0 0.0 10 38
155 A 155 ARG R H H X TS+ 0 0 -63.9 -43.7 178.9 47.1 114.0 19.5 151 -3.1 159 -2.9 0 0.0 0 0.0 8 27
156 A 156 PHE F H H X TS+ 0 0 -61.5 -55.8 178.1 39.5 119.2 8.2 152 -2.3 160 -1.9 0 0.0 0 0.0 9 38
157 A 157 SER S H H X TS+ 0 0 -60.3 -40.0 -178.9 53.3 116.3 25.8 153 -1.7 161 -3.9 0 0.0 0 0.0 11 46
158 A 158 LYS K H H X TS+ 0 0 -63.1 -46.6 -178.0 49.3 107.6 19.7 154 -3.1 162 -1.8 0 0.0 0 0.0 9 36
159 A 159 SER S H H < TS+ 0 0 -60.8 -40.1 -178.6 24.3 128.4 24.7 155 -2.9 0 0.0 0 0.0 0 0.0 7 28
160 A 160 LEU L H H < TS+ 0 0 -89.7 -48.7 -171.1 26.0 139.3 31.4 156 -1.9 0 0.0 0 0.0 0 0.0 10 31
161 A 161 GLY G H H < > TS- 0 0 -101.3 2.2 -177.9 -167.5 86.7 67.3 157 -3.9 164 -1.7 0 0.0 0 0.0 10 38
162 A 162 LEU L T h < 3 T - 0 0 36.9 -159.8 179.2 -50.4 59.2 84.8 158 -1.8 164 -0.8 0 0.0 0 0.0 8 34
163 A 163 PRO P T T 3 TS+ 0 0 -94.6 48.4 -170.1 143.7 88.3 115.4 0 0.0 0 0.0 0 0.0 0 0.0 7 35
164 A 164 GLU E S t < TS- 0 0 -60.0 -50.1 -173.0 -34.9 70.0 22.0 161 -1.7 0 0.0 162 -0.8 0 0.0 7 36
165 A 165 ASN N S S S- 0 0 -141.9 -125.3 -179.3 -23.5 109.3 101.9 0 0.0 167 -0.9 0 0.0 0 0.0 7 29
166 A 166 HIS H E E AC S+ 39 0 -97.8 55.7 -172.5 142.4 79.4 117.0 39 -1.2 39 -1.6 0 0.0 168 -1.0 12 35
167 A 167 ILE I E E AC + 38 0 -102.7 85.0 -176.2 113.6 28.6 136.9 165 -0.9 0 0.0 0 0.0 0 0.0 14 46
168 A 168 VAL V E E AC - 37 0 -141.1 177.7 175.5 -115.0 66.7 152.3 37 -1.6 37 -1.8 166 -1.0 0 0.0 9 50
169 A 169 PHE F + 0 0 -120.4 78.3 179.7 160.6 37.9 131.3 0 0.0 0 0.0 0 0.0 0 0.0 11 53
170 A 170 PRO P + 0 0 -83.0 32.8 -172.5 122.3 38.3 97.5 0 0.0 0 0.0 0 0.0 0 0.0 11 41
171 A 171 VAL V - 0 0 -109.1 107.0 179.5 -171.6 42.0 151.0 0 0.0 0 0.0 0 0.0 0 0.0 11 45
172 A 172 PRO P - 0 0 -74.1 -160.8 178.2 -104.3 32.5 80.4 0 0.0 0 0.0 0 0.0 0 0.0 7 38
173 A 173 ILE I + 0 0 -95.5 -87.7 172.7 139.2 59.6 41.6 0 0.0 0 0.0 0 0.0 0 0.0 6 37
174 A 174 ASP D - 0 0 50.2 44.8 178.1 -161.9 41.1 24.1 0 0.0 0 0.0 0 0.0 0 0.0 6 33
175 A 175 GLN Q g > T - 0 0 -60.0 140.1 -171.5 -131.0 19.3 105.1 0 0.0 178 -1.2 0 0.0 0 0.0 8 38
176 A 176 CYS C G G > TS+ 0 0 -75.8 -10.2 178.9 74.0 99.9 49.3 0 0.0 179 -1.2 0 0.0 0 0.0 7 35
177 A 177 ILE I G G 3 TS+ 0 0 -75.3 -11.6 179.3 58.5 91.5 47.7 0 0.0 0 0.0 0 0.0 0 0.0 4 29
178 A 178 ASP D G G < T 0 0 -94.2 -0.1 -179.6 999.9 999.9 63.6 175 -1.2 0 0.0 0 0.0 0 0.0 5 21
179 A 179 GLY G g < T 0 0 -114.4 999.9 999.9 999.9 999.9 127.7 176 -1.2 0 0.0 0 0.0 0 0.0 6 17
1nglA.pdb
1NGL TRANSPORT PROTEIN MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand SS S GGG S HHHH EEEEEEEEETT SSS EEEEEEETTTEEEEEEEEE SS EEEEEEEEEESSSTT EEETTTTT Kabs/Sand
chirality +-+-+++-----++++----+--+++++----++-++-++-++-++---------+---+-+-----------+---+-+------+-+++----++++ chirality
bends SS S SSS S SSS SS SSS SSS SS SSSSS S SSS bends
turns TTTTT TTTTTT TTTT TTTTT TTTT TTTTTT turns
5-turns 5-turns
3-turns >>3<< >33< >33< >3><3< 3-turns
bridge-2 BB*BBBB DDDDDDD EEEEEEEE FFF GG bridge-2
bridge-1 AAA CCC AAA DDDDDDD EEEEEEEE FFF bridge-1
sheets AAAAAAAAA AAAAAAA AAAAAAAAA AAAAAAAAAA AAA sheets
4-turns >>44<< >444< >444 4-turns
summary SS S gGGGg S hHHHHheEEEEEEEEEeTt SSS eEEEEEEETTTEEEEEEEEEeSSeEEEEEEEEEEeStTTeEEEeTTTT summary
sequence MQDSTSDLIPAPPLSKVPLQQNFQDNQFQGKWYVVGLAGNAILREDKDPQKMYATIYELKEDKSYNVTSVLFRKKKCDYWIRTFVPGCQPGEFTLGNIKS sequence
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author author
Kabs/Sand SSEEEEEEEEEEEETTTEEEEEEEEEETTEEEEEEEEEESSS TTHHHHHHHHHHHHHTTSSEEE GGG Kabs/Sand
chirality -+++-++-+------+-------++----+-+-----+--+-+---++++++++++++++--+--++-++--+--++ chirality
bends SS SSS SS SSS SSSSSSSSSSSSSSS SSSS SS bends
turns T TTTTT TTTT TTTTTTTTTTTTTTTTTTT TTTTT turns
5-turns 5-turns
3-turns >33< >33< >>3<< >33< >>3<< 3-turns
bridge-2 H*HHHHHH**HH IIIIIIIII IIIIIIIII bridge-2
bridge-1 GG HH*HHHHHHH BBBBBB CCC bridge-1
sheets AAAAAAAAAAAA AAAAAAAAAA AAAAAAAAAA AAA sheets
4-turns < >444< >>>>XXXXXXX<<<< 4-turns
summary tSeEEEEEEEEEEEETTTEEEEEEEEEEeTEEEEEEEEEESSS tThHHHHHHHHHHHHHhTtSEEE gGGGg summary
sequence YPGLTSYLVRVVSTNYNQHAMVFFKKVSQNREYFKITLYGRTKELTSELKENFIRFSKSLGLPENHIVFPVPIDQCIDG sequence
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