Secondary structure calculation program - copyright by David Keith Smith, 1989
2act-.pdb
2ACT HYDROLASE (PROTEINASE) ACTINIDIN (SULFHYDRYL PROTEINASE) (E.C. NUMBER NOT CHINESE GOOSEBERRY OR KIWIFRUIT (ACTINIDIA CHINENS
Sequence length - 218
A A K K hydrogen bonding Ooi's
strk chain/ l amino u & S structure bridge dihedral angles donor acceptor donor acceptor N N
num seq.no t acids t S + patterns partners phi psi omega alpha kappa tco to/energy fr/energy to/energy fr/energy 8 14
1 1 LEU L 0 0 999.9 154.5 -179.3 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 4 20
2 2 PRO P - 0 0 -65.1 164.4 179.8 -131.6 999.9 97.6 0 0.0 0 0.0 0 0.0 0 0.0 5 23
3 3 SER S S S S+ 0 0 -94.4 -11.9 -178.9 34.4 91.8 50.3 0 0.0 0 0.0 0 0.0 0 0.0 7 29
4 4 TYR Y + 0 0 -138.9 139.6 174.9 174.2 61.7 173.6 0 0.0 0 0.0 0 0.0 0 0.0 8 34
5 5 VAL V E E AA + 169 0 -144.7 132.1 177.1 168.5 3.4 165.9 169 -2.5 169 -2.3 0 0.0 0 0.0 11 40
6 6 ASP D E E AA > T - 168 0 -148.9 104.1 -177.9 -164.6 19.2 145.5 0 0.0 9 -1.2 0 0.0 0 0.0 10 43
7 7 TRP W G e >>TS+ 0 0 -64.4 -16.7 177.2 70.8 87.1 48.9 167 -3.1 12 -1.9 0 0.0 10 -1.0 12 48
8 8 ARG R G G >5TS+ 0 0 -66.6 -33.8 179.9 57.0 92.6 28.8 0 0.0 11 -1.4 0 0.0 0 0.0 8 46
9 9 A SER S G G <5TS+ 0 0 -73.4 -5.7 -178.6 53.1 104.3 50.8 6 -1.2 0 0.0 0 0.0 0 0.0 6 28
10 10 ALA A G G <5TS- 0 0 -107.8 6.3 -178.6 -112.6 114.0 71.7 7 -1.0 0 0.0 0 0.0 0 0.0 6 32
11 11 GLY G T g <5TS+ 0 0 69.6 22.8 -178.0 119.9 83.8 45.0 8 -1.4 0 0.0 0 0.0 0 0.0 8 32
12 12 ALA A t T - 0 0 -84.8 -14.0 -178.9 -165.4 23.9 42.8 183 -3.3 22 -0.9 0 0.0 0 0.0 13 49
20 20 GLY G T T 3 T - 0 0 70.1 -148.8 -176.8 -28.4 58.8 113.1 0 0.0 0 0.0 0 0.0 0 0.0 6 36
21 21 GLU E T T 3 TS+ 0 0 -82.3 -17.0 178.0 102.6 107.8 49.8 0 0.0 0 0.0 0 0.0 0 0.0 5 27
22 22 CYS C S t < TS- 0 0 -68.4 136.2 -179.6 -134.2 72.9 121.9 19 -0.9 24 -1.4 0 0.0 0 0.0 9 37
23 23 GLY G + 0 0 -86.8 50.4 -179.4 123.6 66.1 106.8 65 -1.7 0 0.0 0 0.0 0 0.0 10 49
24 24 GLY G h > > T + 0 0 -101.1 28.3 177.3 124.1 18.8 85.9 22 -1.4 27 -1.5 0 0.0 28 -1.4 13 59
25 25 CYS C H H > 3 T + 0 0 -55.2 -29.7 176.0 67.9 67.5 38.0 0 0.0 29 -2.8 0 0.0 0 0.0 12 65
26 26 TRP W H H > 3 TS+ 0 0 -53.2 -39.1 179.7 43.9 105.1 30.0 0 0.0 30 -1.9 0 0.0 0 0.0 15 73
27 27 ALA A H H > < TS+ 0 0 -73.5 -43.0 175.8 54.6 109.6 28.5 24 -1.5 31 -2.7 0 0.0 0 0.0 13 76
28 28 PHE F H H X TS+ 0 0 -53.9 -52.2 -178.9 44.5 112.9 23.4 24 -1.4 32 -2.6 0 0.0 0 0.0 13 81
29 29 SER S H H X TS+ 0 0 -64.8 -46.0 -179.1 47.5 112.9 23.6 25 -2.8 33 -1.8 0 0.0 0 0.0 14 76
30 30 ALA A H H X TS+ 0 0 -63.6 -43.0 -179.9 49.1 114.5 19.3 26 -1.9 34 -1.8 0 0.0 0 0.0 14 78
31 31 ILE I H H X TS+ 0 0 -61.0 -47.7 179.5 55.9 106.2 21.1 27 -2.7 35 -3.0 0 0.0 0 0.0 12 82
32 32 ALA A H H X TS+ 0 0 -53.6 -42.6 178.7 44.5 110.7 25.7 28 -2.6 36 -2.0 0 0.0 0 0.0 14 77
33 33 THR T H H X TS+ 0 0 -72.3 -30.8 177.5 51.4 111.6 31.8 29 -1.8 37 -2.6 0 0.0 0 0.0 15 82
34 34 VAL V H H X TS+ 0 0 -69.2 -41.0 175.1 52.3 109.3 24.2 30 -1.8 38 -2.5 0 0.0 0 0.0 10 74
35 35 GLU E H H X TS+ 0 0 -55.7 -47.2 178.6 48.6 111.3 21.9 31 -3.0 39 -1.9 0 0.0 0 0.0 15 65
36 36 GLY G H H X TS+ 0 0 -59.3 -51.5 -177.8 44.2 112.6 22.3 32 -2.0 40 -2.4 0 0.0 0 0.0 13 61
37 37 ILE I H H X TS+ 0 0 -66.2 -34.7 178.0 55.6 110.7 29.6 33 -2.6 41 -2.7 0 0.0 0 0.0 14 56
38 38 ASN N H H X TS+ 0 0 -62.0 -43.2 178.3 46.7 109.7 24.2 34 -2.5 42 -3.1 0 0.0 44 -0.5 15 49
39 39 LYS K H H X TS+ 0 0 -61.8 -49.3 -179.1 50.1 112.5 19.0 35 -1.9 43 -2.3 0 0.0 0 0.0 13 41
40 40 ILE I H H < TS+ 0 0 -55.2 -47.7 -176.4 32.2 121.7 25.4 36 -2.4 0 0.0 0 0.0 0 0.0 10 40
41 41 THR T H H < TS+ 0 0 -80.3 -46.4 -176.3 28.5 131.4 25.7 37 -2.7 0 0.0 0 0.0 0 0.0 8 31
42 42 A SER S H H < TS- 0 0 -91.4 -19.7 179.6 -127.5 95.6 51.1 38 -3.1 0 0.0 0 0.0 0 0.0 6 27
43 43 GLY G S h < TS+ 0 0 87.3 -1.2 -179.7 103.2 76.4 66.7 39 -2.3 0 0.0 0 0.0 0 0.0 7 27
44 44 A SER S - 0 0 -120.7 131.1 -178.3 -145.5 61.6 163.1 38 -0.5 46 -0.6 0 0.0 0 0.0 7 28
45 45 LEU L + 0 0 -97.2 123.2 -178.6 174.7 24.1 147.8 0 0.0 0 0.0 0 0.0 0 0.0 12 38
46 46 ILE I - 0 0 -131.0 135.5 176.2 -125.6 31.1 174.7 44 -0.6 0 0.0 0 0.0 0 0.0 9 42
47 47 SER S - 0 0 -81.8 127.7 -174.4 -152.7 35.3 133.8 0 0.0 86 -2.4 0 0.0 0 0.0 9 48
48 48 LEU L B B B - 85 0 -109.1 160.8 -175.4 -89.6 18.0 129.3 0 0.0 50 -0.6 0 0.0 0 0.0 12 57
49 49 SER S h > T + 0 0 -78.5 111.5 174.0 172.5 30.2 128.0 84 -2.1 53 -0.7 0 0.0 0 0.0 16 66
50 50 GLU E H H > TS+ 0 0 -76.2 -35.7 -178.0 63.6 85.0 33.7 48 -0.6 54 -2.2 0 0.0 0 0.0 12 77
51 51 GLN Q H H > TS+ 0 0 -57.3 -39.2 179.3 55.6 96.1 30.5 0 0.0 55 -2.9 0 0.0 0 0.0 12 65
52 52 GLU E H H > >TS+ 0 0 -61.9 -39.1 179.4 47.6 108.7 26.8 0 0.0 56 -2.8 0 0.0 57 -0.5 14 68
53 53 LEU L H H X 5TS+ 0 0 -67.2 -42.5 180.0 49.4 112.8 24.4 49 -0.7 57 -1.6 0 0.0 0 0.0 13 74
54 54 ILE I H H < 5TS+ 0 0 -59.5 -50.0 -176.8 31.6 122.5 21.0 50 -2.2 0 0.0 0 0.0 0 0.0 15 61
55 55 ASP D H H < 5TS+ 0 0 -79.2 -43.5 -176.2 25.1 133.3 27.0 51 -2.9 98 -0.6 0 0.0 0 0.0 13 53
56 56 CYS C H H < 5TS+ 0 0 -98.2 -17.3 -176.0 66.3 111.2 53.9 52 -2.8 0 0.0 0 0.0 0 0.0 10 54
57 57 GLY G h < T - 62 0 -162.3 135.3 175.9 -39.7 57.6 154.7 62 -2.5 62 -3.2 0 0.0 0 0.0 7 33
60 60 GLN Q T T 3 TS- 0 0 49.9 -119.8 -178.5 -7.1 130.1 103.9 0 0.0 0 0.0 0 0.0 0 0.0 5 23
61 61 ASN N T T 3 TS+ 0 0 -93.3 15.0 177.2 95.5 113.5 77.7 0 0.0 63 -0.7 0 0.0 0 0.0 8 27
62 62 THR T B B C < T + 59 0 -107.5 109.7 -172.3 163.4 46.9 158.3 59 -3.2 59 -2.5 0 0.0 0 0.0 12 40
63 63 ARG R g > T - 0 0 -129.5 66.1 177.9 -108.1 44.6 122.9 67 -2.9 66 -2.1 61 -0.7 0 0.0 12 38
64 64 GLY G G G > TS+ 0 0 52.3 -130.4 -178.1 2.5 97.9 100.3 0 0.0 67 -1.9 0 0.0 0 0.0 14 48
65 65 CYS C G G 3 TS+ 0 0 -67.1 -14.7 175.6 73.2 122.9 51.3 0 0.0 23 -1.7 0 0.0 0 0.0 11 46
66 66 ASP D G G < TS- 0 0 -72.9 -12.7 -177.2 -92.7 114.3 57.3 63 -2.1 0 0.0 0 0.0 0 0.0 9 38
67 67 GLY G g < T + 0 0 119.1 162.6 -178.6 169.6 51.7 117.3 64 -1.9 63 -2.9 0 0.0 0 0.0 12 46
68 68 GLY G - 0 0 174.6 -169.2 -176.8 -67.9 32.7 169.6 0 0.0 0 0.0 0 0.0 0 0.0 11 48
69 69 TYR Y h > > T - 0 0 -120.1 136.7 178.1 -134.5 24.2 161.4 0 0.0 72 -1.3 0 0.0 73 -1.1 10 54
70 70 ILE I H H > > TS+ 0 0 -45.0 -49.4 -178.2 56.4 106.9 31.0 0 0.0 74 -1.6 0 0.0 73 -0.9 14 66
71 71 THR T H H > 3 TS+ 0 0 -60.9 -27.7 177.6 57.0 99.7 42.9 0 0.0 75 -2.5 0 0.0 0 0.0 9 56
72 72 ASP D H H > < TS+ 0 0 -75.3 -24.9 174.1 56.4 103.9 37.1 69 -1.3 76 -2.0 0 0.0 0 0.0 11 58
73 73 GLY G H H X < TS+ 0 0 -66.1 -50.4 177.0 42.5 110.2 16.5 69 -1.1 77 -1.8 70 -0.9 0 0.0 14 70
74 74 PHE F H H X TS+ 0 0 -58.9 -44.8 -178.4 53.5 113.5 23.7 70 -1.6 78 -2.4 0 0.0 0 0.0 12 63
75 75 GLN Q H H X TS+ 0 0 -61.4 -37.2 176.6 54.8 104.2 31.6 71 -2.5 79 -3.1 0 0.0 0 0.0 9 48
76 76 PHE F H H X TS+ 0 0 -57.4 -52.7 -178.3 47.5 110.0 19.4 72 -2.0 80 -3.0 0 0.0 0 0.0 10 55
77 77 ILE I H H X >TS+ 0 0 -57.0 -45.5 175.0 46.9 114.3 22.8 73 -1.8 82 -1.6 0 0.0 81 -1.2 12 60
78 78 ILE I H H < 5TS+ 0 0 -59.6 -55.0 -175.0 42.4 116.0 18.4 74 -2.4 0 0.0 0 0.0 0 0.0 12 42
79 79 ASN N H H < 5TS+ 0 0 -67.0 -33.6 179.5 49.9 115.7 32.3 75 -3.1 0 0.0 0 0.0 0 0.0 7 30
80 80 ASP D H H < 5TS- 0 0 -74.3 -22.6 -175.9 -124.2 107.8 48.3 76 -3.0 0 0.0 0 0.0 0 0.0 7 36
81 81 GLY G T h < 5TS- 0 0 82.8 17.1 177.7 -13.8 75.0 49.0 77 -1.2 0 0.0 0 0.0 0 0.0 9 35
82 82 GLY G t B T - 48 0 -86.3 162.7 179.1 -117.5 24.5 112.2 0 0.0 89 -2.1 0 0.0 0 0.0 12 45
86 86 GLU E T T 4 TS+ 0 0 -62.3 -43.9 177.5 51.9 117.3 24.2 47 -2.4 0 0.0 0 0.0 0 0.0 12 44
87 87 GLU E T T 4 TS+ 0 0 -61.3 -43.2 180.0 44.4 112.5 26.2 0 0.0 0 0.0 0 0.0 0 0.0 8 28
88 88 ASN N T T 4 TS+ 0 0 -72.5 -31.0 -177.0 23.1 129.5 38.2 0 0.0 0 0.0 0 0.0 0 0.0 8 30
89 89 TYR Y S t < TS- 0 0 -138.9 77.9 -173.8 -162.7 91.3 134.1 85 -2.1 0 0.0 0 0.0 0 0.0 11 41
90 90 PRO P - 0 0 -71.0 157.2 -176.1 -99.2 21.6 100.5 0 0.0 0 0.0 0 0.0 0 0.0 10 39
91 91 TYR Y + 0 0 -80.7 133.7 179.3 169.2 36.3 125.0 0 0.0 0 0.0 0 0.0 0 0.0 8 47
92 92 THR T - 0 0 -118.4 -6.7 -177.1 -124.0 45.3 64.9 0 0.0 0 0.0 0 0.0 0 0.0 5 37
93 93 ALA A S S S+ 0 0 63.3 29.9 -178.1 104.9 78.1 38.6 0 0.0 0 0.0 0 0.0 0 0.0 10 38
94 94 GLN Q S S S- 0 0 -135.4 160.3 171.0 -110.1 81.7 159.4 0 0.0 96 -0.5 0 0.0 0 0.0 6 35
95 95 ASP D + 0 0 -84.1 123.1 -176.9 173.7 56.0 140.6 0 0.0 0 0.0 0 0.0 0 0.0 8 37
96 96 GLY G - 0 0 -127.2 -177.5 174.5 -78.3 39.5 136.5 94 -0.5 0 0.0 0 0.0 0 0.0 6 30
97 97 ASP D - 0 0 -73.3 130.9 170.4 -109.3 55.6 133.8 0 0.0 0 0.0 0 0.0 0 0.0 6 26
98 98 CYS C - 0 0 -58.7 123.2 176.2 -135.6 28.9 111.0 55 -0.6 100 -1.1 0 0.0 0 0.0 8 36
99 99 ASP D h > T - 0 0 -89.6 108.5 -175.3 -164.8 17.4 135.5 0 0.0 103 -2.6 0 0.0 0 0.0 9 32
100 100 VAL V H H > TS+ 0 0 -63.4 -35.1 175.9 55.5 83.4 32.4 98 -1.1 104 -1.9 0 0.0 0 0.0 6 28
101 101 ALA A H H > TS+ 0 0 -64.1 -40.6 178.2 41.8 114.7 25.9 0 0.0 105 -0.6 0 0.0 0 0.0 6 24
102 102 LEU L H H 4 TS+ 0 0 -75.6 -30.5 177.9 56.1 111.4 34.3 0 0.0 0 0.0 0 0.0 0 0.0 9 35
103 103 GLN Q H H < TS+ 0 0 -67.3 -30.1 -177.4 52.0 105.7 31.6 99 -2.6 0 0.0 0 0.0 0 0.0 12 41
104 104 ASP D H H < TS+ 0 0 -79.3 -15.4 179.3 88.6 89.5 48.4 100 -1.9 106 -0.8 0 0.0 0 0.0 6 30
105 105 GLN Q h < T - 0 0 -87.8 107.3 -169.3 -177.8 62.9 137.6 101 -0.6 0 0.0 0 0.0 0 0.0 8 32
106 106 LYS K + 0 0 -118.1 125.7 -177.5 159.4 23.9 163.3 104 -0.8 0 0.0 0 0.0 0 0.0 10 39
107 107 TYR Y + 0 0 -113.1 -29.0 -174.4 40.3 69.1 52.5 83 -2.6 0 0.0 0 0.0 0 0.0 8 39
108 108 VAL V B B D - 83 0 -130.9 140.4 -179.2 -173.9 63.6 169.5 83 -1.6 83 -1.8 0 0.0 0 0.0 8 54
109 109 THR T - 0 0 -129.9 158.1 173.9 -163.6 8.7 152.9 0 0.0 0 0.0 0 0.0 0 0.0 12 50
110 110 ILE I - 0 0 -134.7 160.0 -177.8 -148.2 12.6 156.2 0 0.0 0 0.0 0 0.0 0 0.0 13 44
111 111 ASP D - 0 0 -101.3 -37.4 -178.9 -31.7 66.5 35.4 216 -2.8 0 0.0 0 0.0 0 0.0 9 35
112 112 THR T E E BB - 216 0 -160.3 -170.3 173.8 -125.5 54.8 151.6 216 -1.8 216 -3.0 0 0.0 0 0.0 10 34
113 113 TYR Y E E BB - 215 0 -146.5 161.0 178.6 -149.2 14.8 165.6 0 0.0 0 0.0 0 0.0 0 0.0 10 46
114 114 GLU E E E BB - 214 0 -130.3 151.7 172.0 -133.1 11.0 165.1 214 -2.8 214 -2.2 0 0.0 0 0.0 8 40
115 115 ASN N E E BB - 213 0 -99.3 140.1 174.8 -131.9 21.4 147.6 0 0.0 0 0.0 0 0.0 0 0.0 9 41
116 116 VAL V e - 0 0 -83.3 144.5 179.1 -88.7 43.0 132.2 212 -2.2 0 0.0 0 0.0 0 0.0 11 42
117 117 PRO P t > T - 0 0 -53.7 127.5 -175.5 -113.1 56.2 110.7 0 0.0 120 -0.5 0 0.0 0 0.0 9 31
118 118 TYR Y T T 3 TS+ 0 0 -68.7 150.9 177.5 15.4 90.9 109.2 0 0.0 0 0.0 0 0.0 0 0.0 10 37
119 119 ASN N T T 3 TS+ 0 0 56.0 44.8 -177.8 115.6 93.8 28.3 209 -2.2 0 0.0 0 0.0 0 0.0 11 34
120 120 ASN N h > < T - 0 0 -145.7 88.1 -177.3 -177.8 39.4 139.1 209 -0.6 124 -2.0 117 -0.5 0 0.0 12 32
121 121 GLU E H H > TS+ 0 0 -60.8 -30.2 176.7 57.5 84.2 37.4 0 0.0 125 -2.7 0 0.0 0 0.0 11 46
122 122 TRP W H H > TS+ 0 0 -65.2 -43.1 179.6 45.9 108.2 26.2 0 0.0 126 -2.2 0 0.0 0 0.0 6 41
123 123 ALA A H H > TS+ 0 0 -67.0 -37.2 178.9 50.4 113.6 26.2 0 0.0 127 -2.0 0 0.0 0 0.0 9 41
124 124 LEU L H H X TS+ 0 0 -65.6 -43.5 179.2 51.5 108.8 23.9 120 -2.0 128 -2.6 0 0.0 0 0.0 12 55
125 125 GLN Q H H X TS+ 0 0 -59.3 -43.6 178.7 51.1 108.8 23.3 121 -2.7 129 -1.6 0 0.0 0 0.0 9 54
126 126 THR T H H X TS+ 0 0 -59.3 -46.2 -179.5 48.3 110.8 22.7 122 -2.2 130 -0.6 0 0.0 0 0.0 9 39
127 127 ALA A H H X > TS+ 0 0 -61.8 -43.7 179.6 53.3 108.6 23.8 123 -2.0 130 -1.4 0 0.0 131 -1.2 11 48
128 128 VAL V H H < 3 TS+ 0 0 -62.7 -28.3 177.2 68.9 96.1 40.0 124 -2.6 0 0.0 0 0.0 0 0.0 13 59
129 129 A THR T H H < 3 TS+ 0 0 -62.0 -27.3 -180.0 35.7 109.2 35.3 125 -1.6 0 0.0 0 0.0 0 0.0 10 41
130 130 TYR Y H H < < TS- 0 0 -100.9 -19.1 -178.3 -15.9 130.9 42.2 127 -1.4 0 0.0 126 -0.6 0 0.0 6 49
131 131 GLN Q S h < TS- 0 0 -170.6 160.6 174.2 -74.4 79.1 163.2 127 -1.2 0 0.0 0 0.0 0 0.0 13 62
132 132 PRO P - 0 0 -63.4 147.3 -176.3 -148.9 50.8 111.4 0 0.0 0 0.0 0 0.0 0 0.0 16 66
133 133 VAL V E E AC - 166 0 -126.1 140.3 179.4 -127.7 7.2 162.4 166 -1.7 166 -3.5 0 0.0 0 0.0 13 71
134 134 SER S E E ACE + 165 213 -87.3 137.6 178.8 165.8 35.4 134.8 213 -2.7 213 -2.3 0 0.0 0 0.0 16 72
135 135 VAL V E E AC - 164 0 -144.3 166.5 177.3 -137.3 27.2 157.9 164 -2.5 164 -3.2 0 0.0 0 0.0 16 74
136 136 ALA A E E AC + 163 0 -125.3 145.5 178.8 179.4 23.4 160.3 0 0.0 0 0.0 0 0.0 0 0.0 15 66
137 137 LEU L E E AC - 162 0 -140.6 170.6 179.8 -94.1 39.4 154.3 162 -2.7 161 -2.6 0 0.0 162 -1.6 14 62
138 138 ASP D + 0 0 -91.8 106.3 -177.3 163.5 46.3 145.4 206 -2.7 0 0.0 0 0.0 0 0.0 15 46
139 139 ALA A + 0 0 -109.5 17.6 -178.4 105.4 41.3 87.3 0 0.0 0 0.0 0 0.0 0 0.0 11 49
140 140 ALA A + 0 0 -75.2 -18.3 -173.6 88.3 56.4 48.0 0 0.0 0 0.0 0 0.0 0 0.0 8 30
141 141 GLY G S h > TS- 0 0 -84.2 157.4 177.9 -123.0 79.8 116.3 0 0.0 145 -2.2 0 0.0 0 0.0 9 24
142 142 ASP D H H > TS+ 0 0 -65.0 -27.5 -179.9 63.7 109.8 35.6 0 0.0 146 -3.1 0 0.0 0 0.0 6 22
143 143 ALA A H H > TS+ 0 0 -60.9 -44.1 178.3 43.0 107.6 20.3 0 0.0 147 -0.7 0 0.0 0 0.0 9 28
144 144 PHE F H H 4 > TS+ 0 0 -64.4 -47.7 -178.6 46.2 117.0 19.1 0 0.0 147 -1.0 0 0.0 0 0.0 11 47
145 145 LYS K H H < 3 TS+ 0 0 -61.3 -35.8 -177.9 47.5 115.2 30.8 141 -2.2 0 0.0 0 0.0 0 0.0 8 40
146 146 GLN Q H H < 3 TS+ 0 0 -81.8 -11.0 -173.4 135.2 81.0 63.8 142 -3.1 0 0.0 0 0.0 0 0.0 7 32
147 147 TYR Y h < < T + 0 0 -51.3 128.4 178.7 159.2 15.5 100.5 144 -1.0 189 -1.9 143 -0.7 0 0.0 10 38
148 148 ALA A - 0 0 -119.7 -37.0 179.3 -16.8 57.9 46.2 0 0.0 0 0.0 0 0.0 0 0.0 7 29
149 149 SER S S S S+ 0 0 -165.3 167.0 179.3 48.0 85.1 173.4 0 0.0 0 0.0 0 0.0 0 0.0 9 30
150 150 GLY G S e S- 0 0 95.2 -176.6 177.5 -42.5 91.7 109.6 0 0.0 195 -0.8 0 0.0 152 -0.8 6 35
151 151 ILE I E E Ad - 195 0 -91.6 112.3 -177.2 -136.0 64.9 145.7 0 0.0 0 0.0 0 0.0 0 0.0 9 42
152 152 PHE F E E Ad + 196 0 -73.3 135.2 -177.0 173.5 29.4 118.9 195 -3.3 197 -2.9 150 -0.8 0 0.0 10 49
153 153 THR T - 0 0 -120.7 -6.3 -179.8 -141.6 37.3 62.1 0 0.0 0 0.0 0 0.0 0 0.0 7 43
154 154 GLY G - 0 0 125.5 -167.0 0.9 -143.2 45.8 145.4 0 0.0 0 0.0 0 0.0 0 0.0 8 39
155 155 PRO P + 0 0 -72.3 148.8 173.5 120.5 69.9 63.1 0 0.0 0 0.0 0 0.0 0 0.0 8 30
156 156 CYS C - 0 0 -168.0 156.0 -179.6 -124.5 52.2 158.8 0 0.0 0 0.0 0 0.0 0 0.0 12 36
157 157 GLY G - 0 0 -91.7 -166.6 -178.7 -119.4 21.2 94.4 0 0.0 0 0.0 0 0.0 0 0.0 8 33
158 158 THR T S S S+ 0 0 -122.2 11.4 179.4 108.8 76.8 76.8 0 0.0 160 -1.3 0 0.0 0 0.0 13 35
159 159 ALA A S S S- 0 0 -94.1 93.5 -173.6 -139.4 71.3 142.0 0 0.0 0 0.0 0 0.0 0 0.0 8 31
160 160 VAL V + 0 0 -60.4 143.6 179.1 151.5 43.9 100.5 158 -1.3 0 0.0 0 0.0 0 0.0 12 41
161 161 ASP D + 0 0 -153.5 11.8 -176.2 65.2 54.6 71.6 137 -2.6 0 0.0 0 0.0 0 0.0 9 47
162 162 HIS H E E AC - 137 0 -145.2 122.1 -178.2 -144.3 65.4 163.2 137 -1.6 137 -2.7 0 0.0 0 0.0 10 57
163 163 ALA A E E AC + 136 0 -92.0 141.1 178.2 155.5 29.8 135.6 0 0.0 0 0.0 0 0.0 0 0.0 13 67
164 164 ILE I E E AC - 135 0 -144.9 -174.7 -176.9 -108.5 36.0 141.8 135 -3.2 135 -2.5 0 0.0 0 0.0 16 73
165 165 VAL V E E ACE - 134 181 -128.7 137.8 175.3 -139.9 14.3 167.3 181 -2.0 181 -3.1 0 0.0 167 -0.6 14 82
166 166 ILE I E E ACE + 133 180 -92.9 126.1 178.8 175.7 21.7 147.4 133 -3.5 133 -1.7 0 0.0 0 0.0 13 76
167 167 VAL V E E A * - 0 0 -108.8 1.7 179.1 -34.8 58.4 66.9 179 -2.7 7 -3.1 165 -0.6 0 0.0 17 66
168 168 GLY G E E AAE - 6 179 172.2 -168.9 179.4 -131.8 50.0 172.2 179 -0.9 179 -2.4 0 0.0 0 0.0 14 59
169 169 TYR Y E E AAE + 5 178 -165.6 162.3 179.3 153.8 23.8 166.6 5 -2.3 5 -2.5 0 0.0 0 0.0 13 56
170 170 GLY G E E A E - 0 177 -172.7 -166.1 -177.7 -109.2 33.7 159.0 177 -2.0 177 -2.5 0 0.0 0 0.0 11 40
171 171 THR T E E A E - 0 176 -143.5 139.3 176.9 -177.8 23.5 176.7 0 0.0 0 0.0 0 0.0 0 0.0 10 30
172 172 GLU E E E A E> TS- 0 175 -142.3 131.5 178.9 -4.3 72.9 162.2 175 -2.7 175 -1.9 0 0.0 0 0.0 7 26
173 173 GLY G T T 3 TS- 0 0 64.3 25.4 -179.5 -57.4 129.6 36.6 0 0.0 0 0.0 0 0.0 0 0.0 4 17
174 174 GLY G T T 3 TS+ 0 0 81.8 0.6 -177.6 120.8 113.8 59.5 0 0.0 176 -0.6 0 0.0 0 0.0 5 19
175 175 VAL V E E AE < T - 172 0 -105.5 121.8 -178.9 -142.7 56.1 153.7 172 -1.9 172 -2.7 0 0.0 0 0.0 8 23
176 176 ASP D E E AE + 171 0 -82.7 141.3 179.5 175.7 26.6 125.9 174 -0.6 198 -2.5 0 0.0 0 0.0 11 37
177 177 TYR Y E E AEF - 170 197 -139.1 164.3 171.9 -135.4 28.4 159.4 170 -2.5 170 -2.0 0 0.0 0 0.0 14 49
178 178 TRP W E E AEF - 169 196 -111.6 146.6 175.4 -130.7 25.0 152.0 196 -2.3 196 -2.1 0 0.0 180 -0.6 13 66
179 179 ILE I E E AEF - 168 195 -103.1 118.9 -175.0 -164.1 28.0 157.5 168 -2.4 167 -2.7 0 0.0 168 -0.9 14 67
180 180 VAL V E E AEF - 166 194 -114.3 134.1 171.7 -149.0 16.3 156.8 194 -3.2 194 -2.0 178 -0.6 182 -0.6 13 76
181 181 LYS K E E AEF - 165 193 -92.8 117.3 177.0 -171.8 24.1 149.8 165 -3.1 165 -2.0 0 0.0 0 0.0 12 68
182 182 ASN N e - 0 0 -104.1 172.2 -176.2 -133.4 26.1 122.8 192 -1.5 0 0.0 180 -0.6 0 0.0 11 66
183 183 SER S S S S+ 0 0 -123.2 44.9 -177.8 103.2 76.0 105.8 0 0.0 19 -3.3 0 0.0 0 0.0 12 61
184 184 TRP W B B A S- 18 0 -114.6 26.2 -177.0 -101.1 89.7 92.3 0 0.0 0 0.0 0 0.0 0 0.0 12 45
185 185 ASP D t > T - 0 0 72.8 171.9 -176.7 -72.1 43.1 87.4 17 -2.0 188 -1.2 0 0.0 0 0.0 12 34
186 186 THR T T T 3 TS+ 0 0 -79.9 -8.4 177.2 75.4 121.5 54.4 0 0.0 0 0.0 0 0.0 0 0.0 11 26
187 187 THR T T T 3 TS+ 0 0 -81.9 -1.9 177.6 70.7 86.1 60.7 0 0.0 0 0.0 0 0.0 0 0.0 8 25
188 188 TRP W S t > < TS- 0 0 -110.1 148.7 175.4 -18.3 105.0 152.3 185 -1.2 192 -2.4 0 0.0 0 0.0 12 33
189 189 GLY G T T 4 TS- 0 0 60.6 -154.9 -179.8 -16.7 122.7 93.6 147 -1.9 191 -1.7 0 0.0 0 0.0 11 36
190 190 GLU E B B 4 F > TS- 193 0 -89.7 86.9 -179.2 -43.1 130.7 127.3 193 -3.6 193 -1.3 0 0.0 0 0.0 10 33
191 191 GLU E T T 4 3 TS- 0 0 61.4 36.5 -179.6 -39.6 123.3 32.0 189 -1.7 0 0.0 0 0.0 0 0.0 8 29
192 192 GLY G T e < 3 TS+ 0 0 99.9 -18.1 178.5 94.6 125.2 77.6 188 -2.4 182 -1.5 0 0.0 0 0.0 14 43
193 193 TYR Y E E AFF< T - 190 181 -107.4 168.0 -179.9 -152.5 55.4 129.1 190 -1.3 190 -3.6 0 0.0 0 0.0 12 51
194 194 MET M E E A F - 0 180 -137.6 143.5 170.6 -145.8 10.2 173.5 180 -2.0 180 -3.2 0 0.0 196 -0.5 15 56
195 195 ARG R E E AdF - 151 179 -107.1 127.7 -174.4 -172.3 28.9 163.0 150 -0.8 152 -3.3 0 0.0 0 0.0 12 52
196 196 ILE I E E AdF - 152 178 -131.3 140.7 -175.7 -89.4 31.7 165.0 178 -2.1 178 -2.3 194 -0.5 0 0.0 12 60
197 197 LEU L E E A F - 0 177 -51.3 129.2 179.9 -159.8 45.7 101.1 152 -2.9 205 -0.6 0 0.0 0 0.0 13 49
198 198 ARG R e + 0 0 -113.6 158.8 177.7 31.8 58.8 140.5 176 -2.5 0 0.0 0 0.0 0 0.0 11 51
199 199 ASN N + 0 0 62.3 55.7 179.0 131.2 67.6 24.7 0 0.0 0 0.0 0 0.0 0 0.0 8 41
200 200 VAL V - 0 0 -106.6 -10.6 179.1 -121.1 62.6 56.7 0 0.0 0 0.0 0 0.0 0 0.0 7 37
201 201 GLY G t > T + 0 0 96.9 163.4 174.1 35.7 69.8 96.7 0 0.0 204 -2.3 0 0.0 0 0.0 8 30
202 202 GLY G T T 3 TS- 0 0 56.6 -134.2 -177.3 -6.7 128.6 104.7 0 0.0 0 0.0 0 0.0 0 0.0 8 30
203 203 ALA A T T 3 TS- 0 0 -71.3 -7.9 179.9 -127.6 101.8 56.3 0 0.0 209 -2.2 0 0.0 210 -0.7 13 40
204 204 GLY G g X T - 0 0 83.5 175.5 -176.1 -26.5 53.0 98.5 201 -2.3 207 -2.0 0 0.0 0 0.0 15 49
205 205 THR T G G > TS- 0 0 -68.0 122.0 -175.4 -5.4 139.0 117.7 197 -0.6 208 -1.6 0 0.0 0 0.0 14 55
206 206 CYS C G G 3 TS- 0 0 62.3 20.5 -179.8 -69.9 126.3 45.9 0 0.0 138 -2.7 0 0.0 0 0.0 15 55
207 207 GLY G G G X TS+ 0 0 72.4 17.4 -178.3 151.1 88.5 52.5 204 -2.0 210 -2.3 0 0.0 0 0.0 14 51
208 208 ILE I T g < TS+ 0 0 -50.3 -33.6 179.1 44.2 72.2 36.9 205 -1.6 0 0.0 0 0.0 0 0.0 15 71
209 209 ALA A T T 3 TS+ 0 0 -92.5 3.6 -174.0 89.8 90.1 64.9 203 -2.2 119 -2.2 0 0.0 120 -0.6 16 58
210 210 THR T S t < TS+ 0 0 -76.3 -21.0 179.7 14.0 100.7 41.4 207 -2.3 0 0.0 203 -0.7 0 0.0 14 48
211 211 MET M S S S+ 0 0 -149.9 61.1 -178.8 162.9 76.7 105.0 0 0.0 0 0.0 0 0.0 0 0.0 12 52
212 212 PRO P e + 0 0 -85.1 148.7 175.3 166.3 5.2 124.2 0 0.0 116 -2.2 0 0.0 0 0.0 15 65
213 213 SER S E E BBE - 115 134 -150.5 161.8 178.6 -167.6 12.4 167.8 134 -2.3 134 -2.7 0 0.0 0 0.0 13 60
214 214 TYR Y E E BB - 114 0 -150.9 152.2 177.4 -112.7 24.3 174.6 114 -2.2 114 -2.8 0 0.0 0 0.0 14 66
215 215 PRO P E E BB - 113 0 -83.0 154.0 179.5 -143.8 25.6 120.4 0 0.0 0 0.0 0 0.0 0 0.0 13 59
216 216 VAL V E E BB + 112 0 -124.4 136.0 179.4 178.0 17.8 165.2 112 -3.0 111 -2.8 0 0.0 112 -1.8 10 45
217 217 LYS K 0 0 -133.9 112.4 178.3 999.9 999.9 169.5 0 0.0 0 0.0 0 0.0 0 0.0 10 38
218 218 TYR Y 0 0 -78.8 999.9 999.9 999.9 999.9 125.6 0 0.0 0 0.0 0 0.0 0 0.0 5 23
2act-.pdb
2ACT HYDROLASE (PROTEINASE) ACTINIDIN (SULFHYDRYL PROTEINASE) (E.C. NUMBER NOT CHINESE GOOSEBERRY OR KIWIFRUIT (ACTINIDIA CHINENS
author author
Kabs/Sand S EEGGGGT B TTS HHHHHHHHHHHHHHHHHHS B HHHHHHH BTTB GGG HHHHHHHHHHHT B BTTTS SS H Kabs/Sand
chirality -+++-+++-++--------+-+++++++++++++++++++-+-+---++++++++++--++-++-+--++++++++++------+++--+-+-+----+ chirality
bends S SSSSS SS SSSSSSSSSSSSSSSSSS SSSSSSS SS SSS SSSSSSSSSSSS SSSS SS S bends
turns TTTTTTT TTTT TTTTTTTTTTTTTTTTTTTT TTTTTTTTT TTTTTTTTT TTTTTTTTTTTTTT TTTTT TT turns
5-turns >5555< >5555< >5555< 5-turns
3-turns >>><<< >33< >33< >33<>>3<< >>3<< 3-turns
bridge-2 bridge-2
bridge-1 AA A B C C D B bridge-1
sheets AA sheets
4-turns >>>>XXXXXXXXXXXX<<<< >>>>X<<<< >>>>XXXXX<<<< >444< >> 4-turns
summary S EEeGGGgt BtTTt hHHHHHHHHHHHHHHHHHHh BhHHHHHHHh BTTBgGGGg hHHHHHHHHHHHhtB BTTTt SS hH summary
sequence LPSYVDWRSAGAVVDIKSQGECGGCWAFSAIATVEGINKITSGSLISLSEQELIDCGRTQNTRGCDGGYITDGFQFIINDGGINTEENYPYTAQDGDCDV sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand HHHH B EEEE TT HHHHHHHHHHS EEEEE SHHHHH SSEE SS EEEEEEEEEEETTEEEEEEE SB TTSTBTTEEEEE Kabs/Sand
chirality ++++-++----------++-+++++++++----+-+-+++-++++++-+--+--+--+-++-+--+--+----+-+------+--++----+-----++- chirality
bends SSSS SS SSSSSSSSSSS SSSSSS SS SS SSS SS SSSSSSS bends
turns TTTTT TTTTTTTTTTTTTTT TTTTTTT TTTT TTTTTTTTT turns
5-turns 5-turns
3-turns >33< >33< >33< >33< >33< >33< 3-turns
bridge-2 E EE*EEEEE FFFFF FFFFF bridge-2
bridge-1 D BBBB CCCCC dd CCCCC AA EEEEEEE A F F dd bridge-1
sheets BBBB AAAAA AA AAAAAAAAAAA AAAAAAA AAAAA sheets
4-turns >4<<< >>>>XXXX<<<< >>>4<<< >444< 4-turns
summary HHHHh B EEEEetTThHHHHHHHHHHh EEEEE hHHHHHh SeEE SS EEEEEEEEEEETTEEEEEEEeSBtTTtTBTeEEEEEe summary
sequence ALQDQKYVTIDTYENVPYNNEWALQTAVTYQPVSVALDAAGDAFKQYASGIFTGPCGTAVDHAIVIVGYGTEGGVDYWIVKNSWDTTWGEEGYMRILRNV sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand TT GGGTTSS EEEE Kabs/Sand
chirality +-----++++++---+ chirality
bends SS SSSSSSS bends
turns TTTTTTTTTT turns
5-turns 5-turns
3-turns >33X>3X<3< 3-turns
bridge-2 E bridge-2
bridge-1 BBBB bridge-1
sheets BBBB sheets
4-turns 4-turns
summary tTTgGGGgTtSeEEEE summary
sequence GGAGTCGIATMPSYPVKY sequence
210