Secondary structure calculation program - copyright by David Keith Smith, 1989
1lo7A.pdb
1LO7 HYDROLASE MOL_ID: 1; MOL_ID: 1;
Sequence length - 140
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 2 ALA A 0 0 999.9 168.6 -179.6 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 6 25
2 A 3 ARG R e - 0 0 -64.2 118.4 -177.9 -164.4 999.9 116.6 0 0.0 83 -0.6 0 0.0 0 0.0 7 34
3 A 4 SER S E E AA - 82 0 -112.2 136.6 178.6 -163.0 11.5 151.6 0 0.0 0 0.0 0 0.0 0 0.0 9 36
4 A 5 ILE I E E AA - 81 0 -117.7 137.8 -179.9 -156.0 10.8 162.4 81 -2.8 81 -2.7 0 0.0 0 0.0 9 39
5 A 6 THR T E E AA + 80 0 -118.6 147.7 177.2 172.1 14.3 153.0 0 0.0 0 0.0 0 0.0 0 0.0 9 38
6 A 7 MET M E E AA - 79 0 -147.1 154.9 -180.0 -128.8 22.6 169.9 79 -2.3 79 -3.6 0 0.0 0 0.0 8 38
7 A 8 GLN Q E E AA - 78 0 -106.9 152.4 -179.8 -171.2 16.0 139.0 0 0.0 0 0.0 0 0.0 0 0.0 8 40
8 A 9 GLN Q E E AA - 77 0 -145.6 119.3 -179.9 -148.0 12.4 161.7 77 -2.3 77 -3.1 0 0.0 0 0.0 9 42
9 A 10 ARG R E E AA - 76 0 -88.4 139.3 -178.0 -130.0 21.4 135.3 0 0.0 0 0.0 0 0.0 0 0.0 9 35
10 A 11 ILE I e - 0 0 -92.5 135.2 -177.7 -151.4 23.6 140.6 75 -2.2 74 -2.9 0 0.0 0 0.0 12 39
11 A 12 GLU E g > T - 0 0 -104.7 160.9 -179.7 -111.6 26.0 128.0 0 0.0 14 -1.3 0 0.0 0 0.0 9 28
12 A 13 PHE F G G > TS+ 0 0 -55.1 -43.9 -178.4 52.5 118.9 25.6 0 0.0 15 -1.6 0 0.0 0 0.0 8 23
13 A 14 GLY G G G 3 TS+ 0 0 -69.4 -15.5 178.7 67.5 96.8 50.0 0 0.0 0 0.0 0 0.0 0 0.0 5 24
14 A 15 ASP D G G < TS+ 0 0 -80.5 -4.8 -178.6 81.7 92.6 60.4 11 -1.3 22 -2.7 0 0.0 0 0.0 10 29
15 A 16 CYS C B B A < TS- 21 0 -104.3 154.7 -179.5 -136.0 71.1 134.1 12 -1.6 0 0.0 0 0.0 0 0.0 13 28
16 A 17 ASP D t > T - 0 0 -96.3 -176.6 179.5 -83.6 41.6 105.5 20 -2.5 19 -2.4 0 0.0 0 0.0 9 20
17 A 18 PRO P T T 3 TS+ 0 0 -60.7 -23.5 178.9 64.1 127.9 38.9 0 0.0 0 0.0 0 0.0 0 0.0 5 16
18 A 19 ALA A T T 3 TS- 0 0 -79.0 1.0 178.2 -117.0 116.4 66.7 0 0.0 0 0.0 0 0.0 0 0.0 5 16
19 A 20 GLY G S t < TS+ 0 0 75.0 13.8 179.8 98.5 79.4 56.5 16 -2.4 0 0.0 0 0.0 0 0.0 7 21
20 A 21 ILE I S S S- 0 0 -125.5 167.7 -179.7 -64.9 87.6 144.3 0 0.0 16 -2.5 0 0.0 0 0.0 11 31
21 A 22 VAL V B B A - 15 0 -54.2 126.5 177.0 -126.3 49.5 106.2 71 -2.4 0 0.0 0 0.0 0 0.0 14 38
22 A 23 TRP W t > T - 0 0 -74.4 121.8 -174.4 -123.6 27.5 129.1 14 -2.7 25 -2.1 0 0.0 0 0.0 9 32
23 A 24 TYR Y T h > > TS+ 0 0 -43.1 -39.0 -179.8 65.1 103.0 44.5 0 0.0 26 -1.2 0 0.0 27 -1.1 6 38
24 A 25 PRO P H H > 3 TS+ 0 0 -59.3 -24.9 177.5 67.1 93.8 33.0 0 0.0 28 -1.6 0 0.0 0 0.0 6 29
25 A 26 ASN N H H > < TS+ 0 0 -60.7 -38.0 177.4 58.1 92.6 29.3 22 -2.1 29 -2.4 0 0.0 0 0.0 9 39
26 A 27 TYR Y H H > < TS+ 0 0 -59.2 -41.0 179.7 51.3 104.6 21.1 23 -1.2 30 -2.9 0 0.0 0 0.0 9 56
27 A 28 HIS H H H X TS+ 0 0 -64.2 -34.6 177.8 54.2 106.4 26.4 23 -1.1 31 -2.6 0 0.0 0 0.0 8 45
28 A 29 ARG R H H X TS+ 0 0 -61.7 -44.6 -178.2 44.0 113.0 17.9 24 -1.6 32 -1.8 0 0.0 0 0.0 8 36
29 A 30 TRP W H H X TS+ 0 0 -68.0 -37.6 178.1 53.1 110.7 29.4 25 -2.4 33 -2.9 0 0.0 0 0.0 9 50
30 A 31 A LEU L H H X TS+ 0 0 -61.9 -41.2 179.1 51.5 108.9 23.1 26 -2.9 34 -2.5 0 0.0 0 0.0 9 56
31 A 32 ASP D H H X TS+ 0 0 -63.8 -38.5 179.2 46.5 111.1 25.5 27 -2.6 35 -1.8 0 0.0 0 0.0 8 49
32 A 33 ALA A H H X TS+ 0 0 -70.0 -39.3 -179.3 49.7 112.9 23.6 28 -1.8 36 -2.7 0 0.0 0 0.0 8 44
33 A 34 ALA A H H X TS+ 0 0 -66.4 -34.9 179.3 55.1 108.0 27.7 29 -2.9 37 -1.9 0 0.0 0 0.0 13 50
34 A 35 SER S H H X TS+ 0 0 -60.5 -45.8 -177.8 39.1 114.0 20.9 30 -2.5 38 -1.5 0 0.0 0 0.0 10 59
35 A 36 ARG R H H X TS+ 0 0 -73.1 -38.6 179.1 58.1 111.3 28.9 31 -1.8 39 -2.7 0 0.0 0 0.0 8 52
36 A 37 ASN N H H X TS+ 0 0 -58.0 -37.3 179.5 56.9 102.3 31.4 32 -2.7 40 -3.0 0 0.0 0 0.0 8 39
37 A 38 TYR Y H H X TS+ 0 0 -59.9 -51.5 -179.3 42.7 110.0 14.4 33 -1.9 41 -1.8 0 0.0 0 0.0 12 48
38 A 39 PHE F H H < >TS+ 0 0 -63.6 -41.6 -179.6 50.4 114.4 24.7 34 -1.5 43 -2.4 0 0.0 0 0.0 10 53
39 A 40 ILE I H H < >5TS+ 0 0 -61.7 -43.1 -179.7 46.9 112.7 22.4 35 -2.7 42 -1.3 0 0.0 0 0.0 10 36
40 A 41 LYS K H H < 35TS+ 0 0 -68.0 -29.2 179.2 58.2 106.9 36.0 36 -3.0 0 0.0 0 0.0 0 0.0 8 31
41 A 42 CYS C T h < 35TS- 0 0 -76.5 -8.1 178.5 -100.7 125.6 55.2 37 -1.8 0 0.0 0 0.0 0 0.0 8 34
42 A 43 GLY G T T <5TS+ 0 0 106.2 2.9 178.6 140.1 72.7 60.2 39 -1.3 0 0.0 0 0.0 0 0.0 8 26
43 A 44 LEU L t > T - 0 0 -66.0 151.5 -178.9 -112.5 39.6 109.9 0 0.0 49 -2.3 0 0.0 48 -1.6 7 30
46 A 47 TRP W H H > 3 TS+ 0 0 -55.5 -33.3 180.0 67.9 114.9 33.1 0 0.0 50 -2.9 0 0.0 0 0.0 9 34
47 A 48 ARG R H H > 3 TS+ 0 0 -54.0 -34.5 -179.8 36.4 110.3 30.8 0 0.0 51 -0.6 0 0.0 0 0.0 7 22
48 A 49 GLN Q H H > < TS+ 0 0 -86.9 -43.4 -178.8 54.5 113.4 28.9 45 -1.6 52 -2.6 0 0.0 0 0.0 8 21
49 A 50 THR T H H X TS+ 0 0 -61.6 -32.8 -179.0 57.7 103.7 29.9 45 -2.3 53 -2.8 0 0.0 55 -1.1 12 28
50 A 51 VAL V H H X TS+ 0 0 -63.8 -38.4 179.3 42.7 110.7 22.8 46 -2.9 54 -0.9 0 0.0 0 0.0 11 27
51 A 52 VAL V H H < TS+ 0 0 -69.8 -46.0 -178.3 41.9 120.9 22.2 47 -0.6 0 0.0 0 0.0 0 0.0 8 19
52 A 53 GLU E H H < TS- 0 0 -66.7 -49.8 -174.4 -4.6 140.3 22.7 48 -2.6 0 0.0 0 0.0 0 0.0 7 21
53 A 54 ARG R H H < TS- 0 0 -135.1 5.1 176.7 -102.9 94.5 72.9 49 -2.8 0 0.0 0 0.0 0 0.0 6 29
54 A 55 GLY G h < T + 0 0 87.9 -2.7 -177.7 147.5 67.4 66.1 50 -0.9 121 -0.6 0 0.0 0 0.0 9 32
55 A 56 ILE I E E AB - 120 0 -73.3 118.4 -177.3 -177.8 23.6 123.4 49 -1.1 0 0.0 0 0.0 0 0.0 13 39
56 A 57 VAL V E E A* - 0 0 -91.9 -13.3 -178.0 -82.3 52.8 53.8 119 -2.7 0 0.0 0 0.0 0 0.0 12 37
57 A 58 GLY G E E AB - 119 0 146.1 -159.7 -178.6 -59.8 54.8 166.9 119 -0.8 119 -2.1 0 0.0 0 0.0 8 47
58 A 59 THR T - 0 0 -127.3 76.5 179.8 -164.7 49.5 134.4 0 0.0 0 0.0 0 0.0 0 0.0 8 53
59 A 60 PRO P e - 0 0 -60.7 151.8 -179.7 -110.7 24.2 103.5 0 0.0 117 -1.9 0 0.0 0 0.0 8 41
60 A 61 ILE I E E AC + 116 0 -89.3 138.5 179.0 174.9 32.5 132.8 0 0.0 0 0.0 0 0.0 0 0.0 9 40
61 A 62 VAL V E E A* + 0 0 -113.0 -23.4 -179.9 5.3 69.2 57.2 115 -3.2 0 0.0 0 0.0 0 0.0 8 31
62 A 63 SER S E E AC - 115 0 -159.0 154.5 178.0 -167.8 57.9 175.7 115 -1.6 115 -2.9 0 0.0 0 0.0 7 29
63 A 64 CYS C E E AC - 114 0 -149.8 143.8 175.7 -169.4 10.1 172.2 0 0.0 0 0.0 0 0.0 0 0.0 9 34
64 A 65 ASN N E E AC + 113 0 -131.1 114.2 -178.2 172.5 25.2 164.6 113 -2.1 113 -2.7 0 0.0 0 0.0 7 29
65 A 66 ALA A E E AC - 112 0 -126.7 149.7 176.3 -166.8 18.2 158.2 0 0.0 0 0.0 0 0.0 0 0.0 8 35
66 A 67 A SER S E E AC - 111 0 -134.8 138.7 -178.9 -149.2 11.9 174.4 111 -2.6 111 -2.4 0 0.0 68 -0.6 7 29
67 A 68 PHE F E E AC + 110 0 -113.0 109.2 -174.1 174.3 18.9 158.6 0 0.0 0 0.0 0 0.0 0 0.0 8 33
68 A 69 VAL V e - 0 0 -85.3 -42.6 177.7 -6.0 60.7 31.1 109 -2.1 0 0.0 66 -0.6 0 0.0 8 27
69 A 70 CYS C S S S- 0 0 -150.0 165.1 -177.6 -95.2 76.8 162.4 109 -1.7 0 0.0 0 0.0 0 0.0 7 32
70 A 71 THR T - 0 0 -83.6 165.4 176.0 -166.2 28.6 111.2 0 0.0 0 0.0 0 0.0 0 0.0 8 39
71 A 72 ALA A - 0 0 -142.8 161.0 180.0 -169.7 5.5 163.0 0 0.0 21 -2.4 0 0.0 0 0.0 8 47
72 A 73 SER S t > T - 0 0 -145.8 175.6 -179.2 -52.6 39.1 154.0 0 0.0 75 -2.1 0 0.0 0 0.0 12 39
73 A 74 TYR Y T T 3 TS+ 0 0 -56.3 140.5 -177.8 26.1 119.3 100.8 0 0.0 0 0.0 0 0.0 0 0.0 12 30
74 A 75 ASP D T T 3 TS+ 0 0 89.6 -16.6 175.7 124.6 89.3 85.9 10 -2.9 0 0.0 0 0.0 0 0.0 8 25
75 A 76 ASP D e < T - 0 0 -70.4 140.8 178.2 -140.9 57.3 120.1 72 -2.1 10 -2.2 0 0.0 77 -0.7 9 41
76 A 77 VAL V E E AA - 9 0 -105.5 115.3 179.4 -154.6 17.3 156.5 0 0.0 100 -0.6 0 0.0 0 0.0 10 40
77 A 78 LEU L E E AAD - 8 99 -91.1 149.1 176.4 -149.8 5.3 129.9 8 -3.1 8 -2.3 75 -0.7 79 -0.5 12 50
78 A 79 THR T E E AAD - 7 98 -116.7 122.8 179.4 -162.6 12.5 167.7 98 -3.0 98 -2.8 0 0.0 0 0.0 11 46
79 A 80 ILE I E E AAD - 6 97 -109.4 127.8 178.3 -165.8 3.6 159.5 6 -3.6 6 -2.3 77 -0.5 81 -0.5 13 51
80 A 81 GLU E E E AAD - 5 96 -113.7 122.7 -176.9 -173.4 12.3 163.7 96 -2.7 96 -2.7 0 0.0 0 0.0 11 48
81 A 82 THR T E E AAD + 4 95 -122.8 136.1 177.1 154.5 12.0 163.0 4 -2.7 4 -2.8 79 -0.5 0 0.0 14 50
82 A 83 CYS C E E AAD - 3 94 -148.5 166.0 176.8 -104.8 46.2 162.4 94 -2.2 94 -2.4 0 0.0 84 -0.7 12 45
83 A 84 ILE I E E A D - 0 93 -97.1 119.5 -178.6 -173.5 29.4 153.4 2 -0.6 0 0.0 0 0.0 0 0.0 12 51
84 A 85 LYS K E E A * + 0 0 -81.2 -38.6 -178.8 1.3 67.0 34.5 92 -2.3 0 0.0 82 -0.7 0 0.0 9 34
85 A 86 GLU E E E A D - 0 92 -159.3 139.4 177.0 -144.7 54.3 166.3 92 -1.2 92 -2.5 0 0.0 87 -0.5 7 32
86 A 87 TRP W E E A D + 0 91 -102.9 125.9 -178.5 171.5 28.6 154.6 0 0.0 0 0.0 0 0.0 0 0.0 9 34
87 A 88 ARG R e - 0 0 -105.6 -125.9 179.3 -78.2 49.0 69.2 90 -2.3 0 0.0 85 -0.5 0 0.0 8 25
88 A 89 ARG R S S S- 0 0 -108.2 -72.8 178.1 -5.8 114.8 44.2 0 0.0 131 -2.5 0 0.0 0 0.0 7 27
89 A 90 LYS K S e S+ 0 0 -96.2 -12.3 -178.4 56.9 131.8 54.0 0 0.0 118 -0.7 0 0.0 0 0.0 10 34
90 A 91 SER S E E A E - 0 117 -116.7 170.2 176.8 -164.7 59.4 135.6 0 0.0 87 -2.3 0 0.0 0 0.0 12 36
91 A 92 PHE F E E ADE - 86 116 -149.2 154.5 -179.3 -125.5 21.4 169.5 116 -2.1 116 -2.3 0 0.0 93 -0.6 14 47
92 A 93 VAL V E E ADE - 85 115 -106.3 120.8 179.6 -167.0 23.6 156.4 85 -2.5 84 -2.3 0 0.0 85 -1.2 13 46
93 A 94 GLN Q E E ADE - 83 114 -111.7 119.9 -178.8 -157.0 6.5 161.7 114 -3.6 114 -3.3 91 -0.6 0 0.0 14 56
94 A 95 ARG R E E ADE - 82 113 -101.2 138.3 178.4 -170.3 7.6 143.4 82 -2.4 82 -2.2 0 0.0 0 0.0 12 52
95 A 96 HIS H E E ADE - 81 112 -128.4 127.6 177.4 -166.8 4.7 173.9 112 -2.8 112 -2.3 0 0.0 0 0.0 14 55
96 A 97 SER S E E ADE - 80 111 -115.1 124.7 -177.7 -162.7 8.9 166.3 80 -2.7 80 -2.7 0 0.0 98 -0.5 11 51
97 A 98 VAL V E E ADE + 79 110 -111.3 125.8 -179.8 164.5 17.4 156.8 110 -3.1 109 -3.5 0 0.0 110 -1.6 12 55
98 A 99 A SER S E E ADE - 78 108 -134.6 168.2 175.0 -158.9 20.1 152.7 78 -2.8 78 -3.0 96 -0.5 0 0.0 12 46
99 A 100 ARG R E E ADE - 77 107 -142.7 157.0 -179.0 -115.7 22.5 165.5 107 -2.3 107 -3.1 0 0.0 0 0.0 12 40
100 A 101 THR T E E A E - 0 106 -106.6 138.3 177.8 -145.3 11.8 146.2 76 -0.6 0 0.0 0 0.0 0 0.0 11 32
101 A 102 THR T e > T - 0 0 -80.2 158.2 179.3 -109.0 37.4 115.0 105 -2.9 104 -2.0 0 0.0 0 0.0 8 21
102 A 103 PRO P T T 3 TS+ 0 0 -70.6 -4.0 178.0 77.0 117.1 51.4 0 0.0 0 0.0 0 0.0 0 0.0 5 14
103 A 104 GLY G T T 3 TS- 0 0 -76.5 -9.3 -179.7 -110.6 118.1 57.6 0 0.0 0 0.0 0 0.0 0 0.0 5 10
104 A 105 GLY G S t < TS+ 0 0 84.6 11.2 179.4 141.0 77.4 50.3 101 -2.0 0 0.0 0 0.0 0 0.0 6 14
105 A 106 ASP D e - 0 0 -94.1 131.4 -179.0 -138.0 49.9 139.5 0 0.0 101 -2.9 0 0.0 107 -0.8 7 17
106 A 107 VAL V E E A E - 0 100 -92.9 115.5 178.8 -163.1 17.8 142.1 0 0.0 0 0.0 0 0.0 0 0.0 8 26
107 A 108 GLN Q E E A E - 0 99 -99.3 133.0 177.8 -127.3 19.3 143.7 99 -3.1 99 -2.3 105 -0.8 0 0.0 8 28
108 A 109 LEU L E E A E + 0 98 -75.5 130.7 -179.4 176.1 29.5 127.4 0 0.0 0 0.0 0 0.0 0 0.0 11 33
109 A 110 VAL V E E A * - 0 0 -100.3 -51.4 178.6 -23.4 57.9 36.0 97 -3.5 68 -2.1 0 0.0 69 -1.7 12 42
110 A 111 MET M E E ACE - 67 97 -157.7 164.6 179.2 -158.3 52.3 170.6 97 -1.6 97 -3.1 0 0.0 0 0.0 12 47
111 A 112 ARG R E E ACE - 66 96 -147.5 149.9 177.8 -173.5 6.7 175.2 66 -2.4 66 -2.6 0 0.0 0 0.0 13 46
112 A 113 ALA A E E ACE - 65 95 -149.3 141.4 175.3 -154.6 17.7 172.6 95 -2.3 95 -2.8 0 0.0 114 -0.6 11 46
113 A 114 ASP D E E ACE - 64 94 -111.3 112.3 179.6 -166.7 25.7 166.1 64 -2.7 64 -2.1 0 0.0 0 0.0 11 40
114 A 115 GLU E E E ACE - 63 93 -102.6 138.7 176.7 -151.6 12.5 148.1 93 -3.3 93 -3.6 112 -0.6 116 -0.6 13 46
115 A 116 ILE I E E ACE + 62 92 -109.4 118.8 -179.0 163.2 30.4 160.7 62 -2.9 61 -3.2 0 0.0 62 -1.6 12 42
116 A 117 ARG R E E ACE - 60 91 -128.9 175.3 178.4 -151.3 23.1 142.1 91 -2.3 91 -2.1 114 -0.6 0 0.0 13 51
117 A 118 VAL V E E A E - 0 90 -145.3 153.8 174.8 -113.3 25.3 168.7 59 -1.9 0 0.0 0 0.0 0 0.0 14 45
118 A 119 PHE F E E A F - 0 129 -81.3 137.1 -177.6 -177.5 51.8 134.0 89 -0.7 129 -2.3 129 -0.5 0 0.0 15 52
119 A 120 ALA A E E ABF - 57 128 -142.2 169.8 178.0 -149.4 28.4 159.4 57 -2.1 56 -2.7 0 0.0 57 -0.8 13 40
120 A 121 A MET M E E ABF - 55 127 -129.5 157.3 176.7 -126.3 22.9 151.7 127 -2.2 127 -2.4 0 0.0 122 -0.6 13 33
121 A 122 ASN N E E A F - 0 126 -107.0 108.1 179.0 -166.4 18.4 161.8 54 -0.6 123 -1.3 0 0.0 0 0.0 11 25
122 A 123 ASP D E E A F> TS- 0 125 -93.5 86.8 -175.1 -59.6 71.2 141.8 125 -3.2 125 -2.0 120 -0.6 0 0.0 7 18
123 A 124 GLY G T T 3 TS- 0 0 72.1 -126.9 179.5 -17.9 121.2 127.0 121 -1.3 0 0.0 0 0.0 0 0.0 5 14
124 A 125 GLU E T T 3 TS+ 0 0 -88.4 -7.0 -178.7 96.4 120.5 60.9 0 0.0 126 -0.7 0 0.0 0 0.0 5 12
125 A 126 ARG R E E AF < T - 122 0 -96.9 118.1 177.1 -144.9 65.5 142.8 122 -2.0 122 -3.2 0 0.0 0 0.0 6 16
126 A 127 LEU L E E AF - 121 0 -70.8 141.4 -179.3 -174.6 23.1 115.3 124 -0.7 0 0.0 0 0.0 0 0.0 9 24
127 A 128 ARG R E E AF - 120 0 -145.9 128.9 179.8 -132.5 18.6 163.0 120 -2.4 120 -2.2 0 0.0 0 0.0 8 29
128 A 129 ALA A E E AF - 119 0 -77.9 151.0 178.5 -158.0 21.6 116.3 0 0.0 0 0.0 0 0.0 0 0.0 9 34
129 A 130 ILE I E E AF - 118 0 -126.0 161.8 177.9 -86.9 31.4 148.4 118 -2.3 118 -0.5 0 0.0 0 0.0 10 36
130 A 131 GLU E - 0 0 -61.7 141.1 -178.5 -90.6 63.0 114.4 0 0.0 0 0.0 0 0.0 0 0.0 8 32
131 A 132 VAL V - 0 0 -56.6 123.7 179.7 -110.3 49.6 111.8 88 -2.5 0 0.0 0 0.0 0 0.0 14 40
132 A 133 PRO P h > > T - 0 0 -59.8 129.1 -179.6 -140.2 16.5 107.6 0 0.0 136 -2.0 0 0.0 135 -0.5 7 39
133 A 134 ALA A H H > 3 TS+ 0 0 -55.9 -38.8 -179.3 56.2 102.3 28.0 0 0.0 137 -2.1 0 0.0 0 0.0 6 26
134 A 135 ASP D H H > 3 TS+ 0 0 -64.3 -32.2 179.7 51.0 106.1 32.5 0 0.0 138 -1.8 0 0.0 0 0.0 6 25
135 A 136 TYR Y H H > < TS+ 0 0 -72.4 -39.1 178.6 53.7 106.1 25.4 132 -0.5 139 -2.3 0 0.0 0 0.0 9 44
136 A 137 ILE I H H X TS+ 0 0 -60.2 -42.2 178.9 50.6 109.3 20.9 132 -2.0 140 -1.1 0 0.0 0 0.0 9 38
137 A 138 GLU E H H < > TS+ 0 0 -62.7 -42.4 -179.6 49.8 108.4 21.5 133 -2.1 140 -0.6 0 0.0 0 0.0 7 25
138 A 139 LEU L H H < 3 TS+ 0 0 -63.1 -36.7 -177.9 48.5 113.1 27.7 134 -1.8 0 0.0 0 0.0 0 0.0 9 27
139 A 140 CYS C H H < 3 T 0 0 -80.2 -12.4 -179.0 999.9 999.9 53.3 135 -2.3 0 0.0 0 0.0 0 0.0 9 36
140 A 141 A SER S h < < T 0 0 -75.3 999.9 999.9 999.9 999.9 108.9 136 -1.1 0 0.0 137 -0.6 0 0.0 6 28
1lo7A.pdb
1LO7 HYDROLASE MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand EEEEEEE GGGB TTSSB THHHHHHHHHHHHHHHHHTT HHHHHHHH EEE EEEEEEEE S TT EEEEEEEEEEE SSEEEEEEEEEEE Kabs/Sand
chirality ---+------+++--+-+---++++++++++++++++++-+---++++++--+-----++--+--+-----++------+--+-+--+-------+--- chirality
bends SSSS SSSS SSSSSSSSSSSSSSSSSSSS SSSSSSSS S SS SS bends
turns TTTTTTTTT TTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTT TTTT turns
5-turns >5555< 5-turns
3-turns >>3<<>33< >>3<< >33< >33< >33< 3-turns
bridge-2 DDDDDDD*DD EEEEEEEEEEE bridge-2
bridge-1 AAAAAAA A A B*B C*CCCCCC AAAAAAA DDDDDDDDD bridge-1
sheets AAAAAAA AAA AAAAAAAA AAAAAAAAAAA AAAAAAAAAAA sheets
4-turns >>>>XXXXXXXXXXX<<<< >>>>XX<<<< 4-turns
summary eEEEEEEEegGGGBtTTtSBthHHHHHHHHHHHHHHHHHhTt hHHHHHHHHhEEE eEEEEEEEEeS tTTeEEEEEEEEEEEeSeEEEEEEEEEEE summary
sequence ARSITMQQRIEFGDCDPAGIVWYPNYHRWLDAASRNYFIKCGLPPWRQTVVERGIVGTPIVSCNASFVCTASYDDVLTIETCIKEWRRKSFVQRHSVSRT sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand TTS EEEEEEEEEEEEEEEEETTEEEEE HHHHHHH Kabs/Sand
chirality -+-+---+------+--------+--------++++++ chirality
bends SSS SSS SSSSSS bends
turns TTTT TTTT TTTTTTTTT turns
5-turns 5-turns
3-turns >33< >33< >33< >33< 3-turns
bridge-2 EEE*EEEEEEEEFFFFF bridge-2
bridge-1 CCCCCCC BB FFFFF bridge-1
sheets AAAAAAAAAAAAAAAAA AAAAA sheets
4-turns >>>>X<<<< 4-turns
summary eTTteEEEEEEEEEEEEEEEEETTEEEEE hHHHHHHHh summary
sequence TPGGDVQLVMRADEIRVFAMNDGERLRAIEVPADYIELCS sequence
110 120 130 140