Secondary structure calculation program - copyright by David Keith Smith, 1989
1hwmB.pdb
1HWM HYDROLASE MOL_ID: 1; MOL_ID: 1;
Sequence length - 264
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 B 3 GLU E 0 0 999.9 134.5 -179.8 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 4
2 B 4 THR T - 0 0 56.9 117.7 -179.5 -93.0 999.9 34.1 0 0.0 0 0.0 0 0.0 0 0.0 3 5
3 B 5 CYS C - 0 0 -62.6 121.7 179.0 -119.2 41.9 112.8 0 0.0 0 0.0 0 0.0 0 0.0 4 7
4 B 6 ALA A - 0 0 -60.0 142.5 179.7 -105.3 32.1 107.5 0 0.0 0 0.0 0 0.0 0 0.0 4 8
5 B 7 ILE I - 0 0 -73.2 124.8 -179.8 -132.1 38.8 125.7 0 0.0 0 0.0 0 0.0 0 0.0 5 13
6 B 8 PRO P - 0 0 -78.4 156.0 179.2 -115.0 15.0 113.1 0 0.0 0 0.0 0 0.0 0 0.0 5 15
7 B 9 ALA A - 0 0 -85.3 157.0 179.9 -78.2 48.1 120.9 0 0.0 0 0.0 0 0.0 0 0.0 6 17
8 B 10 PRO P - 0 0 -57.0 128.3 179.9 -157.6 54.1 109.1 0 0.0 0 0.0 0 0.0 0 0.0 8 24
9 B 11 PHE F E E AA - 49 0 -112.1 154.5 -179.8 -134.5 9.1 143.2 49 -1.2 49 -2.5 0 0.0 11 -0.5 7 28
10 B 12 THR T E E AA + 48 0 -111.9 125.2 179.1 144.1 37.0 158.0 0 0.0 0 0.0 0 0.0 0 0.0 8 38
11 B 13 ARG R E E AA - 47 0 -146.9 168.2 179.0 -115.9 39.9 157.0 47 -2.8 47 -2.5 9 -0.5 0 0.0 11 39
12 B 14 ARG R E E AB - 132 0 -103.5 173.8 179.9 -118.1 24.7 122.7 132 -0.7 132 -1.0 0 0.0 14 -0.6 13 50
13 B 15 ILE I E E AB - 131 0 -120.2 107.5 179.6 -170.4 25.1 156.2 0 0.0 21 -2.0 0 0.0 0 0.0 13 68
14 B 16 VAL V E E ABA + 130 20 -95.2 133.8 -179.3 141.5 24.2 142.7 130 -2.5 130 -3.2 12 -0.6 0 0.0 16 61
15 B 17 GLY G g > T + 0 0 -138.9 -137.4 -179.3 19.8 40.3 107.9 19 -2.5 18 -2.3 0 0.0 0 0.0 15 75
16 B 18 ARG R G G > TS- 0 0 -45.8 134.5 179.5 -7.0 127.5 94.3 0 0.0 19 -2.3 0 0.0 0 0.0 16 67
17 B 19 ASP D G G 3 TS- 0 0 50.9 15.7 178.9 -70.0 124.2 52.5 0 0.0 0 0.0 0 0.0 0 0.0 7 60
18 B 20 GLY G G G < TS+ 0 0 85.4 4.9 179.8 142.6 93.1 58.9 15 -2.3 0 0.0 0 0.0 0 0.0 14 61
19 B 21 LEU L g < T - 0 0 -78.0 157.5 -179.5 -123.1 45.0 113.5 16 -2.3 15 -2.5 0 0.0 0 0.0 13 57
20 B 22 CYS C E E BCA - 37 14 -104.3 151.7 179.3 -115.5 15.9 137.3 37 -2.7 37 -1.8 0 0.0 22 -0.5 13 59
21 B 23 VAL V E E BC + 36 0 -85.3 122.3 -179.8 159.0 47.1 136.6 13 -2.0 0 0.0 0 0.0 0 0.0 13 72
22 B 24 ASP D E E BC - 35 0 -147.0 147.6 179.8 -101.5 44.7 177.1 35 -2.7 35 -1.8 20 -0.5 0 0.0 12 67
23 B 25 VAL V E E BC > T - 34 0 -69.5 130.1 -179.2 -91.5 56.2 119.1 44 -1.1 26 -2.4 0 0.0 0 0.0 15 55
24 B 26 ARG R G e > TS- 0 0 -45.5 125.0 178.6 -16.8 100.0 96.1 33 -1.9 27 -2.2 0 0.0 0 0.0 10 42
25 B 27 ASN N G G 3 TS- 0 0 51.7 15.1 179.3 -82.3 111.0 52.1 0 0.0 0 0.0 0 0.0 0 0.0 4 34
26 B 28 GLY G G G < TS+ 0 0 64.4 26.8 179.6 164.0 77.6 39.0 23 -2.4 28 -0.6 0 0.0 0 0.0 8 39
27 B 29 TYR Y g < T - 0 0 -81.7 117.0 -179.8 -164.6 27.7 133.6 24 -2.2 0 0.0 0 0.0 0 0.0 7 30
28 B 30 ASP D + 0 0 -82.3 9.8 -179.4 123.2 50.6 71.1 26 -0.6 0 0.0 0 0.0 0 0.0 9 33
29 B 31 THR T S t > TS- 0 0 -77.4 133.6 -179.9 -96.1 75.0 123.2 0 0.0 32 -1.8 0 0.0 0 0.0 7 29
30 B 32 ASP D T T 3 TS+ 0 0 -47.6 133.3 179.3 29.5 107.9 97.6 0 0.0 0 0.0 0 0.0 0 0.0 8 35
31 B 33 GLY G T T 3 TS+ 0 0 100.4 -13.9 -179.2 148.8 76.4 77.0 75 -3.1 0 0.0 0 0.0 0 0.0 7 41
32 B 34 THR T t < T - 0 0 -60.0 124.5 -179.7 -118.5 48.0 110.7 29 -1.8 75 -2.3 0 0.0 0 0.0 12 42
33 B 35 PRO P B e B - 74 0 -63.1 154.7 179.0 -121.7 18.0 99.4 0 0.0 24 -1.9 0 0.0 0 0.0 12 49
34 B 36 ILE I E E BC + 23 0 -98.8 137.7 -178.9 165.3 41.1 144.6 73 -2.9 116 -2.1 0 0.0 0 0.0 14 62
35 B 37 GLN Q E E BCC - 22 115 -145.7 176.5 179.5 -93.6 36.0 151.9 22 -1.8 22 -2.7 0 0.0 0 0.0 13 58
36 B 38 LEU L E E BC + 21 0 -95.0 148.9 -179.6 157.3 43.3 133.2 114 -1.5 113 -2.7 0 0.0 0 0.0 15 54
37 B 39 TRP W E E BC - 20 0 -168.4 143.3 179.9 -76.5 49.7 158.7 20 -1.8 20 -2.7 0 0.0 0 0.0 10 41
38 B 40 PRO P - 0 0 -43.4 143.0 -178.9 -96.4 62.1 94.3 0 0.0 0 0.0 0 0.0 0 0.0 8 42
39 B 41 CYS C + 0 0 -72.7 117.4 179.6 143.3 64.0 122.1 0 0.0 0 0.0 0 0.0 0 0.0 10 44
40 B 42 GLY G - 0 0 -132.3 -160.2 -179.7 -94.3 60.9 121.4 0 0.0 0 0.0 0 0.0 0 0.0 5 32
41 B 43 THR T + 0 0 -97.4 -23.2 -179.8 138.3 66.4 46.2 0 0.0 0 0.0 0 0.0 0 0.0 6 30
42 B 44 GLN Q g > T - 0 0 -27.7 118.6 -179.4 -128.2 60.0 83.5 0 0.0 45 -3.1 0 0.0 0 0.0 6 31
43 B 45 ARG R G G > TS+ 0 0 -45.5 -33.4 -179.2 65.0 106.3 40.9 0 0.0 46 -1.6 0 0.0 0 0.0 7 31
44 B 46 ASN N G G 3 TS+ 0 0 -69.9 -10.6 179.7 61.3 94.0 52.3 0 0.0 23 -1.1 0 0.0 0 0.0 10 45
45 B 47 GLN Q G G < TS+ 0 0 -91.2 -6.3 -179.6 93.2 87.9 59.9 42 -3.1 0 0.0 0 0.0 0 0.0 15 54
46 B 48 GLN Q g < T - 0 0 -92.7 135.2 179.8 -166.1 58.1 137.3 43 -1.6 0 0.0 0 0.0 0 0.0 13 50
47 B 49 TRP W E E AA - 11 0 -123.9 136.0 179.3 -150.7 9.1 165.8 11 -2.5 11 -2.8 0 0.0 49 -0.6 12 59
48 B 50 THR T E E AAD - 10 56 -108.2 122.3 -179.7 -149.6 10.2 156.7 56 -2.0 56 -1.9 0 0.0 50 -0.7 11 42
49 B 51 PHE F E E AAD - 9 55 -94.9 113.4 179.4 -168.1 15.8 144.0 9 -2.5 9 -1.2 47 -0.6 0 0.0 12 41
50 B 52 TYR Y e > T - 0 0 -94.0 166.5 -179.4 -110.2 35.3 120.2 54 -2.5 53 -0.9 48 -0.7 0 0.0 10 31
51 B 53 ASN N T T 3 TS+ 0 0 -71.0 -13.4 179.9 80.5 108.1 50.4 0 0.0 0 0.0 0 0.0 0 0.0 9 26
52 B 54 ASP D T T 3 TS- 0 0 -77.5 16.4 179.7 -108.4 115.8 76.4 0 0.0 0 0.0 0 0.0 0 0.0 5 33
53 B 55 LYS K S t < TS+ 0 0 66.2 14.4 -179.5 125.3 83.8 50.4 50 -0.9 88 -3.2 0 0.0 0 0.0 10 38
54 B 56 THR T e - 0 0 -111.2 140.0 178.4 -158.1 47.7 150.1 0 0.0 50 -2.5 0 0.0 0 0.0 12 49
55 B 57 ILE I E E AD + 49 0 -112.5 134.2 -179.2 179.0 19.5 160.1 0 0.0 62 -3.0 0 0.0 0 0.0 13 55
56 B 58 ARG R E E ADE - 48 61 -143.8 143.9 179.0 -155.8 20.7 175.4 48 -1.9 48 -2.0 0 0.0 0 0.0 12 56
57 B 59 SER S E E A E> TS- 0 60 -114.6 139.5 -179.5 -2.6 85.1 157.1 60 -1.7 60 -1.9 0 0.0 0 0.0 13 51
58 B 60 MET M T T 3 TS- 0 0 51.0 30.5 179.0 -59.1 132.1 36.4 0 0.0 0 0.0 0 0.0 0 0.0 7 43
59 B 61 GLY G T T 3 TS+ 0 0 91.7 -27.7 -179.1 114.1 112.5 87.7 0 0.0 0 0.0 0 0.0 0 0.0 6 39
60 B 62 LYS K E E AE < T - 57 0 -84.7 136.5 -179.4 -119.0 66.2 128.6 57 -1.9 57 -1.7 0 0.0 0 0.0 12 48
61 B 63 CYS C E E AEF - 56 76 -72.9 148.7 178.1 -110.6 23.7 110.8 76 -1.7 76 -1.1 0 0.0 63 -0.7 13 54
62 B 64 MET M E E A F - 0 75 -79.0 115.4 -178.2 -172.5 49.1 135.2 55 -3.0 0 0.0 0 0.0 0 0.0 14 72
63 B 65 THR T E E A F - 0 74 -120.9 146.3 178.8 -127.9 30.1 153.8 74 -3.4 74 -2.5 61 -0.7 65 -0.9 13 65
64 B 66 ALA A E E A F - 0 73 -88.4 108.4 -180.0 -147.7 18.1 141.8 85 -1.8 0 0.0 0 0.0 0 0.0 13 56
65 B 67 ASN N S e S+ 0 0 -41.4 -44.0 178.9 3.3 84.1 30.5 72 -2.2 0 0.0 63 -0.9 0 0.0 9 46
66 B 68 GLY G S S S- 0 0 -138.9 167.3 -179.5 -125.1 70.3 154.1 0 0.0 0 0.0 0 0.0 0 0.0 7 42
67 B 69 LEU L S S S+ 0 0 -107.6 33.3 179.0 79.6 80.2 92.8 0 0.0 0 0.0 0 0.0 0 0.0 10 36
68 B 70 ASN N S t > TS- 0 0 -136.6 158.6 -179.5 -67.5 94.4 160.2 0 0.0 71 -2.4 0 0.0 0 0.0 9 30
69 B 71 SER S T T 3 TS+ 0 0 -45.8 121.6 179.6 23.5 119.8 98.7 0 0.0 0 0.0 0 0.0 0 0.0 9 31
70 B 72 GLY G T T 3 TS+ 0 0 108.5 -22.4 -179.4 137.1 82.3 84.2 118 -3.1 0 0.0 0 0.0 0 0.0 7 36
71 B 73 SER S t < T - 0 0 -61.7 133.0 -179.8 -126.7 50.8 110.7 68 -2.4 118 -3.0 0 0.0 0 0.0 12 40
72 B 74 TYR Y B e D - 117 0 -81.1 159.2 179.8 -122.5 15.1 113.1 0 0.0 65 -2.2 0 0.0 0 0.0 13 47
73 B 75 ILE I E E AF + 64 0 -101.5 146.6 -179.8 151.1 39.6 140.2 116 -2.3 34 -2.9 0 0.0 0 0.0 14 61
74 B 76 MET M E E AFB - 63 33 -160.0 175.2 179.4 -95.2 39.9 160.6 63 -2.5 63 -3.4 0 0.0 0 0.0 13 59
75 B 77 ILE I E E AF + 62 0 -100.6 162.3 179.8 144.8 45.1 128.5 32 -2.3 31 -3.1 0 0.0 0 0.0 18 56
76 B 78 THR T E E AF - 61 0 -177.2 175.5 -180.0 -52.7 53.0 166.1 61 -1.1 61 -1.7 0 0.0 0 0.0 13 42
77 B 79 ASP D t > T - 0 0 -69.4 129.3 -179.8 -149.9 37.4 119.6 0 0.0 81 -1.1 0 0.0 0 0.0 10 34
78 B 80 CYS C T T 4 TS+ 0 0 -66.3 -39.4 -179.5 59.6 94.1 28.5 0 0.0 0 0.0 0 0.0 0 0.0 9 38
79 B 81 SER S T T 4 TS+ 0 0 -62.0 -26.8 -179.7 30.4 117.7 42.1 0 0.0 0 0.0 0 0.0 0 0.0 4 23
80 B 82 THR T T T 4 TS+ 0 0 -111.1 -6.8 180.0 101.4 99.9 61.1 0 0.0 0 0.0 0 0.0 0 0.0 5 25
81 B 83 ALA A S t < TS- 0 0 -73.2 169.3 179.7 -87.2 84.2 101.2 77 -1.1 0 0.0 0 0.0 0 0.0 10 33
82 B 84 ALA A t > T - 0 0 -82.1 132.5 -179.2 -122.0 34.5 130.1 0 0.0 84 -2.8 0 0.0 85 -1.1 8 35
83 B 85 GLU E T T 3 TS+ 0 0 -73.0 63.5 179.5 33.5 108.5 109.6 0 0.0 0 0.0 0 0.0 0 0.0 6 32
84 B 86 ASP D T T 3 TS+ 0 0 178.9 -30.8 178.3 66.0 105.2 85.1 82 -2.8 0 0.0 0 0.0 0 0.0 8 40
85 B 87 ALA A S t < TS+ 0 0 -86.4 5.0 -179.4 47.3 108.3 69.5 82 -1.1 64 -1.8 0 0.0 0 0.0 13 52
86 B 88 THR T S S S+ 0 0 -122.9 -4.2 -179.8 92.7 91.6 66.7 0 0.0 88 -0.5 0 0.0 0 0.0 15 56
87 B 89 LYS K + 0 0 -99.4 124.7 -179.5 172.4 51.5 147.2 0 0.0 0 0.0 0 0.0 0 0.0 13 48
88 B 90 TRP W - 0 0 -132.6 155.3 -179.9 -152.3 20.0 159.0 53 -3.2 0 0.0 86 -0.5 0 0.0 11 54
89 B 91 GLU E E E CG - 97 0 -129.5 133.2 179.4 -154.6 4.9 171.7 97 -2.3 97 -2.3 0 0.0 91 -0.7 10 45
90 B 92 VAL V E E CG - 96 0 -110.6 108.2 -179.5 -168.6 18.5 155.7 0 0.0 0 0.0 0 0.0 0 0.0 8 46
91 B 93 LEU L E E >CG > T - 95 0 -97.8 153.2 -179.3 -120.1 31.4 130.9 95 -2.8 94 -1.9 89 -0.7 95 -0.5 8 38
92 B 94 ILE I T T 4 3 TS+ 0 0 -58.1 -33.1 179.2 70.4 109.2 37.5 0 0.0 0 0.0 0 0.0 0 0.0 5 37
93 B 95 ASP D T T 4 3 TS- 0 0 -63.4 -3.2 180.0 -102.1 125.6 56.4 0 0.0 0 0.0 0 0.0 0 0.0 7 49
94 B 96 GLY G T T 4 < TS+ 0 0 87.5 25.3 -179.1 144.7 77.2 43.3 91 -1.9 129 -2.5 0 0.0 96 -0.6 13 56
95 B 97 SER S E E T - 0 0 -99.8 108.4 -179.5 -147.0 22.8 151.6 103 -2.3 102 -2.8 0 0.0 0 0.0 13 48
99 B 101 PRO P T T 4 TS+ 0 0 -38.7 -57.6 -178.6 48.0 89.3 32.4 0 0.0 0 0.0 0 0.0 0 0.0 10 35
100 B 102 SER S T T 4 TS+ 0 0 -54.7 -65.3 -178.7 26.1 123.4 16.4 0 0.0 0 0.0 0 0.0 0 0.0 5 30
101 B 103 SER S T T 4 TS- 0 0 -73.5 -31.9 -179.4 -136.8 92.1 36.2 0 0.0 0 0.0 0 0.0 0 0.0 7 33
102 B 104 GLY G t < T + 0 0 86.7 0.4 179.4 135.1 58.4 62.1 98 -2.8 0 0.0 0 0.0 0 0.0 9 34
103 B 105 LEU L - 0 0 -81.8 149.3 -179.2 -140.7 45.2 123.0 0 0.0 98 -2.3 0 0.0 0 0.0 14 44
104 B 106 VAL V E E DHE - 119 97 -117.1 148.7 179.4 -93.9 23.3 150.2 119 -2.6 119 -1.9 0 0.0 0 0.0 13 57
105 B 107 MET M E E DH - 118 0 -53.2 139.7 -178.9 -166.9 50.2 103.7 96 -2.1 0 0.0 0 0.0 0 0.0 12 72
106 B 108 THR T E E DH - 117 0 -138.0 152.3 179.2 -154.2 27.0 165.5 117 -2.4 117 -1.7 0 0.0 0 0.0 11 71
107 B 109 ALA A - 0 0 -125.5 88.7 -179.9 -166.0 8.1 144.4 126 -1.5 0 0.0 0 0.0 0 0.0 12 63
108 B 110 PRO P S S S+ 0 0 -42.4 -34.6 -179.7 5.8 75.8 40.1 0 0.0 0 0.0 0 0.0 0 0.0 7 46
109 B 111 SER S - 0 0 -148.6 166.3 -179.5 -122.6 66.3 162.5 0 0.0 0 0.0 0 0.0 0 0.0 9 43
110 B 112 GLY G S S S+ 0 0 -96.3 12.7 -179.8 117.8 71.9 75.0 0 0.0 112 -0.6 0 0.0 0 0.0 10 48
111 B 113 ALA A S t > TS- 0 0 -84.6 120.7 179.9 -112.3 73.7 135.2 0 0.0 114 -1.9 0 0.0 0 0.0 6 31
112 B 114 SER S T T 3 TS+ 0 0 -50.2 142.0 -179.0 42.7 104.1 99.6 110 -0.6 0 0.0 0 0.0 0 0.0 9 33
113 B 115 ARG R T T 3 TS+ 0 0 102.8 -17.7 179.6 143.5 79.8 85.7 36 -2.7 0 0.0 0 0.0 0 0.0 8 35
114 B 116 THR T t < T - 0 0 -56.7 124.5 179.6 -127.7 51.7 109.2 111 -1.9 36 -1.5 0 0.0 0 0.0 11 40
115 B 117 THR T B B C - 35 0 -78.9 129.0 179.9 -129.6 21.4 128.4 0 0.0 0 0.0 0 0.0 0 0.0 11 48
116 B 118 LEU L - 0 0 -78.3 148.5 -179.7 -174.5 30.4 119.2 34 -2.1 73 -2.3 0 0.0 0 0.0 14 63
117 B 119 LEU L E E DHD - 106 72 -137.2 175.4 178.6 -103.6 30.3 145.8 106 -1.7 106 -2.4 0 0.0 0 0.0 13 57
118 B 120 LEU L E E DH + 105 0 -101.0 128.5 -178.7 165.8 50.3 152.7 71 -3.0 70 -3.1 0 0.0 0 0.0 16 53
119 B 121 GLU E E E DH - 104 0 -140.3 172.8 179.3 -77.3 42.9 150.6 104 -1.9 104 -2.6 0 0.0 0 0.0 12 43
120 B 122 ASN N - 0 0 -72.3 133.9 -179.1 -106.8 56.3 122.5 0 0.0 122 -1.0 0 0.0 0 0.0 8 37
121 B 123 ASN N + 0 0 -67.6 100.4 178.6 150.4 57.4 119.1 0 0.0 0 0.0 0 0.0 0 0.0 9 45
122 B 124 ILE I - 0 0 -113.1 13.4 178.9 -122.9 58.9 80.9 120 -1.0 0 0.0 0 0.0 0 0.0 6 40
123 B 125 HIS H + 0 0 54.6 18.3 179.1 162.4 52.9 52.2 0 0.0 0 0.0 0 0.0 0 0.0 11 49
124 B 126 ALA A g > T - 0 0 -59.8 165.2 179.8 -110.0 55.5 96.9 0 0.0 127 -1.5 0 0.0 0 0.0 14 55
125 B 127 ALA A G G > TS+ 0 0 -73.5 -10.4 179.0 70.7 117.8 52.9 210 -0.6 128 -1.0 0 0.0 0 0.0 15 62
126 B 128 SER S G G 3 TS+ 0 0 -79.7 -9.2 179.8 52.0 96.8 55.8 209 -1.2 107 -1.5 0 0.0 0 0.0 15 64
127 B 129 GLN Q G G < TS+ 0 0 -111.3 18.6 179.8 110.6 85.7 85.8 124 -1.5 129 -0.6 0 0.0 0 0.0 18 70
128 B 130 GLY G g < T + 0 0 -101.4 118.1 -179.7 166.7 41.8 150.0 125 -1.0 0 0.0 0 0.0 0 0.0 19 67
129 B 131 TRP W - 0 0 -130.6 155.1 178.6 -164.7 22.5 157.6 94 -2.5 0 0.0 127 -0.6 0 0.0 14 71
130 B 132 THR T E E AB - 14 0 -140.1 116.2 -179.7 -155.9 10.5 162.9 14 -3.2 14 -2.5 0 0.0 132 -0.6 11 57
131 B 133 VAL V E E AB + 13 0 -99.1 117.4 -179.5 116.9 41.0 147.9 0 0.0 0 0.0 0 0.0 0 0.0 8 52
132 B 134 SER S E E AB - 12 0 -167.1 164.9 179.8 -115.7 68.6 166.3 12 -1.0 12 -0.7 130 -0.6 0 0.0 9 43
133 B 135 ASN N S S S+ 0 0 -82.9 -22.4 177.7 79.5 100.5 43.7 0 0.0 135 -1.0 0 0.0 0 0.0 6 34
134 B 136 ASP D - 0 0 -86.7 105.0 -177.3 -180.0 61.3 140.9 0 0.0 0 0.0 0 0.0 0 0.0 4 32
135 B 137 VAL V + 0 0 -89.5 2.4 -179.2 98.6 45.5 66.2 133 -1.0 0 0.0 0 0.0 0 0.0 10 40
136 B 138 GLN Q S S S- 0 0 -92.8 154.8 179.7 -111.6 75.4 125.1 0 0.0 0 0.0 0 0.0 0 0.0 7 40
137 B 139 PRO P - 0 0 -83.0 145.4 -179.9 -112.8 32.2 125.4 0 0.0 139 -0.6 0 0.0 0 0.0 9 49
138 B 140 ILE I E E EI - 175 0 -82.6 116.3 178.9 -147.4 25.6 133.4 175 -1.2 175 -3.1 0 0.0 0 0.0 10 40
139 B 141 ALA A E E EI + 174 0 -82.5 130.2 -179.0 155.3 35.3 134.2 137 -0.6 264 -1.0 0 0.0 263 -0.9 13 42
140 B 142 THR T E E EI - 173 0 -151.5 173.6 178.2 -109.2 47.6 159.8 173 -3.1 173 -2.8 0 0.0 0 0.0 14 44
141 B 143 LEU L E E EJ - 260 0 -105.1 127.7 179.8 -142.7 29.7 156.3 260 -2.0 260 -2.3 0 0.0 143 -1.1 14 48
142 B 144 ILE I E E EJ - 259 0 -97.4 91.3 -179.6 -174.5 25.4 138.3 0 0.0 150 -2.3 0 0.0 0 0.0 13 61
143 B 145 VAL V E E EJK + 258 149 -85.7 144.8 180.0 154.8 12.3 126.3 258 -2.0 258 -2.4 141 -1.1 0 0.0 13 50
144 B 146 GLY G E E >EJK> T - 257 148 -152.7 -171.0 179.7 -9.5 40.1 147.9 148 -2.6 147 -2.1 0 0.0 148 -1.0 13 49
145 B 147 TYR Y T e 4 3 TS+ 0 0 14.1 -89.3 -177.1 19.4 125.1 72.5 256 -0.9 0 0.0 0 0.0 0 0.0 11 44
146 B 148 ASN N T T 4 3 TS- 0 0 -95.8 33.1 -179.8 -85.8 119.1 92.4 0 0.0 0 0.0 0 0.0 0 0.0 5 34
147 B 149 GLU E T e 4 < TS+ 0 0 73.0 17.7 178.7 127.5 95.7 46.0 144 -2.1 164 -0.7 0 0.0 0 0.0 8 31
148 B 150 MET M E E E L >T - 0 158 -127.6 159.5 179.3 -11.7 34.6 150.4 158 -2.1 157 -0.9 0 0.0 158 -0.7 10 39
154 B 156 GLY G T T 4 5TS+ 0 0 65.8 -124.6 -179.6 3.8 129.0 114.6 0 0.0 156 -0.8 0 0.0 0 0.0 6 25
155 B 157 GLU E T T 4 5TS- 0 0 -90.2 46.7 179.6 -102.0 105.7 106.2 0 0.0 0 0.0 0 0.0 0 0.0 5 23
156 B 158 ASN N T T 4 5TS+ 0 0 31.2 61.6 179.8 105.5 100.1 32.9 154 -0.8 0 0.0 0 0.0 0 0.0 9 36
157 B 159 ASN N T T < 5TS+ 0 0 -141.7 -1.6 -179.8 54.8 70.5 74.9 153 -0.9 204 -1.1 0 0.0 0 0.0 10 35
158 B 160 ASN N E E ELF T - 0 0 -135.0 96.9 -178.7 -158.9 19.7 150.1 0 0.0 168 -2.5 0 0.0 0 0.0 6 29
166 B 168 VAL V T T 3 TS+ 0 0 -43.6 -42.8 -178.9 55.0 91.4 35.5 0 0.0 0 0.0 0 0.0 0 0.0 9 33
167 B 169 THR T T T 3 TS+ 0 0 -71.8 -12.8 179.8 107.5 79.7 51.7 0 0.0 169 -0.8 0 0.0 0 0.0 5 27
168 B 170 SER S g X T - 0 0 -71.7 108.0 -179.6 -153.8 61.5 124.2 165 -2.5 171 -2.7 0 0.0 0 0.0 7 34
169 B 171 VAL V G G > TS+ 0 0 -51.8 -28.6 -179.1 65.0 92.7 39.6 167 -0.8 172 -1.3 0 0.0 0 0.0 8 34
170 B 172 GLN Q G G 3 TS+ 0 0 -78.0 4.4 179.9 55.0 98.2 65.8 0 0.0 152 -2.5 0 0.0 0 0.0 8 45
171 B 173 GLN Q G G < TS+ 0 0 -119.0 12.7 -179.6 99.8 85.4 79.0 168 -2.7 173 -0.6 0 0.0 0 0.0 15 54
172 B 174 GLN Q e < T - 0 0 -107.3 121.8 -179.1 -175.5 50.4 154.2 169 -1.3 184 -1.8 0 0.0 0 0.0 14 51
173 B 175 TRP W E E EIM - 140 183 -117.8 151.3 179.4 -140.1 20.4 148.9 140 -2.8 140 -3.1 171 -0.6 175 -0.6 12 59
174 B 176 ALA A E E EIM - 139 182 -112.7 111.1 -179.9 -147.2 11.8 157.5 182 -2.8 182 -1.8 0 0.0 176 -1.8 13 54
175 B 177 LEU L E E EIM - 138 181 -78.3 85.8 -179.3 -153.3 26.4 124.7 138 -3.1 138 -1.2 173 -0.6 0 0.0 12 61
176 B 178 PHE F e > T - 0 0 -60.2 153.2 -179.1 -122.8 19.5 99.1 174 -1.8 179 -1.1 180 -1.3 0 0.0 13 61
177 B 179 ASP D T T 3 TS+ 0 0 -73.6 -13.2 179.1 69.8 107.4 53.1 0 0.0 0 0.0 0 0.0 0 0.0 15 63
178 B 180 ASP D T T 3 TS- 0 0 -87.4 12.3 178.7 -105.6 121.0 74.2 0 0.0 0 0.0 0 0.0 0 0.0 16 72
179 B 181 ARG R S t < TS+ 0 0 74.2 18.8 178.6 123.0 83.0 50.0 176 -1.1 215 -2.2 0 0.0 0 0.0 14 68
180 B 182 THR T e - 0 0 -108.7 153.5 179.2 -134.7 56.5 142.2 0 0.0 176 -1.3 0 0.0 182 -0.5 15 68
181 B 183 ILE I E E EM + 175 0 -110.1 123.6 -178.4 178.1 30.9 159.7 0 0.0 191 -3.2 0 0.0 0 0.0 12 74
182 B 184 ARG R E E EMN - 174 190 -125.9 164.7 178.8 -90.4 38.2 144.7 174 -1.8 174 -2.8 180 -0.5 0 0.0 14 59
183 B 185 VAL V E E EMN> T - 173 186 -72.2 119.8 -179.2 -134.3 38.1 126.5 189 -1.3 186 -2.5 186 -0.8 0 0.0 15 49
184 B 186 ASN N T e > TS+ 0 0 -40.8 -55.8 -179.6 34.0 104.7 29.5 172 -1.8 187 -0.5 0 0.0 0 0.0 10 46
185 B 187 ASN N T T 3 TS+ 0 0 -97.3 37.6 179.2 40.7 128.2 96.8 0 0.0 0 0.0 0 0.0 0 0.0 5 35
186 B 188 SER S E E EN X T + 183 0 -175.7 55.4 -178.1 171.4 66.4 97.9 183 -2.5 189 -2.5 0 0.0 183 -0.8 7 36
187 B 189 ARG R E E E* < TS+ 0 0 -63.6 16.5 178.3 74.8 70.1 77.1 184 -0.5 0 0.0 0 0.0 0 0.0 9 43
188 B 190 GLY G E E E* 3 TS+ 0 0 -102.5 -11.7 179.8 79.4 83.0 58.5 0 0.0 207 -2.8 0 0.0 0 0.0 8 42
189 B 191 LEU L E E E*O< T - 0 206 -100.3 129.0 -179.7 -164.0 65.8 148.1 186 -2.5 183 -1.3 0 0.0 0 0.0 12 49
190 B 192 CYS C E E ENO - 182 205 -116.1 141.5 177.8 -108.2 30.3 154.3 205 -2.6 205 -1.7 0 0.0 0 0.0 14 60
191 B 193 VAL V E E E O - 0 204 -63.1 119.3 -178.4 -171.5 53.2 121.6 181 -3.2 0 0.0 0 0.0 0 0.0 13 70
192 B 194 THR T E E E O - 0 203 -125.4 150.8 178.9 -136.3 24.5 155.5 203 -2.8 203 -2.4 0 0.0 0 0.0 10 62
193 B 195 SER S E E E O - 0 202 -99.8 141.8 -179.0 -138.0 15.4 142.7 212 -1.8 0 0.0 0 0.0 0 0.0 13 57
194 B 196 ASN N S e S- 0 0 -76.1 -6.1 -179.9 -24.2 78.4 57.5 201 -2.8 0 0.0 0 0.0 0 0.0 9 39
195 B 197 GLY G - 0 0 179.6 -175.5 -179.9 -94.4 62.7 170.8 0 0.0 0 0.0 0 0.0 0 0.0 7 36
196 B 198 TYR Y S S S+ 0 0 -110.1 21.6 -179.8 95.6 86.7 85.0 0 0.0 0 0.0 0 0.0 0 0.0 11 36
197 B 199 VAL V S t > TS- 0 0 -115.4 150.8 179.5 -89.3 84.7 148.1 0 0.0 200 -2.0 0 0.0 0 0.0 9 28
198 B 200 SER S T T 3 TS+ 0 0 -53.1 143.7 179.9 22.4 113.2 101.0 0 0.0 0 0.0 0 0.0 0 0.0 9 31
199 B 201 LYS K T T 3 TS+ 0 0 77.5 -4.1 179.1 148.9 85.2 67.9 246 -1.9 0 0.0 0 0.0 0 0.0 7 36
200 B 202 ASP D E E EP < T - 246 0 -63.4 129.3 -179.2 -116.0 49.3 116.5 197 -2.0 246 -1.9 246 -0.6 0 0.0 12 35
201 B 203 LEU L E E EP - 245 0 -63.2 168.2 179.3 -132.9 17.4 92.6 0 0.0 194 -2.8 0 0.0 0 0.0 11 41
202 B 204 ILE I E E EO + 193 0 -129.0 120.4 -179.3 151.8 36.0 170.4 244 -1.1 159 -0.7 0 0.0 0 0.0 14 55
203 B 205 VAL V E E EOF - 192 158 -128.4 -161.4 179.6 -86.4 46.8 118.2 192 -2.4 192 -2.8 0 0.0 205 -0.5 11 51
204 B 206 ILE I E E EO + 191 0 -122.8 109.8 -179.9 168.7 46.9 159.6 157 -1.1 0 0.0 0 0.0 0 0.0 13 53
205 B 207 ARG R E E EO - 190 0 -110.3 175.3 178.7 -79.6 43.7 124.7 190 -1.7 190 -2.6 203 -0.5 0 0.0 9 37
206 B 208 LYS K E E EO - 189 0 -73.9 144.3 -179.4 -101.4 55.7 120.2 0 0.0 208 -0.5 0 0.0 0 0.0 7 39
207 B 209 CYS C e + 0 0 -72.8 117.5 179.9 146.0 60.1 124.2 188 -2.8 0 0.0 0 0.0 0 0.0 9 52
208 B 210 GLN Q - 0 0 -134.4 10.5 180.0 -107.7 65.9 76.2 206 -0.5 0 0.0 0 0.0 0 0.0 8 42
209 B 211 GLY G + 0 0 64.1 35.6 179.4 162.1 62.2 30.6 0 0.0 126 -1.2 0 0.0 0 0.0 13 55
210 B 212 LEU L g > T - 0 0 -82.7 164.9 179.5 -114.0 54.8 113.0 0 0.0 213 -1.3 0 0.0 125 -0.6 10 50
211 B 213 ALA A G G > TS+ 0 0 -70.0 -19.3 -179.7 63.7 117.2 43.9 0 0.0 214 -0.6 0 0.0 0 0.0 12 54
212 B 214 THR T G G 3 TS+ 0 0 -79.2 -11.8 -179.1 45.7 104.2 53.9 0 0.0 193 -1.8 0 0.0 0 0.0 12 52
213 B 215 GLN Q G G < TS+ 0 0 -114.8 9.4 179.6 103.6 85.7 74.4 210 -1.3 215 -0.7 0 0.0 0 0.0 17 65
214 B 216 ARG R g < T - 0 0 -97.8 114.4 -179.2 -178.2 49.4 147.6 211 -0.6 0 0.0 0 0.0 0 0.0 15 64
215 B 217 TRP W - 0 0 -115.1 150.2 180.0 -158.4 15.9 147.4 179 -2.2 0 0.0 213 -0.7 0 0.0 11 70
216 B 218 PHE F E E FQ - 224 0 -130.3 116.8 -179.8 -143.1 13.7 165.8 224 -2.4 224 -3.0 0 0.0 218 -1.3 11 57
217 B 219 PHE F E E FQ - 223 0 -81.4 93.4 -179.9 -152.2 24.5 129.3 0 0.0 0 0.0 0 0.0 0 0.0 9 52
218 B 220 ASN N e > T - 0 0 -67.0 142.9 -179.5 -123.0 19.7 111.4 222 -1.5 221 -2.0 216 -1.3 0 0.0 8 35
219 B 221 SER S T T 3 TS+ 0 0 -60.5 -16.1 -179.6 73.9 106.0 49.7 0 0.0 0 0.0 0 0.0 0 0.0 5 23
220 B 222 ASP D T T 3 TS- 0 0 -78.5 -0.1 179.4 -99.8 122.0 61.4 0 0.0 0 0.0 0 0.0 0 0.0 4 26
221 B 223 GLY G S t < TS+ 0 0 102.7 -13.6 -179.4 114.5 88.7 77.2 218 -2.0 257 -2.1 0 0.0 0 0.0 10 32
222 B 224 SER S e - 0 0 -90.9 160.8 178.5 -137.5 59.1 118.9 0 0.0 218 -1.5 0 0.0 224 -0.5 12 41
223 B 225 VAL V E E FQ - 217 0 -118.2 118.7 -177.8 -161.0 27.3 168.3 0 0.0 232 -1.8 0 0.0 0 0.0 13 54
224 B 226 VAL V E E FQH - 216 231 -107.9 155.9 178.0 -136.6 25.4 134.5 216 -3.0 216 -2.4 222 -0.5 226 -0.9 12 57
225 B 227 ASN N t > > T - 0 0 -104.7 85.3 -178.5 -153.0 24.7 144.0 230 -2.5 229 -2.4 0 0.0 228 -1.7 14 61
226 B 228 LEU L T T 4 3 TS+ 0 0 -27.3 -47.7 -179.0 51.9 89.5 44.4 224 -0.9 0 0.0 0 0.0 0 0.0 11 50
227 B 229 LYS K T T 4 3 TS+ 0 0 -64.6 -42.6 -178.9 26.1 123.9 25.8 0 0.0 0 0.0 0 0.0 0 0.0 10 44
228 B 230 SER S T T 4 < TS- 0 0 -98.7 -8.8 -179.4 -137.6 91.6 58.6 225 -1.7 0 0.0 0 0.0 0 0.0 7 40
229 B 231 THR T t < T + 0 0 60.4 9.9 179.2 133.4 62.8 52.4 225 -2.4 0 0.0 0 0.0 0 0.0 8 39
230 B 232 ARG R - 0 0 -89.2 151.7 -179.0 -141.6 46.5 127.4 0 0.0 225 -2.5 0 0.0 0 0.0 14 46
231 B 233 VAL V E E ERH - 247 224 -112.9 168.5 179.7 -86.7 25.2 131.5 247 -1.9 247 -2.6 0 0.0 0 0.0 13 55
232 B 234 MET M E E ER - 246 0 -75.5 129.0 -178.5 -175.6 48.8 125.9 223 -1.8 0 0.0 0 0.0 0 0.0 12 67
233 B 235 ASP D E E ER - 245 0 -130.7 142.7 179.8 -136.3 22.1 166.1 245 -3.8 245 -3.2 0 0.0 235 -0.6 10 60
234 B 236 VAL V E E ER - 244 0 -101.4 116.9 179.8 -121.4 27.3 150.7 254 -1.3 236 -0.7 0 0.0 0 0.0 12 55
235 B 237 LYS K e > T - 0 0 -58.3 103.6 -179.8 -166.7 24.4 112.8 243 -2.6 238 -1.0 233 -0.6 0 0.0 10 40
236 B 238 GLU E T T 3 TS+ 0 0 -59.2 -43.1 -178.9 73.6 77.3 26.8 234 -0.7 0 0.0 0 0.0 0 0.0 7 31
237 B 239 SER S T T 3 TS+ 0 0 -43.4 -33.8 -178.8 94.6 77.7 42.1 0 0.0 0 0.0 0 0.0 0 0.0 5 19
238 B 240 ASP D t < T - 0 0 -69.4 138.0 178.7 -159.0 59.9 113.4 235 -1.0 0 0.0 0 0.0 0 0.0 8 22
239 B 241 VAL V S S S+ 0 0 -76.4 -61.6 178.9 3.0 77.6 14.0 0 0.0 0 0.0 0 0.0 0 0.0 6 18
240 B 242 SER S S S S+ 0 0 -119.0 173.1 -180.0 21.1 129.7 134.0 0 0.0 0 0.0 0 0.0 0 0.0 6 24
241 B 243 LEU L S S S- 0 0 36.9 36.6 179.7 -165.7 80.9 39.8 0 0.0 0 0.0 0 0.0 0 0.0 8 36
242 B 244 GLN Q - 0 0 -51.2 132.9 -179.3 -129.4 12.9 103.9 0 0.0 161 -1.4 0 0.0 0 0.0 13 38
243 B 245 GLU E B e G - 160 0 -86.2 164.0 179.0 -127.3 10.2 113.4 0 0.0 235 -2.6 0 0.0 0 0.0 12 47
244 B 246 VAL V E E E R + 0 234 -111.6 145.0 -179.8 169.4 30.3 150.9 159 -0.7 202 -1.1 0 0.0 0 0.0 13 59
245 B 247 ILE I E E EPR - 201 233 -142.6 174.8 178.4 -95.3 39.6 149.3 233 -3.2 233 -3.8 0 0.0 247 -0.6 14 53
246 B 248 ILE I E E EPR + 200 232 -101.0 123.6 -178.4 167.9 49.0 152.2 200 -1.9 199 -1.9 0 0.0 200 -0.6 16 52
247 B 249 PHE F E E E R - 0 231 -136.6 147.0 179.8 -88.2 42.6 168.2 231 -2.6 231 -1.9 245 -0.6 0 0.0 12 40
248 B 250 PRO P - 0 0 -52.2 141.3 -179.8 -90.0 60.6 102.0 0 0.0 0 0.0 0 0.0 0 0.0 8 35
249 B 251 ALA A + 0 0 -54.7 138.6 -179.9 158.3 56.0 103.5 0 0.0 0 0.0 0 0.0 0 0.0 7 38
250 B 252 THR T - 0 0 -134.3 -29.1 -179.9 -119.5 51.1 58.8 0 0.0 0 0.0 0 0.0 0 0.0 5 29
251 B 253 GLY G + 0 0 102.9 -15.4 -179.9 140.9 63.8 78.7 0 0.0 0 0.0 0 0.0 0 0.0 6 26
252 B 254 ASN N g > T - 0 0 -58.2 157.9 -179.8 -107.1 65.2 96.4 0 0.0 255 -1.3 0 0.0 0 0.0 6 25
253 B 255 PRO P G G > TS+ 0 0 -55.1 -44.7 -179.0 67.3 112.8 30.7 0 0.0 256 -2.5 0 0.0 0 0.0 6 30
254 B 256 ASN N G G 3 TS+ 0 0 -64.0 9.7 178.4 57.6 97.7 68.6 0 0.0 234 -1.3 0 0.0 0 0.0 11 45
255 B 257 GLN Q G G < TS+ 0 0 -123.8 19.6 179.4 101.0 87.2 88.3 252 -1.3 0 0.0 0 0.0 0 0.0 17 49
256 B 258 GLN Q e < T - 0 0 -108.1 137.2 -179.3 -177.6 49.0 152.6 253 -2.5 145 -0.9 0 0.0 0 0.0 12 43
257 B 259 TRP W E E EJ - 144 0 -142.3 130.5 -179.9 -164.6 12.1 171.8 221 -2.1 259 -0.5 0 0.0 0 0.0 11 48
258 B 260 ARG R E E EJ - 143 0 -118.1 118.6 -179.9 -144.8 15.0 162.9 143 -2.4 143 -2.0 0 0.0 260 -1.2 8 44
259 B 261 THR T E E EJ - 142 0 -83.8 97.4 179.9 -167.6 16.2 132.7 257 -0.5 261 -1.1 0 0.0 0 0.0 8 44
260 B 262 GLN Q E E EJ - 141 0 -89.5 98.8 -179.4 -143.2 14.9 137.3 141 -2.3 141 -2.0 258 -1.2 0 0.0 8 33
261 B 263 VAL V - 0 0 -63.5 121.6 179.6 -174.2 17.6 114.6 259 -1.1 0 0.0 0 0.0 0 0.0 9 32
262 B 264 PRO P S S S+ 0 0 -86.4 -30.7 179.7 0.9 87.6 37.1 0 0.0 0 0.0 0 0.0 0 0.0 8 27
263 B 265 GLN Q 0 0 -121.1 -44.8 179.9 999.9 999.9 46.5 139 -0.9 0 0.0 0 0.0 0 0.0 6 23
264 B 266 ILE I 0 0 129.8 999.9 999.9 999.9 999.9 80.3 139 -1.0 0 0.0 0 0.0 0 0.0 6 23
1hwmB.pdb
1HWM HYDROLASE MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand EEEEEE GGG EEEEGGG STT BEEEE GGG EEE TTS EEETTEEEEESSSSTT BEEEE TTTS TTSS EEETTTEEE TT Kabs/Sand
chirality --------+---++--+--+----+-+-++--+-+--+-+-+++-----+-+-+---+-----+-+-++--+-+--+++--+++++----+-+-+--++ chirality
bends SSS SSS SSS SSS SSS SSS SSSSSS SSSS SSSS SSS SS bends
turns TTTTT TTTTT TTTT TTTTT TTTT TTTT TTTT TTTTTTTTT TTTTT TTT turns
5-turns 5-turns
3-turns >>3<< >>3<< >33< >>3<< >33< >33< >33< >33< >33< 3-turns
bridge-2 A A C DD EE FFFF B E bridge-2
bridge-1 AAABBB CCCC BCCCC AAA DD EE DFFFF GGG GGG bridge-1
sheets AAAAAA BBBB BBBB AAA AAA AAAAA AAAA CCC CCC sheets
4-turns >444< >444< >44 4-turns
summary EEEEEEgGGGgEEEEeGGg tTTteEEEE gGGGgEEEeTTteEEETTEEEEEeSStTTteEEEEtTTTttTTtS EEETTTEEEtTT summary
sequence ETCAIPAPFTRRIVGRDGLCVDVRNGYDTDGTPIQLWPCGTQRNQQWTFYNDKTIRSMGKCMTANGLNSGSYIMITDCSTAAEDATKWEVLIDGSIINPS sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand T EEE S SSTT B EEE GGG EEES S EEEEEEETTTEEEEEETTTTEEEEEE TT GGG EEE TTS EEETTEEEEEEEES SSTTE Kabs/Sand
chirality -+-----+-+-++----+--+-+-++++--+-+-+---+---+-+-+------+-++-+-+--+-++-+++-----+-+-+--+++++-------+-++- chirality
bends S S SSSS SSS S S SSS SSSS SS SSS SSS SS SS S SSSS bends
turns TT TTTT TTTTT TTTTT TTTTTT TTTTTTTT TTTT TTTTTTT TTTT turns
5-turns >5555< 5-turns
3-turns >33< >>3<< >33< >33X>3<< >33< >>3X<3< >33< 3-turns
bridge-2 E D KK LLLLLL F G MMM NN OOOOO bridge-2
bridge-1 HHH C HHH BBB IIIJJJJ KK LLLLLL III MMM N***N P bridge-1
sheets DDD DDD AAA EEEEEEE EEEEEE EEEEEE EEE EEE EEEEEEEE E sheets
4-turns 4< >444< >444< 4-turns
summary Tt EEE S StTTtB EEE gGGGg EEES S EEEEEEEeTeEEEEEETTTTEEEEEEetTTgGGGeEEEeTTteEEEeTEEEEEEEEe StTTE summary
sequence SGLVMTAPSGASRTTLLLENNIHAASQGWTVSNDVQPIATLIVGYNEMCLQANGENNNVWMEDCDVTSVQQQWALFDDRTIRVNNSRGLCVTSNGYVSKD sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand EEEEEE GGG EE TTS EE TTT EEEE TT SSS BEEEE GGG EEEE S Kabs/Sand
chirality -+-+--+-+-+++-----+-+----++-+------++-++---+-+--+-+-+++------+ chirality
bends SSS SSS SSS SS SSS SSS S bends
turns TTTTT TTTT TTTTT TTTT TTTTT turns
5-turns 5-turns
3-turns >>3<< >33< >33< >33< >>3<< 3-turns
bridge-2 F H H RRRR bridge-2
bridge-1 POOOOO QQ QQ RRRR G PP JJJJ bridge-1
sheets EEEEEE FF FF EEEE EEEE EEEE sheets
4-turns >444< 4-turns
summary EEEEEEe gGGGg EEeTTteEEtTTTt EEEEeTTtSSS eEEEE gGGGeEEEE S summary
sequence LIVIRKCQGLATQRWFFNSDGSVVNLKSTRVMDVKESDVSLQEVIIFPATGNPNQQWRTQVPQI sequence
210 220 230 240 250 260