Secondary structure calculation program - copyright by David Keith Smith, 1989
1aisB.pdb
1AIS COMPLEX (RIBOSOME BINDING/DNA) MOL_ID: 1; MOL_ID: 1;
Sequence length - 193
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 B1108 ASN N h > T 0 0 999.9 -29.4 178.4 999.9 999.9 999.9 0 0.0 5 -2.0 0 0.0 0 0.0 5 26
2 B1109 LEU L H H > T + 0 0 -70.2 -23.5 179.1 55.3 999.9 44.7 0 0.0 6 -1.7 0 0.0 0 0.0 5 32
3 B1110 ALA A H H > TS+ 0 0 -76.2 -41.3 179.1 43.9 109.3 28.8 0 0.0 7 -1.2 0 0.0 0 0.0 6 20
4 B1111 PHE F H H > TS+ 0 0 -71.0 -33.1 179.8 58.7 110.9 31.8 0 0.0 8 -1.4 0 0.0 0 0.0 8 24
5 B1112 ALA A H H X > TS+ 0 0 -59.5 -55.0 -179.7 43.6 106.7 16.9 1 -2.0 9 -1.6 0 0.0 8 -0.7 11 37
6 B1113 LEU L H H X 3 TS+ 0 0 -62.9 -28.3 -179.6 59.2 110.3 38.0 2 -1.7 10 -1.1 0 0.0 0 0.0 9 39
7 B1114 SER S H H X 3 TS+ 0 0 -71.0 -33.4 178.9 47.1 105.0 35.1 3 -1.2 11 -0.9 0 0.0 0 0.0 8 31
8 B1115 GLU E H H X < TS+ 0 0 -75.1 -32.9 178.9 59.7 106.4 34.7 4 -1.4 12 -2.7 5 -0.7 0 0.0 10 40
9 B1116 LEU L H H X TS+ 0 0 -62.5 -34.9 178.8 54.0 101.7 34.4 5 -1.6 13 -3.2 0 0.0 0 0.0 14 50
10 B1117 ASP D H H X TS+ 0 0 -68.3 -35.6 178.4 47.6 109.1 32.0 6 -1.1 14 -1.9 0 0.0 0 0.0 8 36
11 B1118 ARG R H H X TS+ 0 0 -67.5 -47.7 -180.0 46.3 115.1 18.6 7 -0.9 15 -3.0 0 0.0 0 0.0 8 37
12 B1119 ILE I H H X TS+ 0 0 -57.9 -53.3 -179.2 44.1 116.0 19.5 8 -2.7 16 -3.1 0 0.0 0 0.0 15 50
13 B1120 THR T H H X >TS+ 0 0 -64.9 -33.2 179.6 48.0 115.8 35.1 9 -3.2 18 -1.2 0 0.0 17 -1.1 11 42
14 B1121 ALA A H H < 5TS+ 0 0 -73.6 -45.1 -179.2 43.1 115.9 20.5 10 -1.9 0 0.0 0 0.0 0 0.0 8 28
15 B1122 GLN Q H H < 5TS+ 0 0 -67.4 -41.8 179.8 36.5 123.9 23.4 11 -3.0 0 0.0 0 0.0 0 0.0 8 29
16 B1123 LEU L H H < 5TS- 0 0 -86.1 -13.0 -179.9 -129.2 104.8 51.0 12 -3.1 0 0.0 0 0.0 0 0.0 9 41
17 B1124 LYS K T h < 5T - 0 0 66.2 33.0 -179.2 -174.3 39.2 38.0 13 -1.1 0 0.0 0 0.0 0 0.0 7 32
18 B1125 LEU L t > T - 0 0 -68.9 161.0 -177.9 -100.8 29.9 105.7 0 0.0 23 -2.2 0 0.0 22 -0.8 7 30
20 B1127 ARG R H H > 3 TS+ 0 0 -51.1 -43.9 -179.3 54.6 118.1 35.3 0 0.0 24 -2.6 0 0.0 0 0.0 6 27
21 B1128 HIS H H H > 3 TS+ 0 0 -63.7 -33.0 -179.6 45.5 111.1 33.3 0 0.0 25 -1.2 0 0.0 0 0.0 6 30
22 B1129 VAL V H H > < TS+ 0 0 -75.7 -45.6 178.0 48.1 113.7 22.0 19 -0.8 26 -2.1 0 0.0 0 0.0 13 40
23 B1130 GLU E H H X TS+ 0 0 -59.5 -43.7 178.9 49.6 112.8 24.9 19 -2.2 27 -2.0 0 0.0 0 0.0 13 44
24 B1131 GLU E H H X TS+ 0 0 -65.8 -31.4 178.8 51.6 109.1 36.3 20 -2.6 28 -2.1 0 0.0 0 0.0 8 39
25 B1132 GLU E H H X TS+ 0 0 -72.6 -35.4 179.0 53.2 107.9 30.8 21 -1.2 29 -2.1 0 0.0 0 0.0 10 43
26 B1133 ALA A H H X TS+ 0 0 -62.5 -47.5 179.7 44.5 111.8 20.9 22 -2.1 30 -2.0 0 0.0 0 0.0 14 58
27 B1134 ALA A H H X TS+ 0 0 -64.0 -44.2 -179.1 50.6 113.1 24.6 23 -2.0 31 -2.0 0 0.0 0 0.0 12 48
28 B1135 ARG R H H X TS+ 0 0 -63.5 -38.0 179.2 50.2 110.1 31.4 24 -2.1 32 -1.2 0 0.0 0 0.0 8 41
29 B1136 LEU L H H X TS+ 0 0 -66.2 -41.5 -179.4 54.0 108.6 25.8 25 -2.1 33 -1.2 0 0.0 0 0.0 10 50
30 B1137 TYR Y H H X TS+ 0 0 -60.5 -45.7 179.2 43.8 110.3 27.0 26 -2.0 34 -1.7 0 0.0 0 0.0 11 56
31 B1138 ARG R H H X TS+ 0 0 -70.8 -25.1 178.7 57.5 110.1 41.8 27 -2.0 35 -1.5 0 0.0 0 0.0 8 39
32 B1139 GLU E H H < TS+ 0 0 -73.7 -26.0 178.9 44.9 110.1 41.0 28 -1.2 0 0.0 0 0.0 0 0.0 9 35
33 B1140 ALA A H H < >>TS+ 0 0 -85.2 -32.4 179.4 63.4 104.0 38.9 29 -1.2 38 -0.8 0 0.0 36 -0.7 11 44
34 B1141 VAL V H H < >5TS+ 0 0 -57.4 -45.4 179.2 50.2 101.7 24.7 30 -1.7 37 -0.8 0 0.0 0 0.0 8 36
35 B1142 ARG R T h < 35TS+ 0 0 -67.2 -17.5 -179.8 57.7 109.3 48.3 31 -1.5 0 0.0 0 0.0 0 0.0 7 20
36 B1143 LYS K T T X5TS- 0 0 -111.6 48.6 178.1 -96.8 122.2 110.6 33 -0.7 38 -1.9 0 0.0 39 -0.6 7 26
37 B1144 GLY G T T <5T - 0 0 72.2 -43.6 -179.0 -129.8 31.7 96.3 34 -0.8 0 0.0 0 0.0 0 0.0 7 25
38 B1145 LEU L T T > 3 T - 0 0 -32.7 141.2 179.7 -130.5 18.7 80.3 41 -0.6 47 -1.9 0 0.0 0 0.0 6 38
44 B1151 ILE I H H > TS+ 0 0 -71.6 -18.9 178.8 50.5 111.6 45.4 0 0.0 48 -0.7 0 0.0 0 0.0 9 45
45 B1152 GLU E H H > TS+ 0 0 -86.0 -34.0 -179.4 51.3 108.7 36.2 0 0.0 49 -1.3 0 0.0 0 0.0 9 50
46 B1153 SER S H H > TS+ 0 0 -69.7 -47.2 -179.6 50.2 107.5 25.0 0 0.0 50 -1.1 0 0.0 0 0.0 11 53
47 B1154 VAL V H H X TS+ 0 0 -62.4 -39.7 -179.9 48.0 111.1 30.2 43 -1.9 51 -2.8 0 0.0 0 0.0 15 63
48 B1155 MET M H H X TS+ 0 0 -72.0 -36.9 178.1 49.4 110.6 32.2 44 -0.7 52 -2.5 0 0.0 0 0.0 14 67
49 B1156 ALA A H H X TS+ 0 0 -71.1 -24.0 178.0 50.8 113.2 42.7 45 -1.3 53 -0.8 0 0.0 0 0.0 14 67
50 B1157 ALA A H H X > TS+ 0 0 -73.4 -53.6 179.4 50.5 108.8 18.0 46 -1.1 54 -2.5 0 0.0 53 -0.7 13 69
51 B1158 CYS C H H X 3 TS+ 0 0 -52.0 -47.5 -180.0 51.2 107.9 27.6 47 -2.8 55 -2.5 0 0.0 0 0.0 14 73
52 B1159 VAL V H H X 3 TS+ 0 0 -63.5 -29.1 178.9 51.1 110.5 33.5 48 -2.5 56 -2.1 0 0.0 0 0.0 14 68
53 B1160 TYR Y H H X < TS+ 0 0 -70.0 -49.9 178.9 42.0 114.3 16.7 49 -0.8 57 -1.7 50 -0.7 0 0.0 12 67
54 B1161 ALA A H H X TS+ 0 0 -66.2 -29.2 -179.8 55.5 113.1 40.3 50 -2.5 58 -2.7 0 0.0 0 0.0 12 62
55 B1162 ALA A H H X TS+ 0 0 -69.6 -48.2 179.7 47.2 107.7 20.5 51 -2.5 59 -2.5 0 0.0 0 0.0 13 58
56 B1163 CYS C H H X >TS+ 0 0 -61.4 -33.1 -179.5 47.8 115.4 33.4 52 -2.1 61 -2.3 0 0.0 60 -0.5 12 54
57 B1164 ARG R H H < >5TS+ 0 0 -74.4 -46.9 179.8 48.6 111.0 23.1 53 -1.7 60 -0.6 0 0.0 0 0.0 14 50
58 B1165 LEU L H H < 35TS+ 0 0 -61.4 -36.8 -178.5 39.9 119.3 27.0 54 -2.7 0 0.0 0 0.0 0 0.0 10 45
59 B1166 LEU L H H < 35TS- 0 0 -94.0 -1.7 179.1 -119.7 109.2 62.2 55 -2.5 0 0.0 0 0.0 0 0.0 7 39
60 B1167 LYS K T h < <5T + 0 0 67.9 27.8 178.1 140.4 65.8 40.7 57 -0.6 0 0.0 56 -0.5 0 0.0 8 40
61 B1168 VAL V t > T - 0 0 -43.4 131.9 179.6 -119.0 23.6 95.4 0 0.0 68 -1.3 0 0.0 67 -0.8 6 58
65 B1172 LEU L H H > 3 TS+ 0 0 -49.6 -18.5 177.7 62.9 115.1 50.3 0 0.0 69 -1.2 0 0.0 0 0.0 8 48
66 B1173 ASP D H H > 3 TS+ 0 0 -69.1 -55.4 -179.7 51.0 99.6 14.4 0 0.0 70 -1.7 0 0.0 0 0.0 6 38
67 B1174 GLU E H H > < TS+ 0 0 -51.0 -40.6 179.7 41.8 115.5 36.0 64 -0.8 71 -0.9 0 0.0 0 0.0 9 42
68 B1175 ILE I H H X TS+ 0 0 -81.3 -27.3 -179.0 62.7 108.2 40.2 64 -1.3 72 -0.6 0 0.0 0 0.0 13 50
69 B1176 ALA A H H < >TS+ 0 0 -66.1 -46.1 -179.2 39.5 106.2 25.9 65 -1.2 74 -1.2 0 0.0 0 0.0 13 40
70 B1177 ASP D H H < >5TS+ 0 0 -73.8 -45.5 -179.7 50.9 112.9 23.3 66 -1.7 73 -1.7 0 0.0 0 0.0 9 33
71 B1178 ILE I H H < 35TS+ 0 0 -67.0 -16.2 179.5 52.6 110.9 48.8 67 -0.9 0 0.0 0 0.0 0 0.0 9 33
72 B1179 ALA A T h < 35TS- 0 0 -97.9 0.2 179.6 -122.4 113.1 67.5 68 -0.6 0 0.0 0 0.0 0 0.0 9 45
73 B1180 ARG R T T <5TS+ 0 0 55.4 71.4 -179.7 74.4 75.0 10.6 70 -1.7 0 0.0 0 0.0 0 0.0 6 30
74 B1181 VAL V S t T - 0 0 -128.9 172.6 -179.2 -96.5 36.6 145.7 0 0.0 79 -1.3 0 0.0 0 0.0 8 27
76 B1183 LYS K H H > TS+ 0 0 -61.6 -10.7 -179.2 80.1 104.3 56.0 0 0.0 80 -1.6 0 0.0 0 0.0 8 33
77 B1184 LYS K H H > TS+ 0 0 -62.9 -87.9 179.8 14.8 105.8 11.4 0 0.0 81 -2.0 0 0.0 0 0.0 6 26
78 B1185 GLU E H H > TS+ 0 0 -59.7 -30.3 177.9 62.6 125.9 36.0 0 0.0 82 -2.6 0 0.0 0 0.0 8 35
79 B1186 ILE I H H X TS+ 0 0 -56.2 -57.9 -179.2 42.6 107.0 9.5 75 -1.3 83 -2.7 0 0.0 0 0.0 14 43
80 B1187 GLY G H H X TS+ 0 0 -58.2 -40.8 -179.4 50.6 113.9 32.5 76 -1.6 84 -2.8 0 0.0 0 0.0 9 38
81 B1188 ARG R H H X TS+ 0 0 -66.8 -43.1 179.3 43.8 113.7 24.6 77 -2.0 85 -1.9 0 0.0 0 0.0 8 34
82 B1189 SER S H H X TS+ 0 0 -68.5 -39.5 178.5 49.3 116.0 25.4 78 -2.6 86 -3.5 0 0.0 0 0.0 12 47
83 B1190 TYR Y H H X TS+ 0 0 -58.6 -66.9 179.6 42.8 114.5 4.6 79 -2.7 87 -2.8 0 0.0 0 0.0 13 53
84 B1191 ARG R H H X TS+ 0 0 -49.2 -33.1 -179.7 48.2 119.2 36.5 80 -2.8 88 -1.2 0 0.0 0 0.0 8 40
85 B1192 PHE F H H X TS+ 0 0 -73.9 -60.4 179.9 40.7 113.9 9.2 81 -1.9 89 -1.6 0 0.0 0 0.0 8 42
86 B1193 ILE I H H X TS+ 0 0 -59.3 -25.0 -179.8 67.8 109.9 41.4 82 -3.5 90 -0.8 0 0.0 0 0.0 13 51
87 B1194 ALA A H H < >>TS+ 0 0 -60.3 -73.0 179.6 19.4 114.7 6.8 83 -2.8 92 -1.0 0 0.0 90 -1.0 11 47
88 B1195 ARG R H H < 35TS+ 0 0 -77.7 -7.9 177.1 72.3 115.1 54.7 84 -1.2 0 0.0 0 0.0 0 0.0 9 34
89 B1196 ASN N H H < 35TS+ 0 0 -73.2 -24.1 178.8 38.7 108.6 41.9 85 -1.6 0 0.0 0 0.0 0 0.0 7 32
90 B1197 LEU L T h < <5TS- 0 0 -102.1 -151.3 -179.3 -77.5 116.9 89.8 87 -1.0 0 0.0 86 -0.8 0 0.0 8 37
91 B1198 ASN N T T 5TS+ 0 0 -94.7 2.6 -177.3 133.3 83.1 65.8 0 0.0 0 0.0 0 0.0 0 0.0 6 29
92 B1199 LEU L t T - 0 0 -110.1 154.7 179.5 -116.3 35.5 139.0 0 0.0 97 -2.5 0 0.0 0 0.0 8 23
94 B1201 PRO P T T 4 TS+ 0 0 -56.7 -29.3 179.2 55.1 118.3 34.8 0 0.0 0 0.0 0 0.0 0 0.0 6 25
95 B1202 LYS K T T 4 > TS+ 0 0 -69.6 -45.9 -179.6 43.2 110.0 16.9 0 0.0 98 -0.8 0 0.0 0 0.0 5 19
96 B1203 LYS K T T 4 3 TS+ 0 0 -67.9 -33.2 -180.0 43.4 119.3 32.7 0 0.0 0 0.0 0 0.0 0 0.0 8 28
97 B1204 LEU L T T < 3 TS+ 0 0 -89.6 -1.8 -178.9 122.8 87.7 64.9 93 -2.5 0 0.0 0 0.0 0 0.0 10 40
98 B1205 PHE F t < T - 0 0 -66.6 124.2 179.0 -171.5 41.6 116.4 95 -0.8 0 0.0 0 0.0 0 0.0 8 32
99 B1206 VAL V - 0 0 -122.4 122.9 179.2 -147.3 10.4 168.3 0 0.0 0 0.0 0 0.0 0 0.0 8 40
100 B1207 LYS K g > T - 0 0 -82.6 158.2 179.4 -115.4 26.3 118.2 0 0.0 103 -1.4 0 0.0 0 0.0 7 46
101 B1208 PRO P G G > TS+ 0 0 -62.2 -29.9 178.7 64.3 117.5 33.6 0 0.0 104 -1.7 0 0.0 0 0.0 11 53
102 B1209 THR T G G > > TS+ 0 0 -64.9 -21.9 179.9 70.8 87.5 43.5 0 0.0 105 -0.6 0 0.0 106 -0.5 11 49
103 B1210 ASP D G G 4 < TS+ 0 0 -70.0 -15.3 179.6 48.5 98.8 47.0 100 -1.4 0 0.0 0 0.0 0 0.0 10 44
104 B1211 TYR Y G h > < TS+ 0 0 -97.9 -15.6 -177.3 86.9 87.4 54.9 101 -1.7 108 -2.2 0 0.0 0 0.0 12 55
105 B1212 VAL V H H > < TS+ 0 0 -54.7 -43.5 -178.9 48.3 88.5 26.9 102 -0.6 109 -2.3 0 0.0 0 0.0 13 52
106 B1213 ASN N H H X TS+ 0 0 -66.3 -48.5 179.8 46.2 112.5 19.5 102 -0.5 110 -2.0 0 0.0 0 0.0 10 46
107 B1214 LYS K H H > > TS+ 0 0 -58.6 -54.6 -178.8 42.4 118.0 12.9 0 0.0 111 -1.9 0 0.0 110 -0.5 8 47
108 B1215 PHE F H H X 3 TS+ 0 0 -62.3 -32.2 180.0 53.0 113.4 33.3 104 -2.2 112 -1.5 0 0.0 0 0.0 10 56
109 B1216 ALA A H H X 3>TS+ 0 0 -72.1 -31.4 178.4 54.4 105.8 36.1 105 -2.3 113 -1.0 0 0.0 114 -0.8 12 51
110 B1217 ASP D H H < X5TS+ 0 0 -65.9 -44.9 179.2 46.5 110.2 20.6 106 -2.0 113 -0.6 107 -0.5 0 0.0 8 35
111 B1218 GLU E H H < 35TS+ 0 0 -67.5 -29.9 -179.0 49.6 113.5 38.0 107 -1.9 0 0.0 0 0.0 0 0.0 8 35
112 B1219 LEU L H H < 35TS- 0 0 -85.9 -14.5 -178.1 -84.7 130.5 51.2 108 -1.5 0 0.0 0 0.0 0 0.0 10 41
113 B1220 GLY G T h < <5T - 0 0 104.9 59.1 177.1 -124.7 58.1 35.4 109 -1.0 0 0.0 110 -0.6 0 0.0 6 32
114 B1221 LEU L t > T - 0 0 94.1 107.5 -180.0 -137.0 32.9 42.1 0 0.0 119 -2.0 0 0.0 118 -0.6 7 30
116 B1223 GLU E H H > 3 TS+ 0 0 -57.0 -29.8 178.9 62.7 104.0 37.0 0 0.0 120 -2.2 0 0.0 0 0.0 6 29
117 B1224 LYS K H H > 3 TS+ 0 0 -60.4 -47.8 -179.9 42.5 107.4 23.7 0 0.0 121 -1.8 0 0.0 0 0.0 7 29
118 B1225 VAL V H H > < TS+ 0 0 -64.2 -46.9 -179.9 51.7 113.0 25.0 115 -0.6 122 -2.3 0 0.0 0 0.0 13 41
119 B1226 ARG R H H X TS+ 0 0 -59.9 -36.1 179.3 51.1 110.5 32.1 115 -2.0 123 -1.7 0 0.0 0 0.0 14 44
120 B1227 ARG R H H X TS+ 0 0 -69.4 -42.6 -179.5 47.2 109.6 25.2 116 -2.2 124 -2.0 0 0.0 0 0.0 8 38
121 B1228 ARG R H H X TS+ 0 0 -68.9 -32.3 179.6 52.1 111.9 31.9 117 -1.8 125 -2.1 0 0.0 0 0.0 10 46
122 B1229 ALA A H H X TS+ 0 0 -69.9 -40.0 178.9 47.9 109.8 30.4 118 -2.3 126 -2.2 0 0.0 0 0.0 15 59
123 B1230 ILE I H H X TS+ 0 0 -68.7 -36.1 178.5 51.8 111.2 29.8 119 -1.7 127 -3.0 0 0.0 0 0.0 11 46
124 B1231 GLU E H H X TS+ 0 0 -66.0 -42.3 178.4 46.6 111.2 25.8 120 -2.0 128 -2.7 0 0.0 0 0.0 8 42
125 B1232 ILE I H H X TS+ 0 0 -63.9 -43.9 179.2 47.0 115.2 28.2 121 -2.1 129 -2.2 0 0.0 0 0.0 9 52
126 B1233 LEU L H H X TS+ 0 0 -65.5 -42.4 179.2 47.0 113.6 24.3 122 -2.2 130 -1.7 0 0.0 0 0.0 13 53
127 B1234 ASP D H H X TS+ 0 0 -65.0 -44.2 179.8 47.2 115.1 19.7 123 -3.0 131 -1.9 0 0.0 0 0.0 9 37
128 B1235 GLU E H H X TS+ 0 0 -65.9 -34.2 179.9 56.7 107.2 31.8 124 -2.7 132 -1.8 0 0.0 0 0.0 9 36
129 B1236 ALA A H H < >TS+ 0 0 -65.2 -39.5 179.8 49.2 107.3 24.8 125 -2.2 134 -2.0 0 0.0 0 0.0 12 42
130 B1237 TYR Y H H < >5TS+ 0 0 -63.4 -50.6 179.7 50.3 109.8 16.2 126 -1.7 133 -2.3 0 0.0 0 0.0 10 34
131 B1238 LYS K H H < 35TS+ 0 0 -56.4 -37.4 -179.7 49.3 110.9 37.2 127 -1.9 0 0.0 0 0.0 0 0.0 7 20
132 B1239 ARG R T h < 35TS- 0 0 -88.5 14.2 179.5 -119.8 116.1 77.4 128 -1.8 0 0.0 0 0.0 0 0.0 7 23
133 B1240 GLY G T T <5TS+ 0 0 46.4 62.2 -179.6 129.4 72.6 23.3 130 -2.3 0 0.0 0 0.0 0 0.0 7 23
134 B1241 LEU L t T + 0 0 -112.6 -24.8 -178.0 119.6 61.4 47.3 0 0.0 138 -1.8 0 0.0 0 0.0 8 40
136 B1243 SER S T T 3 TS+ 0 0 -50.8 125.8 178.8 7.2 88.8 102.6 0 0.0 0 0.0 0 0.0 0 0.0 6 25
137 B1244 GLY G T T 3 TS+ 0 0 90.7 -26.0 178.6 115.8 100.7 83.2 0 0.0 0 0.0 0 0.0 0 0.0 4 20
138 B1245 LYS K S t < TS- 0 0 -74.8 152.1 179.7 -105.0 73.7 117.3 135 -1.8 0 0.0 0 0.0 0 0.0 7 35
139 B1246 SER S h > T - 0 0 -78.9 144.6 179.9 -126.7 22.0 122.5 0 0.0 143 -1.5 0 0.0 0 0.0 6 44
140 B1247 PRO P H H > TS+ 0 0 -54.6 -45.9 179.9 54.4 107.9 25.5 0 0.0 144 -2.7 0 0.0 0 0.0 8 55
141 B1248 ALA A H H > TS+ 0 0 -58.8 -41.8 179.0 50.1 107.0 29.4 0 0.0 145 -1.9 0 0.0 0 0.0 11 54
142 B1249 GLY G H H > TS+ 0 0 -65.5 -38.8 -179.5 44.7 114.0 28.7 0 0.0 146 -1.7 0 0.0 0 0.0 13 54
143 B1250 LEU L H H X TS+ 0 0 -71.8 -43.0 -179.4 46.4 115.0 27.0 139 -1.5 147 -2.2 0 0.0 0 0.0 15 65
144 B1251 VAL V H H X TS+ 0 0 -70.3 -31.5 178.5 55.5 110.1 33.6 140 -2.7 148 -2.6 0 0.0 0 0.0 15 71
145 B1252 ALA A H H X TS+ 0 0 -64.4 -48.1 -179.9 42.9 111.4 20.1 141 -1.9 149 -2.4 0 0.0 0 0.0 12 67
146 B1253 ALA A H H X TS+ 0 0 -64.5 -43.8 179.3 50.0 114.6 27.3 142 -1.7 150 -3.1 0 0.0 0 0.0 14 69
147 B1254 ALA A H H X TS+ 0 0 -60.4 -49.6 179.8 46.7 112.8 19.8 143 -2.2 151 -2.8 0 0.0 0 0.0 14 76
148 B1255 LEU L H H X TS+ 0 0 -59.8 -42.1 178.4 49.7 113.5 25.7 144 -2.6 152 -2.2 0 0.0 0 0.0 14 72
149 B1256 TYR Y H H X TS+ 0 0 -61.1 -50.2 -179.4 45.5 113.1 16.8 145 -2.4 153 -1.6 0 0.0 0 0.0 14 71
150 B1257 ILE I H H X TS+ 0 0 -61.8 -41.0 179.8 50.9 112.7 28.6 146 -3.1 154 -2.4 0 0.0 0 0.0 12 63
151 B1258 ALA A H H X TS+ 0 0 -65.3 -41.9 178.6 56.2 104.2 28.6 147 -2.8 155 -2.8 0 0.0 0 0.0 12 57
152 B1259 SER S H H < >TS+ 0 0 -57.2 -38.7 178.7 45.9 111.9 24.6 148 -2.2 157 -2.9 0 0.0 0 0.0 12 51
153 B1260 LEU L H H < >5TS+ 0 0 -67.1 -52.5 -179.3 47.6 112.9 14.6 149 -1.6 156 -1.6 0 0.0 0 0.0 12 43
154 B1261 LEU L H H < 35TS+ 0 0 -57.6 -39.3 -178.9 45.4 115.5 32.0 150 -2.4 0 0.0 0 0.0 0 0.0 10 36
155 B1262 GLU E T h < 35TS- 0 0 -88.8 3.9 179.2 -113.6 114.0 69.2 151 -2.8 0 0.0 0 0.0 0 0.0 10 34
156 B1263 GLY G T T <5TS+ 0 0 70.6 25.1 176.8 108.9 89.6 36.6 153 -1.6 0 0.0 0 0.0 0 0.0 6 28
157 B1264 GLU E t T - 0 0 -74.6 160.0 177.9 -115.7 20.6 112.6 0 0.0 164 -2.5 0 0.0 0 0.0 7 41
161 B1268 GLN Q H H > TS+ 0 0 -60.2 -33.6 179.7 55.0 119.6 29.5 0 0.0 165 -2.9 0 0.0 0 0.0 10 40
162 B1269 ARG R H H > TS+ 0 0 -67.2 -39.8 179.6 46.9 107.7 25.9 0 0.0 166 -1.7 0 0.0 0 0.0 7 35
163 B1270 GLU E H H > TS+ 0 0 -67.7 -43.5 179.7 43.6 116.8 22.5 0 0.0 167 -1.3 0 0.0 0 0.0 9 38
164 B1271 VAL V H H X TS+ 0 0 -68.0 -42.5 179.6 54.4 111.2 22.9 160 -2.5 168 -2.3 0 0.0 0 0.0 14 50
165 B1272 ALA A H H X >TS+ 0 0 -59.3 -38.8 180.0 51.5 107.9 30.3 161 -2.9 170 -2.2 0 0.0 169 -1.0 13 42
166 B1273 GLU E H H < 5TS+ 0 0 -71.9 -34.1 178.8 43.0 111.7 35.5 162 -1.7 0 0.0 0 0.0 0 0.0 9 36
167 B1274 VAL V H H < 5TS+ 0 0 -79.0 -35.8 179.3 43.9 119.5 28.4 163 -1.3 0 0.0 0 0.0 0 0.0 9 42
168 B1275 ALA A H H < 5TS- 0 0 -77.4 -18.0 179.8 -130.6 108.3 50.8 164 -2.3 0 0.0 0 0.0 0 0.0 11 53
169 B1276 ARG R T h < 5T + 0 0 66.6 44.0 176.4 115.8 65.9 25.6 165 -1.0 0 0.0 0 0.0 0 0.0 7 44
170 B1277 VAL V t T - 0 0 -82.9 167.9 178.5 -114.9 29.5 111.8 0 0.0 175 -1.7 0 0.0 0 0.0 8 30
172 B1279 GLU E H H > TS+ 0 0 -70.0 -30.0 179.6 59.4 117.8 36.0 0 0.0 176 -2.8 0 0.0 0 0.0 9 31
173 B1280 VAL V H H > TS+ 0 0 -64.5 -42.9 178.4 48.5 105.2 20.6 0 0.0 177 -2.8 0 0.0 0 0.0 6 28
174 B1281 THR T H H > TS+ 0 0 -63.2 -40.1 179.6 47.3 112.9 25.3 0 0.0 178 -2.5 0 0.0 0 0.0 9 37
175 B1282 VAL V H H X TS+ 0 0 -67.3 -40.9 -179.2 50.8 112.0 23.5 171 -1.7 179 -2.8 0 0.0 0 0.0 15 43
176 B1283 ARG R H H X TS+ 0 0 -62.1 -43.9 179.5 48.4 111.7 19.5 172 -2.8 180 -2.4 0 0.0 0 0.0 10 38
177 B1284 ASN N H H X TS+ 0 0 -61.1 -53.0 -179.8 40.1 116.5 19.4 173 -2.8 181 -1.6 0 0.0 0 0.0 8 35
178 B1285 ARG R H H X TS+ 0 0 -65.0 -42.4 -178.5 50.9 116.5 24.1 174 -2.5 182 -2.4 0 0.0 0 0.0 11 50
179 B1286 TYR Y H H X TS+ 0 0 -64.4 -42.4 179.4 49.0 109.1 27.0 175 -2.8 183 -2.4 0 0.0 0 0.0 13 54
180 B1287 LYS K H H X TS+ 0 0 -66.5 -35.6 179.0 48.3 113.1 30.7 176 -2.4 184 -2.0 0 0.0 0 0.0 8 37
181 B1288 GLU E H H X TS+ 0 0 -69.7 -46.6 -179.8 47.8 112.4 21.5 177 -1.6 185 -2.7 0 0.0 0 0.0 8 39
182 B1289 LEU L H H X TS+ 0 0 -62.3 -42.8 -179.6 50.7 111.5 23.9 178 -2.4 186 -1.6 0 0.0 0 0.0 14 48
183 B1290 VAL V H H X >TS+ 0 0 -62.1 -49.0 -178.8 37.3 117.8 16.0 179 -2.4 188 -2.0 0 0.0 187 -0.5 12 41
184 B1291 GLU E H H < >5TS+ 0 0 -68.9 -49.8 -178.7 44.2 120.2 18.3 180 -2.0 187 -0.6 0 0.0 0 0.0 8 25
185 B1292 LYS K H H < 35TS+ 0 0 -71.8 -19.7 178.0 38.2 122.1 48.5 181 -2.7 0 0.0 0 0.0 0 0.0 6 28
186 B1293 LEU L H H < 35TS- 0 0 -107.8 0.9 -179.0 -129.0 105.4 66.2 182 -1.6 0 0.0 0 0.0 0 0.0 9 33
187 B1294 LYS K T h < <5T + 0 0 49.9 54.8 179.5 179.4 39.0 21.6 184 -0.6 0 0.0 183 -0.5 0 0.0 7 24
188 B1295 ILE I t 5555< >5555< >5555< >5555< >5555< 5-turns
3-turns >33< >33< >>3X<3< >33< >33< >33< >33< >33< >33< > 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>XXXXXXXXX<<<< >>>>XXXXXXXXX<<<< >444<>>>>XXXXXXXXXX<<<< >>>>X<<<< >>>>XXXXXXXX<<<< >444< 4-turns
summary hHHHHHHHHHHHHHHHhthHHHHHHHHHHHHHHHhTTTTTTthHHHHHHHHHHHHHHHHht hHHHHHHHhTthHHHHHHHHHHHHHHhTttTTTTt g summary
sequence NLAFALSELDRITAQLKLPRHVEEEAARLYREAVRKGLIRGRSIESVMAACVYAACRLLKVPRTLDEIADIARVDKKEIGRSYRFIARNLNLTPKKLFVK sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand GGGGHHHHHHHHT HHHHHHHHHHHHHHHHTT TTS HHHHHHHHHHHHHHHTT HHHHHHHHT HHHHHHHHHHHHHHHT Kabs/Sand
chirality +++++++++++--+-++++++++++++++++-+++++--+++++++++++++++-+----+++++++-+--++++++++++++++-+---- chirality
bends SSSSSSSSSSSS SSSSSSSSSSSSSSSSSS SSS SSSSSSSSSSSSSSSSS SSSSSSSS SSSSSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555< >5555< >5555< >5555< 5-turns
3-turns >><<< >33X33< >33< >33< >33< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >4>>X>XX<<<< >>>>XXXXXXXXXX<<<< >>>>XXXXXXXXX<<<< >>>>XX<<<< >>>>XXXXXXXXX<<<< 4-turns
summary GGGhHHHHHHHHhthHHHHHHHHHHHHHHHHhTttTTthHHHHHHHHHHHHHHHhTt hHHHHHHHHhthHHHHHHHHHHHHHHHht summary
sequence PTDYVNKFADELGLSEKVRRRAIEILDEAYKRGLTSGKSPAGLVAAALYIASLLEGEKRTQREVAEVARVTEVTVRNRYKELVEKLKIKVPIA sequence
110 120 130 140 150 160 170 180 190