Secondary structure calculation program - copyright by David Keith Smith, 1989
1fzcB.pdb
1FZC BLOOD COAGULATION MOL_ID: 1; MOL_ID: 1;
Sequence length - 308
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 151 LEU L t > T 0 0 999.9 -120.1 -177.0 999.9 999.9 999.9 0 0.0 4 -1.0 0 0.0 0 0.0 3 6
2 B 152 TYR Y T T 3 T + 0 0 -77.5 1.9 -179.6 98.1 999.9 67.3 0 0.0 0 0.0 0 0.0 0 0.0 4 9
3 B 153 ILE I T T > T + 0 0 -66.6 -11.5 175.9 85.7 60.2 47.7 0 0.0 6 -1.0 0 0.0 0 0.0 5 10
4 B 154 ASP D T T < T + 0 0 -80.1 34.4 174.9 84.7 66.6 89.0 1 -1.0 0 0.0 0 0.0 0 0.0 7 11
5 B 155 GLU E T T > > TS+ 0 0 -93.1 -47.5 179.2 65.3 76.5 34.9 0 0.0 8 -3.9 0 0.0 9 -1.6 8 13
6 B 156 THR T T T 4 <>TS+ 0 0 -52.1 -6.4 178.1 72.4 87.5 60.7 3 -1.0 11 -2.8 0 0.0 0 0.0 8 15
7 B 157 VAL V T T 4 35TS+ 0 0 -79.1 -31.6 -179.7 22.0 115.0 37.6 0 0.0 0 0.0 0 0.0 0 0.0 8 15
8 B 158 ASN N T T 4 <5TS+ 0 0 -115.9 1.9 176.1 35.3 137.6 63.8 5 -3.9 0 0.0 0 0.0 0 0.0 8 14
9 B 159 SER S T h X 5TS+ 0 0 -112.0 -81.4 -178.5 21.1 121.6 42.1 5 -1.6 13 -1.1 0 0.0 0 0.0 8 15
10 B 160 ASN N H H > >5TS+ 0 0 -61.9 -56.1 179.9 53.5 118.6 21.2 0 0.0 14 -2.6 0 0.0 13 -0.8 9 17
11 B 161 ILE I H H > 3 3 TS+ 0 0 -57.2 -36.2 -178.1 47.4 112.2 33.4 0 0.0 16 -0.8 0 0.0 0 0.0 9 16
13 B 163 THR T H H X < TS+ 0 0 -73.9 -44.6 176.0 50.2 109.9 25.3 9 -1.1 17 -2.4 10 -0.8 0 0.0 8 16
14 B 164 ASN N H H X TS+ 0 0 -52.7 -44.8 -176.1 52.1 110.6 23.2 10 -2.6 18 -2.7 0 0.0 0 0.0 8 17
15 B 165 LEU L H H X TS+ 0 0 -66.5 -24.9 177.0 52.6 108.4 37.0 11 -2.5 19 -1.5 0 0.0 0 0.0 8 17
16 B 166 ARG R H H X TS+ 0 0 -72.6 -51.7 -177.8 42.0 112.0 17.4 12 -0.8 20 -1.9 0 0.0 0 0.0 8 18
17 B 167 VAL V H H X TS+ 0 0 -61.6 -52.7 177.2 48.0 116.7 15.0 13 -2.4 21 -2.3 0 0.0 0 0.0 8 16
18 B 168 LEU L H H X TS+ 0 0 -56.0 -44.1 177.2 54.1 109.4 28.2 14 -2.7 22 -2.3 0 0.0 0 0.0 8 16
19 B 169 ARG R H H X TS+ 0 0 -59.5 -47.3 -175.3 46.0 109.6 28.1 15 -1.5 23 -2.1 0 0.0 0 0.0 8 17
20 B 170 SER S H H X TS+ 0 0 -67.7 -42.6 -179.3 48.0 113.7 22.8 16 -1.9 24 -2.1 0 0.0 0 0.0 8 16
21 B 171 ILE I H H X TS+ 0 0 -64.1 -39.7 -176.8 48.2 112.5 19.2 17 -2.3 25 -2.8 0 0.0 0 0.0 8 16
22 B 172 LEU L H H X TS+ 0 0 -69.9 -41.0 174.2 45.2 114.1 22.0 18 -2.3 26 -1.9 0 0.0 0 0.0 8 16
23 B 173 GLU E H H X TS+ 0 0 -66.1 -38.2 178.6 52.5 113.0 30.8 19 -2.1 27 -1.9 0 0.0 0 0.0 8 16
24 B 174 ASN N H H X TS+ 0 0 -65.0 -43.4 176.7 49.1 108.4 25.2 20 -2.1 28 -1.9 0 0.0 0 0.0 8 16
25 B 175 LEU L H H X TS+ 0 0 -65.3 -30.3 -179.7 58.2 107.4 28.4 21 -2.8 29 -1.8 0 0.0 0 0.0 8 16
26 B 176 ARG R H H X TS+ 0 0 -69.5 -38.6 176.1 45.1 107.0 18.7 22 -1.9 30 -1.7 0 0.0 0 0.0 8 16
27 B 177 SER S H H X TS+ 0 0 -71.1 -37.3 175.2 54.4 109.9 33.7 23 -1.9 31 -1.7 0 0.0 0 0.0 8 16
28 B 178 LYS K H H X TS+ 0 0 -58.0 -44.4 179.4 52.9 106.6 25.5 24 -1.9 32 -2.7 0 0.0 0 0.0 8 16
29 B 179 ILE I H H X TS+ 0 0 -57.9 -45.9 179.2 50.6 107.5 16.8 25 -1.8 33 -1.9 0 0.0 0 0.0 8 16
30 B 180 GLN Q H H X TS+ 0 0 -64.1 -38.0 177.8 47.9 111.2 32.2 26 -1.7 34 -1.8 0 0.0 0 0.0 8 16
31 B 181 LYS K H H X TS+ 0 0 -65.9 -40.5 177.9 54.3 108.8 25.2 27 -1.7 35 -2.2 0 0.0 0 0.0 8 16
32 B 182 LEU L H H X TS+ 0 0 -63.6 -32.9 178.4 51.4 107.1 31.4 28 -2.7 36 -2.1 0 0.0 0 0.0 8 16
33 B 183 GLU E H H X TS+ 0 0 -71.1 -35.6 173.9 51.7 108.3 24.6 29 -1.9 37 -2.5 0 0.0 0 0.0 8 16
34 B 184 SER S H H X TS+ 0 0 -62.5 -39.4 -178.9 50.6 109.8 28.3 30 -1.8 38 -2.2 0 0.0 0 0.0 8 16
35 B 185 ASP D H H X TS+ 0 0 -67.3 -42.3 -179.4 46.7 110.6 26.7 31 -2.2 39 -2.1 0 0.0 0 0.0 8 16
36 B 186 VAL V H H X TS+ 0 0 -66.1 -40.1 174.7 51.0 112.9 15.9 32 -2.1 40 -2.1 0 0.0 0 0.0 8 16
37 B 187 SER S H H X TS+ 0 0 -65.6 -40.3 174.1 49.8 109.1 25.7 33 -2.5 41 -1.3 0 0.0 0 0.0 8 15
38 B 188 ALA A H H X > TS+ 0 0 -60.8 -49.9 177.2 50.2 110.1 14.5 34 -2.2 42 -1.9 0 0.0 41 -0.8 8 15
39 B 189 GLN Q H H X 3 TS+ 0 0 -56.5 -35.1 176.3 59.3 104.3 28.9 35 -2.1 43 -1.9 0 0.0 0 0.0 8 17
40 B 190 MET M H H < 3 TS+ 0 0 -65.2 -32.2 172.7 50.3 105.0 31.8 36 -2.1 0 0.0 0 0.0 0 0.0 8 15
41 B 191 GLU E H H < X TS+ 0 0 -63.2 -47.7 179.9 50.5 108.8 25.9 37 -1.3 44 -2.0 38 -0.8 0 0.0 7 14
42 B 192 TYR Y H H < > TS+ 0 0 -58.8 -35.4 -177.9 64.8 101.4 32.1 38 -1.9 45 -1.7 0 0.0 0 0.0 7 14
43 B 193 CYS C T h < 3 TS+ 0 0 -74.2 2.1 172.3 82.7 78.6 53.9 39 -1.9 0 0.0 0 0.0 0 0.0 7 15
44 B 194 ARG R T T < TS+ 0 0 -74.2 -15.0 177.0 49.4 94.6 52.3 41 -2.0 0 0.0 0 0.0 0 0.0 6 12
45 B 195 THR T S t < TS- 0 0 -118.4 148.5 178.6 -129.7 85.7 168.9 42 -1.7 0 0.0 0 0.0 0 0.0 5 11
46 B 196 PRO P - 0 0 -92.2 159.0 169.8 -114.9 15.6 111.5 0 0.0 0 0.0 0 0.0 0 0.0 5 16
47 B 197 CYS C - 0 0 -79.3 155.2 178.3 -156.1 38.3 125.2 0 0.0 0 0.0 0 0.0 0 0.0 4 22
48 B 198 THR T - 0 0 -135.0 163.4 179.9 -174.2 16.3 158.2 0 0.0 0 0.0 0 0.0 0 0.0 4 23
49 B 199 VAL V - 0 0 -144.0 159.9 171.1 -147.8 17.7 167.4 0 0.0 0 0.0 0 0.0 0 0.0 6 29
50 B 200 SER S - 0 0 -128.4 96.7 -174.6 -175.2 20.4 153.1 0 0.0 52 -1.0 0 0.0 0 0.0 9 28
51 B 201 CYS C - 0 0 -104.5 89.9 178.6 -156.9 10.3 136.2 0 0.0 0 0.0 0 0.0 0 0.0 11 34
52 B 202 ASN N - 0 0 -56.9 141.2 -170.0 -115.2 26.7 111.4 134 -1.0 0 0.0 50 -1.0 0 0.0 7 30
53 B 203 ILE I - 0 0 -100.1 121.6 175.8 -120.3 17.8 141.6 0 0.0 0 0.0 0 0.0 0 0.0 8 36
54 B 204 PRO P - 0 0 -46.7 139.9 179.8 -131.1 19.6 99.3 0 0.0 0 0.0 0 0.0 0 0.0 8 38
55 B 205 VAL V S S S+ 0 0 -62.2 -41.6 -172.6 82.7 85.3 28.2 0 0.0 0 0.0 0 0.0 0 0.0 4 31
56 B 206 VAL V + 0 0 -74.9 130.9 178.9 161.4 57.7 126.6 0 0.0 0 0.0 0 0.0 0 0.0 9 35
57 B 207 SER S + 0 0 -139.1 174.4 179.0 148.9 6.0 149.9 0 0.0 0 0.0 0 0.0 0 0.0 10 39
58 B 208 GLY G B B a - 77 0 178.8 -166.5 -174.9 -62.1 60.0 159.2 76 -0.6 78 -2.3 0 0.0 0 0.0 11 40
59 B 209 LYS K S S S- 0 0 -74.2 -35.1 174.5 -21.9 108.8 32.1 0 0.0 0 0.0 0 0.0 0 0.0 10 48
60 B 210 GLU E S h > TS- 0 0 -162.9 -179.6 -172.8 -75.7 82.3 147.7 0 0.0 64 -1.3 0 0.0 0 0.0 10 61
61 B 211 CYS C H H > TS+ 0 0 -63.2 -21.9 179.1 58.5 123.0 38.4 0 0.0 65 -2.1 0 0.0 0 0.0 15 62
62 B 212 GLU E H H > TS+ 0 0 -76.6 -37.0 173.7 47.5 105.9 33.7 0 0.0 66 -1.5 0 0.0 0 0.0 12 53
63 B 213 GLU E H H > TS+ 0 0 -68.0 -32.4 -178.1 53.7 111.9 32.0 0 0.0 67 -1.4 0 0.0 0 0.0 10 42
64 B 214 ILE I H H < >TS+ 0 0 -71.5 -39.8 175.5 48.9 105.6 17.6 60 -1.3 69 -2.5 0 0.0 0 0.0 14 44
65 B 215 ILE I H H < >5TS+ 0 0 -65.5 -40.0 176.6 52.0 111.6 19.3 61 -2.1 68 -2.5 0 0.0 0 0.0 12 41
66 B 216 ARG R H H < 35TS+ 0 0 -67.8 -21.9 170.2 57.9 104.8 34.3 62 -1.5 0 0.0 0 0.0 0 0.0 7 31
67 B 217 LYS K T h < 35TS- 0 0 -83.1 7.1 -177.8 -92.6 132.6 67.8 63 -1.4 0 0.0 0 0.0 0 0.0 7 26
68 B 218 GLY G T T <5TS+ 0 0 102.3 -9.3 177.3 143.0 78.8 63.3 65 -2.5 70 -1.3 0 0.0 0 0.0 7 27
69 B 219 GLY G t T - 0 0 -142.6 126.7 176.5 -141.1 66.5 154.7 0 0.0 83 -2.5 0 0.0 0 0.0 7 27
81 B 231 SER S T T 3 TS+ 0 0 -47.1 -26.3 175.0 52.9 110.6 42.8 0 0.0 0 0.0 0 0.0 0 0.0 6 18
82 B 232 SER S T T 3 TS+ 0 0 -81.3 -28.1 -176.9 72.0 101.9 34.6 0 0.0 0 0.0 0 0.0 0 0.0 4 15
83 B 233 VAL V S t < TS- 0 0 -90.2 151.6 176.1 -115.0 87.5 129.0 80 -2.5 0 0.0 0 0.0 0 0.0 7 24
84 B 234 LYS K - 0 0 -82.3 139.7 -177.6 -96.2 42.8 122.2 0 0.0 0 0.0 0 0.0 0 0.0 7 22
85 B 235 PRO P - 0 0 -49.1 145.8 178.9 -171.0 48.6 99.3 0 0.0 0 0.0 0 0.0 0 0.0 8 32
86 B 236 TYR Y E E AA - 77 0 -142.4 164.7 179.2 -95.9 23.0 162.0 77 -2.4 77 -2.3 0 0.0 0 0.0 7 48
87 B 237 ARG R E E AA + 76 0 -81.0 143.7 177.3 163.5 41.2 121.5 0 0.0 0 0.0 0 0.0 0 0.0 9 58
88 B 238 VAL V E E AA - 75 0 -152.3 154.3 172.0 -114.0 39.2 166.6 75 -2.2 75 -2.8 0 0.0 90 -0.6 12 67
89 B 239 TYR Y E E AA - 74 0 -88.0 123.1 172.2 -155.8 31.0 152.2 0 0.0 101 -2.4 0 0.0 91 -0.5 13 70
90 B 240 CYS C E E AAB - 73 100 -97.2 124.4 175.0 -152.7 4.4 150.8 73 -2.3 92 -0.9 88 -0.6 73 -0.8 13 69
91 B 241 ASP D E E A B + 0 99 -96.7 103.2 -176.2 171.6 20.4 144.0 99 -2.6 99 -1.8 89 -0.5 0 0.0 14 52
92 B 242 MET M + 0 0 -93.5 2.0 -178.7 51.9 66.7 65.7 90 -0.9 0 0.0 0 0.0 0 0.0 13 41
93 B 243 ASN N S g > TS+ 0 0 -107.0 -49.6 -179.5 81.2 82.9 31.8 0 0.0 96 -0.6 0 0.0 0 0.0 10 32
94 B 244 THR T G G > TS- 0 0 -65.9 148.4 178.1 -8.4 109.2 106.6 0 0.0 97 -3.4 0 0.0 0 0.0 6 38
95 B 245 GLU E G G 3 TS- 0 0 31.4 63.6 -176.6 -44.1 135.6 34.7 0 0.0 0 0.0 0 0.0 0 0.0 4 40
96 B 246 ASN N G G < TS- 0 0 57.3 19.5 167.6 -111.6 94.0 62.8 93 -0.6 0 0.0 0 0.0 0 0.0 6 31
97 B 247 GLY G S g < TS+ 0 0 62.0 177.1 -171.5 110.3 80.2 84.3 94 -3.4 0 0.0 0 0.0 0 0.0 10 41
98 B 248 GLY G + 0 0 75.4 28.1 177.8 150.6 48.5 37.6 0 0.0 0 0.0 0 0.0 0 0.0 14 49
99 B 249 TRP W E E AB - 91 0 -90.6 126.7 175.2 -146.9 39.7 146.2 91 -1.8 91 -2.6 0 0.0 101 -0.6 12 60
100 B 250 THR T E E ABC - 90 304 -90.0 112.3 -171.6 -132.6 22.6 146.7 304 -2.9 304 -1.9 0 0.0 0 0.0 14 68
101 B 251 VAL V E E A C + 0 303 -78.4 133.2 -172.6 171.8 31.6 128.4 89 -2.4 0 0.0 99 -0.6 0 0.0 14 70
102 B 252 ILE I E E A * + 0 0 -116.0 -20.9 178.4 16.0 69.2 56.8 302 -2.3 144 -2.5 0 0.0 0 0.0 12 68
103 B 253 GLN Q E E ADC - 143 302 -159.6 146.8 -176.9 -176.1 61.1 171.9 302 -1.5 302 -2.1 0 0.0 0 0.0 11 66
104 B 254 ASN N E E ADC + 142 301 -152.4 120.4 172.6 174.5 7.6 165.1 142 -2.0 142 -1.4 0 0.0 0 0.0 14 60
105 B 255 ARG R E E A C + 0 300 -117.0 138.7 -177.5 129.7 27.3 164.3 300 -2.4 300 -1.8 0 0.0 0 0.0 12 55
106 B 256 GLN Q S S S+ 0 0 -163.0 -17.4 -174.7 13.5 78.7 68.8 0 0.0 0 0.0 0 0.0 0 0.0 9 51
107 B 257 ASP D S S S- 0 0 -157.9 169.3 -172.5 -107.5 87.7 149.6 0 0.0 0 0.0 0 0.0 0 0.0 8 40
108 B 258 GLY G S S S+ 0 0 -113.1 50.0 -172.3 130.7 73.8 88.6 0 0.0 0 0.0 0 0.0 0 0.0 9 38
109 B 259 SER S + 0 0 -70.0 -10.6 -176.0 55.0 59.2 59.6 0 0.0 0 0.0 0 0.0 0 0.0 5 37
110 B 260 VAL V S S S- 0 0 -135.6 143.8 -178.3 -122.1 78.6 167.5 0 0.0 0 0.0 0 0.0 0 0.0 7 45
111 B 261 ASP D + 0 0 -83.6 124.7 179.9 178.9 23.6 128.2 0 0.0 0 0.0 0 0.0 0 0.0 7 40
112 B 262 PHE F + 0 0 -101.5 1.6 -178.0 96.7 57.2 69.3 0 0.0 114 -1.5 0 0.0 251 -0.5 10 55
113 B 263 GLY G + 0 0 -88.1 63.7 -174.9 141.8 61.6 127.6 0 0.0 0 0.0 0 0.0 0 0.0 11 51
114 B 264 ARG R - 0 0 -113.0 167.6 -173.7 -108.5 48.5 137.1 112 -1.5 228 -0.7 0 0.0 0 0.0 11 39
115 B 265 LYS K h > T - 0 0 -87.4 179.9 179.8 -82.5 45.4 105.3 0 0.0 119 -1.8 0 0.0 0 0.0 11 38
116 B 266 TRP W H H > TS+ 0 0 -52.7 -48.2 -177.6 50.3 120.6 42.5 0 0.0 120 -1.5 0 0.0 0 0.0 12 41
117 B 267 ASP D H H > TS+ 0 0 -67.2 -47.4 171.4 49.2 109.5 25.5 0 0.0 121 -1.8 0 0.0 0 0.0 6 33
118 B 268 PRO P H H > TS+ 0 0 -54.4 -40.9 175.0 51.4 110.9 15.5 0 0.0 122 -2.4 0 0.0 0 0.0 10 35
119 B 269 TYR Y H H < TS+ 0 0 -66.1 -30.8 178.7 48.6 112.2 28.6 115 -1.8 146 -2.4 0 0.0 0 0.0 14 51
120 B 270 LYS K H H < TS+ 0 0 -75.7 -35.2 -177.0 34.6 119.4 32.3 116 -1.5 147 -1.6 0 0.0 0 0.0 9 46
121 B 271 GLN Q H H < TS- 0 0 -91.4 -22.4 -173.5 -117.2 113.4 44.9 117 -1.8 0 0.0 0 0.0 0 0.0 11 36
122 B 272 GLY G h < T - 0 0 93.7 156.0 -179.9 -153.9 28.9 85.5 118 -2.4 0 0.0 0 0.0 0 0.0 11 45
123 B 273 PHE F E E AE + 143 0 -153.2 168.4 176.7 50.8 42.4 156.9 143 -1.4 143 -2.1 0 0.0 0 0.0 10 42
124 B 274 GLY G E E AE S- 142 0 90.9 -173.4 -171.6 -49.5 85.9 109.0 0 0.0 126 -0.5 0 0.0 0 0.0 10 48
125 B 275 ASN N e - 0 0 -109.9 128.8 -175.5 -164.9 33.1 153.1 141 -2.7 140 -0.7 0 0.0 0 0.0 9 48
126 B 276 VAL V S e S- 0 0 -76.6 -33.1 -172.3 -10.9 73.7 28.5 124 -0.5 140 -0.8 0 0.0 0 0.0 12 55
127 B 277 ALA A E E BF - 139 0 -163.1 153.7 179.1 -151.3 58.4 174.2 0 0.0 0 0.0 0 0.0 0 0.0 14 52
128 B 278 THR T E E BF - 138 0 -132.8 163.7 -178.7 -76.3 39.1 149.2 138 -2.7 138 -1.4 0 0.0 0 0.0 13 40
129 B 279 ASN N - 0 0 -66.3 120.6 172.1 -130.9 37.5 116.5 0 0.0 0 0.0 0 0.0 0 0.0 14 29
130 B 280 THR T t > T - 0 0 -65.7 134.2 -174.7 -79.1 52.3 118.5 135 -1.3 133 -2.1 0 0.0 0 0.0 10 26
131 B 281 ASP D T T 3 TS- 0 0 -49.1 101.5 -177.5 -8.6 112.5 93.2 0 0.0 0 0.0 0 0.0 0 0.0 4 18
132 B 282 GLY G T T 3 TS+ 0 0 80.4 32.6 173.4 114.4 107.8 30.1 0 0.0 0 0.0 0 0.0 0 0.0 5 14
133 B 283 LYS K t < T - 0 0 -124.8 164.8 177.5 -133.5 66.0 152.7 130 -2.1 0 0.0 0 0.0 0 0.0 7 19
134 B 284 ASN N S S S+ 0 0 -99.1 13.3 174.6 65.9 86.2 84.2 0 0.0 52 -1.0 0 0.0 0 0.0 9 22
135 B 285 TYR Y S S S- 0 0 -130.2 156.3 -179.5 -114.1 84.2 167.5 0 0.0 130 -1.3 0 0.0 137 -1.0 10 33
136 B 286 CYS C + 0 0 -97.0 97.2 179.9 154.8 43.0 132.7 0 0.0 74 -1.9 0 0.0 0 0.0 15 35
137 B 287 GLY G + 0 0 -95.8 -10.2 177.4 78.6 53.7 61.5 135 -1.0 0 0.0 0 0.0 0 0.0 11 38
138 B 288 LEU L E E BF S- 128 0 -104.6 138.3 -179.7 -128.0 78.8 154.8 128 -1.4 128 -2.7 0 0.0 0 0.0 9 44
139 B 289 PRO P E E BF - 127 0 -78.2 146.5 173.8 -152.5 20.2 121.0 0 0.0 0 0.0 0 0.0 0 0.0 13 50
140 B 290 GLY G e - 0 0 -106.0 -171.2 -178.6 -78.4 37.0 117.2 126 -0.8 0 0.0 125 -0.7 0 0.0 12 51
141 B 291 GLU E S e S+ 0 0 -89.3 133.1 179.5 144.8 70.0 138.0 0 0.0 125 -2.7 0 0.0 0 0.0 16 53
142 B 292 TYR Y E E ADE - 104 124 -160.3 172.5 176.5 -140.0 49.4 176.7 104 -1.4 104 -2.0 0 0.0 0 0.0 14 54
143 B 293 TRP W E E ADE - 103 123 -130.1 111.6 -175.6 -143.7 26.3 178.5 123 -2.1 123 -1.4 0 0.0 0 0.0 11 59
144 B 294 LEU L e - 0 0 -64.7 165.8 176.4 -88.7 48.0 107.9 102 -2.5 0 0.0 0 0.0 0 0.0 13 61
145 B 295 GLY G h > T - 0 0 -80.6 171.8 172.5 -118.7 24.3 116.2 0 0.0 149 -2.7 0 0.0 0 0.0 12 54
146 B 296 ASN N H H > TS+ 0 0 -60.5 -32.8 174.2 52.2 115.6 26.9 119 -2.4 150 -2.3 0 0.0 0 0.0 12 52
147 B 297 ASP D H H > TS+ 0 0 -75.3 -36.0 177.7 47.2 110.3 26.9 120 -1.6 151 -1.8 0 0.0 0 0.0 10 44
148 B 298 LYS K H H > TS+ 0 0 -67.5 -41.5 -177.4 46.3 114.6 19.5 0 0.0 152 -1.9 0 0.0 0 0.0 9 53
149 B 299 ILE I H H X TS+ 0 0 -67.0 -39.4 -179.3 51.4 110.7 24.2 145 -2.7 153 -2.5 0 0.0 0 0.0 11 66
150 B 300 SER S H H X TS+ 0 0 -65.9 -42.3 175.6 48.3 111.3 16.7 146 -2.3 154 -1.4 0 0.0 0 0.0 13 53
151 B 301 GLN Q H H X TS+ 0 0 -62.5 -40.4 179.7 52.5 110.0 32.9 147 -1.8 155 -0.7 0 0.0 0 0.0 9 47
152 B 302 LEU L H H < > TS+ 0 0 -63.3 -42.8 -175.8 43.9 112.9 18.2 148 -1.9 155 -0.9 0 0.0 0 0.0 9 61
153 B 303 THR T H H < > TS+ 0 0 -77.0 -14.8 -174.4 58.6 109.3 46.9 149 -2.5 156 -0.7 0 0.0 0 0.0 12 50
154 B 304 ARG R H H < 3 TS+ 0 0 -93.4 -7.7 174.5 74.9 86.3 52.8 150 -1.4 0 0.0 0 0.0 0 0.0 10 36
155 B 305 MET M T h < < TS- 0 0 -72.2 -19.3 -173.5 -44.4 117.0 52.0 152 -0.9 0 0.0 151 -0.7 0 0.0 6 37
156 B 306 GLY G S t < TS- 0 0 167.1 166.3 175.8 -36.4 88.6 156.5 153 -0.7 0 0.0 0 0.0 0 0.0 7 30
157 B 307 PRO P - 0 0 -49.5 136.7 -169.4 -173.3 64.8 105.2 0 0.0 0 0.0 0 0.0 0 0.0 11 32
158 B 308 THR T - 0 0 -143.1 142.3 177.6 -140.8 18.6 174.3 0 0.0 179 -1.0 0 0.0 0 0.0 13 46
159 B 309 GLU E E E AG - 305 0 -107.0 152.8 179.3 -145.6 13.7 138.8 305 -2.4 305 -1.5 0 0.0 0 0.0 13 51
160 B 310 LEU L E E AGH - 304 176 -118.6 137.5 174.9 -168.0 9.5 165.3 176 -2.5 176 -2.8 0 0.0 0 0.0 13 61
161 B 311 LEU L E E AGH - 303 175 -128.1 123.8 175.8 -171.8 1.2 167.9 303 -2.9 303 -2.2 0 0.0 0 0.0 11 60
162 B 312 ILE I E E AGH - 302 174 -114.9 124.9 -179.7 -175.4 8.6 171.8 174 -2.6 174 -2.6 0 0.0 0 0.0 11 62
163 B 313 GLU E E E AGH + 301 173 -120.2 146.3 175.4 179.8 2.7 148.5 301 -1.1 301 -1.7 0 0.0 0 0.0 12 58
164 B 314 MET M E E AGH - 300 172 -149.5 157.5 177.7 -162.7 13.7 179.3 172 -1.9 172 -1.7 0 0.0 0 0.0 12 55
165 B 315 GLU E E E AGH - 299 171 -140.4 134.0 176.3 -142.3 13.4 173.5 299 -2.3 299 -2.1 0 0.0 298 -1.9 12 45
166 B 316 ASP D e > T - 0 0 -85.3 -176.5 -173.0 -88.0 40.6 103.1 170 -2.3 169 -1.5 0 0.0 0 0.0 12 42
167 B 317 TRP W T T 3 TS+ 0 0 -82.5 5.8 170.3 48.7 124.2 53.0 0 0.0 0 0.0 0 0.0 0 0.0 9 33
168 B 318 LYS K T T 3 TS- 0 0 -122.4 20.0 176.1 -98.5 122.3 87.3 0 0.0 0 0.0 0 0.0 0 0.0 4 19
169 B 319 GLY G S t < TS+ 0 0 87.0 -5.0 174.1 141.8 72.5 68.9 166 -1.5 0 0.0 0 0.0 0 0.0 6 21
170 B 320 ASP D e - 0 0 -69.0 150.9 -172.6 -160.8 32.7 117.9 0 0.0 166 -2.3 0 0.0 0 0.0 7 23
171 B 321 LYS K E E AH + 165 0 -136.6 141.7 -178.3 176.0 15.2 168.1 0 0.0 0 0.0 0 0.0 0 0.0 8 34
172 B 322 VAL V E E AH - 164 0 -145.5 168.1 -175.1 -145.2 13.5 144.0 164 -1.7 164 -1.9 0 0.0 0 0.0 10 39
173 B 323 LYS K E E AH - 163 0 -141.3 154.6 173.2 -158.4 9.3 174.1 0 0.0 199 -2.4 0 0.0 198 -1.4 11 44
174 B 324 ALA A E E AHI - 162 197 -137.9 120.7 179.7 -168.8 16.1 169.4 162 -2.6 162 -2.6 0 0.0 0 0.0 14 49
175 B 325 HIS H E E AHI - 161 196 -111.6 136.2 176.4 -168.5 8.7 157.4 196 -2.9 196 -1.6 0 0.0 0 0.0 12 47
176 B 326 TYR Y E E AHI - 160 195 -124.6 113.0 -175.3 -159.2 11.1 170.9 160 -2.8 160 -2.5 0 0.0 0 0.0 13 45
177 B 327 GLY G E E A * S+ 0 0 -69.3 -11.9 176.1 40.5 84.5 42.8 194 -2.2 0 0.0 193 -0.8 0 0.0 12 37
178 B 328 GLY G E E A I + 0 193 -138.4 138.6 -177.2 158.1 64.4 174.2 193 -1.6 193 -1.9 0 0.0 0 0.0 12 42
179 B 329 PHE F E E A I + 0 192 -158.8 126.8 176.1 170.8 5.5 150.2 158 -1.0 0 0.0 0 0.0 0 0.0 14 52
180 B 330 THR T E E A I - 0 191 -139.3 147.6 178.8 -161.8 15.2 167.3 191 -2.1 191 -2.1 0 0.0 0 0.0 12 50
181 B 331 VAL V E E A I - 0 190 -130.3 120.7 -176.5 -141.5 21.3 168.3 0 0.0 0 0.0 0 0.0 0 0.0 12 52
182 B 332 GLN Q e - 0 0 -76.9 174.3 -179.8 -78.0 31.6 96.6 189 -2.2 0 0.0 0 0.0 0 0.0 11 37
183 B 333 ASN N g >>T - 0 0 -72.2 167.7 -176.4 -98.2 43.1 85.4 0 0.0 188 -2.9 0 0.0 186 -0.8 11 34
184 B 334 GLU E G G >5TS+ 0 0 -55.5 -38.2 177.4 58.7 123.2 27.8 0 0.0 187 -2.2 0 0.0 0 0.0 8 38
185 B 335 ALA A G G 35TS+ 0 0 -65.0 -21.4 178.2 47.4 108.4 42.4 0 0.0 0 0.0 0 0.0 0 0.0 5 22
186 B 336 ASN N G G X5TS- 0 0 -103.1 20.5 178.3 -114.0 121.0 79.6 183 -0.8 189 -1.0 0 0.0 0 0.0 8 29
187 B 337 LYS K T g <5T - 0 0 57.4 28.5 176.1 -71.8 58.3 41.0 184 -2.2 225 -2.1 0 0.0 0 0.0 10 42
188 B 338 TYR Y T T 3 >T + 0 0 -80.6 63.5 -178.7 154.8 60.9 116.0 0 0.0 205 -1.9 0 0.0 206 -0.5 12 49
202 B 352 ALA A H H > 5T + 0 0 -65.2 -36.7 -179.6 56.0 67.7 26.0 200 -1.8 206 -1.1 0 0.0 0 0.0 15 62
203 B 353 LEU L H H 4 5TS+ 0 0 -65.7 -54.1 177.5 24.7 119.8 22.1 0 0.0 221 -1.8 0 0.0 220 -1.6 11 61
204 B 354 MET M H H 4 5TS+ 0 0 -83.0 -29.2 -178.1 27.3 135.1 41.9 0 0.0 0 0.0 0 0.0 0 0.0 10 46
205 B 355 ASP D H H < 5TS- 0 0 -111.6 -14.4 179.7 -137.9 92.4 47.9 201 -1.9 0 0.0 0 0.0 0 0.0 11 45
206 B 356 GLY G h < T - 0 0 -67.0 120.2 -179.6 -150.9 52.6 112.1 0 0.0 210 -2.0 0 0.0 0 0.0 12 40
208 B 358 SER S T T 3 TS+ 0 0 -66.4 -16.0 178.0 66.6 92.5 42.2 0 0.0 0 0.0 0 0.0 0 0.0 10 33
209 B 359 GLN Q T T 3 TS+ 0 0 -89.8 10.8 176.7 69.2 94.3 63.4 0 0.0 0 0.0 0 0.0 0 0.0 6 30
210 B 360 LEU L S t < TS- 0 0 -119.3 162.9 -179.3 -142.3 71.1 144.2 207 -2.0 0 0.0 0 0.0 0 0.0 7 29
211 B 361 MET M h > > T - 0 0 -123.4 156.8 172.4 -23.3 49.9 147.6 0 0.0 214 -1.6 0 0.0 215 -0.5 7 18
212 B 362 GLY G H H > > TS+ 0 0 54.0 -141.9 -176.6 0.5 126.5 94.8 0 0.0 216 -1.8 0 0.0 215 -1.6 6 16
213 B 363 GLU E H H > 3 TS+ 0 0 -53.6 -28.8 178.7 62.9 129.5 40.3 0 0.0 217 -1.7 0 0.0 0 0.0 6 22
214 B 364 ASN N H H 4 < TS+ 0 0 -66.1 -29.9 -174.5 43.4 107.9 32.7 211 -1.6 0 0.0 0 0.0 0 0.0 8 25
215 B 365 ARG R H H < X TS+ 0 0 -80.9 -49.5 -178.9 52.7 110.4 12.6 212 -1.6 218 -2.1 211 -0.5 0 0.0 14 34
216 B 366 THR T H H < > TS+ 0 0 -61.5 -31.3 175.1 61.8 100.3 42.5 212 -1.8 219 -1.3 0 0.0 0 0.0 9 34
217 B 367 MET M T h < 3 TS+ 0 0 -74.4 4.0 179.2 57.4 100.4 62.6 213 -1.7 0 0.0 0 0.0 0 0.0 12 36
218 B 368 THR T T T < TS+ 0 0 -113.0 4.7 171.8 114.1 77.9 62.2 215 -2.1 259 -0.5 0 0.0 0 0.0 15 49
219 B 369 ILE I t < T - 0 0 -72.2 140.0 -172.8 -165.0 47.4 123.9 216 -1.3 0 0.0 0 0.0 0 0.0 15 49
220 B 370 HIS H t > T + 0 0 -99.7 -31.6 177.9 103.1 53.2 47.1 203 -1.6 223 -1.6 0 0.0 0 0.0 15 58
221 B 371 ASN N T T 3 TS+ 0 0 -58.3 144.7 -177.7 20.9 86.7 109.0 203 -1.8 0 0.0 0 0.0 0 0.0 9 49
222 B 372 GLY G T T 3 TS+ 0 0 78.2 -9.4 -179.7 127.4 98.9 73.0 190 -2.3 0 0.0 0 0.0 0 0.0 7 39
223 B 373 MET M t < T - 0 0 -82.7 160.4 167.2 -125.8 55.7 115.2 220 -1.6 190 -2.6 0 0.0 0 0.0 13 51
224 B 374 PHE F - 0 0 -91.2 159.6 177.3 -99.6 31.9 124.4 0 0.0 0 0.0 0 0.0 0 0.0 13 51
225 B 375 PHE F - 0 0 -84.0 138.7 177.4 -170.6 38.6 129.1 187 -2.1 0 0.0 0 0.0 0 0.0 14 62
226 B 376 SER S B B B - 252 0 -125.8 146.9 172.5 -173.9 8.8 160.4 252 -2.1 252 -1.7 0 0.0 0 0.0 14 59
227 B 377 THR T B B C > T - 230 0 -130.6 166.5 -175.2 -93.8 47.9 132.9 230 -1.5 230 -1.3 0 0.0 0 0.0 15 55
228 B 378 TYR Y T T 3 TS+ 0 0 -67.5 -12.7 175.3 41.6 128.3 46.0 114 -0.7 0 0.0 0 0.0 0 0.0 15 43
229 B 379 ASP D T T 3 TS+ 0 0 -110.4 15.5 -178.6 53.8 116.5 82.5 0 0.0 0 0.0 0 0.0 0 0.0 6 32
230 B 380 ARG R B B C < T - 227 0 -155.8 93.0 -176.0 -162.9 69.5 131.6 227 -1.3 227 -1.5 0 0.0 232 -0.7 8 43
231 B 381 ASP D + 0 0 -84.5 115.1 177.2 143.4 32.2 132.2 0 0.0 0 0.0 0 0.0 0 0.0 9 45
232 B 382 ASN N + 0 0 -133.8 25.3 -178.2 133.4 37.3 97.4 230 -0.7 0 0.0 0 0.0 0 0.0 8 44
233 B 383 ASP D - 0 0 -76.1 -174.1 -173.2 -110.7 68.9 83.1 0 0.0 0 0.0 0 0.0 0 0.0 16 50
234 B 384 GLY G S S S+ 0 0 -98.7 4.9 -179.0 98.1 88.5 76.0 0 0.0 236 -0.6 0 0.0 0 0.0 10 42
235 B 385 TRP W - 0 0 -104.2 115.2 -179.2 -157.6 60.3 152.9 0 0.0 237 -1.0 0 0.0 0 0.0 9 38
236 B 386 LEU L + 0 0 -97.3 86.1 -176.9 143.1 37.1 136.2 234 -0.6 0 0.0 0 0.0 0 0.0 5 23
237 B 387 THR T - 0 0 -117.0 171.4 -177.7 -147.5 49.0 133.3 235 -1.0 0 0.0 0 0.0 0 0.0 7 20
238 B 388 SER S S S S+ 0 0 -112.0 -34.9 178.3 93.2 73.9 48.2 0 0.0 0 0.0 0 0.0 0 0.0 5 15
239 B 389 ASP D t > T - 0 0 -67.7 116.6 -178.0 -146.5 69.5 125.4 0 0.0 242 -2.1 0 0.0 0 0.0 5 15
240 B 390 PRO P T T 3 TS+ 0 0 -54.8 -29.6 179.4 61.2 99.5 40.6 0 0.0 0 0.0 0 0.0 0 0.0 6 21
241 B 391 ARG R T T 3 TS+ 0 0 -71.4 -22.9 177.4 85.0 83.7 37.6 0 0.0 243 -1.8 0 0.0 0 0.0 5 27
242 B 392 LYS K t < T + 0 0 -85.1 79.9 -178.1 124.6 59.9 121.8 239 -2.1 0 0.0 0 0.0 0 0.0 9 31
243 B 393 GLN Q t > > T - 0 0 -140.0 119.1 -177.1 -141.7 59.1 169.9 241 -1.8 247 -2.0 0 0.0 246 -0.6 12 42
244 B 394 CYS C T T 4 3 TS+ 0 0 -51.9 -39.3 -178.3 53.9 104.1 28.3 0 0.0 0 0.0 0 0.0 0 0.0 12 57
245 B 395 SER S T T > 3 TS+ 0 0 -71.3 -27.0 173.7 49.0 107.1 26.8 0 0.0 249 -0.7 0 0.0 0 0.0 14 58
246 B 396 LYS K T T 4 < TS+ 0 0 -75.6 -35.8 174.4 44.2 117.7 36.4 243 -0.6 0 0.0 0 0.0 0 0.0 11 49
247 B 397 GLU E T T < TS+ 0 0 -95.9 153.4 177.4 34.3 117.1 141.9 243 -2.0 0 0.0 0 0.0 0 0.0 11 54
248 B 398 ASP D T T 4 TS- 0 0 82.9 -19.4 159.7 -125.1 103.6 80.9 0 0.0 0 0.0 0 0.0 0 0.0 14 61
249 B 399 GLY G t < T + 0 0 70.5 9.8 176.4 72.5 66.1 65.8 245 -0.7 0 0.0 0 0.0 0 0.0 14 54
250 B 400 GLY G S S S- 0 0 -140.9 -171.3 170.0 -91.1 79.7 145.8 0 0.0 0 0.0 0 0.0 0 0.0 15 66
251 B 401 GLY G + 0 0 -102.8 129.3 -175.4 134.5 64.4 150.2 112 -0.5 0 0.0 0 0.0 0 0.0 16 67
252 B 402 TRP W B B B - 226 0 -164.0 168.3 173.6 -85.5 68.9 170.5 226 -1.7 226 -2.1 0 0.0 254 -1.8 11 74
253 B 403 TRP W - 0 0 -84.0 65.1 176.4 -176.2 62.5 115.0 0 0.0 0 0.0 0 0.0 0 0.0 12 66
254 B 404 TYR Y - 0 0 -68.2 147.7 178.9 -179.9 22.4 104.8 252 -1.8 0 0.0 0 0.0 0 0.0 16 63
255 B 405 ASN N S S S- 0 0 -138.1 76.4 -177.7 -35.0 78.6 136.8 257 -2.8 0 0.0 0 0.0 0 0.0 14 55
256 B 406 ARG R S S S- 0 0 39.6 51.6 -15.4 -63.0 125.5 34.8 0 0.0 0 0.0 0 0.0 0 0.0 10 53
257 B 407 CYS C S S S- 0 0 -114.3 -54.7 -178.1 -56.5 83.6 142.0 0 0.0 255 -2.8 0 0.0 0 0.0 11 64
258 B 408 HIS H - 0 0 -158.0 165.7 168.6 -162.2 10.2 174.9 0 0.0 0 0.0 0 0.0 0 0.0 12 67
259 B 409 ALA A S S S+ 0 0 -112.6 -28.0 178.6 34.7 101.3 56.7 218 -0.5 288 -3.1 0 0.0 0 0.0 15 60
260 B 410 ALA A B B D - 287 0 -127.1 138.8 -178.5 -176.6 60.2 169.0 0 0.0 0 0.0 0 0.0 0 0.0 10 73
261 B 411 ASN N t > T + 0 0 -130.4 60.1 176.2 163.3 13.6 114.8 286 -2.4 264 -2.0 0 0.0 0 0.0 14 73
262 B 412 PRO P T T 3 TS+ 0 0 -68.1 152.3 178.8 47.3 76.6 120.6 0 0.0 0 0.0 0 0.0 0 0.0 9 78
263 B 413 ASN N T T 3 TS+ 0 0 93.1 -2.8 176.5 126.6 92.4 66.6 0 0.0 0 0.0 0 0.0 0 0.0 11 69
264 B 414 GLY G S t < TS- 0 0 -76.2 -170.7 -175.3 -66.5 72.0 85.4 261 -2.0 0 0.0 0 0.0 0 0.0 14 69
265 B 415 ARG R - 0 0 -85.5 138.0 -174.3 -125.0 45.9 123.4 0 0.0 285 -1.2 0 0.0 267 -1.0 12 57
266 B 416 TYR Y - 0 0 -89.0 97.2 -178.7 -166.9 26.8 136.5 0 0.0 0 0.0 0 0.0 0 0.0 10 51
267 B 417 TYR Y t > T - 0 0 -85.4 129.7 -176.9 -122.6 22.8 137.6 265 -1.0 270 -0.8 0 0.0 0 0.0 11 47
268 B 418 TRP W T T 3 TS+ 0 0 -73.4 127.3 178.2 14.9 91.5 128.3 0 0.0 0 0.0 0 0.0 0 0.0 6 32
269 B 419 GLY G T T 3 TS- 0 0 91.9 -10.5 174.7 -102.0 108.2 72.4 0 0.0 271 -0.8 0 0.0 0 0.0 6 28
270 B 420 GLY G S t < TS+ 0 0 96.2 -55.0 -179.1 95.0 88.7 107.7 267 -0.8 296 -2.7 0 0.0 0 0.0 11 43
271 B 421 GLN Q B B E + 295 0 -79.9 141.7 175.8 158.1 42.5 120.4 269 -0.8 0 0.0 0 0.0 0 0.0 9 34
272 B 422 TYR Y - 0 0 -155.2 163.9 -177.3 -150.4 19.8 161.0 294 -1.7 0 0.0 0 0.0 0 0.0 10 35
273 B 423 THR T t > > T - 0 0 -134.8 172.5 -173.5 -93.9 36.5 141.9 0 0.0 276 -1.9 0 0.0 277 -1.2 7 28
274 B 424 TRP W T T 4 3 TS+ 0 0 -61.1 -33.7 179.9 55.4 122.3 36.0 0 0.0 0 0.0 0 0.0 0 0.0 8 23
275 B 425 ASP D T T 4 3 TS+ 0 0 -90.3 20.0 173.0 48.4 108.5 72.3 0 0.0 0 0.0 0 0.0 0 0.0 6 19
276 B 426 MET M T T 4 < TS+ 0 0 -117.2 -24.9 -177.3 89.2 94.1 60.0 273 -1.9 0 0.0 0 0.0 0 0.0 7 28
277 B 427 ALA A S t < > TS- 0 0 -84.2 124.9 -173.0 -127.6 81.0 126.8 273 -1.2 280 -2.0 0 0.0 0 0.0 11 34
278 B 428 LYS K T T 3 TS+ 0 0 -44.1 -56.1 177.2 22.4 106.7 30.7 0 0.0 0 0.0 0 0.0 0 0.0 7 28
279 B 429 HIS H T T 3 TS- 0 0 -99.7 15.7 176.9 -104.3 113.6 88.8 0 0.0 0 0.0 0 0.0 0 0.0 6 29
280 B 430 GLY G S t < TS+ 0 0 72.8 14.7 175.5 113.0 85.6 46.9 277 -2.0 0 0.0 0 0.0 0 0.0 8 26
281 B 431 THR T S S S- 0 0 -115.9 178.4 -179.2 -85.7 82.5 132.3 0 0.0 283 -2.0 0 0.0 0 0.0 9 41
282 B 432 ASP D + 0 0 -83.8 81.9 -176.2 145.2 66.1 115.4 0 0.0 0 0.0 0 0.0 0 0.0 10 49
283 B 433 ASP D + 0 0 -99.3 -151.9 174.0 90.5 28.6 88.3 281 -2.0 0 0.0 0 0.0 0 0.0 12 55
284 B 434 GLY G S S S- 0 0 84.6 140.2 -175.3 -52.1 99.4 98.6 0 0.0 286 -1.8 0 0.0 0 0.0 14 61
285 B 435 VAL V S S S+ 0 0 -74.8 84.2 -169.1 179.0 78.6 114.2 265 -1.2 297 -2.8 0 0.0 0 0.0 16 68
286 B 436 VAL V + 0 0 -98.9 145.4 172.6 174.9 39.6 120.7 284 -1.8 261 -2.4 0 0.0 0 0.0 18 73
287 B 437 TRP W B h > D > T - 260 0 -139.5 86.3 -165.0 -167.4 19.3 146.5 292 -0.6 290 -1.6 0 0.0 291 -1.4 14 70
288 B 438 MET M H H > 3 TS+ 0 0 -54.4 -38.4 -173.5 58.7 80.1 30.7 259 -3.1 292 -1.9 0 0.0 0 0.0 12 58
289 B 439 ASN N H H 4 3 TS+ 0 0 -67.1 -19.3 -179.3 35.1 115.7 52.0 0 0.0 0 0.0 0 0.0 0 0.0 14 49
290 B 440 TRP W H H 4 < TS+ 0 0 -96.1 -62.8 -176.0 1.2 140.8 35.2 287 -1.6 0 0.0 0 0.0 0 0.0 7 48
291 B 441 LYS K H H < TS- 0 0 -117.3 13.3 178.7 -120.0 94.7 75.0 287 -1.4 0 0.0 0 0.0 0 0.0 9 50
292 B 442 GLY G h < > T - 0 0 78.3 -172.5 -178.5 -57.4 46.9 97.8 288 -1.9 295 -0.6 0 0.0 287 -0.6 9 40
293 B 443 SER S T T 3 TS+ 0 0 -79.7 -29.2 -171.6 56.7 122.6 48.2 0 0.0 0 0.0 0 0.0 0 0.0 8 49
294 B 444 TRP W T T 3 TS+ 0 0 -104.4 32.9 -179.5 84.1 88.0 91.3 0 0.0 272 -1.7 0 0.0 0 0.0 11 44
295 B 445 TYR Y B B E < T - 271 0 -137.0 127.2 -173.9 -157.1 59.6 176.1 292 -0.6 0 0.0 0 0.0 0 0.0 12 46
296 B 446 SER S - 0 0 -114.8 127.3 -170.4 -114.2 24.3 150.6 270 -2.7 0 0.0 0 0.0 0 0.0 13 56
297 B 447 MET M - 0 0 -61.2 157.7 172.6 -148.0 5.1 99.3 285 -2.8 0 0.0 0 0.0 0 0.0 13 54
298 B 448 ARG R S S S+ 0 0 -83.9 -39.4 -178.8 20.8 91.3 34.9 165 -1.9 0 0.0 0 0.0 0 0.0 14 46
299 B 449 LYS K E E A G + 0 165 -134.9 142.0 -177.8 163.7 64.8 178.2 165 -2.1 165 -2.3 0 0.0 0 0.0 12 54
300 B 450 MET M E E ACG + 105 164 -157.5 133.0 -173.8 168.8 9.7 164.8 105 -1.8 105 -2.4 0 0.0 0 0.0 14 59
301 B 451 SER S E E ACG - 104 163 -150.5 160.6 -177.8 -154.6 19.1 172.2 163 -1.7 163 -1.1 0 0.0 0 0.0 12 61
302 B 452 MET M E E ACG + 103 162 -139.6 132.7 -174.3 167.9 21.2 175.7 103 -2.1 102 -2.3 0 0.0 103 -1.5 12 71
303 B 453 LYS K E E ACG - 101 161 -154.7 155.6 -170.7 -151.4 15.2 174.0 161 -2.2 161 -2.9 0 0.0 0 0.0 12 64
304 B 454 ILE I E E ACG - 100 160 -135.9 160.0 -177.8 -174.1 7.0 151.2 100 -1.9 100 -2.9 0 0.0 0 0.0 12 67
305 B 455 ARG R E E A G - 0 159 -151.5 135.6 172.7 -112.3 38.4 164.6 159 -1.5 159 -2.4 0 0.0 0 0.0 12 57
306 B 456 PRO P - 0 0 -46.1 -13.3 167.0 -149.2 45.0 48.9 0 0.0 308 -1.2 0 0.0 0 0.0 9 47
307 B 457 PHE F 0 0 89.1 -89.7 179.6 999.9 999.9 127.9 0 0.0 0 0.0 0 0.0 0 0.0 7 38
308 B 458 PHE F 0 0 48.9 999.9 999.9 999.9 999.9 80.2 306 -1.2 0 0.0 0 0.0 0 0.0 2 24
1fzcB.pdb
1FZC BLOOD COAGULATION MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand TTTTTTTTHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHTTS S BSSHHHHHHTT S EEEEE S TTS EEEEEE SGGGS EE Kabs/Sand
chirality +++++++++++++++++++++++++++++++++++++++++++----------+++---++++++-+++-+-----++-++----+---+++---++-- chirality
bends SSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSSS S SSSSSSSSSS S S S SSS SSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTT TTTT TTTTT turns
5-turns >5555< >5555< 5-turns
3-turns >3><><3< >33< >33X>3<< >33< >33< >>3<< 3-turns
bridge-2 a BB C bridge-2
bridge-1 a AAAAA AAAAA BB bridge-1
sheets AAAAA AAAAAA AA sheets
4-turns >444X>>>XXXXXXXXXXXXXXXXXXXXXXXXXXX<<<< >>>><<<< 4-turns
summary tTTTTTTThHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHhTt S BShHHHHHHhTt S EEEEE StTTt EEEEEE gGGGg EE summary
sequence LYIDETVNSNIPTNLRVLRSILENLRSKIQKLESDVSAQMEYCRTPCTVSCNIPVVSGKECEEIIRKGGETSEMYLIQPDSSVKPYRVYCDMNTENGGWT sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand EEEEESSS S HHHHHH EE SEE TT SS EE SEE HHHHHHHHHTS EEEEEEE TTS EEEEEEEEEEE GGGTT EEEEEEEESS Kabs/Sand
chirality ++-+++-++-+++--+++++--+--------+-+-++---+----+++++++++--------+---+-+-+-----+++----++-----+++-++-+-- chirality
bends SSS S SSSSSS S S SS SS S S SSSSSSSSSSS SSS S SSS S SS bends
turns TTTTTTTT TTTT TTTTTTTTTTTT TTTT TTTTTTT turns
5-turns >5555< 5-turns
3-turns >33< >>3<< >33< >>3X<3< 3-turns
bridge-2 C*CCC EE HHHHHH III*IIII bridge-2
bridge-1 DD EE FF FF DD GGGGGGG HHHHHH IIII*III bridge-1
sheets AAAAA AA BB BB AA AAAAAAA AAAAAAAAAAA AAAAAAAA sheets
4-turns >>>><<<< >>>>XXX<<<< 4-turns
summary EEEEESSS S hHHHHHHhEEeeEE tTTtSS EEeeEEehHHHHHHHHHht EEEEEEEeTTteEEEEEEEEEEEegGGGgTeEEEEEEEEeS summary
sequence VIQNRQDGSVDFGRKWDPYKQGFGNVATNTDGKNYCGLPGEYWLGNDKISQLTRMGPTELLIEMEDWKGDKVKAHYGGFTVQNEANKYQISVNKYRGTAG sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand HHHH TTS HHHHHTT TT BBTTB S S TT TTTTT S B SSS SB TTS TTSB TTTSTTSS SS BHHHH TTB SEE Kabs/Sand
chirality ++++---++--+++++++-+++-----++-++-+-+-+-+++-++++-+-+-------+-+++----+-++--+++-+-+-++-++-+++--++---+++ chirality
bends SSS SSS SSSSSSS SS SS S S SS SSSSS S SSS S SSS SSS SSSSSSSS SS SSSS SS S bends
turns TTTTTTTTTTTTTTTTTTTTTTT TTTT TTTTTTTTTTT TTTT TTTT TTTTTTTT TTTTTTTTT turns
5-turns >5555< 5-turns
3-turns >33<>>33<<>33< >33< >33<>33< >33< >33< >33<>33< >33< >33< 3-turns
bridge-2 GG bridge-2
bridge-1 BC C B D E D E C bridge-1
sheets AA sheets
4-turns >>44<< >>>4<<< >4>4<4< >444< >>44<< 4-turns
summary hHHHHhtTTthHHHHHhTttTTt BBTTB S StTTttTTTTTtS B SSS SBtTTt tTTtB tTTTtTTtS SS hHHHHhTTB SEE summary
sequence NALMDGASQLMGENRTMTIHNGMFFSTYDRDNDGWLTSDPRKQCSKEDGGGWWYNRCHAANPNGRYYWGGQYTWDMAKHGTDDGVVWMNWKGSWYSMRKM sequence
210 220 230 240 250 260 270 280 290 300
author author
Kabs/Sand EEEEE Kabs/Sand
chirality -+---- chirality
bends bends
turns turns
5-turns 5-turns
3-turns 3-turns
bridge-2 GGGGG bridge-2
bridge-1 CCCC bridge-1
sheets AAAAA sheets
4-turns 4-turns
summary EEEEE summary
sequence SMKIRPFF sequence