Secondary structure calculation program - copyright by David Keith Smith, 1989
1hi7A.pdb
1HI7 GROWTH FACTOR MOL_ID: 1; MOL_ID: 1;
Sequence length - 60
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 1 GLU E 0 0 999.9 2.5 -179.9 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 2 11
2 A 2 ALA A + 0 0 -142.3 77.4 179.7 162.9 999.9 127.0 0 0.0 0 0.0 0 0.0 0 0.0 5 14
3 A 3 GLN Q - 0 0 -94.9 159.2 -179.9 -170.5 12.7 125.4 0 0.0 0 0.0 0 0.0 0 0.0 8 14
4 A 4 THR T E E AA - 50 0 -149.2 151.9 -180.0 -124.2 20.7 173.6 50 -1.6 50 -1.8 0 0.0 6 -0.5 8 19
5 A 5 GLU E E E AA + 49 0 -102.3 127.6 -179.9 179.9 31.5 149.3 0 0.0 0 0.0 0 0.0 0 0.0 8 23
6 A 6 THR T E E AA - 48 0 -117.6 176.8 -179.0 -151.1 28.3 128.8 48 -1.7 48 -1.0 4 -0.5 0 0.0 9 27
7 A 7 CYS C + 0 0 -123.7 -15.7 180.0 103.9 67.4 59.9 0 0.0 9 -3.0 0 0.0 0 0.0 9 36
8 A 8 THR T + 0 0 -70.9 69.3 -179.7 134.2 56.8 111.9 0 0.0 0 0.0 0 0.0 0 0.0 4 29
9 A 9 VAL V - 0 0 -114.9 171.8 179.1 -90.4 64.1 131.4 7 -3.0 0 0.0 0 0.0 0 0.0 9 30
10 A 10 ALA A t > > T - 0 0 -86.8 121.2 -179.2 -143.3 28.2 137.3 0 0.0 14 -2.7 0 0.0 13 -1.5 6 28
11 A 11 PRO P T T 4 3 TS+ 0 0 -45.2 -59.5 179.9 55.5 101.2 22.6 0 0.0 0 0.0 0 0.0 0 0.0 9 31
12 A 12 ARG R T T 4 3 TS+ 0 0 -46.4 -29.8 -179.3 30.6 122.9 38.1 0 0.0 0 0.0 0 0.0 0 0.0 5 22
13 A 13 GLU E T T 4 < TS+ 0 0 -104.7 -17.8 179.5 117.8 94.4 53.4 10 -1.5 0 0.0 0 0.0 0 0.0 6 24
14 A 14 ARG R S t < TS- 0 0 -52.0 139.4 -179.6 -121.6 70.3 101.1 10 -2.7 16 -1.0 0 0.0 0 0.0 10 33
15 A 15 GLN Q e - 0 0 -90.8 98.5 -178.5 -126.3 29.9 138.4 0 0.0 46 -3.3 0 0.0 0 0.0 8 32
16 A 16 ASN N E E BB + 45 0 -42.0 143.0 178.8 163.5 39.6 90.6 14 -1.0 0 0.0 0 0.0 0 0.0 10 36
17 A 17 CYS C E E B* + 0 0 -145.5 3.5 -179.5 7.3 67.0 75.4 44 -3.3 0 0.0 0 0.0 0 0.0 10 36
18 A 18 GLY G E E BB S- 44 0 170.2 124.0 -179.5 -100.5 79.6 125.9 44 -1.5 44 -1.6 0 0.0 0 0.0 10 33
19 A 19 PHE F t > T - 0 0 -44.9 163.9 -179.8 -108.2 40.6 84.7 0 0.0 22 -1.0 0 0.0 0 0.0 9 33
20 A 20 PRO P T T 3 TS+ 0 0 -65.5 -43.9 179.7 68.6 114.7 24.8 0 0.0 0 0.0 0 0.0 0 0.0 9 30
21 A 21 GLY G T T 3 TS+ 0 0 -51.1 -13.7 -179.8 110.0 81.9 49.1 0 0.0 0 0.0 0 0.0 0 0.0 4 25
22 A 22 VAL V t < T - 0 0 -63.5 154.4 179.4 -125.7 68.6 103.0 19 -1.0 0 0.0 0 0.0 0 0.0 10 30
23 A 23 THR T h > T - 0 0 -101.7 160.3 -179.9 -106.5 23.0 130.2 0 0.0 27 -2.8 0 0.0 0 0.0 7 24
24 A 24 PRO P H H > TS+ 0 0 -51.2 -36.0 -179.8 46.9 123.6 33.9 0 0.0 28 -1.6 0 0.0 0 0.0 7 26
25 A 25 SER S H H > TS+ 0 0 -75.7 -37.3 -179.9 48.2 113.2 30.9 0 0.0 29 -0.9 0 0.0 0 0.0 6 22
26 A 26 GLN Q H H 4 TS+ 0 0 -67.4 -55.7 179.8 43.0 114.7 14.0 0 0.0 0 0.0 0 0.0 0 0.0 8 25
27 A 27 CYS C H H < >>TS+ 0 0 -55.7 -52.7 179.4 45.3 118.0 18.7 23 -2.8 30 -1.8 0 0.0 32 -1.1 15 28
28 A 28 ALA A H H < 35TS+ 0 0 -63.5 -22.5 179.8 77.1 96.9 42.2 24 -1.6 0 0.0 0 0.0 0 0.0 10 28
29 A 29 ASN N T h < 35TS+ 0 0 -60.7 -19.1 180.0 38.6 102.5 45.0 25 -0.9 0 0.0 0 0.0 0 0.0 7 19
30 A 30 LYS K T T <5TS- 0 0 -102.2 -26.4 179.8 -104.1 122.3 46.8 27 -1.8 0 0.0 0 0.0 0 0.0 6 22
31 A 31 GLY G T T 5TS+ 0 0 105.5 34.6 179.6 120.6 77.0 41.4 0 0.0 0 0.0 0 0.0 0 0.0 7 29
32 A 32 CYS C t 5555< 5-turns
3-turns >33< >33< >33< 3-turns
bridge-2 CC bridge-2
bridge-1 AAA B*B CC BB AAA bridge-1
sheets AAA BBB BB BB AAA sheets
4-turns >444< >>>4<<< 4-turns
summary EEE tTTTteEEEtTTthHHHHHhTTtEEe SSSSS eEEe EEE SSSS summary
sequence EAQTETCTVAPRERQNCGFPGVTPSQCANKGCCFDDTVRGVPWCFYPNTIDVPPEEECEF sequence
10 20 30 40 50 60