DSSP OUTPUT
==== Secondary Structure Definition by the program DSSP, CMBI version 3.0.1 ==== DATE=2019-06-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER ANTIBIOTIC 07-APR-15 4UJ0 .
COMPND MOL_ID: 1; MOLECULE: FLOWER-SPECIFIC GAMMA-THIONIN-LIKE PROTEIN/ACIDIC .
SOURCE MOL_ID: 1; FRAGMENT: RESIDUES 25-73; ORGANISM_SCIENTIFIC: SOLANUM LYCO .
AUTHOR V.RICHTER,F.T.LAY,M.D.HULETT,M.KVANSAKUL .
95 2 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
6367.3 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
63 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
25 26.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
2 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES .
9 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
5 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
18 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
3 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES .
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** .
0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER .
1 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER .
0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET .
# RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA CHAIN AUTHCHAIN
1 2 A Q 0 0 200 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.5 8.4 21.7 -10.9 A A
2 3 A Q - 0 0 40 52,-0.0 46,-2.7 1,-0.0 2,-0.4 -0.603 360.0-138.3 -75.5 139.2 4.9 23.0 -10.4 A A
3 4 A I E -A 47 0A 80 -2,-0.3 2,-0.3 44,-0.3 -1,-0.0 -0.868 11.4-157.1-110.0 130.2 3.4 21.9 -7.1 A A
4 5 A a E -A 46 0A 2 42,-3.8 42,-2.1 -2,-0.4 2,-0.4 -0.780 11.3-156.1-102.8 150.4 -0.2 20.8 -6.6 A A
5 6 A K E +AB 45 53A 94 48,-2.4 48,-2.4 -2,-0.3 40,-0.2 -0.967 16.8 168.6-133.1 144.3 -2.0 20.9 -3.3 A A
6 7 A A E -A 44 0A 2 38,-2.3 38,-3.2 -2,-0.4 2,-0.1 -0.989 41.7 -96.8-148.6 148.1 -4.9 19.1 -1.6 A A
7 8 A P E -A 43 0A 71 0, 0.0 36,-0.2 0, 0.0 2,-0.1 -0.431 49.4-102.4 -66.3 141.7 -6.3 19.0 2.0 A A
8 9 A S - 0 0 20 34,-2.9 34,-0.2 1,-0.1 17,-0.1 -0.389 23.9-160.1 -65.3 136.6 -5.1 16.0 3.9 A A
9 10 A Q S S+ 0 0 127 1,-0.1 -1,-0.1 -2,-0.1 16,-0.0 0.363 89.6 35.3 -97.4 2.6 -7.6 13.2 4.3 A A
10 11 A T S S+ 0 0 74 2,-0.0 -1,-0.1 0, 0.0 -2,-0.0 0.516 81.9 111.5-130.5 -13.5 -5.9 11.6 7.3 A A
11 12 A F - 0 0 34 31,-0.1 2,-0.5 1,-0.1 31,-0.1 -0.494 61.7-136.5 -67.8 126.0 -4.4 14.5 9.4 A A
12 13 A P - 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.712 50.3 -30.9 -89.7 130.5 -6.3 14.8 12.7 A A
13 14 A G S S- 0 0 59 -2,-0.5 29,-0.2 2,-0.1 2,-0.2 -0.205 105.0 -1.7 76.9-158.4 -7.5 18.1 14.2 A A
14 15 A L - 0 0 115 27,-0.1 2,-0.7 1,-0.1 27,-0.2 -0.492 65.2-130.6 -78.1 140.8 -5.8 21.5 13.9 A A
15 16 A b + 0 0 0 25,-2.8 3,-0.1 -2,-0.2 -1,-0.1 -0.791 48.6 138.2 -97.9 109.6 -2.6 21.9 12.0 A A
16 17 A F + 0 0 128 -2,-0.7 2,-0.7 1,-0.2 -1,-0.2 0.682 62.4 59.8-114.6 -34.0 0.2 23.8 13.8 A A
17 18 A M >> - 0 0 136 1,-0.2 4,-1.8 17,-0.1 3,-0.8 -0.871 60.6-160.5-107.0 113.9 3.3 21.7 13.1 A A
18 19 A D H 3> S+ 0 0 65 -2,-0.7 4,-3.1 1,-0.2 5,-0.2 0.871 91.0 62.3 -52.3 -40.2 4.3 21.4 9.4 A A
19 20 A S H 3> S+ 0 0 72 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.847 104.3 46.5 -61.1 -35.3 6.4 18.3 10.3 A A
20 21 A S H <> S+ 0 0 40 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.932 113.1 48.5 -71.8 -47.3 3.4 16.4 11.5 A A
21 22 A c H X S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 5,-0.2 0.923 108.0 55.8 -55.8 -48.0 1.3 17.3 8.5 A A
22 23 A R H X S+ 0 0 115 -4,-3.1 4,-2.5 11,-0.4 -1,-0.2 0.906 105.5 52.3 -53.3 -42.7 4.2 16.3 6.2 A A
23 24 A K H X S+ 0 0 94 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.936 111.6 44.6 -63.6 -48.2 4.3 12.8 7.7 A A
24 25 A Y H X S+ 0 0 64 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.919 112.9 52.9 -59.2 -44.1 0.6 12.2 7.2 A A
25 26 A d H <>S+ 0 0 0 -4,-2.9 5,-2.2 1,-0.2 3,-0.3 0.899 105.4 52.3 -64.6 -38.4 0.8 13.6 3.6 A A
26 27 A I H ><5S+ 0 0 88 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.891 106.8 53.6 -65.2 -34.5 3.6 11.3 2.6 A A
27 28 A K H 3<5S+ 0 0 153 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.785 103.5 58.1 -68.6 -26.7 1.6 8.3 3.8 A A
28 29 A E T 3<5S- 0 0 31 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.261 128.0-102.0 -82.0 8.6 -1.2 9.7 1.6 A A
29 30 A K T < 5S+ 0 0 170 -3,-1.7 -3,-0.2 1,-0.3 2,-0.2 0.724 83.9 125.8 73.8 24.6 1.3 9.4 -1.4 A A
30 31 A F < - 0 0 9 -5,-2.2 -1,-0.3 -6,-0.1 16,-0.2 -0.528 65.2-127.5 -94.7 174.0 2.1 13.1 -1.6 A A
31 32 A T S S- 0 0 93 14,-2.2 2,-0.3 -2,-0.2 15,-0.2 0.432 78.2 -23.5-106.2 -1.3 5.7 14.3 -1.5 A A
32 33 A G E -C 45 0A 8 13,-1.2 13,-2.3 -7,-0.1 2,-0.3 -0.975 56.6-155.1-179.7-169.4 5.2 16.7 1.4 A A
33 34 A G E -C 44 0A 8 11,-0.3 -11,-0.4 -2,-0.3 2,-0.3 -0.949 2.2-165.7 179.9 158.7 2.8 18.9 3.2 A A
34 35 A H E -C 43 0A 66 9,-2.3 9,-2.9 -2,-0.3 2,-0.3 -0.989 29.7-101.5-153.6 156.7 2.4 22.0 5.4 A A
35 36 A b E -C 42 0A 5 -2,-0.3 2,-0.7 7,-0.2 7,-0.2 -0.607 30.4-125.1 -76.8 137.9 -0.1 23.7 7.7 A A
36 37 A S > - 0 0 12 5,-2.8 4,-1.9 -2,-0.3 5,-0.3 -0.789 16.2-153.3 -76.6 115.7 -2.1 26.6 6.4 A A
37 38 A K T 4 S+ 0 0 162 -2,-0.7 -1,-0.2 1,-0.2 -2,-0.0 0.760 91.3 57.4 -61.4 -19.9 -1.3 29.2 9.0 A A
38 39 A L T 4 S+ 0 0 164 1,-0.1 -1,-0.2 3,-0.1 -3,-0.0 0.991 124.3 9.7 -73.1 -67.3 -4.6 30.6 8.0 A A
39 40 A Q T 4 S- 0 0 146 2,-0.1 -2,-0.2 -25,-0.0 -24,-0.1 0.363 95.4-122.9-103.2 -2.4 -7.2 27.9 8.5 A A
40 41 A R < + 0 0 87 -4,-1.9 -25,-2.8 1,-0.2 2,-0.3 0.886 61.4 145.1 57.0 40.6 -4.9 25.5 10.4 A A
41 42 A K - 0 0 109 -5,-0.3 -5,-2.8 -27,-0.2 2,-0.6 -0.817 55.6-116.5-101.7 149.0 -5.5 22.7 7.9 A A
42 43 A c E - C 0 35A 5 -2,-0.3 -34,-2.9 -29,-0.2 2,-0.6 -0.786 32.4-162.4 -82.1 120.5 -2.9 20.2 6.8 A A
43 44 A L E -AC 7 34A 29 -9,-2.9 -9,-2.3 -2,-0.6 2,-0.3 -0.937 5.3-148.1-110.7 118.0 -2.3 20.7 3.0 A A
44 45 A d E -AC 6 33A 0 -38,-3.2 -38,-2.3 -2,-0.6 2,-0.3 -0.655 15.0-161.4 -87.7 145.6 -0.6 17.9 1.1 A A
45 46 A T E +AC 5 32A 22 -13,-2.3 -14,-2.2 -2,-0.3 -13,-1.2 -0.945 18.5 156.0-130.7 144.6 1.7 18.8 -1.8 A A
46 47 A K E -A 4 0A 44 -42,-2.1 -42,-3.8 -2,-0.3 -16,-0.1 -0.977 51.3 -78.3-155.3 158.4 3.1 16.9 -4.8 A A
47 48 A P E A 3 0A 34 0, 0.0 -44,-0.3 0, 0.0 -45,-0.0 -0.348 360.0 360.0 -55.9 134.8 4.4 17.8 -8.2 A A
48 49 A a 0 0 59 -46,-2.7 -45,-0.1 5,-0.0 4,-0.0 0.838 360.0 360.0 -68.1 360.0 1.6 18.4 -10.6 A A
49 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0
50 3 B Q 0 0 102 0, 0.0 46,-2.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 148.7 -8.9 13.9 -4.6 B B
51 4 B I E - D 0 95A 112 44,-0.2 2,-0.3 45,-0.1 42,-0.0 -0.815 360.0-156.3 -93.6 134.0 -8.9 17.1 -6.6 B B
52 5 B e E - D 0 94A 1 42,-3.4 42,-2.0 -2,-0.4 2,-0.4 -0.855 5.7-156.3-108.3 148.0 -5.5 18.9 -6.6 B B
53 6 B K E +BD 5 93A 92 -48,-2.4 -48,-2.4 -2,-0.3 40,-0.2 -0.945 14.8 172.0-125.9 148.3 -5.1 22.6 -7.1 B B
54 7 B A E - D 0 92A 1 38,-2.1 38,-3.3 -2,-0.4 -50,-0.1 -0.985 39.9-102.0-148.1 141.2 -2.2 24.8 -8.4 B B
55 8 B P E - D 0 91A 64 0, 0.0 36,-0.3 0, 0.0 2,-0.1 -0.348 48.6-100.2 -61.1 137.7 -2.1 28.5 -9.3 B B
56 9 B S - 0 0 19 34,-2.7 34,-0.1 1,-0.1 17,-0.1 -0.404 27.4-158.6 -57.5 133.8 -2.1 29.0 -13.0 B B
57 10 B Q S S+ 0 0 139 1,-0.1 -1,-0.1 -2,-0.1 16,-0.0 0.538 89.2 36.6 -90.5 -11.2 1.3 29.7 -14.3 B B
58 11 B T S S+ 0 0 73 2,-0.0 -1,-0.1 14,-0.0 -2,-0.1 0.600 83.4 113.0-115.6 -15.4 0.2 31.5 -17.5 B B
59 12 B F - 0 0 30 31,-0.1 2,-0.8 1,-0.1 31,-0.1 -0.398 66.1-128.8 -65.7 130.8 -2.9 33.4 -16.4 B B
60 13 B P - 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.714 54.1 -46.0 -88.3 108.6 -2.2 37.2 -16.6 B B
61 14 B G S S+ 0 0 62 -2,-0.8 29,-0.3 2,-0.1 2,-0.0 -0.271 102.3 6.1 80.0-158.5 -3.1 39.2 -13.5 B B
62 15 B L - 0 0 122 27,-0.1 2,-0.6 1,-0.1 27,-0.2 -0.325 65.2-130.3 -71.0 147.8 -6.1 39.1 -11.3 B B
63 16 B f + 0 0 0 25,-2.8 3,-0.1 21,-0.2 -1,-0.1 -0.858 42.2 147.6-103.3 112.9 -8.8 36.5 -11.8 B B
64 17 B F + 0 0 119 -2,-0.6 2,-0.5 1,-0.2 -1,-0.1 0.562 63.9 53.5-116.1 -17.7 -12.4 37.8 -11.9 B B
65 18 B M >> - 0 0 115 1,-0.1 4,-1.7 17,-0.0 3,-0.7 -0.971 64.0-151.2-126.9 123.0 -14.1 35.4 -14.3 B B
66 19 B D H 3> S+ 0 0 67 -2,-0.5 4,-2.9 1,-0.2 5,-0.2 0.900 96.4 57.9 -54.8 -44.9 -14.0 31.6 -13.9 B B
67 20 B S H 3> S+ 0 0 37 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.840 104.9 49.5 -59.5 -37.0 -14.3 30.9 -17.6 B B
68 21 B S H <> S+ 0 0 37 -3,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.917 112.5 47.9 -67.4 -42.9 -11.2 33.0 -18.4 B B
69 22 B g H X S+ 0 0 0 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.936 109.1 54.3 -59.9 -47.9 -9.2 31.1 -15.7 B B
70 23 B R H X S+ 0 0 115 -4,-2.9 4,-2.3 11,-0.4 5,-0.2 0.900 104.4 55.8 -54.0 -44.5 -10.5 27.8 -17.0 B B
71 24 B K H X S+ 0 0 146 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.908 110.9 42.1 -57.2 -46.7 -9.3 28.6 -20.5 B B
72 25 B Y H X S+ 0 0 71 -4,-1.5 4,-1.4 -3,-0.2 -1,-0.2 0.900 112.6 53.9 -66.4 -41.9 -5.7 29.2 -19.4 B B
73 26 B h H <>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 -2,-0.2 0.864 106.4 52.1 -64.0 -36.5 -5.7 26.2 -17.1 B B
74 27 B I H ><5S+ 0 0 88 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.2 0.901 105.5 54.7 -66.9 -38.5 -6.8 24.0 -19.9 B B
75 28 B K H 3<5S+ 0 0 132 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.798 105.7 53.5 -61.7 -28.9 -3.9 25.3 -22.0 B B
76 29 B E T 3<5S- 0 0 36 -4,-1.4 -1,-0.3 -3,-0.1 -2,-0.2 0.263 124.9-108.6 -86.8 9.8 -1.6 24.2 -19.1 B B
77 30 B K T < 5S+ 0 0 169 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.728 74.9 134.9 68.3 25.8 -3.2 20.8 -19.4 B B
78 31 B F < - 0 0 11 -5,-2.6 -1,-0.2 -6,-0.1 16,-0.2 -0.492 68.3-113.5 -86.3 170.5 -5.3 20.9 -16.2 B B
79 32 B T S S- 0 0 105 14,-2.2 2,-0.3 1,-0.2 15,-0.2 0.780 79.9 -54.6 -78.9 -29.1 -8.9 19.7 -16.3 B B
80 33 B G E -E 93 0A 7 13,-1.2 13,-2.3 -7,-0.1 2,-0.3 -0.944 53.1-136.8 179.1-158.0 -10.1 23.2 -15.6 B B
81 34 B G E -E 92 0A 9 -2,-0.3 -11,-0.4 11,-0.3 2,-0.3 -0.973 7.7-166.3-176.1 163.3 -9.9 26.1 -13.3 B B
82 35 B H E -E 91 0A 63 9,-2.1 9,-2.5 -2,-0.3 2,-0.3 -0.977 34.4 -89.0-157.5 163.1 -11.7 28.8 -11.4 B B
83 36 B f E -E 90 0A 7 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.622 25.9-137.2 -79.5 133.3 -11.1 32.0 -9.5 B B
84 37 B S E >> -E 89 0A 41 5,-3.1 5,-1.6 -2,-0.3 4,-0.6 -0.874 21.9-154.1 -80.5 112.0 -10.4 31.9 -5.9 B B
85 38 B K T >45S+ 0 0 118 -2,-0.8 3,-0.7 1,-0.2 -1,-0.2 0.864 81.0 63.6 -60.2 -44.8 -12.6 34.8 -4.9 B B
86 39 B L T 345S+ 0 0 147 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.870 123.9 14.7 -55.3 -43.8 -10.8 35.9 -1.7 B B
87 40 B Q T 345S- 0 0 149 -3,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.153 101.6-119.5-120.4 21.0 -7.5 36.8 -3.4 B B
88 41 B R T <<5 + 0 0 90 -3,-0.7 -25,-2.8 -4,-0.6 2,-0.4 0.889 60.3 152.9 49.2 49.9 -8.7 36.9 -7.1 B B
89 42 B K E < - E 0 84A 108 -5,-1.6 -5,-3.1 -27,-0.2 2,-0.6 -0.906 48.0-124.3-118.1 137.9 -6.3 34.2 -8.1 B B
90 43 B g E - E 0 83A 6 -2,-0.4 -34,-2.7 -29,-0.3 2,-0.5 -0.726 30.2-169.7 -81.7 119.0 -6.7 31.7 -10.9 B B
91 44 B L E -DE 55 82A 26 -9,-2.5 -9,-2.1 -2,-0.6 2,-0.3 -0.939 8.8-149.5-114.4 124.9 -6.4 28.2 -9.6 B B
92 45 B h E -DE 54 81A 0 -38,-3.3 -38,-2.1 -2,-0.5 2,-0.4 -0.651 14.0-154.9 -90.8 150.5 -6.1 25.2 -11.9 B B
93 46 B T E +DE 53 80A 25 -13,-2.3 -14,-2.2 -2,-0.3 -13,-1.2 -0.939 24.1 146.4-129.9 145.3 -7.5 21.8 -10.9 B B
94 47 B K E -D 52 0A 56 -42,-2.0 -42,-3.4 -2,-0.4 -16,-0.1 -0.954 55.2 -74.5-161.6 164.1 -6.8 18.2 -11.8 B B
95 48 B P E D 51 0A 90 0, 0.0 -44,-0.2 0, 0.0 -16,-0.0 -0.397 360.0 360.0 -63.9 142.9 -7.0 14.9 -10.0 B B
96 49 B e 0 0 63 -46,-2.5 -45,-0.1 -2,-0.1 -92,-0.1 0.795 360.0 360.0 -64.8 360.0 -4.1 14.3 -7.5 B B