==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 01-FEB-05 1YQE . COMPND 2 MOLECULE: HYPOTHETICAL UPF0204 PROTEIN AF0625; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR Y.LIU,T.SKARINA,A.DONG,M.KUDRITSKAM,A.SAVCHENKO,E.F.PAI, . 282 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12303.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 15.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.4 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 . 1 0.4 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 . 15 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 1 0 1 0 1 1 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 4 2 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 PARALLEL BRIDGES PER LADDER . 2 0 1 0 2 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 1 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 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 1 -3 A F 0 0 228 0, 0.0 70,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.5 -2.1 12.2 16.5 2 -2 A Q - 0 0 119 1,-0.2 3,-0.1 68,-0.1 71,-0.1 0.481 360.0-159.4-115.5 -7.2 -2.0 16.0 16.7 3 -1 A G - 0 0 29 1,-0.2 -1,-0.2 68,-0.1 68,-0.2 -0.295 34.9 -97.4 57.9-147.0 -5.0 16.9 18.8 4 0 A H S S+ 0 0 140 66,-0.3 2,-0.2 2,-0.0 -1,-0.2 0.347 85.7 100.4-147.8 -3.9 -6.0 20.5 18.2 5 1 A M - 0 0 16 65,-0.3 67,-2.4 -3,-0.1 68,-0.6 -0.584 64.5-125.7 -93.2 154.5 -4.4 22.5 21.0 6 2 A K E -a 73 0A 24 39,-0.4 41,-2.7 -2,-0.2 2,-0.5 -0.723 18.3-145.8 -98.3 146.4 -1.2 24.6 20.8 7 3 A L E -ab 74 47A 0 66,-2.4 68,-2.8 -2,-0.3 2,-0.5 -0.952 3.7-157.3-120.0 125.1 1.8 24.1 23.2 8 4 A V E -ab 75 48A 2 39,-2.4 41,-2.7 -2,-0.5 2,-0.4 -0.854 16.8-163.0 -97.4 128.6 4.1 26.8 24.5 9 5 A V E +ab 76 49A 0 66,-2.0 68,-3.0 -2,-0.5 2,-0.3 -0.954 13.5 167.9-118.9 132.9 7.5 25.4 25.6 10 6 A C E - b 0 50A 1 39,-2.3 41,-1.8 -2,-0.4 2,-0.4 -0.898 32.7-111.2-137.2 165.8 10.0 27.2 27.9 11 7 A S E > - b 0 51A 3 66,-0.5 3,-1.8 -2,-0.3 41,-0.2 -0.824 17.1-136.7-101.2 136.3 13.2 26.4 29.8 12 8 A E T 3 S+ 0 0 63 39,-2.8 40,-0.1 -2,-0.4 -1,-0.1 0.817 107.2 46.4 -58.6 -31.1 13.2 26.4 33.6 13 9 A S T 3 S+ 0 0 95 38,-0.3 2,-0.7 40,-0.2 -1,-0.3 0.277 89.1 99.9 -96.7 11.1 16.5 28.3 33.6 14 10 A D <> - 0 0 9 -3,-1.8 4,-2.9 1,-0.2 5,-0.2 -0.862 54.9-162.6-103.1 109.4 15.5 30.9 30.9 15 11 A T H > S+ 0 0 39 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.902 92.7 46.5 -53.0 -47.9 14.6 34.2 32.5 16 12 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.947 113.3 48.9 -61.7 -49.1 12.8 35.4 29.3 17 13 A G H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.891 111.5 50.6 -57.8 -41.0 11.0 32.1 28.9 18 14 A Q H X S+ 0 0 36 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.894 109.8 48.0 -65.7 -42.8 9.9 32.2 32.6 19 15 A N H X S+ 0 0 8 -4,-2.3 4,-1.6 145,-0.2 -1,-0.2 0.876 112.2 49.9 -66.9 -35.9 8.5 35.7 32.4 20 16 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.937 111.1 51.1 -65.3 -44.0 6.6 34.9 29.2 21 17 A K H X S+ 0 0 16 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.927 105.8 53.7 -57.8 -49.9 5.3 31.8 31.0 22 18 A D H < S+ 0 0 75 -4,-2.7 4,-0.4 1,-0.2 -1,-0.2 0.865 111.7 45.8 -55.1 -38.5 4.1 33.8 34.1 23 19 A N H >< S+ 0 0 34 -4,-1.6 3,-1.2 1,-0.2 4,-0.4 0.898 110.0 52.8 -72.2 -40.3 2.1 36.1 31.8 24 20 A L H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.3 4,-0.3 0.820 100.3 65.0 -62.9 -31.8 0.6 33.2 29.8 25 21 A L T 3< S+ 0 0 44 -4,-2.1 5,-0.4 1,-0.2 3,-0.4 0.673 97.0 54.3 -66.9 -18.9 -0.5 31.7 33.0 26 22 A T T < S+ 0 0 105 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.558 91.4 75.0 -91.8 -8.0 -2.9 34.6 33.7 27 23 A F S < S+ 0 0 44 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 0.575 108.6 6.5 -79.8 -10.7 -4.7 34.2 30.4 28 24 A A S S- 0 0 26 -3,-0.4 2,-1.1 -4,-0.3 -1,-0.1 -0.971 88.1 -81.7-161.1 171.0 -6.6 31.1 31.4 29 25 A D - 0 0 150 -2,-0.3 15,-0.2 -3,-0.0 2,-0.2 -0.711 56.4-172.5 -84.8 99.1 -7.4 28.7 34.3 30 26 A F - 0 0 34 -2,-1.1 2,-0.4 -5,-0.4 13,-0.2 -0.614 20.1-159.9 -97.9 156.1 -4.4 26.5 34.5 31 27 A E E -C 42 0A 121 11,-1.6 11,-2.3 -2,-0.2 2,-0.2 -0.980 19.6-137.4-133.0 116.5 -3.6 23.3 36.5 32 28 A E E +C 41 0A 93 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.512 23.0 177.7 -78.9 142.5 -0.0 22.3 36.9 33 29 A K E -C 40 0A 101 7,-3.0 7,-3.6 -2,-0.2 2,-0.8 -0.989 20.0-147.7-144.3 132.1 1.0 18.6 36.6 34 30 A D E +C 39 0A 99 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.868 29.5 162.1-106.4 102.6 4.5 17.2 36.9 35 31 A V E > -C 38 0A 43 -2,-0.8 3,-2.1 3,-0.7 33,-0.1 -0.938 58.0 -30.9-119.0 142.8 4.9 14.2 34.7 36 32 A G T 3 S- 0 0 63 -2,-0.4 29,-0.0 1,-0.3 0, 0.0 -0.182 123.7 -25.7 51.2-138.4 8.2 12.7 33.6 37 33 A E T 3 S+ 0 0 78 2,-0.0 15,-0.5 -3,-0.0 -1,-0.3 0.396 122.6 83.9 -86.7 3.2 10.9 15.4 33.3 38 34 A F E < -C 35 0A 5 -3,-2.1 -3,-0.7 13,-0.1 2,-0.6 -0.651 66.3-140.7-112.4 165.8 8.4 18.1 32.6 39 35 A K E -CD 34 50A 47 11,-2.0 11,-2.5 -2,-0.2 2,-0.4 -0.979 30.9-163.8-118.7 109.4 6.1 20.6 34.4 40 36 A L E -CD 33 49A 4 -7,-3.6 -7,-3.0 -2,-0.6 2,-0.5 -0.804 12.0-161.7-102.5 141.2 2.9 20.8 32.4 41 37 A Y E -CD 32 48A 16 7,-2.8 7,-1.8 -2,-0.4 2,-0.3 -0.982 17.4-164.1-121.0 118.0 0.3 23.5 32.8 42 38 A L E +C 31 0A 32 -11,-2.3 -11,-1.6 -2,-0.5 2,-0.3 -0.801 20.4 147.2-110.6 148.6 -3.1 22.6 31.4 43 39 A S - 0 0 15 -2,-0.3 -13,-0.1 3,-0.3 -2,-0.0 -0.910 56.1-104.3-158.4 174.5 -6.2 24.6 30.5 44 40 A D S S+ 0 0 143 -2,-0.3 3,-0.1 -15,-0.2 -14,-0.1 0.391 115.5 53.1 -90.4 3.3 -9.0 24.4 27.8 45 41 A E S S- 0 0 63 1,-0.4 -39,-0.4 -16,-0.1 2,-0.3 0.863 121.5 -32.2 -98.5 -65.2 -7.4 27.2 25.9 46 42 A F - 0 0 0 -41,-0.1 -1,-0.4 25,-0.0 -3,-0.3 -0.917 58.4-110.6-150.3 174.0 -3.7 26.2 25.3 47 43 A Y E -b 7 0A 43 -41,-2.7 -39,-2.4 -2,-0.3 2,-0.4 -0.757 16.3-161.3-112.7 158.8 -0.9 24.2 27.0 48 44 A I E -bD 8 41A 1 -7,-1.8 -7,-2.8 -2,-0.3 2,-0.4 -0.998 6.7-168.6-137.9 136.6 2.4 25.2 28.6 49 45 A A E -bD 9 40A 0 -41,-2.7 -39,-2.3 -2,-0.4 2,-0.4 -0.994 5.2-159.6-132.0 134.1 5.3 22.9 29.2 50 46 A E E +bD 10 39A 6 -11,-2.5 -11,-2.0 -2,-0.4 2,-0.3 -0.920 13.6 179.5-112.9 134.9 8.4 23.6 31.3 51 47 A T E -b 11 0A 0 -41,-1.8 -39,-2.8 -2,-0.4 -38,-0.3 -0.945 33.4-139.3-132.9 153.8 11.6 21.6 30.8 52 48 A K S S+ 0 0 142 -15,-0.5 2,-0.1 -2,-0.3 -41,-0.1 0.510 75.6 104.1 -88.6 -5.3 15.1 21.7 32.4 53 49 A E S S- 0 0 44 1,-0.1 2,-0.5 2,-0.0 -2,-0.2 -0.435 83.7-109.7 -77.5 149.8 16.7 21.2 29.1 54 50 A R > - 0 0 116 1,-0.1 3,-1.6 -2,-0.1 4,-0.3 -0.679 31.8-133.5 -75.2 125.8 18.4 23.9 27.1 55 51 A L G > S+ 0 0 5 -2,-0.5 3,-2.3 1,-0.3 -1,-0.1 0.871 99.9 60.5 -52.5 -45.2 16.0 24.4 24.2 56 52 A I G 3 S+ 0 0 23 1,-0.3 -1,-0.3 2,-0.1 48,-0.2 0.713 111.8 41.7 -59.0 -19.2 18.6 24.5 21.4 57 53 A Y G < S+ 0 0 130 -3,-1.6 2,-1.5 46,-0.2 -1,-0.3 0.326 83.3 110.1-106.9 5.6 19.6 21.0 22.4 58 54 A A X + 0 0 0 -3,-2.3 3,-2.0 -4,-0.3 4,-0.2 -0.110 44.7 167.8 -75.9 41.3 16.0 19.8 22.9 59 55 A D T 3 + 0 0 28 -2,-1.5 89,-0.2 1,-0.3 -2,-0.0 -0.286 69.5 9.2 -55.5 139.0 16.0 17.5 19.9 60 56 A H T 3> S+ 0 0 68 87,-2.6 4,-1.7 1,-0.1 3,-0.4 0.593 84.6 133.6 65.2 13.7 13.0 15.2 19.8 61 57 A I H <> + 0 0 0 -3,-2.0 4,-2.3 1,-0.2 5,-0.2 0.791 66.6 61.0 -65.7 -24.4 11.4 17.1 22.7 62 58 A D H > S+ 0 0 5 85,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.897 104.1 48.5 -67.6 -38.7 8.1 17.1 20.8 63 59 A E H 4 S+ 0 0 115 -3,-0.4 4,-0.2 2,-0.2 -2,-0.2 0.886 111.6 50.6 -66.2 -40.2 8.0 13.3 20.8 64 60 A K H >< S+ 0 0 80 -4,-1.7 3,-1.0 1,-0.2 4,-0.3 0.916 113.6 43.2 -63.9 -46.0 8.8 13.3 24.6 65 61 A L H >X S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.2 4,-1.5 0.824 101.4 69.4 -70.6 -31.4 6.0 15.7 25.4 66 62 A A T 3< S+ 0 0 36 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.546 85.1 71.8 -65.6 -6.6 3.5 14.0 23.1 67 63 A K T <4 S+ 0 0 162 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.2 0.797 109.6 30.0 -77.6 -27.8 3.5 11.1 25.5 68 64 A Y T <4 S+ 0 0 80 -3,-1.8 2,-0.3 -4,-0.3 -2,-0.2 0.676 128.4 17.4-105.0 -22.5 1.5 13.1 28.0 69 65 A I < - 0 0 15 -4,-1.5 2,-0.4 2,-0.0 -1,-0.2 -0.994 65.8-121.4-151.1 156.2 -0.5 15.5 25.8 70 66 A D + 0 0 79 -2,-0.3 -65,-0.3 -3,-0.1 2,-0.3 -0.839 38.0 160.6 -99.3 132.7 -1.8 16.1 22.3 71 67 A F - 0 0 0 -2,-0.4 -65,-0.2 -70,-0.3 -68,-0.1 -0.989 36.7-147.9-152.7 143.5 -0.8 19.3 20.5 72 68 A E S S- 0 0 46 -67,-2.4 2,-0.3 -2,-0.3 -66,-0.2 0.634 80.4 -0.9 -87.1 -16.9 -0.7 20.4 16.9 73 69 A E E -a 6 0A 6 -68,-0.6 -66,-2.4 77,-0.2 2,-0.4 -0.989 62.2-123.6-165.1 166.0 2.3 22.7 17.2 74 70 A I E -ae 7 152A 0 77,-2.6 79,-0.9 -2,-0.3 2,-0.6 -0.960 6.6-163.9-122.9 135.7 4.9 24.2 19.5 75 71 A L E -ae 8 153A 0 -68,-2.8 -66,-2.0 -2,-0.4 2,-0.4 -0.945 19.9-151.2-114.9 102.7 5.7 27.9 20.3 76 72 A F E -ae 9 154A 0 77,-2.6 79,-3.1 -2,-0.6 2,-0.6 -0.665 5.9-156.8 -77.3 127.1 9.1 27.9 21.9 77 73 A A E + e 0 155A 0 -68,-3.0 -66,-0.5 -2,-0.4 2,-0.3 -0.930 32.9 139.1-107.0 118.7 9.4 30.9 24.3 78 74 A S E - e 0 156A 13 77,-1.8 79,-0.9 -2,-0.6 2,-0.1 -0.952 50.5 -97.1-153.3 170.6 13.0 31.9 24.9 79 75 A R E - e 0 157A 61 -2,-0.3 2,-0.5 77,-0.2 79,-0.2 -0.464 31.0-137.1 -86.1 164.0 15.5 34.6 25.3 80 76 A H E - 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G 0 154A 8 62,-1.4 62,-3.5 -2,-0.3 2,-0.4 -0.968 41.4-120.7-168.0 161.8 12.7 32.1 13.6 93 89 A V - 0 0 1 46,-0.3 49,-0.8 -2,-0.3 124,-0.2 -0.919 35.6-116.8-112.1 139.0 12.5 28.4 13.1 94 90 A S + 0 0 0 -2,-0.4 16,-1.8 47,-0.2 2,-0.2 -0.320 55.0 115.4 -73.7 157.4 15.4 26.1 14.2 95 91 A G B -I 109 0B 0 48,-2.6 2,-0.3 14,-0.2 14,-0.3 -0.687 46.3-121.7 153.3 154.5 17.5 24.1 11.8 96 92 A N - 0 0 6 12,-2.9 12,-0.5 9,-0.4 4,-0.1 -0.915 14.2-175.7-123.7 149.1 21.1 23.8 10.5 97 93 A V S S- 0 0 12 2,-0.4 10,-3.1 -2,-0.3 -1,-0.1 0.483 80.1 -14.9-102.3-107.6 22.7 24.0 7.1 98 94 A G S S+ 0 0 22 8,-0.2 2,-0.4 9,-0.1 -2,-0.0 0.659 129.0 39.3 -74.9 -18.6 26.4 23.3 6.9 99 95 A T - 0 0 88 6,-0.1 -2,-0.4 7,-0.0 44,-0.2 -0.989 50.6-165.8-136.7 145.4 27.3 23.5 10.6 100 96 A A > + 0 0 31 -2,-0.4 3,-0.6 1,-0.1 -4,-0.1 -0.531 35.4 142.3-124.2 63.8 25.6 22.5 13.9 101 97 A D T 3 S+ 0 0 118 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 0.667 74.7 38.6 -78.0 -18.1 27.6 24.4 16.5 102 98 A F T 3 S- 0 0 103 1,-0.4 42,-2.2 -3,-0.2 -1,-0.2 -0.325 123.6 -46.0-133.7 57.7 24.6 25.2 18.7 103 99 A G S < S+ 0 0 6 -3,-0.6 -1,-0.4 1,-0.2 -46,-0.2 -0.038 93.3 42.6 103.0 155.1 22.3 22.2 18.8 104 100 A G S S- 0 0 22 -48,-0.2 -1,-0.2 -3,-0.1 40,-0.1 -0.169 83.9 -59.5 74.6-166.7 20.8 19.7 16.4 105 101 A K > - 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