==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/STRUCTURAL PROTEIN 27-SEP-05 2B59 . COMPND 2 MOLECULE: COG1196: CHROMOSOME SEGREGATION ATPASES; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM THERMOCELLUM; . AUTHOR J.J.ADAMS,S.P.SMITH,MONTREAL-KINGSTON BACTERIAL STRUCTURAL G . 322 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14865.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 85 26.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 33 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 23 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 1 0 1 1 0 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 1 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 0 0 PARALLEL BRIDGES PER LADDER . 4 3 1 2 4 1 1 1 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 . 2 1 1 0 1 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 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 17 A K 0 0 220 0, 0.0 2,-0.4 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0-168.1 3.1 30.3 -14.4 2 18 A A - 0 0 42 154,-0.0 2,-0.5 27,-0.0 154,-0.1 -0.602 360.0-142.5 -80.5 128.8 5.3 27.6 -15.9 3 19 A S + 0 0 49 -2,-0.4 154,-2.6 152,-0.2 2,-0.3 -0.768 41.9 132.6 -90.3 130.5 8.8 27.3 -14.4 4 20 A S E -Ab 27 157A 6 23,-2.1 23,-3.2 -2,-0.5 2,-0.4 -0.991 49.1-133.6-166.8 171.6 11.5 26.5 -17.0 5 21 A I E -Ab 26 158A 0 152,-2.1 154,-2.5 -2,-0.3 2,-0.3 -0.973 34.7-177.1-131.5 139.8 14.9 27.1 -18.6 6 22 A E E -Ab 25 159A 23 19,-2.8 19,-2.5 -2,-0.4 2,-0.5 -0.997 26.4-148.5-147.0 151.0 15.1 27.4 -22.4 7 23 A L E +A 24 0A 3 152,-1.6 2,-0.3 -2,-0.3 17,-0.2 -0.979 29.3 172.8-116.5 125.2 17.5 27.8 -25.2 8 24 A K E -A 23 0A 124 15,-2.0 15,-3.2 -2,-0.5 2,-0.4 -0.990 23.9-134.5-138.0 145.6 16.1 29.6 -28.3 9 25 A F E -A 22 0A 29 -2,-0.3 13,-0.2 13,-0.2 3,-0.0 -0.799 9.3-143.8-103.1 140.3 17.6 30.9 -31.5 10 26 A D S S+ 0 0 97 11,-2.0 2,-0.3 -2,-0.4 -1,-0.1 0.818 90.7 24.9 -65.9 -31.6 16.9 34.4 -33.0 11 27 A R - 0 0 148 10,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.955 55.5-159.8-135.0 154.0 17.0 32.8 -36.5 12 28 A N S S+ 0 0 108 -2,-0.3 2,-0.3 152,-0.1 153,-0.2 0.481 80.7 38.9-108.0 -8.5 16.3 29.4 -38.0 13 29 A K + 0 0 102 151,-0.1 2,-0.3 153,-0.0 153,-0.1 -0.910 63.6 147.1-136.9 164.6 18.2 29.9 -41.3 14 30 A G - 0 0 13 -2,-0.3 2,-0.2 -3,-0.1 3,-0.1 -0.974 38.4 -93.8 177.2 170.2 21.4 31.6 -42.4 15 31 A E > - 0 0 114 -2,-0.3 3,-2.4 1,-0.1 105,-0.3 -0.584 56.1 -80.3 -98.4 162.2 24.4 31.7 -44.7 16 32 A V T 3 S+ 0 0 93 1,-0.3 105,-0.2 -2,-0.2 -1,-0.1 -0.417 122.9 26.3 -59.5 130.8 27.9 30.3 -44.1 17 33 A G T 3 S+ 0 0 39 103,-2.5 -1,-0.3 1,-0.4 2,-0.1 0.161 91.5 125.5 99.3 -20.5 29.6 32.9 -41.9 18 34 A D < - 0 0 78 -3,-2.4 102,-2.6 102,-0.2 2,-0.7 -0.455 58.4-131.7 -71.9 147.9 26.4 34.2 -40.4 19 35 A I E - C 0 119A 60 100,-0.2 2,-0.3 -2,-0.1 100,-0.3 -0.898 14.8-156.4-107.6 112.0 26.3 34.1 -36.6 20 36 A L E - C 0 118A 9 98,-3.0 98,-3.2 -2,-0.7 2,-0.6 -0.665 14.2-138.8 -82.8 139.0 23.1 32.6 -35.1 21 37 A I E - C 0 117A 45 -2,-0.3 -11,-2.0 96,-0.2 2,-0.6 -0.895 12.1-162.3-107.4 119.6 22.4 33.8 -31.6 22 38 A G E -AC 9 116A 0 94,-3.4 94,-2.7 -2,-0.6 2,-0.6 -0.879 7.7-158.5-100.8 117.5 21.2 31.3 -29.0 23 39 A T E -AC 8 115A 24 -15,-3.2 -15,-2.0 -2,-0.6 2,-0.6 -0.850 1.6-161.1-100.8 121.3 19.6 32.9 -26.0 24 40 A V E +AC 7 114A 0 90,-2.7 89,-2.7 -2,-0.6 90,-1.4 -0.878 23.0 163.9-100.5 123.8 19.4 30.8 -22.8 25 41 A R E -AC 6 112A 90 -19,-2.5 -19,-2.8 -2,-0.6 2,-0.3 -0.934 29.5-137.0-139.6 162.7 16.9 32.1 -20.2 26 42 A I E -AC 5 111A 0 85,-2.5 85,-2.0 -2,-0.3 2,-0.4 -0.862 12.9-157.0-116.2 152.6 15.0 31.0 -17.1 27 43 A N E -A 4 0A 37 -23,-3.2 -23,-2.1 -2,-0.3 83,-0.2 -0.980 67.7 -18.5-135.9 121.3 11.3 31.6 -16.4 28 44 A N S S+ 0 0 56 -2,-0.4 2,-0.9 -25,-0.2 82,-0.2 0.887 71.9 167.4 53.5 50.6 9.8 31.7 -12.9 29 45 A I > - 0 0 2 80,-2.6 3,-1.5 -26,-0.1 -1,-0.2 -0.849 37.1-125.3 -96.6 105.8 12.5 29.9 -11.0 30 46 A K T 3 S- 0 0 144 -2,-0.9 78,-0.1 1,-0.3 79,-0.0 -0.264 81.7 -9.3 -57.3 128.2 11.7 30.5 -7.3 31 47 A N T 3 S- 0 0 32 1,-0.2 117,-1.4 116,-0.1 -1,-0.3 0.795 87.7-169.1 53.0 36.8 14.5 32.0 -5.2 32 48 A F E < +F 147 0B 0 -3,-1.5 76,-0.6 115,-0.2 115,-0.3 -0.289 26.0 152.2 -59.1 130.6 17.0 31.6 -8.1 33 49 A A E - 0 0 0 113,-2.9 62,-2.0 1,-0.4 2,-0.3 0.440 59.1 -6.5-138.8 -7.4 20.7 32.2 -7.1 34 50 A G E -FG 146 94B 0 112,-1.2 112,-2.3 60,-0.2 -1,-0.4 -0.986 51.6-168.7-177.1 171.0 22.8 30.1 -9.4 35 51 A F E -FG 145 93B 0 58,-2.4 58,-1.8 -2,-0.3 2,-0.3 -0.991 13.4-155.3-165.1 169.1 23.2 27.5 -12.2 36 52 A Q E -FG 144 92B 2 108,-1.7 108,-1.9 -2,-0.3 2,-0.3 -0.945 20.3-177.5-152.4 131.6 25.3 25.2 -14.3 37 53 A V E -FG 143 91B 0 54,-2.1 54,-1.4 -2,-0.3 2,-0.5 -0.954 18.5-151.4-134.6 154.6 24.4 23.9 -17.8 38 54 A N E - G 0 90B 7 104,-1.9 93,-2.1 -2,-0.3 2,-0.4 -0.990 20.0-178.3-126.1 118.1 25.9 21.5 -20.3 39 55 A I E -HG 130 89B 0 50,-3.2 50,-3.2 -2,-0.5 2,-0.3 -0.973 5.8-163.4-123.6 133.5 25.1 22.2 -24.0 40 56 A V E +HG 129 88B 20 89,-2.5 89,-1.8 -2,-0.4 2,-0.3 -0.888 13.2 163.5-119.4 147.4 26.3 20.2 -27.0 41 57 A Y - 0 0 16 46,-2.2 87,-0.2 -2,-0.3 7,-0.0 -0.906 46.9 -90.1-147.9 172.0 26.4 21.0 -30.7 42 58 A D >> - 0 0 66 85,-0.3 4,-2.5 -2,-0.3 3,-2.0 -0.817 32.8-159.0 -94.6 104.7 28.1 19.6 -33.9 43 59 A P T 34 S+ 0 0 46 0, 0.0 -1,-0.1 0, 0.0 44,-0.1 0.591 87.7 57.9 -58.3 -17.3 31.5 21.4 -34.2 44 60 A K T 34 S+ 0 0 146 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 0.467 116.1 34.8 -94.9 -0.5 31.8 20.8 -37.9 45 61 A V T <4 S+ 0 0 9 -3,-2.0 76,-3.2 1,-0.4 77,-1.4 0.678 127.5 25.8-115.2 -39.7 28.5 22.5 -38.7 46 62 A L E < -D 120 0A 3 -4,-2.5 2,-0.5 74,-0.2 -1,-0.4 -0.943 63.2-152.8-129.2 149.8 28.5 25.3 -36.0 47 63 A M E -D 119 0A 58 72,-1.6 72,-2.8 -2,-0.3 2,-0.3 -0.985 24.2-122.2-125.7 123.1 31.3 27.1 -34.2 48 64 A A E +D 118 0A 3 -2,-0.5 9,-2.5 70,-0.2 2,-0.3 -0.449 45.1 163.9 -65.7 123.9 30.8 28.6 -30.7 49 65 A V E -DE 117 56A 0 68,-3.8 68,-1.9 -2,-0.3 7,-0.2 -0.980 47.3 -88.2-144.1 153.6 31.5 32.3 -30.9 50 66 A D - 0 0 28 5,-3.0 4,-0.2 -2,-0.3 66,-0.1 -0.415 35.7-141.3 -58.9 125.6 31.0 35.5 -28.9 51 67 A P S S+ 0 0 20 0, 0.0 -1,-0.2 0, 0.0 65,-0.1 0.796 94.8 34.8 -61.7 -27.5 27.6 36.9 -30.1 52 68 A E S S+ 0 0 168 3,-0.1 -2,-0.0 65,-0.1 -3,-0.0 0.928 130.4 21.8 -89.8 -76.7 29.0 40.4 -29.9 53 69 A T S S- 0 0 108 1,-0.1 -4,-0.0 2,-0.1 0, 0.0 0.942 93.0-130.8 -59.2 -51.1 32.7 40.6 -30.8 54 70 A G + 0 0 17 1,-0.3 2,-0.2 -4,-0.2 -1,-0.1 0.552 49.8 155.2 105.7 14.1 32.7 37.3 -32.7 55 71 A K - 0 0 155 1,-0.1 -5,-3.0 -6,-0.1 -1,-0.3 -0.515 50.3-100.5 -75.9 140.9 35.7 36.0 -31.0 56 72 A E B -E 49 0A 102 -7,-0.2 -7,-0.2 -2,-0.2 2,-0.2 -0.357 35.9-113.8 -65.5 136.3 36.0 32.2 -30.9 57 73 A F - 0 0 10 -9,-2.5 2,-0.2 -2,-0.1 -9,-0.1 -0.461 35.5-173.3 -69.5 137.5 35.0 30.4 -27.7 58 74 A T > - 0 0 71 -2,-0.2 3,-1.4 26,-0.1 24,-0.3 -0.658 45.6 -82.9-120.2-179.1 37.8 28.6 -25.8 59 75 A S T 3 S+ 0 0 68 1,-0.3 23,-2.0 -2,-0.2 31,-0.1 0.779 129.3 41.4 -57.9 -27.7 37.7 26.3 -22.7 60 76 A S T 3 S+ 0 0 88 21,-0.2 2,-0.4 2,-0.1 -1,-0.3 0.385 83.1 122.1-102.9 3.1 37.5 29.3 -20.4 61 77 A T < - 0 0 35 -3,-1.4 20,-0.2 18,-0.0 21,-0.1 -0.522 46.0-157.9 -72.1 124.1 35.1 31.6 -22.3 62 78 A F - 0 0 24 -2,-0.4 18,-0.1 18,-0.1 -2,-0.1 -0.888 24.5-113.4-102.9 129.2 32.0 32.5 -20.3 63 79 A P - 0 0 1 0, 0.0 3,-0.2 0, 0.0 53,-0.1 -0.300 31.4-147.9 -62.7 139.3 29.0 33.6 -22.3 64 80 A P + 0 0 45 0, 0.0 51,-1.5 0, 0.0 49,-0.0 -0.222 61.6 71.7 -95.0-173.2 27.8 37.3 -22.0 65 81 A G + 0 0 37 1,-0.2 49,-0.2 49,-0.2 47,-0.1 0.498 55.9 150.6 85.9 5.6 24.4 39.0 -22.2 66 82 A R - 0 0 38 47,-0.3 47,-0.2 -3,-0.2 -1,-0.2 -0.349 31.4-165.0 -71.3 152.9 22.8 37.9 -19.0 67 83 A T + 0 0 87 45,-2.5 2,-0.3 -2,-0.0 3,-0.2 0.295 68.5 62.3-117.8 4.6 20.2 40.2 -17.3 68 84 A V S S+ 0 0 7 44,-1.0 43,-0.1 1,-0.2 -2,-0.1 -0.889 90.2 30.3-129.6 161.1 20.2 38.5 -13.9 69 85 A L S S+ 0 0 0 -2,-0.3 -1,-0.2 1,-0.1 25,-0.1 0.900 77.0 124.6 58.3 46.0 22.8 37.8 -11.1 70 86 A K + 0 0 124 -3,-0.2 2,-0.9 5,-0.0 -1,-0.1 0.431 28.3 115.5-110.8 -5.3 24.7 41.1 -11.9 71 87 A N > - 0 0 77 1,-0.2 3,-2.1 3,-0.1 4,-0.1 -0.576 51.2-159.2 -75.0 107.2 24.6 42.7 -8.5 72 88 A N G > S+ 0 0 139 -2,-0.9 3,-1.8 1,-0.3 -1,-0.2 0.694 82.8 79.2 -57.3 -21.4 28.2 43.0 -7.3 73 89 A A G 3 S+ 0 0 63 1,-0.3 -1,-0.3 2,-0.1 27,-0.1 0.705 98.7 42.3 -62.1 -18.9 27.0 43.3 -3.7 74 90 A Y G < S- 0 0 40 -3,-2.1 23,-1.7 26,-0.1 22,-1.2 0.189 113.2-118.7-113.2 15.8 26.4 39.5 -3.7 75 91 A G < - 0 0 28 -3,-1.8 21,-1.5 20,-0.2 -3,-0.1 0.937 25.5-145.4 49.8 70.0 29.7 38.6 -5.5 76 92 A P E -I 95 0B 30 0, 0.0 2,-0.5 0, 0.0 19,-0.3 -0.420 13.0-158.1 -65.8 135.4 28.6 36.8 -8.7 77 93 A I E -I 94 0B 31 17,-3.0 17,-1.8 -2,-0.1 2,-0.4 -0.969 4.1-161.5-119.0 124.1 31.1 34.1 -9.6 78 94 A Q E -I 93 0B 106 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.856 6.2-173.2-109.3 142.0 31.4 32.8 -13.1 79 95 A I E -I 92 0B 13 13,-3.4 13,-2.9 -2,-0.4 2,-0.4 -0.996 3.1-174.3-134.8 137.3 32.9 29.5 -14.3 80 96 A A E +I 91 0B 24 -2,-0.4 11,-0.2 11,-0.2 -18,-0.1 -0.993 16.0 160.7-133.0 136.6 33.6 28.1 -17.7 81 97 A D + 0 0 68 9,-2.9 -21,-0.2 -2,-0.4 -22,-0.1 -0.391 25.0 159.9-151.9 63.0 34.9 24.7 -18.7 82 98 A N - 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