==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SPLICING 30-JAN-09 2ZYZ . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN PAE0789; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROBACULUM AEROPHILUM; . AUTHOR S.YOSHINARI,D.K.INAOKA,Y.WATANABE,T.SHIBA,G.KURISU,S.HARADA . 555 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24796.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 398 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 21.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 47 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.8 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 4 2 3 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 0 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 PARALLEL BRIDGES PER LADDER . 3 5 2 4 6 4 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 2 0 0 0 2 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 1 A M 0 0 169 0, 0.0 2,-0.5 0, 0.0 443,-0.1 0.000 360.0 360.0 360.0 -74.4 10.4 -0.9 -27.2 2 2 A D > - 0 0 33 1,-0.1 4,-2.3 380,-0.1 380,-0.2 -0.879 360.0-170.9-124.0 101.1 9.1 -3.5 -24.7 3 3 A V H > S+ 0 0 18 378,-1.8 4,-1.1 -2,-0.5 -1,-0.1 0.791 84.2 53.7 -67.0 -29.2 5.7 -4.9 -25.3 4 4 A L H > S+ 0 0 2 377,-0.5 4,-0.7 2,-0.2 3,-0.5 0.936 111.8 43.2 -71.2 -48.5 5.4 -6.6 -22.0 5 5 A Q H >> S+ 0 0 23 1,-0.2 4,-1.4 -3,-0.2 3,-1.0 0.879 108.7 61.9 -60.4 -36.0 6.1 -3.6 -19.9 6 6 A E H 3X S+ 0 0 76 -4,-2.3 4,-2.4 1,-0.3 -1,-0.2 0.836 92.9 63.5 -60.9 -29.0 3.9 -1.7 -22.2 7 7 A Q H 3X S+ 0 0 24 -4,-1.1 4,-2.0 -3,-0.5 -1,-0.3 0.825 100.8 52.8 -65.7 -31.7 1.0 -3.8 -21.1 8 8 A V H <>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 3,-1.2 0.881 112.2 54.2 -62.1 -38.7 -2.9 1.3 -15.4 13 13 A K H ><5S+ 0 0 103 -4,-2.5 3,-1.3 -5,-0.3 -1,-0.2 0.838 99.4 62.7 -65.8 -32.1 -3.8 4.1 -17.8 14 14 A S T 3<5S+ 0 0 84 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.651 106.0 45.7 -64.9 -18.0 -7.1 2.5 -18.6 15 15 A R T < 5S- 0 0 86 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 -0.019 127.9 -86.8-120.2 26.9 -8.2 2.9 -15.0 16 16 A G T < 5S+ 0 0 52 -3,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.589 76.3 141.6 87.8 13.3 -7.2 6.4 -14.4 17 17 A F < - 0 0 11 -5,-2.0 2,-0.4 -6,-0.1 -1,-0.3 -0.644 37.9-148.1 -75.4 143.5 -3.6 6.2 -13.3 18 18 A K E -A 31 0A 103 13,-2.2 13,-2.5 -2,-0.3 2,-0.5 -0.963 16.0-127.1-104.4 136.7 -1.2 8.9 -14.5 19 19 A I E +A 30 0A 29 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.695 29.5 178.7 -80.5 121.5 2.4 7.9 -15.1 20 20 A I E - 0 0 62 9,-2.4 2,-0.3 -2,-0.5 10,-0.2 0.869 57.0 -15.7 -93.4 -43.4 4.5 10.4 -13.1 21 21 A E E -A 29 0A 105 8,-1.5 8,-2.9 0, 0.0 2,-0.6 -0.959 47.4-137.4-163.0 140.1 8.1 9.4 -13.6 22 22 A Q E -A 28 0A 129 -2,-0.3 6,-0.3 6,-0.2 3,-0.1 -0.964 20.4-179.4-100.8 121.4 10.1 6.5 -14.9 23 23 A L E - 0 0 46 4,-2.0 2,-0.3 -2,-0.6 5,-0.2 0.717 60.7 -26.5 -94.0 -27.2 13.0 6.0 -12.6 24 24 A D E > S-A 27 0A 102 3,-1.5 3,-1.0 0, 0.0 -1,-0.2 -0.916 91.1 -51.0-166.2 176.7 14.8 3.0 -14.3 25 25 A D T 3 S+ 0 0 104 -2,-0.3 3,-0.0 1,-0.2 -2,-0.0 -0.484 131.0 6.8 -55.6 137.0 14.1 0.1 -16.4 26 26 A K T 3 S+ 0 0 64 -2,-0.1 14,-2.4 1,-0.1 2,-0.4 0.332 113.8 95.7 77.4 -14.0 11.3 -1.6 -14.7 27 27 A I E < +AB 24 39A 14 -3,-1.0 -4,-2.0 12,-0.2 -3,-1.5 -0.954 42.8 146.8-122.8 126.9 10.7 1.1 -12.1 28 28 A F E -AB 22 38A 4 10,-1.8 10,-3.0 -2,-0.4 2,-0.4 -0.991 38.6-125.4-152.1 157.8 8.2 4.0 -12.3 29 29 A I E +AB 21 37A 8 -8,-2.9 -9,-2.4 -2,-0.3 -8,-1.5 -0.912 31.6 173.1-104.7 135.8 5.9 6.2 -10.2 30 30 A A E -AB 19 36A 0 6,-1.8 6,-2.4 -2,-0.4 2,-0.4 -0.980 14.8-142.8-141.7 156.4 2.2 6.4 -11.0 31 31 A E E +AB 18 35A 67 -13,-2.5 -13,-2.2 -2,-0.3 4,-0.2 -0.962 33.0 148.0-134.6 136.9 -0.7 8.0 -9.4 32 32 A K S S- 0 0 70 2,-2.0 2,-0.6 -2,-0.4 -15,-0.1 -0.681 96.4 -32.0-152.9 91.4 -4.4 7.5 -8.8 33 33 A K S S+ 0 0 175 -2,-0.2 2,-0.3 0, 0.0 -2,-0.1 -0.218 141.9 24.6 77.2 -25.1 -5.4 9.1 -5.5 34 34 A E S S- 0 0 95 -2,-0.6 -2,-2.0 -4,-0.1 2,-0.4 -0.935 91.1-105.3-161.0 155.6 -2.0 8.4 -4.0 35 35 A R E -B 31 0A 109 -2,-0.3 2,-0.3 -4,-0.2 -4,-0.2 -0.757 35.9-168.2 -86.2 137.2 1.3 7.8 -5.7 36 36 A Y E -B 30 0A 17 -6,-2.4 -6,-1.8 -2,-0.4 2,-0.6 -0.919 21.4-129.1-121.5 153.0 2.7 4.4 -5.9 37 37 A L E -Bc 29 66A 0 28,-2.4 30,-2.4 -2,-0.3 2,-0.3 -0.911 29.4-158.0-100.5 118.5 6.1 3.0 -6.8 38 38 A F E -Bc 28 67A 0 -10,-3.0 -10,-1.8 -2,-0.6 2,-0.4 -0.758 13.1-171.4-100.7 140.9 5.8 0.3 -9.4 39 39 A Y E -Bc 27 68A 10 28,-2.0 30,-2.1 -2,-0.3 2,-0.4 -0.968 18.7-142.1-131.0 114.6 8.3 -2.5 -10.1 40 40 A V E - c 0 69A 5 -14,-2.4 2,-0.5 -2,-0.4 30,-0.2 -0.640 14.6-169.8 -84.3 128.6 7.6 -4.6 -13.2 41 41 A M E - c 0 70A 6 28,-2.7 30,-2.3 -2,-0.4 2,-0.3 -0.958 7.7-156.1-118.8 107.9 8.4 -8.3 -12.9 42 42 A V E > - c 0 71A 15 -2,-0.5 3,-2.3 28,-0.2 196,-0.4 -0.638 33.5 -96.2 -86.2 138.3 8.3 -10.2 -16.1 43 43 A E T 3 S+ 0 0 13 28,-2.6 -1,-0.1 -2,-0.3 3,-0.1 -0.222 110.8 16.7 -51.9 130.3 7.7 -14.0 -16.0 44 44 A G T 3 S+ 0 0 26 1,-0.2 2,-0.8 -3,-0.0 419,-0.7 0.275 96.3 112.6 92.2 -10.2 11.1 -15.8 -16.0 45 45 A V < - 0 0 20 -3,-2.3 193,-0.3 417,-0.2 2,-0.3 -0.839 53.6-159.4-103.6 103.2 13.1 -12.8 -15.2 46 46 A E - 0 0 52 -2,-0.8 2,-0.3 415,-0.3 191,-0.2 -0.589 6.3-164.8 -87.1 141.8 14.7 -13.3 -11.8 47 47 A V B -J 236 0B 17 189,-2.9 189,-3.0 -2,-0.3 -6,-0.0 -0.936 24.4-105.8-121.4 155.9 15.9 -10.5 -9.6 48 48 A T > - 0 0 64 -2,-0.3 4,-1.9 187,-0.2 3,-0.2 -0.277 26.3-117.3 -71.4 156.4 18.1 -10.7 -6.5 49 49 A I H > S+ 0 0 14 185,-0.3 4,-2.6 1,-0.2 5,-0.2 0.859 115.7 59.0 -57.4 -35.6 16.8 -10.1 -3.0 50 50 A Q H > S+ 0 0 119 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.920 103.7 49.9 -62.7 -43.3 19.0 -7.1 -2.8 51 51 A T H > S+ 0 0 56 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.970 112.5 47.1 -60.6 -51.3 17.3 -5.5 -5.7 52 52 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.933 111.0 51.2 -55.8 -45.6 13.9 -6.1 -4.3 53 53 A L H X S+ 0 0 34 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.866 108.1 53.5 -62.2 -32.4 14.9 -4.8 -0.9 54 54 A S H X S+ 0 0 70 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.918 108.3 48.0 -69.2 -43.8 16.2 -1.7 -2.5 55 55 A V H X S+ 0 0 4 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.933 111.8 51.3 -59.6 -44.1 13.0 -0.9 -4.3 56 56 A I H X S+ 0 0 7 -4,-2.3 4,-1.6 -5,-0.2 -2,-0.2 0.936 109.8 49.6 -61.9 -44.5 11.1 -1.5 -1.1 57 57 A N H X S+ 0 0 91 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.893 104.8 57.8 -59.3 -40.0 13.4 0.8 0.6 58 58 A M H X S+ 0 0 56 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.920 104.3 54.1 -54.2 -44.7 12.9 3.5 -2.1 59 59 A G H X>S+ 0 0 1 -4,-2.1 5,-2.4 1,-0.2 4,-0.7 0.936 108.0 47.6 -56.0 -50.1 9.2 3.3 -1.3 60 60 A E H ><5S+ 0 0 75 -4,-1.6 3,-0.8 3,-0.2 -1,-0.2 0.925 113.3 48.7 -57.7 -45.4 9.8 4.0 2.3 61 61 A T H 3<5S+ 0 0 100 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.966 116.9 40.3 -58.7 -53.2 12.1 6.9 1.5 62 62 A L H 3<5S- 0 0 75 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.434 112.1-120.5 -75.0 -2.8 9.7 8.5 -1.0 63 63 A S T <<5 + 0 0 109 -3,-0.8 -3,-0.2 -4,-0.7 -28,-0.2 0.945 69.4 126.3 57.0 50.2 6.8 7.7 1.3 64 64 A M < - 0 0 28 -5,-2.4 -1,-0.2 -6,-0.1 -28,-0.2 -0.994 62.5-112.9-137.7 134.6 5.0 5.6 -1.3 65 65 A P - 0 0 48 0, 0.0 -28,-2.4 0, 0.0 2,-0.4 -0.417 33.8-126.1 -66.1 145.0 3.6 2.1 -1.3 66 66 A V E -cD 37 82A 7 16,-0.6 16,-1.7 -30,-0.2 2,-0.4 -0.791 23.5-171.0 -98.4 134.1 5.3 -0.4 -3.5 67 67 A V E -cD 38 81A 0 -30,-2.4 -28,-2.0 -2,-0.4 2,-0.5 -0.991 13.9-146.8-126.9 127.5 3.5 -2.5 -6.0 68 68 A L E -cD 39 80A 0 12,-2.9 12,-2.3 -2,-0.4 2,-0.7 -0.861 10.5-154.5 -91.0 125.2 4.9 -5.3 -8.1 69 69 A A E -cD 40 79A 0 -30,-2.1 -28,-2.7 -2,-0.5 2,-0.4 -0.911 12.0-157.5-103.3 108.7 3.4 -5.6 -11.5 70 70 A L E -cD 41 78A 0 8,-3.0 8,-2.0 -2,-0.7 2,-0.5 -0.761 6.8-165.1 -91.7 129.4 3.7 -9.2 -12.6 71 71 A V E -cD 42 77A 0 -30,-2.3 -28,-2.6 -2,-0.4 6,-0.2 -0.959 12.8-135.1-123.3 125.7 3.6 -9.8 -16.3 72 72 A S > - 0 0 7 4,-2.3 3,-1.9 -2,-0.5 6,-0.0 -0.226 37.5 -96.8 -71.6 167.2 3.0 -13.2 -17.9 73 73 A N T 3 S+ 0 0 25 1,-0.3 354,-0.3 2,-0.1 -1,-0.1 0.683 126.2 38.2 -63.4 -13.7 5.2 -14.3 -20.8 74 74 A D T 3 S- 0 0 11 352,-0.1 -1,-0.3 2,-0.1 350,-0.2 0.075 128.9 -82.1-132.8 31.3 2.5 -13.1 -23.1 75 75 A G S < S+ 0 0 5 -3,-1.9 2,-0.4 1,-0.3 -2,-0.1 0.495 71.7 141.3 103.5 13.2 1.2 -9.9 -21.4 76 76 A T - 0 0 63 330,-0.0 -4,-2.3 2,-0.0 2,-0.4 -0.715 38.0-148.2 -84.5 135.5 -1.2 -10.6 -18.7 77 77 A V E +D 71 0A 29 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.882 20.5 173.1-114.2 131.6 -0.7 -8.2 -15.8 78 78 A T E -D 70 0A 40 -8,-2.0 -8,-3.0 -2,-0.4 2,-0.4 -0.985 19.9-142.2-133.2 141.6 -1.4 -9.0 -12.1 79 79 A Y E -D 69 0A 9 196,-0.4 196,-2.7 -2,-0.3 2,-0.4 -0.887 15.3-177.1-113.6 134.8 -0.5 -6.7 -9.2 80 80 A Y E -DE 68 274A 5 -12,-2.3 -12,-2.9 -2,-0.4 194,-0.2 -0.997 21.4-134.2-122.6 136.2 0.8 -7.5 -5.6 81 81 A Y E -DE 67 273A 97 192,-2.4 192,-1.4 -2,-0.4 2,-0.3 -0.564 26.5-170.1 -69.2 147.2 1.5 -5.1 -2.8 82 82 A V E +DE 66 272A 8 -16,-1.7 -16,-0.6 190,-0.2 2,-0.3 -0.997 11.7 162.6-140.0 147.1 4.8 -5.6 -1.0 83 83 A R E - E 0 271A 148 188,-1.6 188,-2.2 -2,-0.3 2,-0.7 -0.987 41.6-107.6-151.2 155.5 6.3 -4.2 2.2 84 84 A K E - E 0 270A 50 -2,-0.3 186,-0.2 186,-0.2 2,-0.1 -0.807 42.7-133.3 -86.6 120.6 9.0 -4.9 4.6 85 85 A I - 0 0 21 184,-2.0 2,-0.6 -2,-0.7 184,-0.4 -0.445 16.5-163.2 -74.3 139.0 7.4 -6.2 7.8 86 86 A R - 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