==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 04-APR-07 2JOV . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN CPE0013; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM PERFRINGENS; . AUTHOR K.DING,T.A.RAMELOT,C.G.ANKLIN,H.WANG,C.NWOSU,K.CUNNINGHAM, . 85 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6469.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 57 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.2 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 . 1 1.2 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 . 16 18.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 10.6 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+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 0 1 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 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 . 0 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 231 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.9 -22.1 -5.1 9.3 2 2 A H - 0 0 189 1,-0.5 2,-0.3 27,-0.1 0, 0.0 0.537 360.0 -13.3-122.0 -71.5 -22.0 -1.9 7.3 3 3 A K - 0 0 107 27,-0.1 -1,-0.5 28,-0.1 2,-0.3 -0.893 62.6-125.3-134.8 163.2 -18.8 -1.5 5.4 4 4 A D E -A 29 0A 111 25,-2.7 25,-2.9 -2,-0.3 2,-0.4 -0.849 29.0-103.4-115.3 145.4 -15.4 -3.3 5.4 5 5 A I E -A 28 0A 61 -2,-0.3 2,-0.1 23,-0.3 21,-0.0 -0.535 42.8-117.5 -66.4 119.7 -11.9 -1.9 5.8 6 6 A F E + 0 0 0 21,-0.6 19,-1.8 -2,-0.4 2,-0.3 -0.386 43.4 167.1 -60.1 125.7 -10.2 -1.8 2.4 7 7 A T E +A 24 0A 69 17,-0.3 2,-0.3 -2,-0.1 17,-0.2 -0.927 10.0 141.9-145.1 120.4 -7.2 -4.1 2.3 8 8 A S E -A 23 0A 22 15,-2.3 15,-3.0 -2,-0.3 2,-0.5 -0.850 47.3-100.0-148.3 178.2 -5.5 -5.1 -0.9 9 9 A V E -A 22 0A 92 -2,-0.3 2,-0.3 13,-0.2 -2,-0.0 -0.948 33.6-172.1-115.6 121.0 -2.1 -5.7 -2.5 10 10 A V E -A 21 0A 1 11,-2.3 11,-2.5 -2,-0.5 2,-0.3 -0.832 28.7-106.2-112.7 150.6 -0.5 -3.1 -4.7 11 11 A R E -Ab 20 45A 137 33,-0.7 35,-2.5 30,-0.6 2,-0.6 -0.547 25.9-152.6 -77.2 134.4 2.6 -3.4 -6.9 12 12 A V E - b 0 46A 8 7,-2.5 2,-1.0 -2,-0.3 35,-0.2 -0.920 5.8-153.1-112.9 111.6 5.8 -1.6 -5.6 13 13 A R + 0 0 176 33,-1.5 2,-0.2 -2,-0.6 6,-0.1 -0.712 55.1 63.5 -90.8 100.9 8.2 -0.6 -8.3 14 14 A G S S- 0 0 46 -2,-1.0 2,-1.1 4,-0.1 -2,-0.1 -0.801 88.8 -79.0 163.1 162.5 11.7 -0.5 -7.0 15 15 A S S S+ 0 0 114 -2,-0.2 4,-0.1 1,-0.1 -2,-0.1 -0.714 71.4 126.7 -85.0 99.8 14.6 -2.4 -5.5 16 16 A K S S- 0 0 7 -2,-1.1 2,-2.7 2,-0.6 -1,-0.1 -0.133 80.5-101.8-149.6 39.8 13.5 -2.8 -1.9 17 17 A K S S+ 0 0 155 58,-0.2 58,-0.1 56,-0.1 56,-0.1 -0.399 102.8 67.6 70.7 -66.1 13.7 -6.6 -1.2 18 18 A Y - 0 0 86 -2,-2.7 -2,-0.6 56,-0.1 -4,-0.1 -0.034 65.0-154.7 -73.8-179.1 9.9 -7.1 -1.5 19 19 A N S S+ 0 0 113 1,-0.4 -7,-2.5 -4,-0.1 2,-0.3 0.606 73.5 26.4-128.0 -36.4 7.8 -6.7 -4.7 20 20 A V E -A 11 0A 47 -9,-0.2 -1,-0.4 -7,-0.0 -9,-0.2 -0.896 66.2-144.4-129.0 159.0 4.3 -5.9 -3.5 21 21 A V E -A 10 0A 1 -11,-2.5 -11,-2.3 -2,-0.3 2,-0.6 -0.984 16.9-125.3-128.7 133.4 2.9 -4.2 -0.4 22 22 A P E -A 9 0A 55 0, 0.0 48,-1.7 0, 0.0 49,-0.6 -0.672 34.7-168.8 -72.9 118.8 -0.3 -4.9 1.6 23 23 A V E -AC 8 69A 1 -15,-3.0 -15,-2.3 -2,-0.6 2,-0.3 -0.829 7.7-175.9-112.5 150.5 -2.3 -1.7 1.8 24 24 A K E -AC 7 68A 80 44,-3.2 44,-3.1 -2,-0.3 2,-0.3 -0.862 21.6-113.9-136.7 170.6 -5.3 -0.8 4.0 25 25 A S E - C 0 67A 5 -19,-1.8 42,-0.2 -2,-0.3 4,-0.1 -0.759 9.0-139.5-109.5 155.7 -7.7 2.0 4.5 26 26 A N E S+ 0 0 69 40,-1.5 -1,-0.1 -2,-0.3 41,-0.1 0.812 89.5 41.5 -78.0 -32.9 -8.2 4.2 7.5 27 27 A K E S- 0 0 98 39,-0.4 -21,-0.6 -23,-0.1 -1,-0.1 -0.866 96.8 -92.0-122.6 150.9 -12.0 4.3 7.1 28 28 A P E -A 5 0A 80 0, 0.0 2,-0.3 0, 0.0 -23,-0.3 -0.333 42.1-166.8 -64.4 136.9 -14.5 1.5 6.3 29 29 A V E -A 4 0A 10 -25,-2.9 -25,-2.7 -2,-0.1 2,-0.1 -0.893 26.9-101.7-124.6 150.2 -15.4 1.1 2.6 30 30 A E >> - 0 0 68 -2,-0.3 3,-1.7 -27,-0.3 4,-1.3 -0.470 33.1-119.9 -69.5 145.7 -18.2 -0.8 0.8 31 31 A I H 3> S+ 0 0 126 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.789 113.2 63.1 -60.4 -27.3 -17.1 -4.1 -0.7 32 32 A S H 3> S+ 0 0 79 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.811 106.9 43.9 -66.5 -28.0 -18.1 -2.8 -4.1 33 33 A K H <> S+ 0 0 53 -3,-1.7 4,-3.2 2,-0.2 5,-0.3 0.685 100.3 69.6 -90.1 -20.7 -15.5 -0.1 -3.7 34 34 A W H X S+ 0 0 105 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.919 106.0 41.4 -57.6 -43.3 -12.9 -2.6 -2.4 35 35 A I H X S+ 0 0 86 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.928 113.7 53.2 -67.4 -45.6 -12.9 -4.0 -5.9 36 36 A D H X S+ 0 0 47 -4,-1.1 4,-1.5 1,-0.2 -2,-0.2 0.905 110.9 45.1 -59.0 -45.8 -12.9 -0.6 -7.5 37 37 A F H X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.880 110.7 54.1 -67.5 -37.4 -9.9 0.6 -5.5 38 38 A S H X S+ 0 0 16 -4,-1.6 4,-1.2 -5,-0.3 -1,-0.2 0.854 104.4 56.1 -64.4 -33.7 -8.1 -2.6 -6.2 39 39 A N H < S+ 0 0 96 -4,-2.2 4,-0.3 2,-0.2 -1,-0.2 0.896 107.8 48.4 -62.2 -40.2 -8.7 -1.9 -9.9 40 40 A V H >< S+ 0 0 19 -4,-1.5 3,-1.8 1,-0.2 4,-0.4 0.924 108.8 52.4 -65.0 -44.3 -7.0 1.4 -9.4 41 41 A L H >< S+ 0 0 7 -4,-2.4 -30,-0.6 1,-0.3 3,-0.6 0.738 96.9 69.1 -64.9 -21.9 -4.1 -0.2 -7.6 42 42 A S T 3< S+ 0 0 86 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.640 108.7 35.3 -73.5 -13.6 -3.7 -2.6 -10.6 43 43 A R T < S+ 0 0 208 -3,-1.8 2,-0.4 -4,-0.3 -1,-0.3 0.333 106.7 92.6-111.6 1.3 -2.5 0.3 -12.7 44 44 A L < - 0 0 33 -3,-0.6 -33,-0.7 -4,-0.4 2,-0.5 -0.815 54.5-165.3-108.7 133.0 -0.7 1.9 -9.8 45 45 A Y E -b 11 0A 105 -2,-0.4 2,-0.5 -35,-0.1 -33,-0.2 -0.945 9.0-153.4-120.0 110.2 2.9 1.4 -8.9 46 46 A V E -b 12 0A 11 -35,-2.5 -33,-1.5 -2,-0.5 10,-0.0 -0.692 12.3-177.9 -78.0 126.7 4.1 2.6 -5.5 47 47 A G + 0 0 50 -2,-0.5 -1,-0.1 -35,-0.2 -32,-0.1 -0.028 48.3 97.5-117.9 32.0 7.8 3.4 -5.7 48 48 A V - 0 0 81 -34,-0.1 2,-1.0 -32,-0.0 25,-0.1 -0.958 58.9-151.0-127.8 112.1 8.5 4.3 -2.1 49 49 A P + 0 0 44 0, 0.0 2,-0.2 0, 0.0 26,-0.2 -0.738 44.5 154.0 -75.4 102.9 10.0 1.9 0.5 50 50 A T - 0 0 48 -2,-1.0 23,-2.9 21,-0.2 2,-0.1 -0.615 42.8 -93.1-126.6-178.6 8.4 3.3 3.7 51 51 A K - 0 0 144 21,-0.2 3,-0.5 -2,-0.2 20,-0.2 -0.250 60.2 -65.8 -87.9-178.2 7.3 2.4 7.2 52 52 A S S S+ 0 0 52 18,-0.2 18,-0.3 1,-0.2 -1,-0.2 -0.448 116.6 33.3 -74.8 140.1 3.8 1.3 8.3 53 53 A G S S+ 0 0 38 16,-2.3 2,-0.5 1,-0.3 -1,-0.2 0.811 78.1 155.3 86.5 32.2 1.0 3.8 8.0 54 54 A N E -D 69 0A 20 15,-1.8 15,-2.3 -3,-0.5 2,-0.6 -0.822 40.2-131.6 -96.6 128.4 2.3 5.5 4.9 55 55 A V E +D 68 0A 74 -2,-0.5 13,-0.3 13,-0.2 3,-0.2 -0.681 26.6 175.2 -83.1 120.5 -0.3 7.2 2.7 56 56 A V E S+ 0 0 44 11,-2.9 2,-0.4 -2,-0.6 -1,-0.2 0.934 74.2 5.6 -83.0 -61.3 -0.1 6.4 -1.0 57 57 A C E -D 67 0A 43 10,-0.6 10,-1.3 3,-0.0 3,-0.4 -0.985 66.7-153.4-130.7 121.4 -3.1 8.2 -2.3 58 58 A K E S+D 66 0A 143 -2,-0.4 8,-0.2 1,-0.2 4,-0.1 -0.796 84.0 14.0 -91.8 136.5 -5.4 10.5 -0.2 59 59 A N S > S- 0 0 67 6,-2.8 3,-2.3 -2,-0.4 2,-0.2 0.966 86.5-154.8 64.3 56.5 -9.0 10.8 -1.5 60 60 A I T 3 S- 0 0 10 5,-0.9 5,-0.2 -3,-0.4 -1,-0.2 -0.463 79.6 -0.1 -69.4 125.6 -8.7 7.8 -3.8 61 61 A M T 3 S- 0 0 102 -2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.725 131.1 -72.0 64.5 23.9 -11.2 8.1 -6.6 62 62 A N S < S+ 0 0 136 -3,-2.3 -2,-0.2 -4,-0.1 -1,-0.2 0.991 101.1 129.5 51.3 69.5 -12.1 11.4 -4.8 63 63 A T S S- 0 0 71 2,-0.2 -2,-0.1 -3,-0.0 3,-0.1 0.646 73.6-114.7-114.5 -35.0 -13.8 9.8 -1.8 64 64 A G S S+ 0 0 23 1,-0.4 2,-0.2 -4,-0.0 -3,-0.1 0.502 74.9 123.8 104.7 10.0 -12.1 11.4 1.1 65 65 A V - 0 0 12 -5,-0.2 -6,-2.8 -39,-0.0 -5,-0.9 -0.674 55.4-130.0-104.0 157.3 -10.5 8.2 2.3 66 66 A D E - D 0 58A 25 -2,-0.2 -40,-1.5 -8,-0.2 2,-0.6 -0.881 8.6-154.6-109.3 138.0 -6.8 7.4 2.9 67 67 A I E +CD 25 57A 2 -10,-1.3 -11,-2.9 -2,-0.4 -10,-0.6 -0.955 21.4 179.8-111.5 117.2 -5.0 4.4 1.6 68 68 A I E -CD 24 55A 35 -44,-3.1 -44,-3.2 -2,-0.6 2,-0.4 -0.939 26.7-133.3-123.8 136.9 -1.9 3.4 3.7 69 69 A C E -CD 23 54A 0 -15,-2.3 -16,-2.3 -2,-0.4 -15,-1.8 -0.722 15.0-170.4 -82.7 134.6 0.6 0.7 3.4 70 70 A T + 0 0 63 -48,-1.7 2,-0.3 -2,-0.4 -18,-0.2 0.359 57.5 92.8-109.8 3.9 1.2 -1.1 6.8 71 71 A K S S- 0 0 74 -49,-0.6 2,-0.6 -20,-0.2 -21,-0.2 -0.766 76.0-125.5 -96.7 143.6 4.2 -3.1 5.7 72 72 A N - 0 0 85 -2,-0.3 -21,-0.2 -23,-0.1 -2,-0.1 -0.801 20.3-151.1 -90.9 121.1 7.7 -1.8 6.3 73 73 A L - 0 0 14 -23,-2.9 2,-1.1 -2,-0.6 -56,-0.1 -0.836 1.5-156.4 -98.4 112.3 9.7 -1.8 3.1 74 74 A P + 0 0 50 0, 0.0 3,-0.2 0, 0.0 -56,-0.1 -0.740 19.8 169.6 -87.4 96.4 13.5 -2.2 3.6 75 75 A K S S+ 0 0 113 -2,-1.1 2,-0.6 1,-0.3 -58,-0.2 0.975 72.6 31.3 -69.8 -58.4 15.1 -0.7 0.5 76 76 A D S S- 0 0 102 -60,-0.1 2,-1.7 2,-0.1 -1,-0.3 -0.915 75.6-150.5-107.0 113.7 18.7 -0.7 1.8 77 77 A S + 0 0 93 -2,-0.6 2,-0.9 -3,-0.2 -60,-0.0 -0.598 29.6 163.2 -85.4 80.0 19.5 -3.5 4.1 78 78 A L + 0 0 158 -2,-1.7 2,-0.6 2,-0.0 -2,-0.1 -0.788 4.8 168.6-102.1 88.9 22.2 -1.9 6.2 79 79 A E - 0 0 101 -2,-0.9 3,-0.2 1,-0.1 -2,-0.1 -0.914 12.7-176.2-102.9 118.2 22.6 -4.0 9.3 80 80 A H + 0 0 183 -2,-0.6 3,-0.1 1,-0.2 -1,-0.1 -0.318 58.9 92.9-112.1 47.6 25.6 -3.0 11.3 81 81 A H S S+ 0 0 176 1,-0.2 2,-0.3 2,-0.1 -1,-0.2 0.750 88.1 41.9-100.6 -41.6 25.5 -5.6 14.1 82 82 A H S S- 0 0 113 -3,-0.2 -1,-0.2 1,-0.2 -3,-0.0 -0.772 70.0-151.6-101.4 150.7 27.7 -8.2 12.3 83 83 A H - 0 0 173 -2,-0.3 2,-0.2 -3,-0.1 -1,-0.2 0.842 44.9 -88.9 -79.0 -91.7 30.9 -7.3 10.5 84 84 A H 0 0 150 1,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.856 360.0 360.0 176.3 142.4 31.4 -9.9 7.7 85 85 A H 0 0 241 -2,-0.2 -1,-0.1 0, 0.0 0, 0.0 0.857 360.0 360.0 -85.0 360.0 33.1 -13.3 7.2