==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 16-AUG-06 2I2L . COMPND 2 MOLECULE: YOPX PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.M.VOROBIEV,W.ZHOU,J.SEETHARAMAN,F.FOROUHAR,A.A.KUZIN, . 391 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22055.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 59.8 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 . 150 38.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 49 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 1.0 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+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 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 1 14 5 7 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 ANTIPARALLEL BRIDGES PER LADDER . 3 7 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 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 X 0 0 111 0, 0.0 2,-0.5 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 123.9 16.1 93.0 53.6 2 2 A N + 0 0 77 1,-0.2 56,-0.0 184,-0.1 159,-0.0 -0.547 360.0 96.9-110.2 62.7 16.4 94.0 49.9 3 3 A T + 0 0 3 -2,-0.5 -1,-0.2 2,-0.0 158,-0.1 0.564 43.1 120.6-122.7 -19.9 13.4 96.1 49.8 4 4 A A + 0 0 1 -3,-0.4 53,-3.2 53,-0.1 2,-0.3 -0.259 34.8 142.0 -55.4 124.6 14.8 99.6 50.2 5 5 A Y E -A 56 0A 0 51,-0.3 11,-2.4 2,-0.0 2,-0.3 -0.936 32.0-154.0-154.1 169.0 13.9 101.8 47.2 6 6 A R E -AB 55 15A 6 49,-2.1 49,-3.1 -2,-0.3 2,-0.4 -0.977 6.9-152.3-152.9 141.4 12.9 105.3 46.5 7 7 A V E -AB 54 14A 0 7,-2.0 7,-2.3 -2,-0.3 2,-0.6 -0.898 6.5-150.5-117.8 147.3 10.9 106.9 43.6 8 8 A W E -AB 53 13A 47 45,-3.0 45,-1.9 -2,-0.4 5,-0.2 -0.950 8.3-174.1-116.4 109.2 11.1 110.4 42.2 9 9 A D - 0 0 22 3,-1.5 37,-0.1 -2,-0.6 -1,-0.1 0.669 57.9 -96.8 -75.4 -16.9 7.7 111.3 40.8 10 10 A G S S+ 0 0 19 2,-0.5 3,-0.1 -3,-0.1 -2,-0.0 0.021 116.2 46.3 125.2 -27.2 9.2 114.5 39.4 11 11 A E S S+ 0 0 170 1,-0.3 2,-0.3 0, 0.0 -3,-0.0 0.721 117.9 16.7-111.7 -40.9 8.3 117.0 42.2 12 12 A Q S S- 0 0 111 -5,-0.0 -3,-1.5 2,-0.0 -2,-0.5 -0.925 72.8-110.7-137.0 160.3 9.2 115.1 45.3 13 13 A X E -B 8 0A 22 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.647 27.3-154.6 -88.4 146.2 11.2 112.1 46.6 14 14 A H E -B 7 0A 4 -7,-2.3 -7,-2.0 -2,-0.3 2,-0.4 -0.977 1.2-156.4-127.3 121.4 9.5 109.0 47.9 15 15 A Y E > -B 6 0A 73 -2,-0.4 3,-2.8 -9,-0.2 -9,-0.2 -0.816 24.4-124.3 -99.8 134.9 11.0 106.6 50.3 16 16 A W T 3 S+ 0 0 31 -11,-2.4 145,-0.2 -2,-0.4 -1,-0.1 0.765 110.1 53.2 -40.6 -41.0 9.8 103.0 50.6 17 17 A D T 3 S+ 0 0 80 -12,-0.2 -1,-0.3 143,-0.1 3,-0.1 0.569 77.6 122.8 -78.5 -10.0 9.0 103.3 54.3 18 18 A D S X S- 0 0 55 -3,-2.8 3,-0.8 1,-0.1 -4,-0.0 -0.204 80.5 -90.0 -47.6 142.8 6.9 106.4 53.9 19 19 A E T 3 S+ 0 0 84 1,-0.2 2,-0.3 16,-0.0 -1,-0.1 -0.315 105.4 5.5 -61.5 140.2 3.5 105.6 55.3 20 20 A G T 3 S+ 0 0 30 1,-0.2 -1,-0.2 15,-0.1 -2,-0.1 0.033 93.2 127.4 79.3 -28.7 1.0 104.1 52.8 21 21 A L < + 0 0 2 -3,-0.8 138,-0.5 -2,-0.3 2,-0.3 -0.295 29.5 175.0 -65.7 147.7 3.4 103.7 49.9 22 22 A S E -C 34 0B 11 12,-2.0 12,-2.9 136,-0.2 2,-0.4 -0.949 21.5-139.7-152.0 131.2 3.7 100.4 48.2 23 23 A L E -CD 33 157B 0 134,-1.8 134,-2.5 -2,-0.3 2,-0.5 -0.761 13.9-163.6 -95.8 140.3 5.7 99.7 45.0 24 24 A I E -CD 32 156B 16 8,-1.7 8,-1.0 -2,-0.4 2,-0.5 -0.933 2.9-166.3-130.9 111.4 4.3 97.4 42.4 25 25 A I E -CD 31 155B 1 130,-2.0 130,-1.6 -2,-0.5 6,-0.3 -0.814 18.6-144.7 -94.1 130.0 6.5 95.9 39.7 26 26 A K > - 0 0 75 4,-3.7 3,-2.8 -2,-0.5 128,-0.2 -0.627 24.5-107.1-100.7 159.0 4.6 94.3 36.8 27 27 A S T 3 S+ 0 0 26 126,-0.4 127,-0.1 1,-0.3 -1,-0.1 0.692 119.4 56.4 -48.4 -26.1 5.2 91.3 34.5 28 28 A N T 3 S- 0 0 103 2,-0.1 -1,-0.3 124,-0.0 121,-0.1 0.180 123.1-103.4 -95.6 15.9 6.2 93.6 31.7 29 29 A G S < S+ 0 0 11 -3,-2.8 -2,-0.1 1,-0.3 120,-0.1 0.267 79.8 133.6 83.6 -14.7 8.9 95.3 33.7 30 30 A D - 0 0 53 -5,-0.1 -4,-3.7 1,-0.0 2,-0.3 -0.275 39.7-155.8 -65.8 156.1 6.8 98.4 34.4 31 31 A W E -C 25 0B 19 -6,-0.3 16,-1.9 -3,-0.1 2,-0.3 -0.885 9.0-168.3-129.8 163.6 6.6 99.7 37.9 32 32 A T E -CE 24 46B 25 -8,-1.0 -8,-1.7 -2,-0.3 2,-0.5 -0.896 16.2-140.5-156.7 122.1 4.1 101.9 39.7 33 33 A L E -CE 23 45B 0 12,-1.1 11,-2.2 -2,-0.3 12,-1.0 -0.732 27.2-168.7 -86.0 128.0 4.2 103.7 43.1 34 34 A K E -CE 22 43B 65 -12,-2.9 -12,-2.0 -2,-0.5 2,-0.3 -0.948 10.9-160.5-124.7 141.1 1.0 103.5 45.0 35 35 A R E - E 0 42B 80 7,-2.8 7,-4.1 -2,-0.4 2,-0.7 -0.825 17.2-133.2-114.0 152.0 -0.3 105.2 48.1 36 36 A L E + E 0 41B 85 -2,-0.3 5,-0.2 5,-0.2 -15,-0.1 -0.885 32.1 163.3-109.9 102.8 -3.1 104.2 50.4 37 37 A Y S S- 0 0 204 3,-1.7 -1,-0.2 -2,-0.7 4,-0.1 0.971 73.2 -23.5 -79.9 -75.9 -5.5 107.1 51.2 38 38 A T S S- 0 0 70 2,-0.3 -2,-0.0 0, 0.0 3,-0.0 0.663 119.1 -44.9-101.0 -96.3 -8.7 105.6 52.6 39 39 A D S S+ 0 0 96 2,-0.0 2,-0.4 -3,-0.0 -3,-0.0 -0.041 120.3 97.7-124.9 21.2 -9.3 102.0 51.6 40 40 A V S S- 0 0 88 2,-0.0 -3,-1.7 0, 0.0 2,-0.6 -0.936 72.1-134.9-117.5 133.4 -8.3 103.0 48.1 41 41 A L E -E 36 0B 96 -2,-0.4 -5,-0.2 -5,-0.2 -20,-0.0 -0.780 26.3-156.0 -88.3 122.1 -4.9 102.5 46.5 42 42 A V E -E 35 0B 49 -7,-4.1 -7,-2.8 -2,-0.6 2,-0.5 -0.873 16.0-124.2-109.2 129.3 -3.9 105.7 44.6 43 43 A P E +E 34 0B 95 0, 0.0 -9,-0.2 0, 0.0 3,-0.1 -0.529 30.3 175.0 -67.9 111.8 -1.4 106.0 41.7 44 44 A V E - 0 0 46 -11,-2.2 2,-0.3 -2,-0.5 -10,-0.2 0.920 65.2 -25.3 -84.6 -53.9 1.2 108.5 42.8 45 45 A V E -E 33 0B 13 -12,-1.0 -12,-1.1 -35,-0.0 -1,-0.4 -0.905 63.7-148.9-149.9 176.4 3.5 108.2 39.8 46 46 A D E > -E 32 0B 42 -2,-0.3 3,-3.0 -14,-0.2 6,-0.3 -0.986 27.8-112.8-158.5 144.2 4.4 105.5 37.2 47 47 A S T 3 S+ 0 0 29 -16,-1.9 -15,-0.1 -2,-0.3 5,-0.1 0.681 109.3 68.5 -48.7 -26.7 7.2 104.2 35.1 48 48 A T T 3 S+ 0 0 97 -17,-0.3 2,-1.3 1,-0.1 -1,-0.3 0.692 80.1 91.0 -70.3 -12.4 5.6 105.3 31.8 49 49 A N S X S- 0 0 66 -3,-3.0 3,-2.6 1,-0.2 -1,-0.1 -0.689 70.6-159.2 -82.9 94.1 6.3 108.8 33.0 50 50 A R T 3 S+ 0 0 220 -2,-1.3 -1,-0.2 1,-0.3 -3,-0.1 0.515 87.3 60.1 -54.6 -5.4 9.7 109.3 31.5 51 51 A N T 3 S+ 0 0 122 -42,-0.1 -1,-0.3 2,-0.0 -4,-0.1 0.701 92.2 83.5 -94.0 -22.4 10.4 112.1 34.0 52 52 A A < - 0 0 17 -3,-2.6 2,-0.3 -6,-0.3 -43,-0.2 -0.207 62.0-158.9 -77.1 169.3 10.0 109.8 37.0 53 53 A A E -A 8 0A 13 -45,-1.9 -45,-3.0 2,-0.0 2,-0.5 -0.994 14.7-152.1-153.8 144.8 12.7 107.5 38.5 54 54 A L E -A 7 0A 10 -2,-0.3 2,-0.4 -47,-0.2 -47,-0.2 -0.978 18.8-174.9-117.7 123.0 13.0 104.4 40.6 55 55 A X E -A 6 0A 11 -49,-3.1 -49,-2.1 -2,-0.5 2,-0.2 -0.972 14.4-140.6-121.4 131.0 16.2 104.0 42.7 56 56 A W E -A 5 0A 24 -2,-0.4 2,-0.4 10,-0.3 -51,-0.3 -0.535 13.7-131.1 -89.2 155.9 17.1 100.9 44.8 57 57 A G - 0 0 12 -53,-3.2 2,-0.4 -2,-0.2 9,-0.2 -0.845 11.5-155.8-107.7 141.5 18.8 101.0 48.1 58 58 A A E -H 65 0C 2 7,-1.9 7,-1.5 -2,-0.4 2,-0.6 -0.925 18.8-130.1-112.3 137.5 21.8 99.0 49.2 59 59 A K E +H 64 0C 110 -2,-0.4 163,-0.4 5,-0.2 2,-0.3 -0.801 50.4 142.8 -86.1 123.6 22.5 98.2 52.8 60 60 A V E > +H 63 0C 5 3,-2.1 3,-1.0 -2,-0.6 -2,-0.1 -0.859 62.4 15.5-165.2 127.7 26.1 99.1 53.3 61 61 A R T 3 S- 0 0 191 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.816 129.0 -69.5 73.4 31.1 27.8 100.7 56.3 62 62 A G T 3 S+ 0 0 66 1,-0.2 -1,-0.3 0, 0.0 2,-0.1 0.439 121.9 93.3 67.2 -3.0 24.7 99.8 58.2 63 63 A K E < S-H 60 0C 148 -3,-1.0 -3,-2.1 -5,-0.0 2,-0.4 -0.345 77.1-116.0-106.5-170.9 23.0 102.5 56.1 64 64 A F E -H 59 0C 52 -5,-0.2 2,-0.3 -2,-0.1 -5,-0.2 -0.999 27.6-178.6-131.1 123.2 21.0 102.6 52.8 65 65 A I E +H 58 0C 16 -7,-1.5 -7,-1.9 -2,-0.4 28,-0.0 -0.775 4.0 173.2-114.8 166.6 22.4 104.5 49.8 66 66 A Y - 0 0 14 -2,-0.3 -10,-0.3 -9,-0.2 -1,-0.1 0.566 67.1 -36.8-137.5 -63.9 20.5 104.7 46.5 67 67 A D S S+ 0 0 27 51,-0.2 53,-0.9 -12,-0.1 20,-0.1 -0.103 91.2 145.8-166.9 38.4 21.7 107.0 43.6 68 68 A R E -I 119 0D 1 51,-0.2 18,-3.7 17,-0.1 2,-0.4 -0.007 53.9-112.5 -79.5 178.6 23.0 109.9 45.7 69 69 A S E -IJ 118 85D 0 49,-1.4 48,-2.0 16,-0.3 49,-1.3 -0.896 43.5-173.9-108.1 141.6 25.8 112.4 45.5 70 70 A I E -IJ 116 84D 1 14,-1.3 14,-1.5 -2,-0.4 2,-0.7 -0.959 28.6-124.6-140.4 160.5 28.4 111.8 48.2 71 71 A V E -IJ 115 83D 38 44,-2.5 44,-1.4 -2,-0.3 2,-1.0 -0.919 21.2-163.5-107.0 110.8 31.5 113.4 49.7 72 72 A K E -I 114 0D 9 10,-1.4 2,-0.6 -2,-0.7 42,-0.2 -0.816 13.3-179.1 -96.9 98.4 34.4 111.0 49.7 73 73 A I E -I 113 0D 33 40,-1.8 40,-1.8 -2,-1.0 8,-0.3 -0.887 31.2-113.8-103.3 122.7 37.0 112.4 52.1 74 74 A T E -I 112 0D 19 6,-3.8 38,-0.3 -2,-0.6 6,-0.2 -0.164 14.0-134.3 -51.5 140.1 40.2 110.5 52.6 75 75 A S S S+ 0 0 79 36,-2.6 -1,-0.2 1,-0.1 37,-0.2 0.784 98.9 69.0 -68.6 -23.9 40.7 109.1 56.1 76 76 A D S S- 0 0 85 35,-0.6 -1,-0.1 4,-0.0 36,-0.0 0.948 119.2 -66.0 -57.1 -90.7 44.2 110.5 55.9 77 77 A D S S- 0 0 91 3,-0.0 -4,-0.0 0, 0.0 -1,-0.0 0.652 85.6 -49.7-128.4 -74.4 43.9 114.4 55.9 78 78 A K S S+ 0 0 84 3,-0.0 3,-0.1 -5,-0.0 -3,-0.1 -0.166 97.8 126.7-159.0 11.0 42.3 116.4 53.1 79 79 A E S S+ 0 0 80 1,-0.2 2,-0.3 -5,-0.1 -4,-0.1 0.666 80.7 10.6 -52.3 -20.5 44.5 114.2 50.9 80 80 A S + 0 0 16 -6,-0.2 -6,-3.8 19,-0.1 2,-0.3 -0.941 68.5 146.3-164.0 140.1 41.4 113.3 49.0 81 81 A S + 0 0 71 -2,-0.3 2,-0.3 -8,-0.3 -8,-0.2 -0.929 14.9 155.2-165.5 158.8 37.8 114.5 48.9 82 82 A D - 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