==== 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 CELL ADHESION 26-JAN-10 3LJY . COMPND 2 MOLECULE: PUTATIVE ADHESIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARABACTEROIDES DISTASONIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 716 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30593.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 615 85.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 378 52.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 8.7 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 . 3 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 . 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 . 93 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 3 9 21 3 6 3 0 9 0 3 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 0 1 2 3 3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 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 23 A D 0 0 167 0, 0.0 69,-3.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 136.1 44.8 10.6 2.4 2 24 A H E -a 70 0A 128 67,-0.2 2,-0.3 69,-0.1 69,-0.2 -0.879 360.0-172.8-112.9 142.0 42.0 8.2 1.6 3 25 A V E -a 71 0A 31 67,-2.6 69,-3.0 -2,-0.4 70,-0.8 -0.979 10.1-154.8-132.9 148.1 41.4 4.8 3.3 4 26 A K E -a 73 0A 99 -2,-0.3 70,-0.2 68,-0.2 2,-0.1 -0.919 31.4-106.8-116.8 142.1 39.0 1.9 2.6 5 27 A G - 0 0 16 68,-2.0 69,-0.1 -2,-0.4 42,-0.0 -0.481 20.5-136.5 -66.9 142.0 37.8 -0.6 5.3 6 28 A D - 0 0 62 2,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.414 37.6-116.3 -82.2 1.0 39.4 -4.1 4.9 7 29 A G S S+ 0 0 44 1,-0.1 2,-0.7 69,-0.1 -1,-0.1 0.322 81.1 113.1 88.4 -9.4 36.0 -5.8 5.6 8 30 A K - 0 0 129 2,-0.0 39,-2.8 67,-0.0 2,-0.3 -0.881 57.9-147.2-107.1 105.5 37.1 -7.6 8.8 9 31 A L E +B 46 0B 74 -2,-0.7 2,-0.3 37,-0.2 37,-0.2 -0.550 22.7 171.3 -76.1 126.0 35.3 -6.3 11.8 10 32 A T E -B 45 0B 44 35,-2.2 35,-1.9 -2,-0.3 2,-0.4 -0.937 24.2-128.6-131.9 159.1 37.1 -6.2 15.2 11 33 A S E +B 44 0B 59 -2,-0.3 2,-0.3 33,-0.2 33,-0.2 -0.839 20.8 178.6-108.8 138.7 36.2 -4.7 18.6 12 34 A K E -B 43 0B 90 31,-2.0 31,-3.0 -2,-0.4 2,-0.4 -0.989 10.1-161.9-137.2 147.1 38.3 -2.4 20.8 13 35 A K E +B 42 0B 136 -2,-0.3 2,-0.3 29,-0.2 29,-0.2 -0.980 10.7 172.3-135.7 137.2 37.3 -0.9 24.1 14 36 A I E -B 41 0B 81 27,-2.4 27,-2.4 -2,-0.4 2,-0.3 -0.894 31.8-107.7-138.5 167.5 38.5 2.1 26.3 15 37 A S E -B 40 0B 96 -2,-0.3 2,-0.3 25,-0.2 25,-0.2 -0.783 35.5-173.6 -95.5 142.4 37.5 4.0 29.4 16 38 A V - 0 0 29 23,-1.9 23,-0.2 -2,-0.3 3,-0.1 -0.884 31.3 -95.1-133.2 159.4 36.2 7.6 29.1 17 39 A A - 0 0 66 -2,-0.3 2,-0.1 1,-0.1 -1,-0.0 -0.308 60.1 -85.9 -63.4 159.0 35.3 10.4 31.5 18 40 A D - 0 0 25 349,-0.1 2,-0.3 65,-0.1 42,-0.2 -0.420 51.9-170.7 -69.2 147.6 31.6 10.5 32.4 19 41 A Y - 0 0 0 63,-0.1 66,-0.6 66,-0.1 42,-0.2 -0.951 27.5-168.7-140.9 152.2 29.4 12.4 29.9 20 42 A N S S+ 0 0 8 40,-2.5 67,-2.1 -2,-0.3 68,-1.6 0.237 75.9 56.6-123.3 7.1 25.7 13.6 29.8 21 43 A E E -cd 61 88B 56 39,-1.2 41,-3.0 66,-0.2 2,-0.4 -0.993 61.7-161.6-144.8 143.6 25.6 14.5 26.2 22 44 A I E -cd 62 89B 0 66,-1.8 68,-2.3 -2,-0.3 2,-0.4 -0.986 5.2-167.9-128.4 136.6 26.2 12.7 22.9 23 45 A K E +cd 63 90B 93 39,-2.4 41,-0.7 -2,-0.4 2,-0.4 -0.989 15.9 177.9-122.0 117.8 26.9 14.0 19.4 24 46 A V E + d 0 91B 4 66,-2.8 68,-3.1 -2,-0.4 2,-0.3 -0.987 6.3 164.3-127.2 133.7 26.7 11.4 16.6 25 47 A D + 0 0 100 39,-0.4 68,-0.2 -2,-0.4 39,-0.1 -0.897 42.1 36.6-136.1 159.0 27.1 11.9 12.9 26 48 A G S S- 0 0 30 -2,-0.3 2,-1.6 1,-0.1 66,-0.1 -0.097 104.5 -44.8 86.3 175.6 27.7 9.4 10.0 27 49 A V S S+ 0 0 95 68,-0.1 2,-0.4 66,-0.1 50,-0.2 -0.594 85.5 143.0 -85.6 80.7 26.5 5.9 9.3 28 50 A I - 0 0 8 -2,-1.6 68,-2.5 48,-0.1 2,-0.8 -0.966 52.2-139.5-127.0 132.4 27.1 4.6 12.9 29 51 A D E -ef 78 96B 44 48,-2.6 50,-2.8 -2,-0.4 2,-0.7 -0.876 32.2-168.0 -89.4 107.9 25.0 2.1 15.0 30 52 A F E -ef 79 97B 1 66,-2.8 68,-3.0 -2,-0.8 2,-0.5 -0.864 7.2-167.9-114.7 106.4 25.3 3.8 18.4 31 53 A N E -ef 80 98B 31 48,-2.9 50,-2.3 -2,-0.7 2,-0.4 -0.828 8.2-177.3-101.3 124.9 24.2 1.9 21.4 32 54 A Y E -ef 81 99B 0 66,-2.7 68,-2.7 -2,-0.5 69,-0.4 -0.937 7.6-178.0-124.0 141.3 23.7 3.7 24.7 33 55 A E E -e 82 0B 76 48,-1.4 50,-1.4 -2,-0.4 2,-0.6 -1.000 26.2-128.0-134.1 145.1 22.8 2.6 28.3 34 56 A Q E +e 83 0B 43 68,-0.5 2,-0.3 -2,-0.4 50,-0.2 -0.788 49.8 141.1 -88.5 119.8 22.3 4.5 31.5 35 57 A S - 0 0 27 48,-2.2 50,-0.1 -2,-0.6 -2,-0.1 -0.994 58.5-130.5-156.1 154.6 24.4 3.0 34.2 36 58 A D S S+ 0 0 139 -2,-0.3 48,-0.1 48,-0.1 3,-0.1 0.491 75.2 112.1 -80.9 -5.5 26.6 3.8 37.3 37 59 A D S S- 0 0 112 1,-0.1 -2,-0.2 46,-0.1 3,-0.1 -0.354 89.9 -80.5 -64.9 150.0 29.4 1.5 36.0 38 60 A P - 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -21,-0.1 -0.289 59.1-100.0 -53.2 133.5 32.5 3.4 34.9 39 61 A S + 0 0 7 -23,-0.2 -23,-1.9 -3,-0.1 2,-0.3 -0.321 48.3 174.5 -61.9 130.1 31.9 4.8 31.4 40 62 A T E -B 15 0B 29 -25,-0.2 42,-1.0 42,-0.2 2,-0.4 -0.923 22.2-148.9-127.6 156.3 33.5 2.9 28.5 41 63 A V E -BG 14 81B 1 -27,-2.4 -27,-2.4 -2,-0.3 2,-0.4 -0.993 13.6-170.6-120.9 122.2 33.3 3.2 24.8 42 64 A E E -BG 13 80B 52 38,-2.5 38,-1.8 -2,-0.4 2,-0.5 -0.966 4.7-165.3-108.7 131.8 33.6 0.0 22.6 43 65 A V E -BG 12 79B 4 -31,-3.0 -31,-2.0 -2,-0.4 2,-0.5 -0.965 9.7-169.8-120.6 124.0 34.0 0.4 18.9 44 66 A T E +BG 11 78B 33 34,-2.6 34,-2.9 -2,-0.5 2,-0.3 -0.964 35.4 128.8-107.2 119.1 33.5 -2.4 16.3 45 67 A V E -BG 10 77B 0 -35,-1.9 -35,-2.2 -2,-0.5 32,-0.2 -0.938 67.2 -47.2-156.3 172.1 34.7 -1.3 12.9 46 68 A D E >> -B 9 0B 0 30,-0.6 3,-2.1 -2,-0.3 4,-0.5 -0.309 57.5-124.6 -50.1 131.0 37.0 -2.5 10.1 47 69 A Q G >4 S+ 0 0 95 -39,-2.8 3,-0.8 1,-0.3 -1,-0.1 0.810 107.9 53.0 -53.0 -43.8 40.2 -3.6 11.7 48 70 A N G 34 S+ 0 0 55 1,-0.2 -1,-0.3 -40,-0.2 -2,-0.1 0.595 104.1 58.8 -67.7 -13.8 42.4 -1.3 9.6 49 71 A L G X4 S+ 0 0 0 -3,-2.1 3,-1.9 1,-0.2 4,-0.4 0.564 75.7 92.4 -95.3 -9.7 40.3 1.8 10.5 50 72 A H G X< S+ 0 0 27 -3,-0.8 3,-1.6 -4,-0.5 -1,-0.2 0.847 78.7 61.0 -52.4 -44.3 40.7 1.7 14.3 51 73 A P G 3 S+ 0 0 99 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.692 105.0 50.3 -56.1 -19.0 43.7 4.0 14.3 52 74 A Y G < S+ 0 0 72 -3,-1.9 15,-3.1 -4,-0.1 2,-0.5 0.445 82.6 109.3 -98.8 -1.3 41.5 6.7 12.8 53 75 A V E < -H 66 0B 23 -3,-1.6 2,-0.7 -4,-0.4 13,-0.2 -0.654 53.7-162.1 -78.6 119.6 38.7 6.4 15.3 54 76 A N E -H 65 0B 35 11,-3.5 11,-1.9 -2,-0.5 2,-0.5 -0.898 8.2-175.6-109.8 108.0 38.7 9.5 17.5 55 77 A I E +H 64 0B 41 -2,-0.7 2,-0.4 9,-0.2 9,-0.2 -0.909 13.1 170.8-103.0 118.4 36.8 9.2 20.8 56 78 A E E -H 63 0B 72 7,-2.7 7,-2.5 -2,-0.5 2,-0.4 -0.984 26.8-167.0-130.6 141.4 36.6 12.4 22.9 57 79 A V E +H 62 0B 38 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.992 21.3 172.3-115.5 118.6 34.7 13.6 26.0 58 80 A K E > S-H 61 0B 96 3,-1.9 3,-2.2 -2,-0.4 -2,-0.1 -0.999 70.6 -13.8-129.0 132.4 35.0 17.4 26.4 59 81 A D T 3 S- 0 0 60 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.886 131.5 -52.5 32.7 54.4 33.0 19.3 29.0 60 82 A R T 3 S+ 0 0 15 -42,-0.2 -40,-2.5 1,-0.2 -39,-1.2 0.598 111.4 122.5 64.8 17.4 30.9 16.1 29.5 61 83 A V E < -cH 21 58B 22 -3,-2.2 -3,-1.9 -42,-0.2 2,-0.5 -0.947 51.3-146.5-108.1 125.3 30.0 15.7 25.8 62 84 A L E +cH 22 57B 0 -41,-3.0 -39,-2.4 -2,-0.5 2,-0.4 -0.765 20.3 174.4 -87.4 124.3 30.9 12.4 23.9 63 85 A T E -cH 23 56B 40 -7,-2.5 -7,-2.7 -2,-0.5 2,-0.4 -0.993 7.9-173.4-123.2 136.3 31.9 12.7 20.2 64 86 A I E + H 0 55B 6 -41,-0.7 -39,-0.4 -2,-0.4 2,-0.3 -0.984 26.3 134.0-126.9 119.6 33.1 9.7 18.2 65 87 A A E - H 0 54B 52 -11,-1.9 -11,-3.5 -2,-0.4 2,-0.3 -0.947 55.0 -82.0-153.6 171.5 34.3 10.3 14.6 66 88 A F E - H 0 53B 56 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.616 42.6-172.9 -81.4 144.1 37.1 9.5 12.2 67 89 A K + 0 0 125 -15,-3.1 3,-0.1 -2,-0.3 -2,-0.0 -0.970 55.2 17.5-145.3 126.6 40.4 11.6 12.3 68 90 A G S S+ 0 0 59 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 0.781 111.7 47.2 88.6 30.5 43.5 11.8 10.1 69 91 A A S S- 0 0 23 -17,-0.1 2,-0.6 -3,-0.1 -67,-0.2 -0.747 82.1-111.0 175.3 142.6 42.3 10.2 6.8 70 92 A K E -a 2 0A 42 -69,-3.7 -67,-2.6 -2,-0.2 2,-0.8 -0.810 35.3-147.3 -80.0 120.8 39.3 10.5 4.5 71 93 A V E -a 3 0A 32 -2,-0.6 -67,-0.2 -69,-0.2 3,-0.1 -0.863 18.3-177.6 -94.2 111.7 37.5 7.1 5.1 72 94 A D E + 0 0 93 -69,-3.0 2,-0.3 -2,-0.8 -68,-0.2 0.851 64.5 5.0 -77.7 -36.0 35.9 6.2 1.7 73 95 A H E +a 4 0A 116 -70,-0.8 -68,-2.0 0, 0.0 2,-0.3 -0.999 55.3 174.7-152.3 142.6 34.3 3.0 2.9 74 96 A F - 0 0 44 -2,-0.3 3,-0.1 -70,-0.2 -29,-0.0 -0.972 28.8-137.1-145.1 155.9 33.6 0.8 5.9 75 97 A T S S- 0 0 71 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.926 82.9 -21.5 -73.5 -52.4 31.6 -2.3 6.5 76 98 A K - 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