==== 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 UNKNOWN FUNCTION 11-OCT-10 3P69 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES FRAGILIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 256 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13919.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 61.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 32.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 25 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 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 RESIDUES PER ALPHA HELIX . 1 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 2 0 6 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 . 0 0 0 2 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 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 35 A E 0 0 141 0, 0.0 2,-0.3 0, 0.0 108,-0.2 0.000 360.0 360.0 360.0 -49.1 -10.3 60.1 1.6 2 36 A E - 0 0 63 78,-0.2 108,-0.4 106,-0.1 109,-0.1 -0.621 360.0-179.2 -85.6 132.4 -7.2 57.8 1.1 3 37 A A + 0 0 6 -2,-0.3 2,-0.3 106,-0.2 104,-0.2 -0.489 34.5 141.8-127.6 54.7 -7.5 54.6 -1.1 4 38 A E - 0 0 45 104,-0.1 75,-1.7 113,-0.0 2,-0.5 -0.687 52.1-134.8-103.2 151.7 -3.9 53.2 -0.8 5 39 A I E +A 78 0A 1 -2,-0.3 73,-0.3 73,-0.2 3,-0.1 -0.901 26.9 175.3 -95.4 128.6 -2.4 49.7 -0.5 6 40 A T E + 0 0 78 71,-3.0 2,-0.3 -2,-0.5 72,-0.2 0.549 60.0 18.8-113.4 -14.7 0.2 50.0 2.3 7 41 A K E -A 77 0A 56 70,-1.2 70,-2.0 31,-0.0 2,-0.4 -0.973 52.2-160.4-157.1 144.3 1.4 46.4 2.7 8 42 A V E +A 76 0A 0 -2,-0.3 2,-0.3 68,-0.2 68,-0.2 -0.989 24.8 169.4-127.8 116.9 1.4 43.1 0.7 9 43 A G E -A 75 0A 0 66,-2.6 66,-2.4 -2,-0.4 2,-0.3 -0.791 14.2-155.6-123.0 166.4 1.9 39.9 2.6 10 44 A A E -A 74 0A 0 23,-0.4 23,-2.9 -2,-0.3 2,-0.3 -0.998 4.0-161.7-144.9 149.1 1.6 36.1 1.9 11 45 A Y E -AB 73 32A 12 62,-2.6 62,-2.4 -2,-0.3 2,-0.6 -0.951 18.3-138.8-124.9 149.9 1.1 32.7 3.7 12 46 A H E - B 0 31A 9 19,-2.4 19,-2.4 -2,-0.3 2,-0.4 -0.948 26.9-162.1-100.0 116.1 1.7 29.2 2.7 13 47 A R E + B 0 30A 50 -2,-0.6 2,-0.3 58,-0.3 17,-0.2 -0.887 22.3 154.5-105.3 132.5 -1.4 27.3 3.9 14 48 A F E - B 0 29A 18 15,-3.1 15,-3.1 -2,-0.4 2,-0.5 -0.993 48.1 -95.1-155.0 164.9 -1.0 23.5 4.2 15 49 A Y E - B 0 28A 125 -2,-0.3 13,-0.2 13,-0.2 2,-0.1 -0.685 38.9-149.0 -80.9 120.1 -2.0 20.2 5.8 16 50 A S E - 0 0 7 11,-3.2 11,-0.1 -2,-0.5 43,-0.1 -0.410 29.2-107.1 -76.3 171.8 0.2 19.4 8.7 17 51 A G E S+ 0 0 74 -2,-0.1 2,-0.2 41,-0.1 -1,-0.1 0.499 90.3 105.3 -77.3 -0.3 0.8 15.7 9.4 18 52 A D E - 0 0 54 9,-0.3 9,-3.2 40,-0.0 2,-0.4 -0.558 56.1-156.4 -86.9 142.1 -1.4 16.0 12.5 19 53 A K E - B 0 26A 131 7,-0.3 2,-0.4 -2,-0.2 7,-0.2 -0.919 24.0-112.7-117.8 140.3 -5.0 14.6 12.6 20 54 A D > - 0 0 22 5,-3.3 4,-2.1 -2,-0.4 207,-0.1 -0.647 25.4-138.9 -69.2 129.0 -7.9 15.7 14.8 21 55 A A T 4 S+ 0 0 75 -2,-0.4 -1,-0.1 205,-0.2 206,-0.1 0.753 97.4 34.9 -61.3 -27.0 -8.6 12.6 17.1 22 56 A I T 4 S+ 0 0 160 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.890 126.0 33.1 -96.8 -47.8 -12.4 13.0 16.8 23 57 A T T 4 S- 0 0 42 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.700 90.6-137.0 -83.0 -21.4 -13.1 14.2 13.2 24 58 A G < + 0 0 47 -4,-2.1 -3,-0.1 1,-0.3 2,-0.1 0.324 56.5 141.4 78.2 -5.3 -10.1 12.2 11.7 25 59 A E - 0 0 53 -6,-0.1 -5,-3.3 1,-0.1 -1,-0.3 -0.337 59.5-109.6 -70.9 147.8 -9.4 15.4 9.6 26 60 A N E -B 19 0A 57 -7,-0.2 134,-0.4 -3,-0.1 2,-0.3 -0.588 38.8-118.6 -73.2 135.8 -5.8 16.6 8.8 27 61 A I E - 0 0 0 -9,-3.2 -11,-3.2 -2,-0.3 2,-0.3 -0.616 23.2-131.0 -83.6 139.1 -5.1 19.8 10.7 28 62 A V E -Bc 15 161A 13 132,-3.1 134,-2.2 -2,-0.3 2,-0.3 -0.616 23.4-175.0 -92.3 138.8 -4.3 22.9 8.7 29 63 A A E -B 14 0A 12 -15,-3.1 -15,-3.1 -2,-0.3 2,-0.3 -0.902 8.4-154.2-125.9 160.0 -1.3 25.1 9.4 30 64 A E E -B 13 0A 38 132,-0.3 2,-0.4 -2,-0.3 -17,-0.2 -0.988 2.8-163.5-135.2 139.5 -0.3 28.5 7.9 31 65 A K E -B 12 0A 68 -19,-2.4 -19,-2.4 -2,-0.3 2,-0.3 -0.992 18.4-132.6-127.7 124.9 3.2 30.0 7.6 32 66 A E E -B 11 0A 58 -2,-0.4 -21,-0.3 -21,-0.2 2,-0.2 -0.590 24.7-132.9 -74.8 132.8 3.8 33.7 6.8 33 67 A L - 0 0 2 -23,-2.9 -23,-0.4 -2,-0.3 19,-0.2 -0.520 20.5-108.6 -83.6 150.4 6.4 34.3 4.1 34 68 A D E -H 51 0B 85 17,-1.8 17,-2.1 -2,-0.2 2,-0.3 -0.503 49.3-169.4 -72.2 149.7 9.3 36.8 4.5 35 69 A R E -H 50 0B 96 15,-0.2 2,-0.3 -2,-0.2 15,-0.2 -0.909 35.9-157.8-143.7 166.7 8.8 39.8 2.3 36 70 A T E -H 49 0B 90 13,-1.3 13,-1.9 -2,-0.3 2,-0.4 -0.924 26.3-156.6-128.3 146.6 10.0 43.0 0.7 37 71 A N E -H 48 0B 52 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.989 14.2-169.3-128.4 144.3 7.4 45.5 -0.5 38 72 A N E -H 47 0B 101 9,-2.9 9,-3.2 -2,-0.4 2,-0.7 -0.968 10.7-169.9-130.9 106.0 7.6 48.2 -3.2 39 73 A I E -H 46 0B 57 -2,-0.5 2,-0.9 7,-0.2 7,-0.2 -0.903 5.2-171.6-103.3 108.9 4.6 50.5 -3.0 40 74 A D E >> +H 45 0B 58 5,-3.3 5,-2.3 -2,-0.7 4,-0.7 -0.848 6.2 179.1 -99.6 93.8 4.4 52.8 -6.1 41 75 A S T >45S+ 0 0 50 -2,-0.9 3,-0.9 3,-0.2 -1,-0.2 0.923 74.9 57.8 -63.4 -47.7 1.5 55.2 -5.0 42 76 A E T 345S+ 0 0 162 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.861 119.1 31.2 -50.4 -45.7 1.7 57.4 -8.2 43 77 A H T 345S- 0 0 128 2,-0.1 -1,-0.3 75,-0.0 -2,-0.2 0.431 106.5-122.5 -96.4 -1.1 1.1 54.4 -10.5 44 78 A G T <<5 + 0 0 2 -3,-0.9 74,-2.5 -4,-0.7 2,-0.5 0.925 62.8 143.1 57.2 49.2 -1.0 52.3 -8.1 45 79 A V E < -Hi 40 118B 43 -5,-2.3 -5,-3.3 72,-0.2 2,-0.5 -0.989 31.4-171.6-122.9 121.7 1.4 49.4 -8.2 46 80 A A E -Hi 39 119B 0 72,-3.0 74,-2.2 -2,-0.5 2,-0.4 -0.972 11.1-172.9-117.1 114.2 2.1 47.3 -5.1 47 81 A T E -Hi 38 120B 40 -9,-3.2 -9,-2.9 -2,-0.5 2,-0.4 -0.896 4.7-175.5-109.8 139.2 5.0 44.8 -5.6 48 82 A A E -Hi 37 121B 1 72,-2.3 74,-1.8 -2,-0.4 2,-0.5 -0.992 13.5-160.4-136.5 142.0 6.1 42.1 -3.2 49 83 A V E -Hi 36 122B 37 -13,-1.9 -13,-1.3 -2,-0.4 2,-0.4 -0.994 18.2-159.7-116.8 118.7 9.0 39.6 -3.2 50 84 A F E -Hi 35 123B 0 72,-2.8 74,-2.9 -2,-0.5 2,-0.3 -0.835 7.4-169.3-103.6 144.2 8.5 36.7 -0.9 51 85 A T E -Hi 34 124B 56 -17,-2.1 -17,-1.8 -2,-0.4 74,-0.1 -0.916 31.1-107.8-124.2 152.2 11.2 34.4 0.4 52 86 A I - 0 0 21 72,-0.7 -19,-0.1 -2,-0.3 3,-0.1 -0.733 34.9-129.8 -85.0 122.2 10.7 31.1 2.2 53 87 A P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.241 35.9 -82.8 -66.2 160.7 11.4 31.3 6.0 54 88 A A - 0 0 77 1,-0.1 5,-0.1 10,-0.0 7,-0.0 -0.160 57.3 -87.2 -59.8 152.5 13.7 28.8 7.7 55 89 A A + 0 0 41 -3,-0.1 2,-0.2 3,-0.0 5,-0.2 -0.279 60.6 148.4 -60.5 147.2 12.1 25.4 8.8 56 90 A G B > -L 59 0C 43 3,-2.3 3,-1.9 -3,-0.1 2,-0.0 -0.795 53.5 -18.2 178.5 138.4 10.5 25.3 12.3 57 91 A G T 3 S- 0 0 31 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 -0.313 130.4 -13.0 59.4-128.8 7.6 23.4 13.9 58 92 A K T 3 S+ 0 0 55 1,-0.2 2,-1.6 2,-0.1 -1,-0.3 0.610 120.9 87.4 -82.7 -6.6 5.1 21.9 11.4 59 93 A F B < S+L 56 0C 6 -3,-1.9 -3,-2.3 -29,-0.1 -1,-0.2 -0.615 71.8 177.5 -88.1 74.7 6.8 24.1 8.7 60 94 A T > - 0 0 68 -2,-1.6 4,-2.0 -5,-0.2 5,-0.1 -0.207 47.6-100.1 -74.3 171.1 9.4 21.4 8.0 61 95 A E H > S+ 0 0 121 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.904 127.1 53.2 -56.0 -42.7 12.2 21.4 5.3 62 96 A A H 4 S+ 0 0 68 1,-0.2 3,-0.3 2,-0.2 4,-0.3 0.889 108.5 49.0 -60.6 -42.6 9.9 19.1 3.2 63 97 A E H >> S+ 0 0 24 1,-0.2 3,-1.5 2,-0.2 4,-0.5 0.822 102.2 61.9 -68.5 -34.3 7.0 21.7 3.5 64 98 A R H >< S+ 0 0 67 -4,-2.0 3,-1.0 1,-0.3 -1,-0.2 0.872 100.6 55.4 -56.5 -37.4 9.4 24.6 2.5 65 99 A A T 3< S+ 0 0 86 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.597 101.3 59.1 -71.4 -13.0 9.8 22.8 -0.9 66 100 A K T <4 S+ 0 0 136 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.557 73.9 117.1 -93.6 -10.7 5.9 22.8 -1.3 67 101 A V << - 0 0 1 -3,-1.0 2,-0.4 -4,-0.5 5,-0.1 -0.396 46.4-179.3 -61.6 124.3 5.7 26.7 -1.2 68 102 A S > - 0 0 40 3,-0.4 3,-1.6 -2,-0.1 31,-0.1 -0.997 42.1-144.5-138.9 137.3 4.3 27.7 -4.6 69 103 A L G > S+ 0 0 35 -2,-0.4 30,-3.0 1,-0.3 3,-0.5 0.709 104.9 63.4 -63.6 -25.5 3.4 31.0 -6.3 70 104 A S G 3 S+ 0 0 59 28,-0.3 -1,-0.3 1,-0.3 -3,-0.0 0.500 113.4 33.0 -78.6 -6.8 0.5 29.0 -8.0 71 105 A N G < S+ 0 0 84 -3,-1.6 -3,-0.4 27,-0.1 2,-0.4 -0.446 85.2 139.9-151.8 70.5 -1.1 28.4 -4.6 72 106 A L E < - D 0 97A 0 25,-2.7 25,-1.7 -3,-0.5 2,-0.6 -0.915 47.4-135.4-120.9 139.3 -0.4 31.3 -2.3 73 107 A V E -AD 11 96A 3 -62,-2.4 -62,-2.6 -2,-0.4 2,-0.4 -0.858 30.9-170.4 -90.5 115.0 -2.6 33.1 0.2 74 108 A V E -A 10 0A 0 -2,-0.6 20,-2.7 21,-0.6 21,-0.3 -0.894 7.4-177.8-111.0 140.6 -2.1 36.9 -0.3 75 109 A Y E -A 9 0A 43 -66,-2.4 -66,-2.6 -2,-0.4 2,-0.3 -0.946 7.3-157.3-129.8 156.4 -3.3 39.6 2.0 76 110 A V E -A 8 0A 20 -2,-0.3 2,-0.4 -68,-0.2 -68,-0.2 -0.945 11.6-142.0-130.4 151.2 -3.1 43.5 1.8 77 111 A N E -A 7 0A 72 -70,-2.0 -71,-3.0 -2,-0.3 -70,-1.2 -0.928 28.0-173.2-104.6 137.4 -3.3 46.3 4.3 78 112 A V E -A 5 0A 37 -2,-0.4 -73,-0.2 -73,-0.3 3,-0.1 -0.788 35.1 -65.5-124.7 169.9 -5.2 49.4 3.0 79 113 A S S > S- 0 0 17 -75,-1.7 3,-2.4 -2,-0.3 -1,-0.2 -0.121 74.8 -74.4 -49.5 149.5 -5.8 53.0 4.2 80 114 A T T 3 S+ 0 0 134 1,-0.3 30,-0.5 -3,-0.1 -78,-0.2 -0.242 119.8 3.4 -51.5 131.1 -7.9 53.3 7.4 81 115 A A T 3 S+ 0 0 73 1,-0.2 -1,-0.3 -3,-0.1 2,-0.1 0.456 98.9 136.0 66.0 9.4 -11.7 52.5 6.5 82 116 A A < - 0 0 14 -3,-2.4 2,-0.4 27,-0.1 27,-0.2 -0.507 43.6-148.4 -82.3 153.3 -10.8 51.7 2.9 83 117 A R E -J 108 0B 92 25,-2.3 25,-3.3 -2,-0.1 2,-0.4 -0.989 5.5-149.3-124.2 130.4 -12.4 48.6 1.2 84 118 A V E -J 107 0B 46 -2,-0.4 23,-0.2 23,-0.2 -8,-0.0 -0.878 11.7-171.9-106.5 136.2 -10.7 46.6 -1.5 85 119 A T E -J 106 0B 81 21,-2.3 21,-3.0 -2,-0.4 2,-0.1 -0.997 24.7-121.1-126.0 126.8 -12.6 44.7 -4.3 86 120 A P E -J 105 0B 49 0, 0.0 2,-0.3 0, 0.0 19,-0.2 -0.411 27.2-144.0 -66.6 143.7 -11.0 42.3 -6.8 87 121 A L > - 0 0 58 17,-2.2 3,-2.1 4,-0.1 17,-0.3 -0.803 53.1 -33.3-106.7 150.9 -11.5 43.3 -10.5 88 122 A D T 3 S- 0 0 114 -2,-0.3 15,-0.0 1,-0.3 0, 0.0 -0.042 130.6 -6.9 43.4-128.4 -12.1 40.8 -13.4 89 123 A G T 3 S+ 0 0 74 2,-0.0 -1,-0.3 -3,-0.0 -2,-0.0 0.062 97.3 136.7 -84.7 25.7 -10.3 37.5 -12.9 90 124 A S < - 0 0 20 -3,-2.1 13,-0.1 14,-0.2 12,-0.0 -0.538 53.8-120.9 -77.1 136.4 -8.4 38.7 -9.7 91 125 A P - 0 0 21 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 -0.293 27.8-105.2 -71.2 157.9 -8.3 36.3 -6.8 92 126 A K > - 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