==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 07-AUG-12 4GHB . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES UNIFORMIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 512 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24222.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 358 69.9 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 . 249 48.6 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 . 14 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 . 47 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 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 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 . 2 3 0 3 10 4 1 8 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 56 A T 0 0 138 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -4.2 33.4 14.8 17.5 2 57 A Y - 0 0 85 84,-0.1 84,-0.2 80,-0.0 85,-0.1 -0.981 360.0-104.4-159.9 149.4 36.7 16.6 18.6 3 58 A P - 0 0 6 0, 0.0 2,-0.3 0, 0.0 191,-0.0 -0.367 40.0-158.3 -70.5 152.5 40.5 16.0 19.0 4 59 A T - 0 0 55 32,-0.1 32,-0.2 189,-0.1 31,-0.1 -0.948 18.8-147.1-134.9 154.3 41.8 15.6 22.6 5 60 A T - 0 0 4 30,-1.7 166,-0.0 -2,-0.3 186,-0.0 -0.985 18.2-142.4-116.7 124.8 45.1 15.9 24.6 6 61 A P S S+ 0 0 88 0, 0.0 2,-0.3 0, 0.0 165,-0.0 0.152 76.5 78.3 -81.1 26.8 45.4 13.4 27.5 7 62 A F - 0 0 22 28,-0.1 -2,-0.2 1,-0.1 3,-0.1 -0.846 68.7-144.9-127.1 160.4 47.1 16.0 29.8 8 63 A S S S+ 0 0 66 248,-2.1 23,-2.3 1,-0.3 2,-0.3 0.625 87.3 25.0 -97.9 -18.3 45.8 18.9 31.8 9 64 A K E -A 30 0A 53 247,-2.1 247,-2.3 21,-0.2 2,-0.4 -0.983 49.7-174.2-151.9 135.3 48.9 21.1 31.2 10 65 A I E -AB 29 255A 0 19,-2.6 19,-2.8 -2,-0.3 2,-0.4 -0.977 23.1-179.4-126.1 110.1 51.6 21.5 28.6 11 66 A E E -AB 28 254A 29 243,-2.6 243,-2.3 -2,-0.4 2,-0.4 -0.972 12.9-165.3-121.3 129.4 54.2 24.1 29.7 12 67 A L E -AB 27 253A 8 15,-2.7 15,-2.6 -2,-0.4 2,-0.4 -0.919 7.2-174.7-110.4 132.2 57.3 25.3 27.9 13 68 A K E +AB 26 252A 95 239,-2.3 239,-3.0 -2,-0.4 2,-0.3 -0.997 8.0 170.3-128.8 134.5 60.1 27.2 29.7 14 69 A E E -AB 25 251A 19 11,-2.2 11,-3.0 -2,-0.4 2,-0.6 -0.996 30.6-142.7-147.2 138.8 63.1 28.7 28.0 15 70 A V E -A 24 0A 80 235,-0.5 2,-0.7 -2,-0.3 235,-0.3 -0.901 23.4-154.4 -97.5 118.3 66.0 31.1 28.9 16 71 A I E +A 23 0A 50 7,-3.6 7,-1.9 -2,-0.6 3,-0.3 -0.888 18.7 176.3 -96.9 115.1 66.6 33.2 25.8 17 72 A E + 0 0 148 -2,-0.7 -1,-0.1 5,-0.2 7,-0.0 0.517 60.9 91.2 -95.5 -6.0 70.2 34.5 25.8 18 73 A S S S+ 0 0 91 5,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.797 76.0 73.4 -56.2 -39.7 69.9 36.2 22.3 19 74 A D S S- 0 0 20 -3,-0.3 4,-0.0 2,-0.2 0, 0.0 -0.164 100.5 -99.4 -74.5 168.9 68.8 39.6 23.9 20 75 A A S S+ 0 0 47 2,-0.1 -1,-0.1 1,-0.1 485,-0.0 0.931 116.3 25.9 -51.9 -52.7 71.2 42.1 25.9 21 76 A Q S S- 0 0 34 26,-0.1 2,-0.2 1,-0.0 -2,-0.2 -0.846 107.1 -95.7-109.2 143.9 69.8 40.7 29.2 22 77 A P - 0 0 74 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.475 36.9-152.5 -69.7 131.4 68.5 37.0 29.4 23 78 A V E -A 16 0A 16 -7,-1.9 -7,-3.6 -2,-0.2 2,-0.6 -0.863 4.2-146.1 -98.3 133.5 64.7 36.7 29.0 24 79 A T E -AC 15 45A 50 21,-2.7 21,-2.1 -2,-0.4 2,-0.4 -0.922 19.3-165.7 -98.3 121.7 62.8 33.8 30.6 25 80 A A E -AC 14 44A 5 -11,-3.0 -11,-2.2 -2,-0.6 2,-0.4 -0.902 6.6-172.1-110.5 135.5 59.8 32.8 28.4 26 81 A T E -AC 13 43A 12 17,-2.4 17,-2.8 -2,-0.4 2,-0.5 -0.996 6.3-171.6-125.6 132.6 57.0 30.6 29.6 27 82 A H E -AC 12 42A 56 -15,-2.6 -15,-2.7 -2,-0.4 2,-0.5 -0.992 10.8-172.5-123.0 111.1 54.1 29.2 27.4 28 83 A T E -AC 11 41A 13 13,-2.7 13,-2.1 -2,-0.5 2,-0.5 -0.959 6.4-171.9-115.9 120.0 51.4 27.4 29.4 29 84 A Y E -AC 10 40A 7 -19,-2.8 -19,-2.6 -2,-0.5 2,-0.4 -0.937 9.6-161.7-108.9 122.1 48.6 25.4 27.6 30 85 A L E -AC 9 39A 72 9,-2.5 8,-2.8 -2,-0.5 9,-1.4 -0.899 4.0-166.7-111.2 137.4 45.7 24.2 29.8 31 86 A Y E - C 0 37A 12 -23,-2.3 6,-0.2 -2,-0.4 2,-0.1 -0.934 17.0-126.7-121.5 145.8 43.2 21.5 28.9 32 87 A N > - 0 0 62 4,-2.4 3,-1.7 -2,-0.3 -25,-0.1 -0.284 40.6 -92.0 -81.0 174.7 40.0 20.5 30.5 33 88 A S T 3 S+ 0 0 139 1,-0.3 -1,-0.1 2,-0.1 -25,-0.0 0.711 127.8 60.2 -61.4 -22.5 39.1 16.9 31.7 34 89 A A T 3 S- 0 0 42 2,-0.1 -1,-0.3 -30,-0.0 -3,-0.0 0.707 119.8-112.4 -76.6 -19.3 37.5 16.3 28.2 35 90 A G S < S+ 0 0 4 -3,-1.7 -30,-1.7 1,-0.3 2,-0.4 0.534 72.1 133.8 98.3 12.9 41.0 17.0 26.7 36 91 A R - 0 0 41 -32,-0.2 -4,-2.4 1,-0.0 -1,-0.3 -0.769 63.3-109.1 -94.6 138.9 40.1 20.3 24.9 37 92 A L E +C 31 0A 0 155,-0.4 -6,-0.3 -2,-0.4 3,-0.1 -0.487 37.3 174.9 -66.0 129.1 42.4 23.3 25.2 38 93 A T E - 0 0 55 -8,-2.8 23,-2.3 1,-0.3 2,-0.3 0.607 56.7 -7.9-110.5 -22.3 40.7 26.0 27.3 39 94 A G E -CD 30 60A 10 -9,-1.4 -9,-2.5 21,-0.2 2,-0.3 -0.989 45.9-143.4-172.0 163.3 43.5 28.6 27.6 40 95 A Y E -CD 29 59A 8 19,-2.3 19,-3.2 -2,-0.3 2,-0.4 -0.997 8.9-165.2-135.4 137.6 47.0 29.8 27.0 41 96 A T E -CD 28 58A 24 -13,-2.1 -13,-2.7 -2,-0.3 2,-0.4 -0.997 6.4-164.0-125.3 121.2 49.2 32.0 29.2 42 97 A G E -CD 27 57A 0 15,-2.6 15,-2.7 -2,-0.4 2,-0.4 -0.903 12.3-173.9-103.1 130.0 52.4 33.6 27.7 43 98 A K E -CD 26 56A 84 -17,-2.8 -17,-2.4 -2,-0.4 2,-0.4 -0.989 12.4-175.6-130.4 141.2 55.0 35.0 30.2 44 99 A Q E -CD 25 55A 62 11,-2.5 11,-2.7 -2,-0.4 2,-0.4 -0.999 4.5-170.6-133.8 131.4 58.2 37.0 29.8 45 100 A S E +CD 24 54A 34 -21,-2.1 -21,-2.7 -2,-0.4 2,-0.3 -0.993 28.7 118.3-126.8 128.5 60.5 37.9 32.6 46 101 A F E - D 0 53A 27 7,-2.1 7,-3.9 -2,-0.4 2,-0.4 -0.947 55.9-100.9-169.9 171.6 63.5 40.3 32.2 47 102 A T E - D 0 52A 73 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.896 26.7-174.3-112.6 137.9 64.8 43.6 33.4 48 103 A A E > - D 0 51A 6 3,-2.8 3,-0.8 -2,-0.4 2,-0.4 -0.957 68.3 -36.4-135.0 109.4 64.5 46.8 31.3 49 104 A G T 3 S- 0 0 50 -2,-0.4 -2,-0.0 1,-0.2 443,-0.0 -0.610 123.7 -32.5 75.4-122.8 66.3 49.9 32.8 50 105 A D T 3 S+ 0 0 102 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.2 0.763 120.5 98.2 -92.8 -30.6 65.9 49.6 36.6 51 106 A E E < -D 48 0A 114 -3,-0.8 -3,-2.8 -4,-0.1 2,-0.4 -0.407 67.8-142.2 -67.7 119.8 62.4 47.9 36.3 52 107 A L E -D 47 0A 109 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.3 -0.650 28.7-151.2 -76.4 127.4 62.1 44.1 36.6 53 108 A F E -D 46 0A 20 -7,-3.9 -7,-2.1 -2,-0.4 2,-0.4 -0.911 25.1-179.7-112.1 138.4 59.5 43.2 34.1 54 109 A E E -D 45 0A 138 -2,-0.4 2,-0.5 -9,-0.2 -9,-0.2 -0.893 10.9-168.1-133.3 98.6 57.0 40.4 34.1 55 110 A I E +D 44 0A 43 -11,-2.7 -11,-2.5 -2,-0.4 2,-0.4 -0.802 10.3 177.5 -90.6 125.2 54.7 40.4 31.0 56 111 A E E +D 43 0A 102 -2,-0.5 2,-0.4 -13,-0.2 -13,-0.2 -0.963 3.4 178.0-133.0 118.0 51.8 37.9 31.4 57 112 A N E -D 42 0A 18 -15,-2.7 -15,-2.6 -2,-0.4 2,-0.4 -0.972 11.8-155.0-126.1 136.4 49.0 37.5 28.7 58 113 A T E -D 41 0A 51 -2,-0.4 2,-0.4 -17,-0.2 -17,-0.2 -0.917 3.6-165.9-115.2 131.5 46.1 35.1 28.8 59 114 A T E -D 40 0A 7 -19,-3.2 -19,-2.3 -2,-0.4 2,-0.3 -0.913 12.8-150.0-111.1 135.0 44.1 33.8 25.8 60 115 A T E -DE 39 71A 77 11,-2.8 11,-2.2 -2,-0.4 2,-0.5 -0.818 1.1-153.1-106.2 144.8 40.8 32.0 26.3 61 116 A V E - E 0 70A 11 -23,-2.3 2,-0.4 -2,-0.3 9,-0.2 -0.989 13.5-175.3-121.9 121.9 39.3 29.2 24.1 62 117 A E E - E 0 69A 101 7,-2.6 7,-2.9 -2,-0.5 2,-0.4 -0.952 12.8-145.8-118.0 137.9 35.5 28.8 24.0 63 118 A Y E + E 0 68A 49 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.895 22.7 165.0-110.3 134.8 33.7 26.0 22.1 64 119 A K E > - E 0 67A 105 3,-2.1 3,-2.1 -2,-0.4 2,-0.2 -0.729 58.6 -51.4-128.6 176.6 30.3 26.4 20.3 65 120 A D T 3 S- 0 0 145 1,-0.3 3,-0.1 -2,-0.2 17,-0.1 -0.444 127.0 -15.9 -60.7 117.3 28.5 24.2 17.7 66 121 A H T 3 S+ 0 0 74 -2,-0.2 16,-2.4 1,-0.1 2,-0.3 0.756 123.6 102.9 53.5 37.6 31.2 23.6 15.0 67 122 A Q E < -EF 64 81A 58 -3,-2.1 -3,-2.1 14,-0.3 2,-0.4 -0.999 50.9-167.7-148.6 147.1 33.3 26.6 16.4 68 123 A A E -EF 63 80A 0 12,-2.1 12,-3.3 -2,-0.3 2,-0.6 -0.998 18.1-163.4-129.2 116.4 36.4 27.4 18.5 69 124 A V E -EF 62 79A 9 -7,-2.9 -7,-2.6 -2,-0.4 2,-0.6 -0.966 1.6-164.5-109.7 116.3 36.5 31.1 19.5 70 125 A I E -EF 61 78A 10 8,-3.1 8,-2.9 -2,-0.6 2,-0.4 -0.923 9.0-176.5-106.7 116.4 40.0 32.2 20.7 71 126 A T E -EF 60 77A 49 -11,-2.2 -11,-2.8 -2,-0.6 6,-0.2 -0.964 4.3-166.2-118.0 130.5 40.0 35.6 22.5 72 127 A D > - 0 0 24 4,-1.7 3,-1.0 -2,-0.4 -13,-0.2 -0.452 38.3-101.6-104.0-178.6 43.1 37.4 23.8 73 128 A E T 3 S+ 0 0 115 1,-0.2 354,-0.1 -15,-0.2 -14,-0.1 0.669 118.4 64.9 -76.3 -20.7 43.4 40.4 26.3 74 129 A A T 3 S- 0 0 16 351,-0.1 -1,-0.2 2,-0.1 354,-0.1 0.393 119.9-107.7 -79.8 -1.7 44.0 42.8 23.4 75 130 A G < + 0 0 51 -3,-1.0 2,-0.4 1,-0.3 -2,-0.1 0.614 66.8 150.6 84.6 11.9 40.4 42.1 22.2 76 131 A T - 0 0 3 349,-0.1 -4,-1.7 2,-0.0 2,-0.5 -0.666 29.6-160.1 -76.5 133.8 41.3 40.0 19.2 77 132 A V E -F 71 0A 56 -2,-0.4 2,-0.6 -6,-0.2 -6,-0.2 -0.980 6.2-171.3-117.2 112.7 38.5 37.4 18.4 78 133 A S E -F 70 0A 18 -8,-2.9 -8,-3.1 -2,-0.5 2,-0.6 -0.947 7.2-160.4-108.6 117.2 39.7 34.5 16.2 79 134 A T E -FG 69 92A 31 13,-2.8 13,-2.0 -2,-0.6 2,-0.5 -0.915 3.2-164.9-107.8 112.7 36.9 32.3 15.1 80 135 A Y E -FG 68 91A 7 -12,-3.3 -12,-2.1 -2,-0.6 2,-0.5 -0.868 12.7-144.8 -96.3 122.1 37.8 28.8 13.9 81 136 A T E -FG 67 90A 59 9,-2.5 8,-3.0 -2,-0.5 9,-1.2 -0.807 23.5-151.3 -86.1 122.8 35.0 27.0 11.9 82 137 A L E - 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