==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-SEP-03 1R0U . COMPND 2 MOLECULE: PROTEIN YWIB; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.OSIPIUK,X.XU,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIAK,MIDWEST CE . 142 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8737.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 81.7 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 . 93 65.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 6 4.2 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 . 16 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 0 0 0 0 2 0 2 2 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -6 A G 0 0 97 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -85.5 50.7 21.5 3.6 2 -5 A F > - 0 0 178 1,-0.2 3,-1.5 2,-0.1 4,-0.5 -0.293 360.0-128.7 -51.0 132.8 47.7 21.6 1.3 3 -4 A Q G >> S+ 0 0 105 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.806 106.1 70.4 -55.5 -30.1 44.6 20.8 3.4 4 -3 A S G >4 S+ 0 0 76 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.822 90.6 61.3 -57.1 -31.7 43.7 18.2 0.7 5 -2 A N G <4 S+ 0 0 122 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.776 102.8 49.5 -64.9 -30.2 46.7 16.1 1.9 6 -1 A A G <4 S+ 0 0 34 -3,-1.3 36,-0.4 -4,-0.5 2,-0.3 0.475 83.2 116.4 -90.6 -5.1 45.2 15.7 5.4 7 1 A M << - 0 0 49 -3,-0.9 2,-0.3 -4,-0.5 34,-0.2 -0.530 43.6-175.6 -70.2 124.4 41.7 14.6 4.1 8 2 A K E +A 40 0A 134 32,-2.4 32,-2.6 -2,-0.3 3,-0.1 -0.868 59.9 13.0-118.1 154.0 40.9 11.1 5.2 9 3 A Q E S- 0 0 109 -2,-0.3 -1,-0.1 1,-0.2 29,-0.1 0.756 76.1-169.2 53.8 33.3 37.8 8.9 4.3 10 4 A E E + 0 0 116 -3,-0.2 29,-0.2 30,-0.1 -1,-0.2 -0.325 10.9 177.4 -55.0 126.7 36.8 11.3 1.4 11 5 A T E -A 38 0A 26 27,-2.7 27,-2.8 -3,-0.1 2,-0.2 -0.997 32.0-123.5-141.8 124.9 33.3 10.1 0.4 12 6 A P E -A 37 0A 70 0, 0.0 130,-2.1 0, 0.0 2,-0.3 -0.534 41.6-174.9 -66.7 136.8 30.9 11.5 -2.2 13 7 A I E -AB 36 141A 0 23,-2.4 23,-2.2 128,-0.3 2,-0.4 -0.893 30.1-131.6-132.2 158.4 27.6 12.3 -0.5 14 8 A T E -AB 35 140A 53 126,-2.5 126,-1.9 -2,-0.3 2,-0.3 -0.971 33.9-155.2-104.9 131.3 24.1 13.5 -1.2 15 9 A L E -AB 34 139A 2 19,-3.0 19,-1.6 -2,-0.4 2,-0.4 -0.830 19.3-171.6-115.8 147.4 23.0 16.3 1.1 16 10 A H E -AB 33 138A 36 122,-2.8 122,-2.8 -2,-0.3 2,-0.5 -0.991 8.4-171.7-134.0 120.6 19.7 17.6 2.4 17 11 A V E -AB 32 137A 8 15,-2.7 15,-2.1 -2,-0.4 2,-0.4 -0.972 8.4-178.9-119.1 121.8 19.6 20.9 4.4 18 12 A K E -AB 31 136A 82 118,-2.7 118,-2.9 -2,-0.5 2,-0.4 -0.976 6.1-173.0-128.6 130.6 16.4 21.8 6.0 19 13 A S E -AB 30 135A 13 11,-3.5 11,-2.7 -2,-0.4 2,-0.5 -0.989 12.7-160.6-126.5 131.1 15.5 24.9 8.0 20 14 A V E -AB 29 134A 60 114,-2.5 114,-2.3 -2,-0.4 2,-0.4 -0.940 25.3-173.3-100.8 124.8 12.4 25.7 10.0 21 15 A I E -AB 28 133A 33 7,-2.6 7,-2.1 -2,-0.5 2,-0.4 -0.971 19.7-170.9-127.8 137.0 12.4 29.5 10.6 22 16 A E E +AB 27 132A 91 110,-2.5 110,-1.9 -2,-0.4 2,-0.4 -0.997 13.1 171.4-123.6 128.6 10.1 31.8 12.6 23 17 A D E > -A 26 0A 63 3,-2.3 3,-2.5 -2,-0.4 -2,-0.0 -0.936 65.8 -39.9-143.6 111.6 10.5 35.5 12.1 24 18 A D T 3 S- 0 0 160 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.830 127.3 -32.4 37.6 58.2 8.1 38.1 13.6 25 19 A G T 3 S+ 0 0 88 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.107 115.8 108.7 94.8 -20.4 4.9 36.1 12.9 26 20 A N E < -A 23 0A 100 -3,-2.5 -3,-2.3 2,-0.0 2,-0.4 -0.682 47.6-164.2 -93.5 142.1 6.1 34.4 9.7 27 21 A Q E +A 22 0A 134 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.989 13.8 168.3-126.5 137.4 6.8 30.7 9.5 28 22 A E E -A 21 0A 87 -7,-2.1 -7,-2.6 -2,-0.4 2,-0.5 -0.992 25.6-152.7-145.7 146.2 8.7 29.0 6.7 29 23 A V E -A 20 0A 76 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.998 21.8-178.1-118.3 126.7 10.4 25.7 5.9 30 24 A I E +A 19 0A 82 -11,-2.7 -11,-3.5 -2,-0.5 2,-0.4 -0.973 4.6 170.7-124.6 134.1 13.2 25.9 3.4 31 25 A E E -A 18 0A 78 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.996 10.1-171.5-142.9 149.1 15.2 22.9 2.2 32 26 A F E -A 17 0A 60 -15,-2.1 -15,-2.7 -2,-0.4 2,-0.4 -0.970 6.9-156.0-138.4 158.9 17.8 22.2 -0.4 33 27 A R E +A 16 0A 164 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.990 27.6 133.4-134.0 138.9 19.4 19.2 -1.9 34 28 A T E -A 15 0A 48 -19,-1.6 -19,-3.0 -2,-0.4 2,-0.2 -0.930 45.4 -96.6-163.5-178.4 22.8 18.9 -3.7 35 29 A T E +A 14 0A 76 -2,-0.3 15,-0.5 -21,-0.2 2,-0.3 -0.723 47.6 130.3-109.6 167.8 25.9 16.7 -3.8 36 30 A G E -AC 13 49A 8 -23,-2.2 -23,-2.4 107,-0.3 2,-0.4 -0.873 44.8 -65.5-178.6-151.2 29.2 17.1 -2.1 37 31 A F E -AC 12 48A 85 11,-2.5 11,-2.4 -2,-0.3 2,-0.4 -0.983 17.5-155.3-137.0 141.8 31.8 15.4 0.0 38 32 A Y E +AC 11 47A 12 -27,-2.8 -27,-2.7 -2,-0.4 2,-0.3 -0.916 31.9 153.3-102.6 137.7 32.3 14.0 3.5 39 33 A Y E - C 0 46A 11 7,-2.1 7,-2.9 -2,-0.4 2,-0.4 -0.977 34.4-129.0-155.9 167.4 35.9 13.9 4.9 40 34 A V E -AC 8 45A 27 -32,-2.6 -32,-2.4 -2,-0.3 2,-0.4 -0.961 18.1-179.6-121.7 134.3 37.9 13.9 8.1 41 35 A K E > S- C 0 44A 26 3,-2.4 3,-1.6 -2,-0.4 -34,-0.1 -0.990 77.1 -12.4-131.2 129.0 40.9 16.1 9.0 42 36 A Q T 3 S- 0 0 178 -2,-0.4 -1,-0.1 -36,-0.4 3,-0.1 0.894 129.4 -55.6 47.6 45.2 42.6 15.9 12.4 43 37 A N T 3 S+ 0 0 154 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.709 114.0 114.0 62.4 25.9 39.8 13.7 13.6 44 38 A K E < -C 41 0A 78 -3,-1.6 -3,-2.4 21,-0.0 2,-0.3 -0.972 65.3-119.7-121.6 146.7 37.0 16.2 12.8 45 39 A V E -CD 40 64A 21 19,-0.6 19,-2.6 -2,-0.4 2,-0.4 -0.639 27.6-172.9 -86.0 136.3 34.3 15.8 10.2 46 40 A Y E -CD 39 63A 19 -7,-2.9 -7,-2.1 -2,-0.3 2,-0.4 -0.969 9.5-163.5-124.6 143.1 33.9 18.2 7.3 47 41 A L E -CD 38 62A 0 15,-2.0 15,-2.8 -2,-0.4 2,-0.4 -0.979 11.4-169.4-119.3 139.0 31.2 18.4 4.7 48 42 A S E +CD 37 61A 14 -11,-2.4 -11,-2.5 -2,-0.4 2,-0.3 -0.996 21.3 130.4-132.6 139.5 31.8 20.4 1.5 49 43 A Y E -CD 36 60A 9 11,-2.3 11,-2.9 -2,-0.4 2,-0.3 -0.926 44.6-107.8-165.6 177.0 29.3 21.4 -1.2 50 44 A Y E - D 0 59A 109 -15,-0.5 2,-0.3 -2,-0.3 9,-0.2 -0.932 25.6-170.9-119.6 150.3 28.1 24.4 -3.2 51 45 A E E - D 0 58A 42 7,-2.6 7,-2.8 -2,-0.3 2,-0.5 -0.940 22.5-115.5-135.8 162.5 24.9 26.3 -3.0 52 46 A E E - D 0 57A 136 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.843 25.7-176.7-106.7 131.0 23.3 28.9 -5.1 53 47 A H E > - D 0 56A 49 3,-2.5 3,-1.7 -2,-0.5 23,-0.0 -0.768 44.6-103.9-110.8 162.1 22.6 32.5 -4.0 54 48 A D T 3 S+ 0 0 165 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.881 125.4 49.1 -51.5 -36.7 20.8 35.1 -6.1 55 49 A L T 3 S- 0 0 97 1,-0.2 2,-0.3 21,-0.1 -1,-0.3 0.425 124.0 -91.6 -90.9 1.1 24.2 36.7 -6.7 56 50 A G E < S+D 53 0A 25 -3,-1.7 -3,-2.5 2,-0.0 -1,-0.2 -0.847 70.7 1.8 130.6-157.5 25.8 33.4 -7.8 57 51 A K E -D 52 0A 132 -2,-0.3 19,-2.3 -5,-0.2 2,-0.4 -0.402 48.2-167.0 -77.0 138.5 27.7 30.3 -6.5 58 52 A V E -DE 51 75A 3 -7,-2.8 -7,-2.6 17,-0.2 2,-0.5 -0.969 11.8-146.0-120.7 131.9 28.6 29.9 -2.9 59 53 A K E -DE 50 74A 71 15,-2.6 15,-2.2 -2,-0.4 2,-0.4 -0.905 20.1-164.4 -94.3 134.3 31.1 27.3 -1.6 60 54 A T E -DE 49 73A 0 -11,-2.9 -11,-2.3 -2,-0.5 2,-0.4 -0.974 14.2-178.3-127.5 124.3 30.2 25.8 1.8 61 55 A I E -DE 48 72A 38 11,-2.1 11,-3.1 -2,-0.4 2,-0.5 -0.998 10.9-160.5-119.9 128.0 32.4 23.9 4.2 62 56 A V E -DE 47 71A 0 -15,-2.8 -15,-2.0 -2,-0.4 2,-0.5 -0.939 5.0-167.0-108.9 126.2 30.9 22.6 7.4 63 57 A K E -DE 46 70A 59 7,-2.9 7,-2.6 -2,-0.5 2,-0.5 -0.974 6.3-155.6-117.9 124.2 33.3 21.7 10.3 64 58 A V E +DE 45 69A 11 -19,-2.6 -19,-0.6 -2,-0.5 2,-0.2 -0.867 21.0 159.7-107.4 127.1 31.9 19.8 13.2 65 59 A S E > - 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0 0 45 -3,-2.0 19,-2.1 19,-0.4 -3,-0.4 -0.916 68.1-127.5-142.4 164.6 26.9 31.2 23.5 88 82 A S E - H 0 105A 65 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.906 22.3-171.7-115.0 142.8 26.6 34.0 20.9 89 83 A T E - H 0 104A 21 15,-2.3 15,-2.8 -2,-0.4 2,-0.4 -0.936 12.3-144.4-129.6 156.2 29.1 34.9 18.2 90 84 A I E + H 0 103A 102 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.969 22.7 166.6-119.4 138.5 29.4 37.7 15.7 91 85 A A E - H 0 102A 20 11,-2.0 11,-2.5 -2,-0.4 2,-0.3 -0.994 36.7-106.5-146.4 151.5 30.7 37.4 12.1 92 86 A K E - H 0 101A 95 -2,-0.3 2,-0.7 9,-0.2 -12,-0.4 -0.615 19.1-151.5 -78.7 133.0 30.7 39.6 9.0 93 87 A Y E - H 0 100A 57 7,-2.4 7,-1.7 -2,-0.3 2,-0.5 -0.946 28.5-168.5 -99.8 109.4 28.3 38.7 6.2 94 88 A K E +GH 78 99A 78 -16,-2.7 -16,-2.6 -2,-0.7 5,-0.2 -0.893 17.6 174.6-116.0 130.1 30.2 40.0 3.2 95 89 A M E > - H 0 98A 41 3,-3.2 3,-1.1 -2,-0.5 -18,-0.1 -0.676 50.7 -92.8-118.3 176.8 29.1 40.5 -0.4 96 90 A S T 3 S+ 0 0 119 -20,-0.3 3,-0.1 1,-0.2 -19,-0.1 0.816 125.2 40.7 -62.5 -26.5 30.9 42.1 -3.3 97 91 A F T 3 S- 0 0 153 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.329 126.4 -44.9-109.5 7.2 29.4 45.5 -2.5 98 92 A G E < -H 95 0A 37 -3,-1.1 -3,-3.2 2,-0.0 2,-0.3 -0.949 51.8-108.9 157.0-170.7 29.5 45.6 1.3 99 93 A E E -H 94 0A 113 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.962 9.3-164.7-151.6 161.5 29.0 43.9 4.6 100 94 A L E -H 93 0A 91 -7,-1.7 -7,-2.4 -2,-0.3 2,-0.3 -0.971 29.1-116.7-148.8 134.7 26.9 43.6 7.8 101 95 A E E -H 92 0A 112 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.551 29.1-163.3 -71.6 132.7 27.6 41.9 11.2 102 96 A L E -H 91 0A 27 -11,-2.5 -11,-2.0 -2,-0.3 2,-0.5 -0.966 8.0-144.3-117.2 137.9 25.3 39.1 12.1 103 97 A K E -HI 90 127A 80 24,-2.4 24,-1.4 -2,-0.4 2,-0.5 -0.878 10.4-163.6-104.8 132.0 24.9 37.6 15.6 104 98 A T E -HI 89 126A 2 -15,-2.8 -15,-2.3 -2,-0.5 2,-0.6 -0.965 4.5-171.8-119.3 117.8 24.3 33.9 16.1 105 99 A S E -HI 88 125A 14 20,-3.0 20,-2.8 -2,-0.5 2,-0.4 -0.941 15.0-154.3-111.9 110.1 23.0 32.7 19.5 106 100 A T E + I 0 124A 1 -19,-2.1 -20,-2.0 -2,-0.6 -19,-0.4 -0.718 20.0 178.4 -96.1 130.7 23.1 28.9 19.6 107 101 A K E - 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