==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-NOV-00 1G9Q . COMPND 2 MOLECULE: HYPOTHETICAL 23.7 KDA PROTEIN IN ICC-TOLC . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.B GABELLI,M.A.BIANCHET,M.J.BESSMAN,L.M.AMZEL . 407 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17607.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 296 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 101 24.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 46 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 18.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 2 0 0 0 2 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 3 1 3 3 1 1 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 2 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 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 M 0 0 235 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.3 18.3 -2.8 9.8 2 2 A L - 0 0 161 1,-0.1 3,-0.1 0, 0.0 0, 0.0 -0.331 360.0-101.6 -67.0 152.1 21.0 -1.8 12.3 3 3 A K - 0 0 192 1,-0.1 -1,-0.1 -2,-0.0 0, 0.0 -0.462 45.2 -95.5 -75.3 150.2 20.3 1.3 14.4 4 4 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.151 44.2 -97.3 -60.7 159.0 22.1 4.5 13.3 5 5 A D - 0 0 138 1,-0.1 2,-0.2 -3,-0.1 0, 0.0 -0.431 40.5-109.1 -76.2 156.3 25.3 5.5 15.0 6 6 A N - 0 0 151 -2,-0.1 -1,-0.1 2,-0.0 3,-0.0 -0.520 34.6-168.2 -82.0 152.9 25.1 8.1 17.8 7 7 A L - 0 0 64 -2,-0.2 5,-0.1 2,-0.1 377,-0.0 -0.991 27.8-144.7-141.6 146.5 26.5 11.6 17.2 8 8 A P S S+ 0 0 32 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 0.520 88.6 58.3 -88.9 -0.7 27.2 14.4 19.6 9 9 A V S S- 0 0 14 2,-0.1 -2,-0.1 281,-0.1 283,-0.1 -0.621 90.7-110.3-117.9 177.4 26.0 16.9 16.9 10 10 A T S S+ 0 0 50 -2,-0.2 2,-0.3 357,-0.1 -1,-0.1 0.846 90.4 44.4 -80.9 -37.8 22.8 17.4 14.9 11 11 A F - 0 0 25 28,-0.1 279,-0.3 2,-0.0 2,-0.2 -0.785 58.9-162.9-116.6 157.8 23.8 16.3 11.4 12 12 A G > - 0 0 13 -2,-0.3 3,-2.1 276,-0.1 4,-0.2 -0.550 48.4 -77.9-120.2-173.8 25.8 13.5 9.8 13 13 A K G > S+ 0 0 67 274,-0.6 3,-1.1 1,-0.3 275,-0.1 0.727 124.4 64.6 -62.1 -22.2 27.4 12.9 6.4 14 14 A N G 3 S+ 0 0 167 1,-0.2 -1,-0.3 3,-0.1 274,-0.0 0.507 95.6 60.7 -77.8 -4.2 24.0 12.1 4.8 15 15 A D G < S+ 0 0 51 -3,-2.1 24,-2.3 24,-0.1 2,-0.3 0.366 102.4 57.1-101.4 1.2 23.0 15.7 5.6 16 16 A V E < -A 38 0A 12 -3,-1.1 2,-0.4 22,-0.2 22,-0.2 -0.982 64.0-160.9-133.4 144.0 25.8 17.2 3.4 17 17 A E E -A 37 0A 115 20,-2.6 20,-2.3 -2,-0.3 2,-0.7 -0.994 12.2-144.1-128.8 127.5 26.6 16.7 -0.3 18 18 A I E -A 36 0A 44 -2,-0.4 18,-0.3 18,-0.2 3,-0.1 -0.819 8.4-168.1 -93.9 116.3 29.9 17.5 -1.8 19 19 A I E - 0 0 58 16,-2.0 2,-0.3 -2,-0.7 17,-0.2 0.898 61.7 -54.8 -69.3 -42.4 29.5 18.9 -5.3 20 20 A A E -A 35 0A 41 15,-1.5 15,-2.5 2,-0.0 2,-0.4 -0.962 38.0-117.6 175.0 170.8 33.2 18.6 -6.0 21 21 A R E -A 34 0A 99 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.989 28.0-168.8-130.7 117.6 36.8 19.4 -5.1 22 22 A E E -A 33 0A 81 11,-1.9 11,-2.6 -2,-0.4 2,-0.5 -0.916 25.1-118.3-111.5 137.5 38.8 21.4 -7.6 23 23 A T E +A 32 0A 90 -2,-0.4 9,-0.2 9,-0.2 3,-0.2 -0.612 27.2 179.3 -78.0 119.8 42.6 21.9 -7.2 24 24 A L E S+ 0 0 43 7,-2.2 2,-0.3 -2,-0.5 8,-0.2 0.879 77.8 0.0 -81.7 -44.0 43.6 25.5 -6.7 25 25 A Y E -A 31 0A 64 6,-1.8 6,-1.9 200,-0.1 2,-0.4 -0.987 69.6-148.7-148.5 138.2 47.3 24.7 -6.5 26 26 A R + 0 0 177 -2,-0.3 2,-0.2 4,-0.2 4,-0.2 -0.936 37.7 121.1-115.5 130.5 49.1 21.3 -6.7 27 27 A G S S- 0 0 19 -2,-0.4 -2,-0.0 225,-0.0 0, 0.0 -0.798 84.7 -69.1-159.5-167.5 52.3 20.4 -4.9 28 28 A F S S+ 0 0 159 -2,-0.2 2,-0.4 1,-0.1 -2,-0.0 0.809 137.7 42.0 -66.7 -23.0 53.3 17.7 -2.4 29 29 A F S S- 0 0 33 27,-0.0 2,-0.3 2,-0.0 27,-0.2 -0.958 92.1-160.9-116.2 135.6 51.0 19.8 -0.3 30 30 A S E - B 0 55A 23 25,-2.6 25,-3.5 -2,-0.4 2,-0.6 -0.881 22.3-144.7-126.9 156.9 47.9 21.1 -2.0 31 31 A L E +AB 25 54A 0 -6,-1.9 -7,-2.2 -2,-0.3 -6,-1.8 -0.970 30.5 179.5-116.8 111.0 45.2 23.7 -1.7 32 32 A D E -AB 23 53A 26 21,-2.6 21,-3.7 -2,-0.6 2,-0.6 -0.719 25.0-130.1-111.1 162.2 41.8 22.5 -2.9 33 33 A L E -AB 22 52A 12 -11,-2.6 -11,-1.9 -2,-0.3 2,-0.4 -0.943 16.2-152.8-117.3 112.8 38.4 24.1 -3.1 34 34 A Y E -AB 21 51A 0 17,-2.7 17,-2.4 -2,-0.6 2,-0.5 -0.730 8.3-166.7 -84.7 129.7 35.5 22.2 -1.6 35 35 A R E +AB 20 50A 51 -15,-2.5 -16,-2.0 -2,-0.4 -15,-1.5 -0.979 28.9 138.7-116.0 124.0 32.1 23.0 -3.2 36 36 A F E -AB 18 49A 4 13,-2.5 13,-2.8 -2,-0.5 2,-0.3 -0.986 41.6-140.5-162.1 168.6 29.1 21.7 -1.2 37 37 A R E +A 17 0A 96 -20,-2.3 -20,-2.6 -2,-0.3 2,-0.3 -0.919 23.2 178.5-131.8 157.3 25.6 22.1 0.2 38 38 A H E -A 16 0A 9 -2,-0.3 8,-2.4 -22,-0.2 -22,-0.2 -0.991 35.4 -88.9-157.8 158.0 24.3 21.0 3.6 39 39 A R B -D 45 0B 88 -24,-2.3 6,-0.3 -2,-0.3 2,-0.2 -0.421 40.9-139.7 -69.9 146.6 21.2 21.1 5.7 40 40 A L > - 0 0 2 4,-3.3 3,-1.8 -2,-0.1 -1,-0.0 -0.677 22.8-111.1-102.3 161.4 20.8 24.2 8.0 41 41 A F T 3 S+ 0 0 25 1,-0.3 315,-0.1 -2,-0.2 -1,-0.1 0.756 115.9 66.3 -64.0 -24.4 19.5 24.0 11.5 42 42 A N T 3 S- 0 0 37 315,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.367 122.1-106.0 -78.4 7.1 16.4 25.8 10.4 43 43 A G S < S+ 0 0 38 -3,-1.8 -2,-0.1 1,-0.3 2,-0.1 0.431 85.0 112.1 87.5 -3.7 15.6 22.7 8.4 44 44 A Q - 0 0 115 -5,-0.0 -4,-3.3 1,-0.0 2,-0.4 -0.351 67.0-111.7 -95.4-179.4 16.4 24.1 5.0 45 45 A M B -D 39 0B 128 -6,-0.3 -6,-0.2 -2,-0.1 -1,-0.0 -0.925 31.4-121.3-115.5 139.9 19.1 23.3 2.6 46 46 A S - 0 0 8 -8,-2.4 2,-0.2 -2,-0.4 3,-0.1 -0.115 17.6-113.8 -74.6 170.5 22.0 25.7 1.8 47 47 A H - 0 0 132 1,-0.2 -9,-0.2 -10,-0.1 -1,-0.1 -0.436 64.9 -60.2 -89.1 175.0 23.1 27.2 -1.5 48 48 A E - 0 0 63 -2,-0.2 2,-0.4 -11,-0.1 -11,-0.2 -0.345 58.2-162.7 -60.3 136.4 26.5 26.1 -2.7 49 49 A V E -B 36 0A 13 -13,-2.8 -13,-2.5 -3,-0.1 2,-0.4 -0.933 2.6-152.9-120.5 144.7 29.2 27.1 -0.2 50 50 A R E +B 35 0A 116 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.982 13.4 179.2-126.2 134.3 32.9 27.1 -1.2 51 51 A R E -B 34 0A 82 -17,-2.4 -17,-2.7 -2,-0.4 2,-0.6 -0.995 25.2-136.4-135.8 137.5 35.9 26.6 1.0 52 52 A E E -B 33 0A 25 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.2 -0.834 31.2-167.1 -92.6 123.2 39.7 26.6 0.3 53 53 A I E -B 32 0A 0 -21,-3.7 -21,-2.6 -2,-0.6 2,-0.7 -0.951 20.7-132.8-121.6 132.2 41.2 23.7 2.2 54 54 A F E -Bc 31 137A 2 82,-2.9 84,-1.6 -2,-0.4 2,-0.7 -0.701 20.7-162.7 -82.1 113.4 44.8 22.9 2.9 55 55 A E E +B 30 0A 38 -25,-3.5 -25,-2.6 -2,-0.7 3,-0.1 -0.896 31.8 142.9-100.3 115.5 45.5 19.2 2.1 56 56 A R - 0 0 37 -2,-0.7 -1,-0.1 1,-0.5 2,-0.1 0.168 56.8-112.0-140.9 14.8 48.7 18.2 3.7 57 57 A G - 0 0 29 41,-0.1 -1,-0.5 2,-0.0 2,-0.3 -0.395 42.7 -77.4 80.6-164.8 48.2 14.6 4.8 58 58 A H - 0 0 53 41,-0.4 41,-2.6 81,-0.2 2,-0.3 -0.935 37.4-132.8-137.7 156.9 48.0 13.6 8.5 59 59 A A E -Ef 98 141C 13 81,-1.7 83,-1.9 -2,-0.3 2,-0.4 -0.737 4.4-141.2-118.1 162.3 50.4 13.0 11.3 60 60 A A E -Ef 97 142C 0 37,-3.0 37,-2.0 -2,-0.3 2,-0.4 -0.950 23.8-161.6-114.5 134.3 51.3 10.6 14.1 61 61 A V E -Ef 96 143C 2 81,-3.3 83,-1.8 -2,-0.4 2,-0.5 -0.972 5.4-164.3-124.9 135.0 52.4 12.1 17.4 62 62 A L E -Ef 95 144C 0 33,-3.5 33,-1.6 -2,-0.4 83,-0.2 -0.970 9.5-155.6-123.0 127.4 54.3 10.4 20.3 63 63 A L E - f 0 145C 0 81,-3.7 83,-3.1 -2,-0.5 2,-0.9 -0.871 18.8-145.7 -98.9 105.0 54.7 11.7 23.8 64 64 A P E + f 0 146C 0 0, 0.0 9,-1.8 0, 0.0 2,-0.5 -0.626 26.1 177.6 -77.0 104.9 57.9 10.1 25.3 65 65 A F E -Gf 72 147C 0 81,-2.5 83,-2.1 -2,-0.9 7,-0.2 -0.936 25.9-163.2-118.0 125.8 57.2 9.5 29.0 66 66 A D E >> -G 71 0C 7 5,-2.5 5,-1.6 -2,-0.5 4,-0.8 -0.906 12.0-172.5-101.4 101.0 59.6 7.9 31.5 67 67 A P T 45S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 135,-0.1 0.792 79.2 51.3 -68.5 -28.5 57.1 7.1 34.3 68 68 A V T 45S+ 0 0 112 1,-0.2 81,-0.1 -3,-0.1 -2,-0.0 0.940 120.6 31.2 -76.2 -46.9 59.8 6.0 36.8 69 69 A R T 45S- 0 0 130 2,-0.1 -1,-0.2 100,-0.0 3,-0.1 0.504 104.1-131.9 -87.4 -2.8 62.0 9.0 36.5 70 70 A D T <5 + 0 0 48 -4,-0.8 100,-2.2 1,-0.2 101,-0.4 0.924 59.6 135.3 51.1 52.4 58.9 11.2 35.8 71 71 A E E < -GH 66 169C 34 -5,-1.6 -5,-2.5 98,-0.3 2,-0.4 -0.824 46.0-144.1-126.5 166.0 60.6 12.8 32.9 72 72 A V E -GH 65 168C 0 96,-3.6 96,-2.7 -2,-0.3 2,-0.7 -0.975 11.1-139.4-131.3 141.1 59.7 13.8 29.3 73 73 A V E - H 0 167C 1 -9,-1.8 94,-0.2 -2,-0.4 22,-0.2 -0.915 25.5-171.9-106.5 114.5 61.9 13.7 26.2 74 74 A L E - H 0 166C 1 92,-3.1 92,-1.9 -2,-0.7 2,-0.4 -0.504 14.2-137.7 -99.0 168.7 61.3 16.7 23.9 75 75 A I E -IH 93 165C 0 18,-2.1 18,-4.1 90,-0.2 2,-0.5 -0.997 7.8-150.4-131.3 130.9 62.7 17.5 20.5 76 76 A E E +IH 92 164C 0 88,-3.0 88,-2.0 -2,-0.4 2,-0.3 -0.886 30.9 148.7-102.4 133.9 64.0 20.9 19.2 77 77 A Q E -I 91 0C 32 14,-2.0 14,-2.4 -2,-0.5 2,-0.3 -0.989 47.0 -98.1-160.8 151.7 63.6 21.7 15.6 78 78 A I E -I 90 0C 16 84,-0.5 2,-0.4 -2,-0.3 12,-0.3 -0.599 28.5-175.9 -81.7 134.4 63.1 24.7 13.3 79 79 A R > - 0 0 57 10,-3.9 3,-2.0 -2,-0.3 4,-0.3 -0.867 6.5-167.6-128.6 92.6 59.6 25.5 12.1 80 80 A I G > S+ 0 0 4 -2,-0.4 3,-1.8 1,-0.3 4,-0.3 0.772 82.9 66.1 -55.0 -30.4 59.8 28.5 9.7 81 81 A A G 3 S+ 0 0 1 253,-0.7 3,-0.3 1,-0.3 -1,-0.3 0.729 94.3 60.8 -65.5 -20.4 56.0 29.1 9.7 82 82 A A G X> S+ 0 0 0 -3,-2.0 3,-0.7 252,-0.3 4,-0.6 0.535 83.6 91.4 -80.6 -8.7 56.3 30.0 13.4 83 83 A Y G X4 S+ 0 0 53 -3,-1.8 3,-1.0 -4,-0.3 -1,-0.2 0.902 78.2 49.7 -54.3 -56.2 58.6 32.9 12.4 84 84 A D G 34 S+ 0 0 77 -4,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.671 123.8 30.0 -64.5 -17.5 56.2 35.8 11.9 85 85 A T G <4 S+ 0 0 41 -3,-0.7 2,-0.3 -4,-0.2 -1,-0.2 0.218 111.4 68.9-127.1 14.9 54.5 35.3 15.3 86 86 A S S << S- 0 0 19 -3,-1.0 0, 0.0 -4,-0.6 0, 0.0 -0.959 74.0-127.0-135.7 153.9 57.2 33.8 17.5 87 87 A E S S+ 0 0 174 -2,-0.3 126,-0.5 1,-0.2 -1,-0.1 0.839 101.3 17.2 -65.7 -35.3 60.5 35.0 19.1 88 88 A T - 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