==== 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 HYDROLASE 06-OCT-97 4OVW . COMPND 2 MOLECULE: ENDOGLUCANASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: FUSARIUM OXYSPORUM; . AUTHOR G.J.DAVIES,M.SCHULEIN . 800 2 18 18 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32728.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 519 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 219 27.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.2 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 . 65 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.2 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 3 2 4 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 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 0 PARALLEL BRIDGES PER LADDER . 14 6 4 6 5 5 0 6 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 . 6 0 4 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 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 X 0 0 4 0, 0.0 162,-0.4 0, 0.0 161,-0.3 0.000 360.0 360.0 360.0 172.1 35.7 -0.0 30.2 2 2 A T E -a 71 0A 32 68,-2.0 70,-1.7 65,-0.7 159,-0.0 -0.707 360.0-130.4-103.8 115.9 37.8 3.4 30.8 3 3 A P E -a 72 0A 28 0, 0.0 70,-0.2 0, 0.0 37,-0.0 -0.323 20.4-130.9 -64.1 142.8 35.9 6.6 30.2 4 4 A D - 0 0 35 68,-2.2 68,-0.0 1,-0.0 69,-0.0 -0.077 29.7 -97.3 -76.4-167.2 37.7 9.1 27.9 5 5 A K S S+ 0 0 175 69,-0.1 68,-0.1 2,-0.1 3,-0.1 0.248 76.2 125.9-106.2 9.7 38.0 12.8 28.9 6 6 A A S S- 0 0 43 1,-0.1 2,-0.3 70,-0.0 69,-0.2 -0.293 72.0 -96.9 -67.5 152.8 35.1 14.3 27.0 7 7 A K - 0 0 148 67,-0.2 2,-0.5 2,-0.0 -1,-0.1 -0.603 31.4-142.3 -74.0 122.4 32.7 16.4 29.1 8 8 A E - 0 0 12 -2,-0.3 2,-0.5 66,-0.1 68,-0.3 -0.824 15.5-170.4 -84.9 129.3 29.6 14.4 30.3 9 9 A Q - 0 0 58 66,-2.9 71,-0.2 -2,-0.5 3,-0.1 -0.702 7.0-163.0-124.1 80.9 26.5 16.7 30.2 10 10 A H - 0 0 11 -2,-0.5 22,-0.1 1,-0.1 2,-0.1 -0.302 26.9-112.0 -66.5 127.4 23.6 14.8 31.9 11 11 A P - 0 0 20 0, 0.0 20,-1.9 0, 0.0 2,-0.3 -0.393 34.6-120.1 -59.8 137.3 20.1 16.2 31.1 12 12 A K E -D 30 0B 94 18,-0.2 2,-0.4 75,-0.1 18,-0.2 -0.659 29.0-170.1 -82.4 136.4 18.6 17.8 34.3 13 13 A L E -D 29 0B 1 16,-3.4 16,-2.3 -2,-0.3 2,-0.3 -0.975 13.7-145.6-134.0 118.6 15.4 16.3 35.6 14 14 A E E +D 28 0B 37 75,-2.3 375,-0.4 -2,-0.4 14,-0.2 -0.721 26.4 175.0 -76.0 127.8 13.3 17.9 38.3 15 15 A T E -D 27 0B 0 12,-2.3 12,-1.8 -2,-0.3 2,-0.3 -0.629 19.4-127.1-123.8 179.6 11.6 15.3 40.5 16 16 A Y E -De 26 390B 32 373,-2.3 375,-1.9 10,-0.2 2,-0.4 -0.988 6.1-154.7-134.2 150.2 9.4 15.6 43.7 17 17 A R E -De 25 391B 54 8,-1.7 8,-2.6 -2,-0.3 2,-0.4 -0.953 25.9-157.3-120.6 133.0 9.4 14.1 47.2 18 18 A a E +De 24 392B 4 373,-3.1 375,-1.9 -2,-0.4 2,-0.3 -0.933 21.2 176.9-129.1 144.9 6.1 14.0 49.0 19 19 A T E > -D 23 0B 45 4,-2.6 4,-1.9 -2,-0.4 376,-0.0 -0.962 35.5-128.1-130.0 147.8 4.5 13.9 52.5 20 20 A K T 4 S+ 0 0 134 -2,-0.3 3,-0.2 2,-0.2 -1,-0.1 0.956 110.7 50.0 -61.7 -43.1 0.9 14.0 53.6 21 21 A A T 4 S+ 0 0 99 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.942 126.3 18.1 -59.2 -56.8 1.8 16.8 56.1 22 22 A S T 4 S- 0 0 72 1,-0.3 -1,-0.2 3,-0.0 -2,-0.2 0.348 94.9-129.7-107.5 16.4 3.8 19.1 53.8 23 23 A G E < -D 19 0B 35 -4,-1.9 -4,-2.6 -3,-0.2 2,-0.5 -0.441 52.8 -33.0 78.9-158.2 3.0 18.3 50.1 24 24 A a E -D 18 0B 34 -6,-0.3 2,-0.4 -2,-0.2 -6,-0.2 -0.945 52.4-157.2-114.0 121.3 5.6 17.7 47.4 25 25 A K E -D 17 0B 128 -8,-2.6 -8,-1.7 -2,-0.5 -10,-0.1 -0.888 18.7-125.8-104.8 128.0 8.9 19.4 47.3 26 26 A K E +D 16 0B 113 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.464 31.8 175.8 -67.8 148.7 10.9 19.8 44.1 27 27 A Q E -D 15 0B 72 -12,-1.8 -12,-2.3 -2,-0.1 2,-0.5 -0.943 30.7-105.6-151.7 159.3 14.5 18.6 43.9 28 28 A T E +D 14 0B 27 -2,-0.3 84,-0.3 -14,-0.2 2,-0.3 -0.790 39.1 167.1 -91.9 126.9 17.1 18.3 41.2 29 29 A N E -D 13 0B 1 -16,-2.3 -16,-3.4 -2,-0.5 2,-0.3 -0.797 22.0-134.7-126.5 169.5 18.1 15.0 39.7 30 30 A Y E -DF 12 110B 41 80,-2.3 80,-3.7 -2,-0.3 2,-0.4 -0.907 7.7-134.5-129.0 152.4 20.1 13.9 36.6 31 31 A I E - F 0 109B 0 -20,-1.9 2,-0.4 -2,-0.3 78,-0.2 -0.915 18.4-169.1-105.9 137.6 19.6 11.4 33.8 32 32 A V E - F 0 108B 0 76,-2.3 76,-2.1 -2,-0.4 2,-0.2 -0.973 18.2-130.5-129.0 134.3 22.4 9.0 32.5 33 33 A A E - F 0 107B 0 -2,-0.4 74,-0.2 74,-0.2 5,-0.1 -0.512 44.3 -86.8 -75.5 154.9 22.4 6.9 29.4 34 34 A D >> - 0 0 25 72,-2.1 3,-1.7 -2,-0.2 4,-1.3 -0.258 41.1-110.2 -48.7 144.4 23.4 3.2 29.8 35 35 A A H >> S+ 0 0 10 133,-3.0 3,-0.9 1,-0.3 4,-0.7 0.878 118.7 55.4 -45.5 -46.7 27.2 2.7 29.7 36 36 A G H 34 S+ 0 0 42 132,-0.3 3,-0.4 1,-0.2 4,-0.3 0.745 99.6 57.9 -67.2 -23.6 26.7 1.0 26.3 37 37 A I H <4 S+ 0 0 53 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.794 95.2 66.4 -73.4 -25.3 24.8 3.9 24.6 38 38 A H H << S- 0 0 12 -4,-1.3 -1,-0.2 -3,-0.9 -2,-0.2 0.901 120.4-102.7 -60.7 -33.4 27.8 6.1 25.4 39 39 A G < - 0 0 19 -4,-0.7 34,-2.1 -3,-0.4 2,-0.5 0.342 32.8-152.7 106.9 114.1 29.9 4.0 22.9 40 40 A I E +B 72 0A 26 -4,-0.3 8,-0.8 32,-0.2 2,-0.3 -0.981 32.4 155.5-121.5 117.6 32.4 1.4 24.1 41 41 A R E -BC 71 47A 129 30,-2.5 30,-2.4 -2,-0.5 6,-0.2 -0.999 43.1-116.3-146.9 153.9 35.2 0.8 21.7 42 42 A Q > - 0 0 30 4,-2.9 3,-1.6 -2,-0.3 28,-0.1 -0.059 46.3-103.0 -77.2 171.0 38.7 -0.3 21.0 43 43 A K T 3 S+ 0 0 197 26,-0.3 -1,-0.1 1,-0.3 27,-0.1 0.845 122.7 55.1 -65.4 -26.2 41.3 2.1 19.6 44 44 A N T 3 S- 0 0 131 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.181 123.2-105.6 -88.1 11.3 40.9 0.6 16.0 45 45 A G S < S+ 0 0 36 -3,-1.6 -2,-0.1 1,-0.3 -1,-0.0 0.240 76.2 135.3 83.1 -15.5 37.2 1.3 16.2 46 46 A A - 0 0 41 1,-0.1 -4,-2.9 -5,-0.1 -1,-0.3 -0.270 57.7-113.4 -62.1 154.1 36.0 -2.4 16.8 47 47 A G B -C 41 0A 37 -6,-0.2 -6,-0.2 1,-0.1 3,-0.1 -0.337 16.4-123.4 -77.6 167.2 33.4 -2.8 19.5 48 48 A b S S- 0 0 4 -8,-0.8 8,-1.7 1,-0.4 2,-0.1 0.295 76.1 -48.0-100.8 17.7 34.2 -4.7 22.7 49 49 A G - 0 0 32 6,-0.3 -1,-0.4 -9,-0.2 2,-0.2 -0.363 56.5 -96.3 131.3 146.3 31.4 -7.3 22.3 50 50 A D > - 0 0 128 4,-0.3 3,-1.7 -2,-0.1 0, 0.0 -0.598 47.3 -86.4 -88.9 152.7 27.7 -7.7 21.5 51 51 A W T 3 S+ 0 0 171 1,-0.3 128,-0.2 -2,-0.2 -1,-0.1 -0.321 115.7 36.9 -52.1 124.9 24.7 -8.1 23.8 52 52 A G T 3 S+ 0 0 31 126,-2.2 2,-0.3 1,-0.2 -1,-0.3 0.339 109.8 71.1 110.3 -9.3 24.4 -11.8 24.5 53 53 A Q S < S- 0 0 119 -3,-1.7 -1,-0.2 125,-0.2 134,-0.1 -0.962 83.2 -89.0-139.7 164.5 28.1 -12.6 24.7 54 54 A K - 0 0 122 -2,-0.3 -4,-0.3 1,-0.1 134,-0.1 -0.183 62.4 -87.5 -57.0 159.6 31.4 -12.4 26.5 55 55 A P - 0 0 8 0, 0.0 -6,-0.3 0, 0.0 -1,-0.1 -0.289 65.5 -65.8 -70.1 154.7 33.6 -9.3 25.5 56 56 A N > - 0 0 55 -8,-1.7 4,-2.3 1,-0.1 -7,-0.0 -0.136 47.0-139.2 -41.9 130.7 35.9 -9.6 22.5 57 57 A A T 4 S+ 0 0 80 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.842 97.9 51.4 -73.9 -28.8 38.5 -12.1 23.5 58 58 A T T 4 S+ 0 0 116 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.875 117.6 36.4 -80.1 -33.8 41.4 -10.2 22.0 59 59 A A T 4 S+ 0 0 0 1,-0.2 10,-0.4 2,-0.1 -2,-0.2 0.784 128.9 37.7 -83.6 -22.2 40.7 -6.9 23.7 60 60 A c < + 0 0 5 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 -0.500 57.0 140.6-130.2 66.9 39.5 -8.7 26.9 61 61 A P S S- 0 0 81 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.743 88.2 -3.7 -74.0 -23.9 41.6 -11.8 27.7 62 62 A D S > S- 0 0 73 -3,-0.1 4,-1.8 1,-0.1 124,-0.1 -0.949 87.2 -89.9-157.0 175.6 41.3 -10.8 31.4 63 63 A E H > S+ 0 0 60 -2,-0.3 4,-1.9 1,-0.2 123,-0.3 0.833 117.1 50.9 -66.1 -41.8 39.9 -7.9 33.3 64 64 A A H > S+ 0 0 41 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.881 112.5 47.7 -65.9 -39.6 42.8 -5.5 33.5 65 65 A S H > S+ 0 0 18 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.830 107.8 56.2 -68.0 -35.5 43.3 -5.7 29.7 66 66 A c H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 -64,-0.3 0.958 108.4 47.1 -62.1 -48.1 39.6 -5.1 29.1 67 67 A A H < S+ 0 0 7 -4,-1.9 -65,-0.7 1,-0.2 -1,-0.2 0.799 114.4 47.8 -60.3 -41.4 39.7 -1.9 31.0 68 68 A K H < S+ 0 0 141 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.931 120.0 35.9 -66.3 -49.2 42.8 -0.7 29.2 69 69 A N H < S+ 0 0 73 -4,-2.7 2,-0.7 -10,-0.4 -26,-0.3 0.594 103.0 74.8 -83.8 -10.9 41.6 -1.5 25.7 70 70 A b < - 0 0 0 -4,-1.9 -68,-2.0 -5,-0.2 2,-0.5 -0.919 64.7-166.0-114.3 106.4 37.8 -0.7 25.9 71 71 A I E -aB 2 41A 51 -30,-2.4 -30,-2.5 -2,-0.7 2,-0.5 -0.882 8.3-152.0 -98.0 132.9 37.2 3.1 25.9 72 72 A L E -aB 3 40A 0 -70,-1.7 -68,-2.2 -2,-0.5 2,-0.5 -0.851 20.0-131.5-101.6 130.9 33.8 4.6 26.9 73 73 A S - 0 0 48 -34,-2.1 -68,-0.0 -2,-0.5 -2,-0.0 -0.712 15.3-119.6 -93.3 128.2 33.0 7.9 25.3 74 74 A G - 0 0 14 -2,-0.5 2,-0.6 1,-0.1 -67,-0.2 -0.156 26.4-135.5 -53.9 144.1 31.7 10.9 27.3 75 75 A M - 0 0 6 -69,-0.2 -66,-2.9 -42,-0.1 -1,-0.1 -0.944 18.3-168.1-115.4 113.5 28.3 12.2 26.2 76 76 A D > - 0 0 61 -2,-0.6 4,-2.3 -68,-0.3 5,-0.1 -0.274 46.8 -86.2 -84.5-177.8 27.7 15.9 25.8 77 77 A S H > S+ 0 0 48 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.892 131.3 51.4 -62.2 -33.4 24.2 17.4 25.4 78 78 A N H > S+ 0 0 107 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.882 107.5 52.9 -66.8 -37.2 24.3 16.8 21.6 79 79 A A H > S+ 0 0 32 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.955 110.0 48.4 -61.6 -45.4 25.3 13.2 22.2 80 80 A Y H ><>S+ 0 0 1 -4,-2.3 5,-2.4 2,-0.2 3,-0.6 0.956 113.7 47.3 -59.5 -54.8 22.2 12.8 24.6 81 81 A K H ><5S+ 0 0 96 -4,-2.6 3,-2.2 1,-0.3 -2,-0.2 0.943 111.6 48.5 -50.3 -54.2 20.0 14.4 21.9 82 82 A N H 3<5S+ 0 0 96 -4,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.759 106.6 59.0 -62.4 -20.6 21.3 12.2 19.1 83 83 A A T <<5S- 0 0 11 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.404 124.1-107.5 -86.0 5.9 20.7 9.3 21.5 84 84 A G T < 5S+ 0 0 0 -3,-2.2 11,-2.1 1,-0.2 2,-0.5 0.775 80.5 127.0 78.0 22.9 17.0 10.3 21.6 85 85 A I E < +G 94 0B 0 -5,-2.4 2,-0.3 9,-0.2 -2,-0.2 -0.961 23.3 147.6-123.1 119.0 17.2 11.6 25.2 86 86 A T E -G 93 0B 29 7,-1.7 7,-3.5 -2,-0.5 2,-0.3 -0.993 22.2-157.8-142.3 153.5 16.1 15.1 26.2 87 87 A T E -G 92 0B 38 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.881 9.7-177.9-129.8 167.2 14.6 16.8 29.3 88 88 A S E > -G 91 0B 81 3,-2.0 3,-2.5 -2,-0.3 2,-0.5 -0.816 67.1 -48.0-165.7 106.8 12.5 19.9 30.1 89 89 A G T 3 S- 0 0 40 1,-0.3 -75,-2.3 -2,-0.3 -1,-0.0 -0.446 129.4 -14.0 61.9-105.4 11.5 20.9 33.7 90 90 A N T 3 S+ 0 0 35 -2,-0.5 298,-0.6 -77,-0.2 2,-0.4 0.315 116.7 104.2-108.8 14.1 10.1 17.6 35.0 91 91 A K E < -GH 88 387B 79 -3,-2.5 -3,-2.0 296,-0.2 2,-0.5 -0.785 47.8-166.9-104.4 138.8 9.8 15.9 31.6 92 92 A L E -GH 87 386B 0 294,-2.9 294,-1.8 -2,-0.4 2,-0.5 -0.963 11.6-159.2-116.7 112.9 12.0 13.2 30.1 93 93 A R E -GH 86 385B 93 -7,-3.5 -7,-1.7 -2,-0.5 2,-0.5 -0.824 6.5-171.0 -98.3 125.8 11.5 12.6 26.3 94 94 A L E -GH 85 384B 0 290,-2.5 290,-2.2 -2,-0.5 2,-0.4 -0.944 2.6-167.8-118.8 115.9 12.6 9.2 24.9 95 95 A Q E - 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