==== 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 20-JAN-99 8A3H . COMPND 2 MOLECULE: PROTEIN (ENDOGLUCANASE); . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AGARADHAERENS; . AUTHOR A.VARROT,M.SCHULEIN,M.PIPELIER,A.VASELLA,G.J.DAVIES . 300 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11541.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 216 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 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 2 0 0 0 0 1 0 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 1 2 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 PARALLEL BRIDGES PER LADDER . 3 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 4 A S > 0 0 95 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -44.2 73.5 43.3 7.5 2 5 A V H > + 0 0 31 88,-0.4 4,-2.9 87,-0.3 5,-0.4 0.943 360.0 36.8 -64.7 -53.7 72.8 41.0 10.6 3 6 A V H > S+ 0 0 6 87,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.882 116.4 53.6 -71.3 -36.3 69.5 39.5 9.4 4 7 A E H 4 S+ 0 0 157 86,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.933 115.6 41.9 -62.2 -40.6 70.6 39.3 5.8 5 8 A E H < S+ 0 0 114 -4,-2.4 -2,-0.2 1,-0.1 -1,-0.2 0.958 126.8 27.8 -70.6 -52.3 73.7 37.4 6.8 6 9 A H H < S+ 0 0 43 -4,-2.9 13,-2.3 -5,-0.2 14,-0.2 0.792 86.7 169.5 -85.5 -29.6 72.3 35.0 9.5 7 10 A G < + 0 0 5 -4,-2.2 2,-0.4 -5,-0.4 -1,-0.2 -0.262 50.8 28.3 63.6-134.7 68.8 34.7 8.1 8 11 A Q S S- 0 0 65 -2,-0.1 2,-0.2 10,-0.0 120,-0.1 -0.516 73.9-150.6 -70.0 119.0 66.5 32.1 9.5 9 12 A L + 0 0 4 -2,-0.4 2,-0.3 118,-0.4 9,-0.2 -0.633 24.2 160.7 -85.6 152.0 67.3 31.3 13.1 10 13 A S E -A 17 0A 39 7,-2.1 7,-2.8 -2,-0.2 2,-0.5 -0.940 39.7-101.6-155.9 173.4 66.6 27.8 14.5 11 14 A I E +A 16 0A 28 -2,-0.3 2,-0.4 179,-0.2 5,-0.2 -0.916 34.6 176.3-105.8 128.6 67.6 25.5 17.4 12 15 A S E > S-A 15 0A 52 3,-2.5 3,-1.6 -2,-0.5 -2,-0.0 -0.987 72.4 -17.5-132.0 121.1 70.0 22.7 16.7 13 16 A N T 3 S- 0 0 157 -2,-0.4 -1,-0.1 1,-0.3 205,-0.1 0.898 129.2 -50.8 51.9 40.3 71.3 20.4 19.5 14 17 A G T 3 S+ 0 0 11 1,-0.2 2,-0.4 204,-0.1 207,-0.4 0.618 117.2 108.7 80.7 7.9 70.1 22.9 22.2 15 18 A E E < S-A 12 0A 55 -3,-1.6 -3,-2.5 205,-0.1 2,-0.4 -0.950 72.9-115.8-121.8 144.1 71.9 25.9 20.5 16 19 A L E +A 11 0A 9 -2,-0.4 8,-1.9 237,-0.2 2,-0.3 -0.622 46.8 173.6 -72.8 125.7 70.7 29.0 18.6 17 20 A V E -AB 10 23A 7 -7,-2.8 -7,-2.1 -2,-0.4 6,-0.2 -0.902 27.0-121.3-132.8 162.1 72.1 28.7 15.1 18 21 A N > - 0 0 3 4,-2.6 3,-2.3 -2,-0.3 -11,-0.2 -0.176 50.0 -78.7 -90.0-172.5 71.7 30.6 11.8 19 22 A E T 3 S+ 0 0 113 -13,-2.3 -12,-0.1 1,-0.3 -10,-0.1 0.589 131.6 53.3 -74.4 -6.6 70.5 29.2 8.4 20 23 A R T 3 S- 0 0 126 -14,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.298 120.6-107.6 -97.8 -0.9 73.9 27.6 7.8 21 24 A G S < S+ 0 0 49 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.584 74.2 139.6 84.2 10.7 73.8 25.8 11.2 22 25 A E - 0 0 95 -16,-0.1 -4,-2.6 1,-0.1 -1,-0.3 -0.684 60.2-102.5 -88.3 139.8 76.4 28.0 12.7 23 26 A Q B -B 17 0A 111 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.3 -0.321 40.4-170.7 -58.1 140.9 76.1 29.2 16.3 24 27 A V - 0 0 9 -8,-1.9 2,-0.5 229,-0.1 -8,-0.2 -0.983 11.3-155.2-134.2 144.3 74.9 32.8 16.7 25 28 A Q - 0 0 37 -2,-0.3 2,-0.4 229,-0.1 229,-0.1 -0.987 7.9-155.0-123.9 120.5 74.7 35.0 19.8 26 29 A L + 0 0 4 -2,-0.5 230,-2.5 29,-0.0 2,-0.4 -0.792 12.8 179.9 -92.0 140.0 72.3 37.9 20.0 27 30 A K E +c 256 0B 10 -2,-0.4 29,-2.0 228,-0.2 30,-0.6 -0.986 24.4 114.6-139.9 127.8 73.1 40.9 22.3 28 31 A G E -cd 257 57B 0 228,-1.7 230,-2.2 -2,-0.4 2,-0.3 -0.846 52.0 -70.4-165.5-162.4 70.8 43.9 22.7 29 32 A M E -cd 258 58B 0 28,-0.9 30,-2.6 228,-0.3 2,-0.4 -0.875 24.4-143.9-113.0 146.7 68.5 46.1 24.7 30 33 A S E -cd 259 59B 0 228,-3.0 231,-2.4 -2,-0.3 230,-0.6 -0.865 22.6-126.0 -95.9 142.6 65.0 45.7 26.1 31 34 A S E -c 261 0B 0 28,-2.9 231,-0.1 -2,-0.4 3,-0.1 -0.293 25.1-118.9 -63.4 163.6 62.6 48.6 26.3 32 35 A H S S- 0 0 6 229,-0.8 29,-0.4 5,-0.2 2,-0.2 -0.146 71.9 -37.0 -80.6-164.7 61.1 49.4 29.7 33 36 A G >> - 0 0 0 1,-0.2 4,-2.6 29,-0.1 3,-1.9 -0.412 55.6-141.6 -62.4 130.8 57.3 49.2 29.7 34 37 A L H 3> S+ 0 0 10 27,-1.9 4,-0.6 1,-0.3 -1,-0.2 0.725 100.2 61.5 -66.2 -19.3 55.9 50.4 26.4 35 38 A Q H 34 S+ 0 0 45 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.613 118.1 27.1 -78.6 -13.5 53.0 52.1 28.2 36 39 A W H <4 S+ 0 0 115 -3,-1.9 -2,-0.2 2,-0.0 3,-0.1 0.715 134.4 23.0-114.8 -41.5 55.4 54.3 30.2 37 40 A Y H >< S+ 0 0 43 -4,-2.6 3,-1.5 1,-0.1 -5,-0.2 -0.123 71.9 130.2-130.7 36.9 58.6 54.8 28.1 38 41 A G G >< + 0 0 9 -4,-0.6 3,-2.0 1,-0.3 -1,-0.1 0.673 59.5 77.9 -67.6 -17.3 57.5 54.2 24.5 39 42 A Q G 3 S+ 0 0 88 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.736 88.5 59.0 -65.0 -21.3 59.1 57.4 23.3 40 43 A F G < S+ 0 0 3 -3,-1.5 2,-0.7 221,-0.2 -1,-0.3 0.442 90.6 80.6 -82.4 -0.1 62.5 55.6 23.5 41 44 A V < + 0 0 1 -3,-2.0 2,-0.3 -7,-0.1 -1,-0.1 -0.906 64.1 108.1-113.8 102.9 61.3 53.0 21.0 42 45 A N S > S- 0 0 23 -2,-0.7 4,-2.4 1,-0.1 5,-0.3 -0.968 79.6 -90.5-164.1 164.9 61.5 54.3 17.4 43 46 A Y H > S+ 0 0 89 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.890 121.1 50.8 -52.5 -46.6 63.6 53.8 14.2 44 47 A E H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.925 112.3 43.4 -65.8 -42.7 66.1 56.5 15.1 45 48 A S H > S+ 0 0 0 232,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.915 115.9 49.5 -66.5 -37.6 66.9 55.3 18.6 46 49 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.870 110.1 51.1 -67.6 -37.0 67.1 51.7 17.4 47 50 A K H X S+ 0 0 73 -4,-2.5 4,-2.8 -5,-0.3 5,-0.3 0.914 109.8 50.1 -65.7 -41.8 69.4 52.8 14.5 48 51 A W H X>S+ 0 0 76 -4,-2.3 4,-3.1 1,-0.2 5,-0.9 0.925 110.8 49.1 -62.3 -44.4 71.6 54.6 17.1 49 52 A L H X>S+ 0 0 0 -4,-2.5 6,-1.9 3,-0.2 5,-1.2 0.919 113.4 47.8 -59.6 -43.2 71.7 51.4 19.2 50 53 A R H <5S+ 0 0 63 -4,-2.4 4,-0.4 4,-0.2 -2,-0.2 0.952 122.2 32.6 -59.6 -49.6 72.6 49.3 16.2 51 54 A D H <5S+ 0 0 95 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.873 129.9 30.4 -83.5 -39.3 75.3 51.6 14.9 52 55 A D H <5S+ 0 0 30 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.1 0.825 133.3 28.6 -92.4 -38.2 76.9 53.1 18.1 53 56 A W T < S+ 0 0 25 33,-0.4 3,-1.4 4,-0.1 4,-0.1 -0.104 93.5 70.8-100.4-164.1 48.9 44.6 33.3 66 69 A S T 3 S- 0 0 49 1,-0.3 -1,-0.1 2,-0.1 -3,-0.1 0.866 136.6 -44.7 61.6 37.9 50.1 47.8 35.1 67 70 A G T 3 S+ 0 0 37 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.532 116.7 121.9 81.2 7.1 48.4 50.1 32.5 68 71 A G S X> S- 0 0 0 -3,-1.4 4,-2.6 3,-0.1 3,-0.6 0.352 78.5 -39.9 -83.0-149.1 49.7 47.9 29.6 69 72 A Y T 34 S+ 0 0 28 -6,-2.7 -5,-0.2 1,-0.3 -4,-0.1 0.778 130.9 52.0 -56.5 -41.4 47.9 46.0 26.9 70 73 A I T 34 S+ 0 0 45 -6,-2.4 -1,-0.3 1,-0.2 -5,-0.1 0.913 118.2 39.3 -63.7 -41.2 44.9 44.6 28.8 71 74 A D T <4 S+ 0 0 97 -7,-0.7 -2,-0.2 -3,-0.6 -1,-0.2 0.825 139.6 8.1 -73.5 -37.6 44.1 48.1 30.1 72 75 A D >< - 0 0 84 -4,-2.6 3,-1.2 1,-0.1 -1,-0.3 -0.810 64.3-168.6-150.6 99.3 44.8 50.0 26.9 73 76 A P G > + 0 0 67 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.572 69.0 93.7 -75.7 -3.2 45.5 47.8 23.8 74 77 A S G > + 0 0 72 1,-0.3 3,-2.0 2,-0.2 4,-0.5 0.767 68.7 77.2 -58.3 -22.7 46.8 50.7 21.8 75 78 A V G X> S+ 0 0 14 -3,-1.2 4,-1.5 1,-0.3 3,-0.9 0.744 74.9 75.5 -62.8 -21.7 50.3 49.8 22.9 76 79 A K H <> S+ 0 0 47 -3,-2.4 4,-2.1 1,-0.2 -1,-0.3 0.830 88.2 61.1 -59.0 -26.7 50.3 46.9 20.4 77 80 A E H <> S+ 0 0 98 -3,-2.0 4,-2.2 -4,-0.3 -1,-0.2 0.820 99.8 53.6 -71.1 -27.0 50.9 49.6 17.7 78 81 A K H <> S+ 0 0 64 -3,-0.9 4,-2.3 -4,-0.5 -1,-0.2 0.866 106.2 52.7 -70.3 -37.4 54.2 50.5 19.5 79 82 A V H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.942 109.2 50.0 -57.5 -47.5 55.2 46.8 19.3 80 83 A K H X S+ 0 0 25 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.922 108.4 52.4 -57.8 -44.0 54.4 47.0 15.5 81 84 A E H X S+ 0 0 73 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.926 111.4 47.0 -56.3 -45.1 56.6 50.1 15.2 82 85 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.913 112.3 48.6 -64.3 -43.9 59.5 48.3 16.9 83 86 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.934 112.9 48.1 -62.0 -46.1 59.1 45.2 14.7 84 87 A E H X S+ 0 0 93 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.885 110.6 51.3 -63.7 -38.9 59.0 47.3 11.6 85 88 A A H X S+ 0 0 6 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.922 109.4 50.3 -62.4 -43.2 62.0 49.3 12.6 86 89 A A H X>S+ 0 0 0 -4,-2.4 5,-2.2 2,-0.2 4,-0.8 0.902 110.6 49.9 -61.8 -41.3 64.0 46.1 13.3 87 90 A I H ><5S+ 0 0 31 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.947 113.7 45.6 -59.6 -47.3 63.0 44.8 9.8 88 91 A D H 3<5S+ 0 0 117 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.830 116.7 45.0 -67.2 -30.2 64.2 48.1 8.3 89 92 A L H 3<5S- 0 0 1 -4,-2.3 -87,-0.3 -5,-0.2 -1,-0.2 0.437 109.3-123.2 -92.0 -5.1 67.4 48.1 10.3 90 93 A D T <<5 + 0 0 38 -3,-0.8 -87,-1.9 -4,-0.8 -88,-0.4 0.868 68.7 122.8 61.5 45.1 68.1 44.4 9.6 91 94 A I < - 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