==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-FEB-00 1DYM . COMPND 2 MOLECULE: ENDOGLUCANASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMICOLA INSOLENS; . AUTHOR G.J.DAVIES,O.MORAZ,H.DRIGUEZ,M.SCHULEIN . 398 1 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16639.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 250 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 26.6 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 . 31 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 1 1 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 PARALLEL BRIDGES PER LADDER . 6 2 4 2 3 2 1 2 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 . 2 1 1 0 0 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 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 0 0, 0.0 162,-0.3 0, 0.0 73,-0.2 0.000 360.0 360.0 360.0 162.1 13.6 -11.3 34.9 2 2 A K E -a 74 0A 108 71,-2.0 73,-2.8 67,-0.4 159,-0.1 -0.430 360.0-113.8 -74.2 123.8 15.7 -14.7 34.6 3 3 A P E -a 75 0A 33 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.345 36.6-141.2 -58.2 135.6 14.8 -16.9 31.6 4 4 A G - 0 0 19 71,-2.3 72,-0.0 2,-0.1 73,-0.0 -0.157 26.1 -90.3 -87.4-170.8 13.2 -20.1 32.7 5 5 A E S S+ 0 0 187 2,-0.1 71,-0.1 71,-0.0 -1,-0.0 0.827 89.9 102.7 -73.6 -30.8 13.5 -23.6 31.5 6 6 A T S S- 0 0 57 1,-0.1 71,-0.8 71,-0.1 -2,-0.1 -0.279 75.6-115.1 -67.6 132.9 10.7 -23.5 29.0 7 7 A K - 0 0 141 70,-0.1 2,-0.5 69,-0.1 -1,-0.1 -0.398 17.9-136.9 -70.2 141.5 11.6 -23.2 25.3 8 8 A E - 0 0 11 69,-0.2 2,-0.6 -2,-0.1 69,-0.1 -0.839 18.0-170.9 -93.5 123.9 10.7 -20.0 23.3 9 9 A V - 0 0 67 69,-2.6 72,-0.4 -2,-0.5 -2,-0.0 -0.861 11.3-155.5-118.4 98.5 9.4 -20.9 19.8 10 10 A H - 0 0 11 -2,-0.6 22,-0.1 1,-0.1 2,-0.0 -0.562 17.1-118.6 -77.7 133.9 9.0 -17.7 17.8 11 11 A P - 0 0 18 0, 0.0 20,-2.1 0, 0.0 2,-0.4 -0.298 29.2-129.4 -62.0 139.4 6.5 -17.5 14.9 12 12 A Q E -C 30 0B 101 18,-0.2 2,-0.4 76,-0.1 18,-0.3 -0.777 24.7-172.4 -92.0 137.9 8.3 -16.8 11.6 13 13 A L E -C 29 0B 2 16,-2.7 16,-2.0 -2,-0.4 2,-0.5 -0.986 16.7-141.8-132.9 127.3 7.0 -14.0 9.4 14 14 A T E +C 28 0B 36 76,-2.3 375,-0.3 -2,-0.4 374,-0.3 -0.785 29.3 171.8 -87.7 128.1 8.2 -13.2 5.8 15 15 A T E -C 27 0B 0 12,-2.4 12,-2.6 -2,-0.5 2,-0.3 -0.563 22.2-116.9-121.8-177.7 8.3 -9.4 5.1 16 16 A F E -Cd 26 390B 37 373,-2.1 375,-1.8 10,-0.3 2,-0.5 -0.968 8.3-155.2-134.8 151.4 9.7 -7.4 2.2 17 17 A R E -Cd 25 391B 68 8,-2.3 8,-3.1 -2,-0.3 2,-0.4 -0.986 30.4-158.9-118.6 124.2 12.4 -4.8 1.4 18 18 A a E +Cd 24 392B 5 373,-2.3 375,-2.1 -2,-0.5 2,-0.3 -0.878 22.1 167.2-120.4 142.1 11.5 -2.6 -1.7 19 19 A T E > -C 23 0B 54 4,-1.5 4,-2.0 -2,-0.4 376,-0.0 -0.953 41.4-120.6-142.4 156.6 13.2 -0.5 -4.3 20 20 A K T 4 S+ 0 0 148 -2,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.964 114.4 42.5 -65.4 -42.2 11.9 1.0 -7.6 21 21 A R T 4 S+ 0 0 248 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.871 126.1 31.0 -72.0 -35.5 14.6 -0.9 -9.6 22 22 A G T 4 S- 0 0 33 1,-0.2 -1,-0.2 3,-0.0 -2,-0.2 0.521 93.7-143.1-101.1 -10.7 14.4 -4.2 -7.8 23 23 A G E < -C 19 0B 33 -4,-2.0 -4,-1.5 -3,-0.1 2,-0.5 -0.297 54.1 -31.7 75.9-163.9 10.7 -4.4 -6.7 24 24 A a E -C 18 0B 52 -6,-0.2 -6,-0.3 -4,-0.1 368,-0.1 -0.768 62.4-164.1 -96.4 120.6 9.9 -6.0 -3.3 25 25 A K E -C 17 0B 134 -8,-3.1 -8,-2.3 -2,-0.5 2,-0.1 -0.887 22.5-111.0-107.8 133.9 12.2 -8.8 -2.1 26 26 A P E -C 16 0B 98 0, 0.0 2,-0.3 0, 0.0 -10,-0.3 -0.302 31.1-174.3 -60.4 147.7 11.4 -11.3 0.7 27 27 A A E -C 15 0B 24 -12,-2.6 -12,-2.4 -2,-0.1 2,-0.5 -0.979 24.2-121.8-141.2 141.3 13.2 -11.2 4.1 28 28 A T E +C 14 0B 36 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.807 38.7 165.3 -88.9 128.2 12.9 -13.7 7.0 29 29 A N E -C 13 0B 0 -16,-2.0 -16,-2.7 -2,-0.5 2,-0.3 -0.803 23.4-137.9-134.5 165.7 11.8 -12.2 10.3 30 30 A F E -CE 12 112B 18 82,-1.9 82,-3.1 -2,-0.3 2,-0.4 -0.887 11.4-131.2-126.3 163.1 10.5 -13.5 13.6 31 31 A I E - E 0 111B 0 -20,-2.1 2,-0.4 -2,-0.3 80,-0.2 -0.944 19.8-173.2-119.3 132.3 7.7 -12.4 16.1 32 32 A V E - E 0 110B 0 78,-2.0 78,-2.7 -2,-0.4 2,-0.1 -0.989 19.4-131.1-129.8 133.6 8.2 -12.1 19.9 33 33 A L E - E 0 109B 2 -2,-0.4 76,-0.2 76,-0.2 5,-0.1 -0.412 45.9 -80.8 -76.5 155.9 5.6 -11.3 22.5 34 34 A D >> - 0 0 9 74,-2.2 3,-1.7 1,-0.1 4,-0.6 -0.285 40.9-120.1 -53.5 142.7 6.2 -8.6 25.1 35 35 A S G >4 S+ 0 0 8 133,-2.1 3,-1.6 1,-0.3 134,-0.2 0.864 111.8 50.6 -50.5 -50.2 8.5 -9.8 27.9 36 36 A L G 34 S+ 0 0 53 1,-0.3 -1,-0.3 132,-0.3 4,-0.2 0.503 101.5 63.1 -75.5 1.6 5.9 -9.1 30.7 37 37 A S G <4 S+ 0 0 53 -3,-1.7 -1,-0.3 71,-0.1 -2,-0.2 0.558 86.1 88.9 -96.0 -13.7 3.2 -11.1 28.7 38 38 A H S << S- 0 0 5 -3,-1.6 2,-0.2 -4,-0.6 39,-0.1 -0.466 106.4 -77.8 -74.0 160.7 5.3 -14.3 29.1 39 39 A P - 0 0 50 0, 0.0 37,-2.6 0, 0.0 2,-0.5 -0.420 53.0-167.6 -60.8 125.1 4.5 -16.3 32.2 40 40 A I E +B 75 0A 31 35,-0.2 2,-0.3 -2,-0.2 35,-0.2 -0.987 19.7 153.0-120.0 117.1 6.4 -14.5 35.1 41 41 A H E -B 74 0A 68 33,-2.3 33,-2.9 -2,-0.5 2,-0.2 -0.824 41.4 -87.3-135.5 179.4 6.6 -16.4 38.3 42 42 A R E -B 73 0A 53 7,-0.7 31,-0.2 5,-0.4 3,-0.1 -0.571 47.6 -92.2 -95.7 159.2 8.8 -16.8 41.4 43 43 A A > - 0 0 22 29,-2.2 3,-1.9 -2,-0.2 4,-0.2 -0.118 63.7 -69.0 -63.7 159.6 11.8 -18.9 41.9 44 44 A E T 3 S+ 0 0 202 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.144 122.6 23.5 -51.7 133.4 11.4 -22.4 43.3 45 45 A G T 3 S+ 0 0 78 -3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.402 97.8 92.5 89.6 -6.7 10.4 -22.3 47.0 46 46 A L S < S- 0 0 75 -3,-1.9 -2,-0.1 1,-0.3 -3,-0.1 0.434 85.3-126.6-101.2 4.4 8.8 -18.8 47.0 47 47 A G - 0 0 46 -4,-0.2 -5,-0.4 -5,-0.1 -1,-0.3 -0.211 39.9 -36.0 83.5-175.6 5.2 -19.8 46.3 48 48 A P S S+ 0 0 124 0, 0.0 2,-0.1 0, 0.0 -7,-0.1 -0.273 84.1 64.3 -79.2 171.6 2.7 -18.8 43.6 49 49 A G - 0 0 46 -7,-0.1 -7,-0.7 -2,-0.1 2,-0.0 -0.282 69.6 -86.3 103.4 163.4 2.1 -15.4 42.0 50 50 A G - 0 0 34 -9,-0.2 -9,-0.2 -2,-0.1 3,-0.1 0.034 37.3 -98.1 -90.5-157.5 4.0 -13.0 39.7 51 51 A b S S- 0 0 3 1,-0.4 2,-0.1 -11,-0.1 -10,-0.1 -0.096 84.9 -48.1-123.7 43.6 6.5 -10.2 40.2 52 52 A G - 0 0 33 6,-0.2 -1,-0.4 2,-0.0 2,-0.2 -0.126 56.4 -99.7 108.6 151.8 4.1 -7.2 40.0 53 53 A D > - 0 0 125 4,-0.3 3,-1.5 1,-0.1 0, 0.0 -0.689 51.2 -75.9-103.7 159.7 1.3 -5.8 37.9 54 54 A W T 3 S+ 0 0 167 1,-0.2 125,-0.2 -2,-0.2 -1,-0.1 -0.156 117.2 32.9 -51.6 139.7 1.3 -3.1 35.2 55 55 A G T 3 S+ 0 0 34 123,-2.2 -1,-0.2 1,-0.2 124,-0.2 0.363 107.9 76.2 93.4 -3.0 1.6 0.3 36.7 56 56 A N S < S- 0 0 79 -3,-1.5 -1,-0.2 122,-0.2 131,-0.1 -0.903 79.8-103.5-132.8 161.0 3.7 -0.6 39.7 57 57 A P - 0 0 53 0, 0.0 -4,-0.3 0, 0.0 131,-0.1 -0.302 57.5 -87.1 -68.6 161.7 7.3 -1.4 40.9 58 58 A P - 0 0 7 0, 0.0 -6,-0.2 0, 0.0 2,-0.1 -0.394 60.8 -76.8 -68.7 156.6 7.9 -5.1 41.5 59 59 A P >> - 0 0 35 0, 0.0 4,-2.5 0, 0.0 3,-0.5 -0.309 39.3-134.2 -61.4 132.4 7.1 -6.4 45.1 60 60 A K T 34 S+ 0 0 179 1,-0.2 5,-0.0 2,-0.2 9,-0.0 0.700 96.9 58.5 -65.7 -23.9 9.8 -5.4 47.6 61 61 A D T 34 S+ 0 0 119 2,-0.2 -1,-0.2 1,-0.1 0, 0.0 0.869 118.6 29.1 -79.4 -34.9 10.2 -8.7 49.4 62 62 A V T <4 S+ 0 0 7 -3,-0.5 10,-0.2 1,-0.2 -2,-0.2 0.732 134.7 37.4 -90.4 -28.1 11.2 -10.7 46.2 63 63 A c < + 0 0 1 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.2 -0.400 59.0 142.2-123.5 72.0 12.7 -7.5 44.7 64 64 A P S S+ 0 0 71 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.761 84.0 2.6 -73.4 -22.2 14.5 -5.3 47.2 65 65 A D S > S- 0 0 60 -3,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.964 84.6 -96.0-155.4 168.3 17.1 -4.5 44.6 66 66 A V H > S+ 0 0 38 -2,-0.3 4,-2.2 1,-0.2 120,-0.3 0.876 118.9 54.8 -60.2 -40.6 17.9 -5.3 41.0 67 67 A E H > S+ 0 0 100 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.900 110.8 43.3 -63.5 -41.8 20.2 -8.2 41.8 68 68 A S H >> S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 3,-0.7 0.888 113.3 51.7 -68.8 -41.9 17.6 -10.1 44.0 69 69 A c H 3X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -67,-0.4 0.886 102.5 62.2 -60.0 -36.8 14.8 -9.5 41.4 70 70 A A H 3< S+ 0 0 17 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.702 116.6 28.3 -68.5 -19.0 17.1 -10.9 38.7 71 71 A K H << S+ 0 0 129 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.690 119.1 54.2-109.1 -25.1 17.2 -14.3 40.4 72 72 A N H < S+ 0 0 39 -4,-2.4 -29,-2.2 -10,-0.2 2,-0.4 0.652 101.0 61.5 -86.1 -14.5 13.9 -14.4 42.2 73 73 A b E < - B 0 42A 0 -4,-1.8 -71,-2.0 -31,-0.2 2,-0.4 -0.960 69.5-162.1-117.7 127.9 11.6 -13.6 39.2 74 74 A I E -aB 2 41A 17 -33,-2.9 -33,-2.3 -2,-0.4 2,-0.6 -0.942 7.9-155.9-114.7 133.0 11.6 -16.1 36.3 75 75 A M E -aB 3 40A 0 -73,-2.8 -71,-2.3 -2,-0.4 2,-0.2 -0.934 19.5-145.4-111.0 110.6 10.3 -15.4 32.8 76 76 A E - 0 0 28 -37,-2.6 -69,-0.1 -2,-0.6 -71,-0.0 -0.585 14.1-116.0 -82.8 145.5 9.2 -18.6 31.0 77 77 A G - 0 0 3 -71,-0.8 -69,-0.2 -2,-0.2 -70,-0.1 -0.348 25.4-127.5 -65.9 151.7 9.6 -19.2 27.2 78 78 A I - 0 0 2 1,-0.1 -69,-2.6 -72,-0.1 3,-0.2 -0.908 23.4-177.1-104.6 112.7 6.4 -19.7 25.2 79 79 A P S S+ 0 0 59 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.705 77.6 37.6 -83.3 -15.5 6.5 -22.9 23.2 80 80 A D > - 0 0 75 1,-0.1 3,-1.6 -69,-0.0 4,-0.1 -0.830 61.0-174.5-140.5 89.5 3.1 -22.3 21.5 81 81 A Y G > >S+ 0 0 8 -72,-0.4 3,-2.0 -2,-0.4 5,-1.8 0.722 77.9 77.4 -59.6 -21.3 2.3 -18.7 20.5 82 82 A S G > 5S+ 0 0 44 1,-0.3 3,-1.6 3,-0.2 -1,-0.3 0.792 83.1 66.7 -58.1 -26.7 -1.3 -19.7 19.4 83 83 A Q G < 5S+ 0 0 86 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.475 102.1 47.7 -72.9 -7.7 -2.2 -19.9 23.1 84 84 A Y G < 5S- 0 0 47 -3,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.151 125.3-101.2-115.9 16.4 -1.7 -16.1 23.2 85 85 A G T < 5S+ 0 0 0 -3,-1.6 11,-2.8 1,-0.2 2,-0.5 0.677 84.1 127.2 73.1 17.2 -3.7 -15.4 20.1 86 86 A V E < +F 95 0B 1 -5,-1.8 2,-0.3 9,-0.2 -2,-0.2 -0.939 24.7 150.5-113.3 118.1 -0.6 -15.0 17.9 87 87 A T E -F 94 0B 48 7,-1.8 7,-3.0 -2,-0.5 2,-0.3 -0.987 23.8-155.5-142.2 150.9 -0.2 -17.0 14.7 88 88 A T E -F 93 0B 44 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.939 8.6-174.0-126.5 155.4 1.6 -16.6 11.3 89 89 A N E > -F 92 0B 136 3,-2.5 3,-1.9 -2,-0.3 2,-0.6 -0.799 65.6 -63.7-146.8 92.4 1.0 -18.0 7.9 90 90 A G T 3 S- 0 0 47 -2,-0.3 -76,-2.3 1,-0.3 -1,-0.0 -0.470 125.7 -3.0 65.8-106.4 3.7 -17.1 5.3 91 91 A T T 3 S+ 0 0 37 -2,-0.6 297,-1.8 -78,-0.2 298,-0.5 0.348 118.7 93.1 -97.8 7.2 3.4 -13.3 5.0 92 92 A S E < -FG 89 387B 31 -3,-1.9 -3,-2.5 295,-0.2 2,-0.4 -0.829 52.1-165.1-112.1 140.9 0.4 -12.9 7.3 93 93 A L E -FG 88 386B 0 293,-2.8 293,-2.6 -2,-0.4 2,-0.5 -0.997 9.4-161.8-119.8 117.4 0.2 -12.2 11.1 94 94 A R E -FG 87 385B 91 -7,-3.0 -7,-1.8 -2,-0.4 2,-0.5 -0.916 3.4-168.8-105.0 123.3 -3.1 -12.9 12.9 95 95 A L E -FG 86 384B 0 289,-2.8 289,-1.9 -2,-0.5 2,-0.5 -0.954 3.8-166.0-112.8 115.3 -3.7 -11.3 16.3 96 96 A Q E - 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