==== 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 CELLULOSE DOCKING DOMAIN 28-SEP-00 1E8Q . COMPND 2 MOLECULE: ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PIROMYCES EQUI; . AUTHOR S.RAGHOTHAMA,R.Y.EBERHARDT,P.WHITE,G.P.HAZLEWOOD, . 46 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3366.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 25 54.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 26.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 4.3 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 . 5 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.2 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 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 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 0 PARALLEL BRIDGES PER LADDER . 0 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 115 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 173.1 11.3 5.8 -7.0 2 2 A S + 0 0 64 42,-0.1 42,-0.2 43,-0.1 41,-0.2 -0.826 360.0 9.8-168.3-152.2 9.2 2.7 -6.2 3 3 A a - 0 0 7 -2,-0.2 3,-0.5 40,-0.2 4,-0.4 -0.156 57.1-176.0 -43.8 103.4 6.5 1.4 -3.8 4 4 A W S > S+ 0 0 59 1,-0.2 3,-1.3 2,-0.2 4,-0.5 0.847 76.3 68.7 -76.7 -31.0 5.5 4.8 -2.3 5 5 A A G >>>S+ 0 0 0 1,-0.3 4,-2.2 2,-0.2 5,-1.8 0.796 83.5 77.2 -58.0 -23.1 3.0 3.1 0.1 6 6 A Q G 345S+ 0 0 127 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.929 77.9 69.1 -54.1 -45.1 6.1 1.6 1.8 7 7 A S G <45S+ 0 0 110 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.858 111.0 34.8 -43.4 -35.9 6.8 5.0 3.5 8 8 A Q T <45S- 0 0 120 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.840 124.1-101.9 -90.0 -35.6 3.7 4.2 5.5 9 9 A G T <5S+ 0 0 60 -4,-2.2 -3,-0.2 1,-0.2 2,-0.1 0.575 73.2 134.6 123.2 20.6 4.1 0.4 5.7 10 10 A Y < - 0 0 99 -5,-1.8 -1,-0.2 1,-0.2 28,-0.1 -0.472 52.4-112.7 -94.1 169.7 1.7 -0.9 3.1 11 11 A N E -a 38 0A 79 26,-1.1 28,-1.1 -2,-0.1 2,-0.3 0.217 31.0-106.3 -81.4-151.2 2.5 -3.7 0.5 12 12 A a E -a 39 0A 37 26,-0.3 2,-0.3 -7,-0.1 28,-0.2 -0.993 22.0-118.4-145.4 134.9 2.7 -3.3 -3.3 13 13 A b - 0 0 2 26,-1.7 28,-0.3 -2,-0.3 2,-0.3 -0.558 31.9-120.2 -75.2 131.9 0.4 -4.4 -6.0 14 14 A N S S- 0 0 94 -2,-0.3 4,-0.2 1,-0.2 -1,-0.1 -0.521 92.1 -1.3 -70.8 130.4 1.9 -6.9 -8.5 15 15 A N S > S- 0 0 118 -2,-0.3 3,-0.9 29,-0.2 -1,-0.2 0.943 72.5-167.3 49.9 84.5 1.8 -5.4 -12.0 16 16 A P G > S+ 0 0 15 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.633 76.6 78.0 -77.0 -16.4 0.1 -2.1 -11.2 17 17 A S G 3 S+ 0 0 93 1,-0.3 -2,-0.1 24,-0.1 25,-0.0 0.543 107.9 30.3 -72.3 -1.6 -0.5 -1.4 -15.0 18 18 A S G < S+ 0 0 110 -3,-0.9 2,-0.7 -4,-0.2 -1,-0.3 0.050 91.5 105.9-143.8 29.4 -3.4 -3.9 -14.7 19 19 A T S < S- 0 0 21 -3,-1.2 3,-0.1 -6,-0.1 -6,-0.1 -0.837 70.2-129.5-115.9 97.9 -4.7 -3.6 -11.2 20 20 A K - 0 0 177 -2,-0.7 12,-0.6 1,-0.1 2,-0.4 -0.157 30.7-121.8 -43.9 120.1 -8.0 -1.7 -11.0 21 21 A V E +B 31 0A 43 1,-0.2 10,-0.3 10,-0.2 -1,-0.1 -0.535 40.0 168.5 -71.8 127.3 -7.3 0.9 -8.4 22 22 A E E + 0 0 109 8,-1.1 2,-0.2 -2,-0.4 9,-0.2 0.622 65.3 58.1-109.3 -21.6 -9.8 0.7 -5.5 23 23 A Y E +B 30 0A 72 7,-1.0 7,-1.0 2,-0.0 2,-0.2 -0.614 57.8 178.1-102.7 167.7 -7.9 3.1 -3.2 24 24 A T E +B 29 0A 91 5,-0.2 2,-0.2 -2,-0.2 5,-0.2 -0.682 21.9 127.2-170.7 108.7 -6.9 6.7 -3.8 25 25 A D E > S-B 28 0A 88 3,-1.8 3,-2.0 -2,-0.2 -2,-0.0 -0.785 77.0 -64.8-147.9-167.1 -5.1 8.9 -1.4 26 26 A A T 3 S+ 0 0 114 1,-0.3 3,-0.1 -2,-0.2 0, 0.0 0.628 125.6 71.4 -66.0 -6.2 -2.1 11.2 -1.1 27 27 A S T 3 S- 0 0 18 1,-0.3 2,-0.5 -22,-0.0 -1,-0.3 0.340 114.5-113.1 -89.7 8.3 -0.1 7.9 -1.6 28 28 A G E < -B 25 0A 37 -3,-2.0 -3,-1.8 -24,-0.1 2,-0.3 -0.836 62.4 -31.9 100.0-128.9 -1.3 7.9 -5.2 29 29 A Q E -BC 24 40A 108 11,-0.6 11,-1.3 -2,-0.5 2,-0.2 -0.938 59.6-165.7-127.9 150.6 -3.6 5.1 -6.2 30 30 A W E -BC 23 39A 3 -7,-1.0 -8,-1.1 -2,-0.3 -7,-1.0 -0.768 10.3-137.2-128.3 178.6 -3.8 1.6 -4.8 31 31 A G E -BC 21 38A 0 7,-1.4 7,-1.4 -10,-0.3 2,-0.5 -0.970 14.7-130.4-135.8 151.0 -5.4 -1.8 -5.6 32 32 A V E + C 0 37A 61 -12,-0.6 2,-0.3 -2,-0.3 5,-0.2 -0.866 34.6 157.8-105.5 133.7 -7.2 -4.4 -3.4 33 33 A Q E > + C 0 36A 69 3,-1.5 3,-1.5 -2,-0.5 -2,-0.0 -0.969 66.0 2.0-154.2 135.4 -6.2 -8.0 -3.6 34 34 A N T 3 S- 0 0 165 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.691 125.2 -68.4 63.2 12.5 -6.6 -11.0 -1.2 35 35 A G T 3 S+ 0 0 74 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.821 112.3 112.8 76.8 28.7 -8.4 -8.5 1.0 36 36 A Q E < - C 0 33A 79 -3,-1.5 -3,-1.5 -5,-0.0 2,-0.3 -0.990 69.9-113.8-135.7 142.7 -5.1 -6.6 1.7 37 37 A W E - C 0 32A 74 -2,-0.4 -26,-1.1 -5,-0.2 2,-0.3 -0.546 33.8-176.7 -76.4 134.4 -4.1 -3.1 0.6 38 38 A b E -aC 11 31A 2 -7,-1.4 -7,-1.4 -2,-0.3 2,-0.6 -0.954 27.8-116.4-129.5 148.5 -1.2 -2.8 -1.8 39 39 A G E -aC 12 30A 0 -28,-1.1 -26,-1.7 -2,-0.3 2,-0.6 -0.731 23.5-147.3 -88.0 122.4 0.6 0.3 -3.2 40 40 A I E + C 0 29A 15 -11,-1.3 -11,-0.6 -2,-0.6 2,-0.3 -0.759 31.7 157.7 -89.9 120.2 0.2 0.8 -6.9 41 41 A D - 0 0 27 -2,-0.6 3,-0.4 -28,-0.3 -24,-0.1 -0.998 43.3-143.3-142.6 146.6 3.3 2.4 -8.4 42 42 A Y S S+ 0 0 194 -2,-0.3 -1,-0.1 1,-0.2 -25,-0.1 0.885 105.9 53.3 -77.0 -37.3 4.8 2.5 -11.9 43 43 A S S S+ 0 0 65 -41,-0.2 2,-1.2 2,-0.1 3,-0.4 0.535 81.5 113.3 -74.8 -1.2 8.4 2.4 -10.6 44 44 A Y + 0 0 43 -3,-0.4 -29,-0.2 -42,-0.2 -42,-0.1 -0.555 29.3 123.0 -73.4 99.6 7.3 -0.7 -8.7 45 45 A G 0 0 68 -2,-1.2 -1,-0.2 1,-0.1 -43,-0.1 0.601 360.0 360.0-127.9 -34.6 9.4 -3.4 -10.5 46 46 A Q 0 0 240 -3,-0.4 -1,-0.1 0, 0.0 -3,-0.0 -0.683 360.0 360.0 -85.8 360.0 11.5 -5.0 -7.7