==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-APR-12 2LRP . COMPND 2 MOLECULE: ENDOGLUCANASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM THERMOCELLUM; . AUTHOR A.VIEGAS,E.J.CABRITA . 172 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9468.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 52.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 39.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 1 0.6 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 . 11 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 3.5 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+4), 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 . 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 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 PARALLEL BRIDGES PER LADDER . 2 1 1 2 3 1 1 1 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 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 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 0 206 0, 0.0 3,-0.5 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 140.8 16.5 -10.2 -14.8 2 2 A A T 3 - 0 0 91 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.498 360.0 -1.3 -81.1 148.1 15.0 -13.2 -13.0 3 3 A S T 3 S+ 0 0 140 -2,-0.2 -1,-0.2 4,-0.1 3,-0.1 0.713 108.4 90.1 51.3 32.7 16.5 -15.1 -10.1 4 4 A A S < S+ 0 0 76 -3,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.520 80.1 43.5-130.6 -18.5 19.7 -12.9 -10.0 5 5 A V S S- 0 0 101 -4,-0.3 2,-1.9 2,-0.1 -1,-0.2 -0.901 90.6 -91.8-134.5 160.3 19.0 -10.0 -7.6 6 6 A G S S+ 0 0 48 -2,-0.3 163,-2.7 164,-0.1 2,-0.3 -0.461 79.6 109.2 -77.4 70.3 17.3 -9.5 -4.1 7 7 A E E -A 168 0A 83 -2,-1.9 2,-0.3 161,-0.2 161,-0.2 -0.981 42.0-167.3-138.1 152.9 13.6 -8.8 -5.0 8 8 A K E -A 167 0A 134 159,-2.5 159,-3.0 -2,-0.3 2,-0.3 -0.999 26.8-111.0-142.3 137.2 10.3 -10.8 -4.7 9 9 A M E +A 166 0A 120 -2,-0.3 157,-0.3 157,-0.2 3,-0.1 -0.512 30.0 171.1 -80.2 131.5 6.9 -10.2 -6.2 10 10 A L E S- 0 0 23 155,-2.3 2,-0.3 -2,-0.3 156,-0.2 0.880 76.9 -19.3 -91.2 -60.0 3.8 -9.1 -4.3 11 11 A D E +A 165 0A 28 154,-1.5 154,-2.2 1,-0.1 -1,-0.2 -0.925 48.0 167.1-155.3 128.1 1.5 -8.3 -7.2 12 12 A D - 0 0 7 -2,-0.3 28,-0.2 152,-0.2 26,-0.2 0.160 55.7-118.2-121.8 14.5 2.1 -7.5 -11.0 13 13 A F S S+ 0 0 6 1,-0.1 28,-0.1 3,-0.1 4,-0.1 0.406 72.5 131.8 68.8 7.4 -1.6 -7.9 -12.0 14 14 A E S S+ 0 0 106 26,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.278 71.3 41.4 -74.7 13.2 -1.2 -10.9 -14.4 15 15 A G S S- 0 0 63 1,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.154 110.9 -37.8-124.1-142.1 -4.1 -12.8 -12.7 16 16 A V - 0 0 143 -2,-0.1 2,-0.7 1,-0.0 -3,-0.1 -0.817 63.6-106.2 -95.0 138.2 -7.6 -11.9 -11.3 17 17 A L + 0 0 55 -2,-0.4 14,-0.0 1,-0.2 16,-0.0 -0.506 40.5 171.6 -71.4 104.5 -8.1 -8.5 -9.4 18 18 A N + 0 0 87 -2,-0.7 41,-0.2 41,-0.1 -1,-0.2 0.387 36.7 121.5 -90.8 -2.2 -8.4 -9.2 -5.6 19 19 A W - 0 0 47 39,-0.1 39,-0.2 1,-0.1 2,-0.1 -0.347 55.9-126.0 -74.7 147.1 -8.2 -5.6 -4.5 20 20 A G E -F 57 0B 26 37,-2.6 37,-0.6 -2,-0.1 2,-0.3 -0.418 19.0-168.5 -81.6 161.0 -10.9 -3.8 -2.4 21 21 A S E +F 56 0B 57 35,-0.2 2,-0.3 -2,-0.1 35,-0.2 -0.975 16.0 148.4-143.9 149.3 -12.9 -0.5 -3.1 22 22 A Y E +F 55 0B 107 33,-1.9 33,-2.8 -2,-0.3 2,-0.3 -0.963 9.5 168.8-166.5 162.8 -15.2 1.6 -0.9 23 23 A S E -F 54 0B 50 -2,-0.3 2,-0.3 31,-0.2 31,-0.2 -0.965 8.7-171.5-159.0 173.0 -16.3 5.3 -0.3 24 24 A G E > +F 53 0B 15 29,-1.9 3,-1.2 -2,-0.3 29,-1.1 -0.962 59.0 39.1-163.1 172.1 -18.7 7.8 1.4 25 25 A E T 3 S- 0 0 124 -2,-0.3 27,-0.2 1,-0.2 25,-0.2 0.860 127.6 -43.4 54.8 47.4 -19.7 11.5 1.5 26 26 A G T 3 S+ 0 0 53 1,-0.3 -1,-0.2 23,-0.1 2,-0.1 0.204 109.7 113.1 90.2 -10.8 -19.5 12.3 -2.3 27 27 A A < - 0 0 5 -3,-1.2 -1,-0.3 26,-0.2 2,-0.3 -0.478 45.4-167.2 -82.6 162.1 -16.2 10.5 -3.1 28 28 A K E -B 47 0A 137 19,-2.4 19,-1.4 -2,-0.1 2,-0.3 -0.967 10.4-150.5-148.0 157.8 -16.1 7.4 -5.4 29 29 A V E +B 46 0A 26 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.992 10.6 178.2-133.7 143.0 -13.7 4.5 -6.5 30 30 A S E -B 45 0A 64 15,-2.3 15,-2.5 -2,-0.3 2,-0.4 -0.848 10.2-166.0-143.0 107.3 -13.3 2.4 -9.7 31 31 A T E +B 44 0A 37 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.803 19.3 163.7 -91.5 129.4 -10.4 -0.2 -10.0 32 32 A K E -B 43 0A 80 11,-2.8 11,-3.0 -2,-0.4 2,-0.2 -0.997 37.8-108.9-146.7 148.7 -9.6 -1.6 -13.5 33 33 A I E +B 42 0A 79 -2,-0.3 9,-0.3 9,-0.2 2,-0.2 -0.498 43.5 158.4 -72.3 142.6 -6.9 -3.6 -15.5 34 34 A V E -B 41 0A 40 7,-1.6 7,-2.8 -2,-0.2 2,-0.3 -0.729 47.9 -66.0-142.1-171.3 -4.8 -1.7 -18.1 35 35 A S E +B 40 0A 109 5,-0.3 5,-0.3 -2,-0.2 2,-0.2 -0.712 59.5 171.4 -84.7 142.2 -1.4 -2.1 -19.8 36 36 A G - 0 0 21 3,-1.8 5,-0.2 -2,-0.3 127,-0.1 -0.753 48.3 -60.5-145.4-171.1 1.8 -1.9 -17.6 37 37 A K S S+ 0 0 91 -2,-0.2 2,-0.3 1,-0.2 4,-0.1 0.631 126.4 12.6 -58.7 -21.2 5.6 -2.3 -17.2 38 38 A T S S- 0 0 85 2,-0.3 -1,-0.2 -26,-0.2 126,-0.2 -0.898 133.0 -37.6-148.0 131.0 5.3 -6.0 -18.0 39 39 A G S S- 0 0 53 -2,-0.3 -3,-1.8 -3,-0.1 2,-0.2 -0.376 117.6 -0.8 57.2-121.4 2.1 -7.5 -19.5 40 40 A N E -B 35 0A 37 -5,-0.3 -5,-0.3 -2,-0.2 -2,-0.3 -0.559 61.3-166.3 -98.5 160.3 -0.9 -5.7 -17.8 41 41 A G E -B 34 0A 0 -7,-2.8 -7,-1.6 -2,-0.2 2,-0.4 -0.556 21.5-112.8-118.7-170.8 -1.1 -3.0 -15.1 42 42 A M E -BC 33 162A 9 120,-2.3 120,-2.5 -9,-0.3 2,-0.3 -0.994 21.2-165.1-135.0 133.2 -3.9 -1.6 -12.8 43 43 A E E -BC 32 161A 40 -11,-3.0 -11,-2.8 -2,-0.4 2,-0.4 -0.844 3.9-160.1-105.7 145.2 -5.5 1.8 -13.0 44 44 A V E -BC 31 160A 19 116,-3.1 116,-2.5 -2,-0.3 2,-0.3 -0.976 5.2-164.4-132.0 122.4 -7.7 3.3 -10.2 45 45 A S E -BC 30 159A 19 -15,-2.5 -15,-2.3 -2,-0.4 2,-0.3 -0.744 13.1-179.0-101.6 149.5 -10.1 6.2 -10.8 46 46 A Y E -BC 29 158A 22 112,-2.9 112,-1.6 -2,-0.3 2,-0.4 -0.990 34.5-148.1-141.4 153.3 -11.8 8.4 -8.1 47 47 A T E -B 28 0A 53 -19,-1.4 -19,-2.4 -2,-0.3 2,-0.3 -0.948 38.2-160.5 -99.2 142.5 -14.1 11.2 -7.2 48 48 A G - 0 0 10 -2,-0.4 2,-0.2 107,-0.3 109,-0.1 -0.907 15.4-179.5-122.4 151.9 -12.6 12.8 -3.9 49 49 A T - 0 0 39 -2,-0.3 -23,-0.1 105,-0.2 105,-0.1 -0.601 29.8-121.6-129.1-167.3 -14.1 15.1 -1.1 50 50 A T S S+ 0 0 111 -2,-0.2 -1,-0.1 -25,-0.2 104,-0.0 0.820 104.4 30.4-106.0 -49.0 -12.7 16.8 2.1 51 51 A D S S+ 0 0 132 -26,-0.1 -26,-0.1 2,-0.1 0, 0.0 0.434 113.0 74.8 -93.3 -1.7 -14.7 15.5 5.1 52 52 A G S S- 0 0 5 -27,-0.2 2,-0.3 -28,-0.1 -27,-0.2 0.188 75.2-119.4 -87.9-152.7 -15.5 12.0 3.5 53 53 A Y E -F 24 0B 105 -29,-1.1 -29,-1.9 -26,-0.0 2,-0.3 -0.963 20.5-179.3-159.7 139.0 -13.4 8.9 2.8 54 54 A W E +F 23 0B 6 -2,-0.3 2,-0.3 -31,-0.2 -31,-0.2 -0.977 20.3 168.6-150.0 129.9 -12.4 6.9 -0.4 55 55 A G E -F 22 0B 0 -33,-2.8 -33,-1.9 -2,-0.3 2,-0.3 -0.969 29.6-163.2-155.9 153.4 -10.3 3.7 -0.3 56 56 A T E -F 21 0B 13 -2,-0.3 94,-2.1 -35,-0.2 2,-0.3 -0.986 23.8-160.4-146.4 141.6 -8.8 0.6 -1.9 57 57 A V E -FG 20 149B 29 -37,-0.6 -37,-2.6 -2,-0.3 2,-0.3 -0.896 12.7-163.8-135.8 151.7 -7.4 -2.5 -0.1 58 58 A Y E - G 0 148B 12 90,-2.3 90,-2.7 -2,-0.3 2,-0.4 -0.995 7.7-156.3-139.7 137.5 -5.1 -5.6 -0.5 59 59 A S E - G 0 147B 78 -2,-0.3 88,-0.2 88,-0.2 -41,-0.1 -0.915 29.3-127.8-111.0 132.0 -4.7 -8.8 1.6 60 60 A L - 0 0 30 86,-0.6 3,-0.1 -2,-0.4 -50,-0.0 -0.526 15.3-146.8 -93.0 150.3 -1.3 -10.5 1.2 61 61 A P S S+ 0 0 109 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.621 97.2 33.7 -79.1 -17.0 -0.1 -14.2 0.4 62 62 A D + 0 0 78 1,-0.0 3,-0.1 -52,-0.0 -2,-0.0 -0.997 51.5 163.9-138.0 141.6 2.9 -13.6 2.7 63 63 A G + 0 0 5 -2,-0.3 82,-2.7 80,-0.1 29,-0.1 -0.052 62.5 85.8-138.2 25.0 3.1 -11.5 6.0 64 64 A D + 0 0 86 80,-0.2 3,-0.3 1,-0.1 79,-0.3 -0.388 44.8 135.4-129.4 41.2 6.4 -12.9 7.4 65 65 A W > + 0 0 19 77,-1.7 3,-2.1 1,-0.2 78,-0.2 -0.035 11.2 137.9-100.5 32.8 9.0 -10.7 5.6 66 66 A S T 3 S+ 0 0 72 76,-0.3 -1,-0.2 1,-0.3 77,-0.1 0.763 72.4 55.7 -39.7 -40.2 11.4 -9.8 8.6 67 67 A K T 3 S+ 0 0 173 -3,-0.3 103,-0.3 75,-0.1 -1,-0.3 0.619 93.2 85.7 -78.4 -13.7 14.5 -10.4 6.3 68 68 A W < - 0 0 56 -3,-2.1 101,-0.2 101,-0.1 74,-0.1 -0.490 57.7-163.5 -90.4 155.7 13.4 -7.9 3.6 69 69 A L + 0 0 55 99,-2.5 51,-2.5 1,-0.2 2,-0.3 0.767 59.9 22.0-112.4 -36.7 14.1 -4.1 3.8 70 70 A K E -DE 119 168A 59 98,-2.0 98,-2.7 49,-0.3 -1,-0.2 -0.944 55.9-132.0-135.2 154.2 11.7 -2.2 1.4 71 71 A I E -DE 118 167A 16 47,-2.5 47,-1.6 -2,-0.3 2,-0.3 -0.652 29.3-163.0 -84.7 161.7 8.5 -2.2 -0.6 72 72 A S E +DE 117 166A 0 94,-2.2 94,-2.8 -2,-0.2 2,-0.3 -0.976 16.1 162.6-143.4 138.7 8.7 -1.2 -4.3 73 73 A F E -D 116 0A 19 43,-0.7 43,-2.9 -2,-0.3 2,-0.6 -0.974 35.3-132.1-139.4 160.7 6.1 -0.2 -6.9 74 74 A D E +DE 115 163A 5 89,-2.0 89,-1.8 -2,-0.3 2,-0.3 -0.955 51.4 158.4-108.6 108.9 6.2 1.6 -10.3 75 75 A I E -DE 114 162A 21 39,-1.5 39,-0.9 -2,-0.6 35,-0.4 -0.925 25.8-167.7-139.3 146.3 3.4 4.2 -9.9 76 76 A K E - 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