==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-JUL-05 2BW8 . COMPND 2 MOLECULE: ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOTHERMUS MARINUS; . AUTHOR S.J.CRENNELL,E.NORDBERG-KARLSSON . 452 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 196 43.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 46 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 2 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 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 PARALLEL BRIDGES PER LADDER . 4 8 4 4 4 0 6 0 4 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 0 0 0 2 0 0 0 0 0 0 2 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 2 A T 0 0 127 0, 0.0 2,-0.4 0, 0.0 35,-0.2 0.000 360.0 360.0 360.0 161.0 14.6 9.3 0.2 2 3 A V E -A 35 0A 37 33,-1.8 33,-3.0 2,-0.0 2,-0.6 -0.991 360.0-134.9-132.5 141.6 17.2 11.1 2.2 3 4 A E E -A 34 0A 72 -2,-0.4 2,-0.5 31,-0.2 31,-0.2 -0.877 18.3-162.5-100.2 125.8 19.9 9.5 4.5 4 5 A L E +A 33 0A 2 29,-3.1 29,-2.0 -2,-0.6 7,-0.0 -0.925 23.5 158.3-108.4 123.0 20.3 11.2 7.9 5 6 A a + 0 0 63 -2,-0.5 26,-0.5 27,-0.2 -1,-0.1 0.442 36.0 115.5-122.0 -3.3 23.5 10.5 9.8 6 7 A G S > S- 0 0 31 1,-0.1 3,-1.5 24,-0.1 18,-0.2 -0.404 73.0-121.0 -69.5 144.6 23.7 13.4 12.2 7 8 A R T 3 S+ 0 0 104 1,-0.3 17,-2.3 16,-0.1 -1,-0.1 0.855 112.0 21.8 -52.2 -40.3 23.4 12.6 15.9 8 9 A W T 3 S+ 0 0 162 15,-0.2 -1,-0.3 14,-0.1 -2,-0.1 -0.019 92.7 146.9-118.7 28.0 20.3 14.8 16.3 9 10 A D < + 0 0 49 -3,-1.5 13,-2.7 12,-0.1 14,-0.5 -0.261 19.7 172.7 -68.8 151.8 19.1 14.9 12.7 10 11 A A E -F 21 0B 16 11,-0.2 2,-0.3 12,-0.1 11,-0.2 -0.975 20.6-160.6-154.1 160.7 15.5 15.1 11.8 11 12 A R E -F 20 0B 97 9,-2.1 9,-2.7 -2,-0.3 2,-0.3 -0.966 21.4-130.5-146.6 136.4 13.0 15.5 9.0 12 13 A D E -F 19 0B 86 -2,-0.3 2,-0.3 7,-0.2 7,-0.3 -0.672 38.2-176.7 -79.6 141.0 9.3 16.5 9.0 13 14 A V E > > +F 18 0B 2 5,-2.6 5,-1.6 -2,-0.3 3,-1.4 -0.826 47.3 35.1-135.1 171.0 7.4 14.0 7.0 14 15 A A G > 5S- 0 0 32 23,-1.7 3,-1.6 1,-0.3 -1,-0.2 0.898 133.4 -48.9 50.9 48.0 3.8 13.4 5.7 15 16 A G G 3 5S- 0 0 80 22,-0.3 -1,-0.3 1,-0.3 23,-0.1 0.661 108.1 -56.2 70.5 15.0 3.0 17.1 5.3 16 17 A G G < 5S+ 0 0 15 -3,-1.4 56,-2.7 2,-0.2 -1,-0.3 0.391 111.3 116.4 96.6 -1.1 4.3 17.9 8.7 17 18 A R T < 5S+ 0 0 93 -3,-1.6 47,-0.3 -4,-0.4 2,-0.3 0.834 81.8 21.8 -70.0 -32.4 2.0 15.5 10.5 18 19 A Y E < -F 13 0B 17 -5,-1.6 -5,-2.6 45,-0.1 2,-0.4 -0.832 67.9-148.1-129.6 168.2 4.9 13.4 11.8 19 20 A R E -FG 12 62B 72 43,-1.7 43,-2.4 -2,-0.3 2,-0.4 -0.999 7.2-148.2-139.5 139.1 8.7 13.9 12.4 20 21 A V E -FG 11 61B 0 -9,-2.7 -9,-2.1 -2,-0.4 2,-0.4 -0.899 15.9-168.6-108.2 132.9 11.5 11.3 12.1 21 22 A I E -FG 10 60B 15 39,-2.8 39,-2.1 -2,-0.4 -11,-0.2 -0.981 25.6-153.2-126.6 136.2 14.5 11.7 14.4 22 23 A N - 0 0 0 -13,-2.7 36,-0.3 -2,-0.4 -14,-0.1 0.896 33.9-178.9 -71.5 -41.4 17.9 9.9 14.2 23 24 A N + 0 0 11 -14,-0.5 35,-2.2 1,-0.2 2,-1.9 0.821 16.3 176.3 49.7 56.7 18.1 10.4 18.0 24 25 A V + 0 0 4 -17,-2.3 3,-0.3 33,-0.2 33,-0.2 -0.598 21.7 152.8 -88.4 75.1 21.5 8.9 18.9 25 26 A W + 0 0 119 -2,-1.9 32,-0.2 1,-0.2 -1,-0.2 0.639 60.6 43.4 -83.7 -16.6 21.0 10.1 22.5 26 27 A G S S+ 0 0 27 30,-2.5 2,-0.3 -3,-0.2 31,-0.2 0.304 113.6 22.7-116.5 12.4 23.0 7.5 24.4 27 28 A A - 0 0 12 29,-0.6 22,-0.0 -3,-0.3 24,-0.0 -0.965 58.5-128.6-162.5 174.0 26.3 7.1 22.5 28 29 A E + 0 0 182 -2,-0.3 2,-0.1 2,-0.1 3,-0.1 0.255 67.7 119.3-115.7 8.8 28.7 8.6 20.0 29 30 A T S S- 0 0 53 1,-0.1 20,-0.1 27,-0.1 -2,-0.1 -0.441 72.9 -92.1 -74.7 150.8 28.8 5.6 17.6 30 31 A A + 0 0 33 18,-0.1 18,-2.9 -2,-0.1 2,-0.3 -0.293 46.8 169.2 -69.2 145.5 27.6 6.2 14.1 31 32 A Q E - B 0 47A 3 -26,-0.5 2,-0.4 16,-0.2 16,-0.2 -0.958 8.6-176.7-155.5 135.7 24.1 5.7 12.8 32 33 A a E - B 0 46A 3 14,-2.1 14,-1.6 -2,-0.3 13,-1.6 -0.979 5.0-166.2-131.7 148.4 22.2 6.5 9.7 33 34 A I E -AB 4 44A 0 -29,-2.0 -29,-3.1 -2,-0.4 2,-0.6 -0.977 16.2-139.6-130.3 144.9 18.6 6.1 8.7 34 35 A E E -AB 3 43A 81 9,-2.6 9,-1.9 -2,-0.4 2,-0.4 -0.942 27.6-160.2-107.8 119.3 17.2 6.4 5.1 35 36 A V E -AB 2 42A 0 -33,-3.0 -33,-1.8 -2,-0.6 2,-0.6 -0.840 20.5-142.7-111.8 133.7 13.8 8.2 5.2 36 37 A G > - 0 0 16 5,-3.0 4,-2.6 -2,-0.4 5,-0.2 -0.811 20.0-151.0 -86.0 121.5 10.9 8.3 2.8 37 38 A L T 4 S+ 0 0 72 -2,-0.6 -23,-1.7 1,-0.2 -22,-0.3 0.761 87.3 48.0 -71.6 -25.0 9.7 11.9 3.1 38 39 A E T 4 S+ 0 0 151 -25,-0.2 -1,-0.2 -24,-0.1 -25,-0.1 0.898 128.0 21.7 -82.1 -35.8 6.0 11.4 2.2 39 40 A T T 4 S- 0 0 67 2,-0.1 180,-0.2 -26,-0.1 -2,-0.2 0.718 91.9-127.9-101.6 -25.2 5.4 8.5 4.6 40 41 A G < + 0 0 1 -4,-2.6 -3,-0.1 1,-0.3 176,-0.1 0.477 53.9 153.9 85.7 1.9 8.1 8.7 7.1 41 42 A N - 0 0 25 -5,-0.2 -5,-3.0 -6,-0.1 2,-0.3 -0.383 20.8-178.0 -62.8 142.1 9.1 5.1 6.5 42 43 A F E -BC 35 216A 0 174,-2.2 174,-2.9 -7,-0.2 2,-0.4 -0.997 25.9-154.6-148.3 149.9 12.7 4.5 7.3 43 44 A T E -BC 34 215A 33 -9,-1.9 -9,-2.6 -2,-0.3 2,-0.8 -0.962 27.6-124.2-117.2 140.2 15.4 1.8 7.3 44 45 A I E +B 33 0A 1 170,-2.6 169,-2.8 -2,-0.4 -11,-0.3 -0.764 33.2 176.7 -81.1 113.5 18.4 1.9 9.6 45 46 A T E + 0 0 30 -13,-1.6 2,-0.3 -2,-0.8 -12,-0.2 0.689 64.9 20.1 -94.6 -21.0 21.3 1.7 7.1 46 47 A R E +B 32 0A 17 -14,-1.6 -14,-2.1 165,-0.1 -1,-0.3 -0.980 57.5 163.9-148.7 134.9 24.2 2.0 9.5 47 48 A A E +B 31 0A 13 -2,-0.3 165,-0.4 -16,-0.2 -16,-0.2 -0.729 5.9 175.8-153.7 100.8 24.4 1.3 13.2 48 49 A D + 0 0 73 -18,-2.9 -18,-0.1 -2,-0.2 -17,-0.1 0.231 34.8 141.8 -90.0 13.7 27.8 0.9 14.8 49 50 A H + 0 0 5 -19,-0.3 161,-2.0 161,-0.2 159,-0.1 -0.241 20.0 158.1 -66.4 143.9 26.5 0.6 18.3 50 51 A D B +H 209 0B 119 159,-0.2 159,-0.2 157,-0.1 -1,-0.1 -0.534 19.0 154.3-159.3 73.3 28.0 -1.7 20.9 51 52 A N > - 0 0 44 157,-2.7 3,-1.5 1,-0.3 2,-0.3 0.205 38.4-139.9 -98.6 11.1 26.8 -0.0 24.1 52 53 A G T 3 S- 0 0 34 1,-0.2 -1,-0.3 156,-0.2 4,-0.1 -0.480 73.9 -15.5 71.1-128.2 26.6 -2.8 26.7 53 54 A N T 3 S+ 0 0 141 -2,-0.3 2,-0.4 2,-0.1 -1,-0.2 0.392 118.4 86.5 -95.5 3.2 23.6 -2.5 29.0 54 55 A N S < S- 0 0 115 -3,-1.5 2,-0.2 154,-0.1 -3,-0.1 -0.842 84.7-108.6-107.1 141.5 22.7 1.1 28.1 55 56 A V - 0 0 20 -2,-0.4 153,-0.2 1,-0.2 3,-0.1 -0.466 27.1-169.1 -66.2 130.4 20.5 2.2 25.2 56 57 A A - 0 0 0 151,-3.0 -30,-2.5 1,-0.3 -29,-0.6 0.804 61.4 -12.2 -87.9 -35.7 22.6 3.9 22.5 57 58 A A B -I 207 0B 0 150,-1.2 150,-2.6 -32,-0.2 -1,-0.3 -0.987 40.7-151.6-161.3 164.8 19.9 5.3 20.4 58 59 A Y - 0 0 3 -35,-2.2 148,-0.2 -2,-0.3 2,-0.1 -0.570 16.2-167.7-145.3 73.5 16.2 5.4 19.6 59 60 A P + 0 0 0 0, 0.0 146,-1.8 0, 0.0 2,-0.3 -0.478 33.0 159.2 -61.1 135.5 15.6 6.3 15.9 60 61 A A E -GJ 21 204B 0 -39,-2.1 -39,-2.8 144,-0.2 2,-0.4 -0.968 45.9-131.3-157.3 166.2 11.9 7.0 15.8 61 62 A I E -GJ 20 203B 1 142,-2.5 142,-2.2 -2,-0.3 2,-0.3 -0.954 36.3-174.1-121.0 141.1 8.9 8.6 14.2 62 63 A Y E -GJ 19 202B 1 -43,-2.4 -43,-1.7 -2,-0.4 2,-0.4 -0.961 27.6-151.2-143.3 164.2 6.6 10.7 16.3 63 64 A F E S+ J 0 201B 2 138,-2.3 138,-2.6 -2,-0.3 2,-0.4 -0.997 72.5 11.1-127.9 127.2 3.3 12.6 16.6 64 65 A G E S- J 0 200B 0 -2,-0.4 7,-2.0 -47,-0.3 2,-0.6 -0.824 107.8 -19.5 108.5-145.5 3.1 15.5 19.1 65 66 A b E -R 70 0C 3 134,-3.0 2,-0.7 -2,-0.4 5,-0.3 -0.913 45.7-173.9-119.3 114.9 5.8 17.2 21.1 66 67 A H E > S-R 69 0C 27 3,-2.4 3,-2.0 -2,-0.6 -2,-0.1 -0.912 81.6 -28.5-106.7 107.8 9.2 15.6 21.7 67 68 A W T 3 S- 0 0 108 -2,-0.7 -1,-0.2 1,-0.3 48,-0.2 0.901 128.4 -46.1 50.2 46.0 11.2 17.8 24.1 68 69 A G T 3 S+ 0 0 43 1,-0.2 2,-0.8 -3,-0.1 -1,-0.3 0.259 113.8 115.2 85.9 -12.7 9.4 20.9 22.9 69 70 A A E < -R 66 0C 37 -3,-2.0 -3,-2.4 45,-0.2 2,-0.3 -0.827 50.5-168.6 -94.2 108.6 9.7 20.1 19.2 70 71 A b E -R 65 0C 71 -2,-0.8 -5,-0.2 -5,-0.3 3,-0.1 -0.732 18.3-127.2-105.4 147.5 6.1 19.6 18.0 71 72 A T > - 0 0 10 -7,-2.0 3,-0.6 -2,-0.3 2,-0.4 -0.257 49.0 -74.6 -77.8 170.7 4.6 18.3 14.8 72 73 A S T 3 S- 0 0 63 -56,-2.7 -1,-0.1 1,-0.2 -8,-0.0 -0.591 100.1 -20.9 -78.5 125.9 2.0 20.2 12.8 73 74 A N T 3 S+ 0 0 151 -2,-0.4 -1,-0.2 1,-0.1 -56,-0.0 0.869 78.2 151.0 44.9 55.4 -1.5 20.4 14.2 74 75 A S < - 0 0 14 -3,-0.6 149,-0.1 2,-0.2 -1,-0.1 0.717 54.3-129.4 -83.5 -23.6 -1.3 17.3 16.4 75 76 A G + 0 0 50 1,-0.4 -3,-0.0 -11,-0.0 -2,-0.0 0.550 58.0 161.4 83.5 3.5 -3.8 18.6 19.0 76 77 A L + 0 0 17 123,-0.1 -1,-0.4 2,-0.1 -2,-0.2 -0.795 34.7 54.7-110.0 156.1 -1.3 17.7 21.7 77 78 A P S S+ 0 0 36 0, 0.0 2,-0.3 0, 0.0 122,-0.2 0.498 74.6 157.7 -72.6 151.3 -0.5 18.2 24.5 78 79 A R E -K 198 0B 54 120,-1.5 120,-3.1 -2,-0.1 5,-0.1 -0.998 44.5-101.1-143.9 140.9 -3.9 17.2 25.8 79 80 A R E > -K 197 0B 75 -2,-0.3 3,-1.7 118,-0.3 118,-0.3 -0.354 25.4-127.9 -63.5 141.1 -5.0 16.0 29.2 80 81 A V G > S+ 0 0 6 116,-2.9 3,-2.0 113,-0.3 115,-0.2 0.899 110.1 57.7 -53.3 -43.4 -5.6 12.2 29.6 81 82 A Q G 3 S+ 0 0 88 113,-2.5 -1,-0.3 115,-0.3 114,-0.1 0.666 103.4 54.5 -66.2 -13.7 -9.0 12.9 31.0 82 83 A E G < S+ 0 0 78 -3,-1.7 144,-2.2 112,-0.2 2,-0.4 0.283 86.5 101.8-100.7 7.6 -9.9 14.7 27.8 83 84 A L E < +D 225 0A 4 -3,-2.0 142,-0.2 142,-0.2 3,-0.1 -0.784 37.8 172.0 -94.8 133.6 -9.0 11.9 25.5 84 85 A S E + 0 0 51 140,-3.1 2,-0.3 -2,-0.4 141,-0.2 0.761 70.0 4.6-106.5 -35.6 -11.7 9.7 24.1 85 86 A D E -D 224 0A 31 139,-1.6 139,-2.8 2,-0.0 -1,-0.4 -0.995 53.1-178.1-151.7 140.8 -9.8 7.6 21.6 86 87 A V E +D 223 0A 0 -2,-0.3 93,-1.8 137,-0.2 94,-1.0 -0.946 17.1 174.0-141.9 117.8 -6.1 7.2 20.6 87 88 A R E -DE 222 178A 79 135,-2.1 135,-2.2 -2,-0.4 2,-0.3 -0.915 6.2-178.3-127.9 153.5 -5.2 4.8 17.8 88 89 A T E -DE 221 177A 1 89,-1.2 89,-2.8 -2,-0.3 2,-0.3 -0.995 11.0-159.6-151.5 152.9 -2.1 3.9 16.0 89 90 A S E +D 220 0A 19 131,-2.0 131,-1.7 -2,-0.3 2,-0.3 -0.948 18.2 161.7-129.5 151.0 -0.8 1.6 13.2 90 91 A W E - 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