==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-AUG-10 3OEB . COMPND 2 MOLECULE: S-LAYER ASSOCIATED MULTIDOMAIN ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CALDANAEROBIUS POLYSACCHAROLYTICUS; . AUTHOR V.AGARWAL,S.K.NAIR . 144 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6883.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 59.0 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 . 58 40.3 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 . 0 0.0 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 . 13 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.9 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 1 0 2 0 3 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 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 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 0 210 0, 0.0 2,-0.4 0, 0.0 143,-0.1 0.000 360.0 360.0 360.0 131.4 -21.5 -2.2 2.3 2 2 A V - 0 0 102 141,-0.3 2,-0.6 2,-0.0 141,-0.5 -0.964 360.0-146.7-125.0 127.6 -21.6 0.6 4.9 3 3 A N B -A 142 0A 47 -2,-0.4 139,-0.2 139,-0.1 137,-0.1 -0.834 9.5-158.6 -86.6 121.6 -19.6 3.8 5.2 4 4 A M + 0 0 60 137,-3.3 2,-0.4 -2,-0.6 -1,-0.1 0.653 64.6 97.7 -74.6 -17.4 -19.2 4.5 8.9 5 5 A V S S- 0 0 7 136,-0.3 2,-0.3 134,-0.1 -2,-0.1 -0.614 72.6-134.6 -79.0 127.3 -18.5 8.2 8.3 6 6 A S S S+ 0 0 60 -2,-0.4 4,-0.1 1,-0.3 -2,-0.1 -0.637 87.1 0.4 -79.4 137.3 -21.4 10.5 8.7 7 7 A N S > S+ 0 0 16 -2,-0.3 3,-1.5 1,-0.1 -1,-0.3 0.934 81.7 175.7 49.7 54.9 -21.9 13.1 5.9 8 8 A P T 3 S+ 0 0 43 0, 0.0 131,-2.4 0, 0.0 130,-0.2 0.639 73.2 41.0 -72.6 -16.0 -18.8 11.6 4.2 9 9 A G T 3 S- 0 0 7 129,-0.2 27,-0.3 128,-0.2 24,-0.1 0.229 105.4-121.1-112.4 10.0 -19.0 13.8 1.1 10 10 A F S X S+ 0 0 0 -3,-1.5 3,-1.6 5,-0.1 27,-0.1 0.694 70.7 136.1 57.2 21.3 -19.9 17.1 2.8 11 11 A E T 3 S+ 0 0 81 1,-0.3 -1,-0.1 25,-0.1 3,-0.1 0.742 72.7 51.2 -71.7 -22.2 -23.1 17.1 0.8 12 12 A D T > S- 0 0 107 1,-0.4 3,-1.2 3,-0.1 -1,-0.3 0.018 116.9-121.9 -94.2 24.2 -25.0 18.1 4.0 13 13 A G T < S- 0 0 16 -3,-1.6 -1,-0.4 1,-0.2 14,-0.1 -0.556 72.7 -21.8 73.0-132.0 -22.4 20.9 4.5 14 14 A L T > S+ 0 0 58 -2,-0.3 3,-2.1 12,-0.1 -1,-0.2 0.284 92.7 143.4 -96.7 10.0 -20.6 20.6 7.8 15 15 A D T < S+ 0 0 100 -3,-1.2 -3,-0.1 1,-0.3 -5,-0.1 -0.212 73.1 9.5 -50.3 133.8 -23.3 18.5 9.5 16 16 A S T 3 S+ 0 0 79 1,-0.2 2,-0.5 -4,-0.0 -1,-0.3 0.353 105.1 111.1 76.2 -3.7 -21.8 15.8 11.8 17 17 A W < - 0 0 16 -3,-2.1 2,-0.3 33,-0.1 33,-0.2 -0.897 62.2-138.7-106.8 127.8 -18.3 17.3 11.6 18 18 A Q E -F 49 0B 79 31,-3.0 31,-1.1 -2,-0.5 2,-0.7 -0.629 10.2-148.4 -78.2 139.4 -16.6 19.1 14.5 19 19 A D E +F 48 0B 54 -2,-0.3 3,-0.3 29,-0.2 29,-0.2 -0.908 17.9 178.9-112.9 101.9 -14.7 22.3 13.6 20 20 A W S S+ 0 0 74 27,-1.7 28,-0.1 -2,-0.7 -1,-0.1 0.775 78.8 24.3 -80.6 -28.7 -11.8 22.5 16.0 21 21 A Q S S- 0 0 55 26,-0.7 -1,-0.2 0, 0.0 27,-0.1 0.155 102.5-113.5-123.3 16.8 -10.1 25.8 14.8 22 22 A Q S S+ 0 0 156 -3,-0.3 26,-0.1 25,-0.2 -2,-0.1 0.908 86.3 115.0 50.4 50.2 -13.0 27.5 13.1 23 23 A D + 0 0 32 24,-0.2 18,-2.2 17,-0.0 2,-0.4 0.033 44.2 101.1-138.2 23.6 -11.3 27.1 9.8 24 24 A M E +B 40 0A 17 16,-0.2 2,-0.3 23,-0.1 16,-0.2 -0.908 37.0 168.6-118.6 142.1 -13.6 24.8 7.9 25 25 A S E -B 39 0A 47 14,-1.9 14,-3.1 -2,-0.4 2,-0.8 -0.985 32.9-130.0-149.4 142.7 -16.3 25.5 5.2 26 26 A A E +B 38 0A 27 -2,-0.3 12,-0.2 12,-0.2 -12,-0.1 -0.852 47.6 157.9 -92.7 111.0 -18.3 23.3 2.9 27 27 A V E > -B 37 0A 27 10,-2.0 10,-1.9 -2,-0.8 3,-1.0 -0.927 53.2-119.5-137.7 154.6 -17.8 24.9 -0.6 28 28 A P G > S+ 0 0 95 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.813 107.8 66.2 -65.0 -31.2 -18.1 23.9 -4.3 29 29 A E G 3 S+ 0 0 96 1,-0.3 9,-0.1 8,-0.1 7,-0.1 0.750 102.6 49.5 -61.3 -24.0 -14.4 24.7 -5.0 30 30 A A G < S+ 0 0 0 -3,-1.0 8,-0.4 7,-0.3 2,-0.3 0.372 84.9 119.8 -97.0 0.6 -13.5 21.8 -2.7 31 31 A A < + 0 0 24 -3,-1.7 6,-0.2 6,-0.3 3,-0.1 -0.528 26.8 166.6 -74.8 128.3 -15.9 19.2 -4.3 32 32 A H S S+ 0 0 51 1,-0.5 2,-0.3 4,-0.4 -1,-0.2 0.716 81.4 12.1 -97.7 -41.9 -14.4 16.1 -5.8 33 33 A N S S+ 0 0 77 3,-0.3 -1,-0.5 -24,-0.1 3,-0.3 -0.940 121.5 5.5-129.9 157.5 -17.8 14.4 -6.1 34 34 A G S S- 0 0 63 -2,-0.3 -24,-0.0 1,-0.2 -3,-0.0 -0.286 106.7 -56.9 66.3-156.4 -21.3 15.9 -5.7 35 35 A A S S+ 0 0 65 1,-0.0 2,-0.3 -5,-0.0 -4,-0.2 0.657 112.4 41.9 -96.6 -19.2 -21.8 19.7 -5.2 36 36 A L + 0 0 40 -3,-0.3 -4,-0.4 -27,-0.3 -3,-0.3 -0.903 50.1 177.2-132.9 154.9 -19.6 20.3 -2.1 37 37 A G E -B 27 0A 0 -10,-1.9 -10,-2.0 -2,-0.3 2,-0.6 -0.893 39.9 -90.8-141.0 175.3 -16.3 19.4 -0.5 38 38 A L E -BC 26 136A 0 98,-2.9 98,-2.2 -8,-0.4 2,-0.5 -0.817 32.6-163.8 -92.9 124.3 -14.5 20.5 2.7 39 39 A K E -BC 25 135A 44 -14,-3.1 -14,-1.9 -2,-0.6 2,-0.6 -0.933 2.9-166.1-102.2 124.3 -12.2 23.4 2.5 40 40 A I E -BC 24 134A 0 94,-2.8 94,-2.6 -2,-0.5 -16,-0.2 -0.963 30.6-122.6-106.3 114.1 -9.7 23.8 5.4 41 41 A G - 0 0 12 -18,-2.2 3,-0.5 -2,-0.6 92,-0.1 -0.255 23.8-121.6 -64.5 140.0 -8.3 27.4 5.1 42 42 A G S S+ 0 0 24 89,-0.4 89,-0.2 1,-0.2 91,-0.2 -0.042 78.8 62.9 -71.8 173.5 -4.5 27.9 4.7 43 43 A G S S+ 0 0 51 87,-2.9 2,-0.3 89,-0.3 -1,-0.2 0.105 100.7 40.1 102.0 -21.7 -2.1 29.8 6.9 44 44 A K S S- 0 0 101 -3,-0.5 2,-0.2 84,-0.2 84,-0.1 -0.977 92.0 -89.6-151.3 156.3 -2.5 28.0 10.2 45 45 A A + 0 0 36 -2,-0.3 2,-0.3 82,-0.2 82,-0.2 -0.515 61.1 151.3 -68.8 131.8 -2.8 24.3 11.4 46 46 A A E + G 0 126B 1 80,-1.9 80,-2.7 -2,-0.2 2,-0.3 -0.990 11.4 145.8-159.4 158.5 -6.4 23.3 11.6 47 47 A G E - G 0 125B 0 -2,-0.3 -27,-1.7 78,-0.2 -26,-0.7 -0.958 20.1-147.2-172.0-168.1 -8.8 20.4 11.3 48 48 A G E +FG 19 124B 0 76,-1.8 76,-3.4 -2,-0.3 2,-0.3 -0.926 17.3 161.2-163.8-179.2 -12.0 18.7 12.4 49 49 A G E -FG 18 123B 0 -31,-1.1 -31,-3.0 -2,-0.3 2,-0.3 -0.982 24.3-113.6 177.2-169.2 -13.5 15.2 12.8 50 50 A Q E - G 0 122B 10 72,-1.9 72,-2.9 -2,-0.3 2,-0.3 -0.988 28.4-105.9-154.9 150.4 -16.1 12.9 14.3 51 51 A D E - G 0 121B 93 -2,-0.3 70,-0.2 70,-0.2 -2,-0.0 -0.624 33.7-171.8 -74.7 134.0 -16.4 10.1 16.8 52 52 A I - 0 0 4 68,-2.4 2,-0.4 -2,-0.3 -47,-0.1 -0.904 18.0-142.0-132.3 106.6 -16.9 6.7 15.2 53 53 A P - 0 0 96 0, 0.0 2,-0.3 0, 0.0 66,-0.1 -0.539 27.6-164.7 -64.2 118.0 -17.7 3.6 17.4 54 54 A L - 0 0 15 -2,-0.4 -2,-0.0 1,-0.0 0, 0.0 -0.776 19.9-111.3-106.3 152.6 -15.8 0.8 15.8 55 55 A K > - 0 0 113 -2,-0.3 3,-0.6 1,-0.1 57,-0.2 -0.550 36.2-112.6 -76.5 144.2 -16.2 -3.0 16.3 56 56 A P T 3 S+ 0 0 61 0, 0.0 58,-0.2 0, 0.0 3,-0.1 -0.395 96.1 16.9 -72.1 158.2 -13.4 -4.8 18.1 57 57 A N T 3 S+ 0 0 97 56,-1.7 2,-0.4 55,-0.3 57,-0.1 0.838 98.9 134.4 48.5 42.3 -11.3 -7.4 16.3 58 58 A T < - 0 0 19 -3,-0.6 54,-2.5 55,-0.2 2,-0.5 -0.953 54.0-132.5-129.2 140.0 -12.5 -5.9 13.0 59 59 A T E -D 111 0A 45 85,-0.4 85,-2.3 -2,-0.4 2,-0.3 -0.797 30.2-178.6 -95.8 129.8 -10.6 -5.0 9.8 60 60 A Y E -DE 110 143A 0 50,-3.0 50,-2.2 -2,-0.5 2,-0.4 -0.911 22.9-139.3-127.2 151.9 -11.4 -1.6 8.2 61 61 A I E -DE 109 142A 35 81,-2.6 81,-2.2 -2,-0.3 2,-0.4 -0.924 14.5-164.3-105.6 138.3 -10.4 0.4 5.3 62 62 A L E +DE 108 141A 0 46,-2.2 46,-2.5 -2,-0.4 2,-0.3 -0.996 21.2 157.6-118.9 127.2 -9.8 4.2 5.6 63 63 A G E +DE 107 140A 0 77,-2.3 77,-3.3 -2,-0.4 2,-0.3 -0.962 11.0 169.1-146.1 160.4 -9.7 6.3 2.4 64 64 A A E -D 106 0A 0 42,-1.8 42,-2.0 -2,-0.3 2,-0.4 -0.968 29.6-123.7-164.8 156.4 -10.2 9.9 1.2 65 65 A W E +DE 105 137A 65 72,-2.2 72,-2.2 -2,-0.3 2,-0.3 -0.911 41.6 161.2-101.0 135.0 -9.8 12.2 -1.7 66 66 A A E +DE 104 136A 0 38,-2.3 38,-2.1 -2,-0.4 2,-0.3 -0.993 17.0 170.6-150.9 156.5 -7.7 15.3 -1.1 67 67 A K E - E 0 135A 50 68,-2.3 68,-3.3 -2,-0.3 2,-0.3 -0.933 25.3-133.6-158.5 147.9 -5.7 18.1 -2.7 68 68 A F E - E 0 134A 0 32,-2.7 66,-0.2 -2,-0.3 3,-0.1 -0.748 18.7-136.5 -90.6 151.2 -4.0 21.4 -1.7 69 69 A D S S+ 0 0 69 64,-2.4 2,-0.3 -2,-0.3 65,-0.1 0.467 89.2 16.7 -87.8 -1.4 -4.7 24.4 -4.0 70 70 A S S S- 0 0 56 63,-0.3 60,-0.1 30,-0.1 -1,-0.0 -0.942 108.2 -66.9-157.4 162.6 -1.0 25.4 -3.9 71 71 A K - 0 0 183 -2,-0.3 61,-0.3 1,-0.1 60,-0.2 -0.396 56.3-144.8 -62.4 124.9 2.2 23.6 -2.9 72 72 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 -0.429 15.7-145.7 -85.4 164.0 2.2 22.9 0.9 73 73 A A S S+ 0 0 84 -2,-0.1 55,-0.0 59,-0.1 2,-0.0 0.821 88.1 10.1 -88.5 -43.8 5.1 22.9 3.4 74 74 A G S S- 0 0 28 1,-0.1 2,-0.3 52,-0.0 52,-0.0 0.147 92.3 -85.7-108.8-137.5 3.6 20.1 5.5 75 75 A T - 0 0 42 50,-0.0 53,-1.6 -2,-0.0 52,-0.5 -0.836 13.2-125.0-135.0 168.3 0.8 17.7 5.0 76 76 A F E -HI 98 126B 0 22,-2.6 22,-2.6 -2,-0.3 2,-0.4 -0.992 35.7-157.8-112.3 131.1 -2.9 17.0 5.3 77 77 A D E -HI 97 125B 26 48,-3.1 48,-3.0 -2,-0.4 2,-0.5 -0.906 18.3-159.6-117.9 136.6 -3.7 13.9 7.3 78 78 A V E -HI 96 124B 0 18,-2.1 18,-2.6 -2,-0.4 2,-0.4 -0.976 32.7-179.7-109.8 123.1 -6.7 11.6 7.5 79 79 A V E -HI 95 123B 7 44,-2.7 44,-2.8 -2,-0.5 2,-0.5 -0.959 35.6-160.2-136.0 136.8 -6.5 9.7 10.7 80 80 A V E +HI 94 122B 2 14,-1.9 14,-3.0 -2,-0.4 2,-0.4 -0.992 32.8 177.6-108.8 125.5 -8.2 7.1 12.8 81 81 A Q E +HI 93 121B 22 40,-2.4 40,-2.5 -2,-0.5 2,-0.3 -0.980 11.5 138.7-135.6 142.2 -7.0 7.4 16.4 82 82 A Y E -H 92 0B 5 10,-1.9 10,-2.8 -2,-0.4 2,-0.3 -0.970 43.9-100.3-168.2 163.8 -7.8 5.7 19.7 83 83 A H E -H 91 0B 56 -2,-0.3 34,-3.3 8,-0.2 35,-1.0 -0.708 31.3-123.2 -91.7 147.6 -6.2 4.2 22.9 84 84 A L B -J 116 0C 46 6,-3.1 2,-1.0 -2,-0.3 32,-0.2 -0.546 27.8-117.7 -76.3 155.4 -5.6 0.5 23.5 85 85 A K S S+ 0 0 132 30,-1.2 2,-0.2 -2,-0.2 31,-0.1 -0.598 72.3 111.1-100.3 71.3 -7.2 -0.8 26.6 86 86 A D S S- 0 0 68 -2,-1.0 3,-0.3 4,-0.1 -3,-0.0 -0.552 88.4 -75.3-123.6-169.4 -4.2 -1.9 28.6 87 87 A A S S+ 0 0 103 1,-0.2 -2,-0.0 -2,-0.2 0, 0.0 0.702 131.4 35.4 -63.8 -19.4 -2.3 -0.7 31.7 88 88 A N S S- 0 0 133 2,-0.0 -1,-0.2 0, 0.0 3,-0.1 0.578 96.1-130.0-111.0 -14.7 -0.9 2.3 29.8 89 89 A N - 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