==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-DEC-07 2ZEW . COMPND 2 MOLECULE: S-LAYER ASSOCIATED MULTIDOMAIN ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOANAEROBACTERIUM . AUTHOR B.BAE,S.K.NAIR . 293 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 61.8 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 . 120 41.0 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 . 31 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 5.5 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 . 4 2 3 2 0 4 0 6 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 2 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 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 S 0 0 95 0, 0.0 2,-0.2 0, 0.0 154,-0.1 0.000 360.0 360.0 360.0 -25.7 46.0 34.5 5.7 2 2 A H - 0 0 71 150,-0.1 2,-0.2 151,-0.1 150,-0.2 -0.478 360.0-117.5 -96.5 154.5 42.4 34.2 4.4 3 3 A M E -A 151 0A 0 148,-2.0 148,-2.9 -2,-0.2 2,-0.5 -0.652 23.2-145.9 -80.1 148.3 39.2 32.6 5.7 4 4 A V E -A 150 0A 41 141,-0.4 141,-0.8 -2,-0.2 2,-0.5 -0.966 7.5-144.8-116.9 115.4 37.8 29.8 3.6 5 5 A N E -AB 149 144A 5 144,-3.3 144,-2.6 -2,-0.5 139,-0.2 -0.669 5.5-161.7 -77.4 121.3 34.0 29.6 3.6 6 6 A M + 0 0 27 137,-3.1 2,-0.5 -2,-0.5 -1,-0.1 0.560 63.3 97.4 -80.4 -9.4 33.0 25.9 3.5 7 7 A V S S- 0 0 1 136,-0.2 2,-0.3 142,-0.1 142,-0.2 -0.696 72.0-136.3 -84.1 124.8 29.5 26.8 2.4 8 8 A S S S+ 0 0 57 -2,-0.5 4,-0.1 1,-0.2 -2,-0.1 -0.597 85.8 2.0 -78.0 140.3 28.9 26.6 -1.4 9 9 A N S > S+ 0 0 18 -2,-0.3 3,-1.4 1,-0.1 -1,-0.2 0.921 81.5 172.7 49.7 52.3 26.9 29.5 -2.9 10 10 A P T 3 S+ 0 0 29 0, 0.0 131,-2.0 0, 0.0 130,-0.3 0.680 72.5 42.1 -70.6 -22.1 26.7 31.1 0.6 11 11 A G T 3 S- 0 0 7 129,-0.2 27,-0.3 128,-0.2 24,-0.2 0.271 105.7-122.1-105.8 7.8 25.1 34.4 -0.6 12 12 A F S X S+ 0 0 0 -3,-1.4 3,-1.5 5,-0.1 27,-0.1 0.685 70.1 136.9 58.6 22.3 22.6 32.8 -3.0 13 13 A E T 3 S+ 0 0 78 1,-0.3 -1,-0.1 25,-0.1 3,-0.1 0.702 72.0 50.5 -73.4 -19.1 24.2 34.9 -5.7 14 14 A D T > S- 0 0 107 1,-0.4 3,-1.7 3,-0.2 -1,-0.3 -0.122 114.7-122.4-102.8 32.8 24.1 31.8 -8.0 15 15 A G T < S- 0 0 19 -3,-1.5 -1,-0.4 1,-0.2 14,-0.1 -0.435 73.3 -21.9 68.2-134.0 20.4 31.2 -7.2 16 16 A L T > S+ 0 0 55 -2,-0.2 3,-1.9 12,-0.1 -1,-0.2 0.232 94.1 141.4 -94.9 10.6 19.7 27.8 -5.7 17 17 A D T < S+ 0 0 103 -3,-1.7 -3,-0.2 1,-0.2 -5,-0.1 -0.285 72.7 9.9 -52.7 134.5 22.9 26.2 -7.0 18 18 A S T 3 S+ 0 0 80 1,-0.2 2,-0.4 -11,-0.0 -1,-0.2 0.401 106.9 106.4 76.0 0.4 24.6 23.8 -4.5 19 19 A W < - 0 0 20 -3,-1.9 2,-0.4 33,-0.1 -1,-0.2 -0.906 64.5-136.7-111.0 138.0 21.6 23.8 -2.2 20 20 A Q E -G 51 0B 84 31,-3.0 31,-1.4 -2,-0.4 2,-0.7 -0.781 10.7-150.6 -85.9 137.2 19.1 21.0 -1.7 21 21 A D E -G 50 0B 30 -2,-0.4 3,-0.5 29,-0.2 29,-0.2 -0.917 13.3-174.1-110.1 101.1 15.4 22.2 -1.6 22 22 A W S S+ 0 0 87 27,-1.7 28,-0.2 -2,-0.7 -1,-0.1 0.786 80.1 24.0 -74.1 -26.5 13.7 19.6 0.7 23 23 A Q S S- 0 0 66 26,-0.7 -1,-0.2 0, 0.0 27,-0.1 0.140 104.3-110.3-125.3 15.4 10.1 20.7 0.4 24 24 A Q S S+ 0 0 156 -3,-0.5 -2,-0.1 25,-0.2 -3,-0.0 0.917 87.4 117.4 50.4 49.5 10.1 22.6 -3.0 25 25 A D + 0 0 33 24,-0.2 18,-2.4 2,-0.0 2,-0.4 0.040 43.4 99.3-134.0 23.2 9.6 25.8 -1.0 26 26 A M E +C 42 0A 16 16,-0.2 2,-0.3 23,-0.1 16,-0.2 -0.908 36.4 167.1-118.5 143.8 12.8 27.8 -1.8 27 27 A S E -C 41 0A 46 14,-1.9 14,-3.2 -2,-0.4 2,-0.7 -0.989 32.7-129.9-145.9 150.3 13.6 30.6 -4.2 28 28 A A E +C 40 0A 25 -2,-0.3 12,-0.2 12,-0.2 -12,-0.1 -0.891 45.3 163.1 -99.3 114.2 16.5 33.0 -4.7 29 29 A V E > -C 39 0A 25 10,-2.0 10,-1.6 -2,-0.7 3,-1.2 -0.923 49.4-120.4-138.3 151.8 15.0 36.5 -4.9 30 30 A P G > S+ 0 0 88 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.846 108.6 61.7 -64.0 -34.5 16.0 40.2 -4.6 31 31 A E G 3 S+ 0 0 102 1,-0.3 7,-0.1 8,-0.1 9,-0.1 0.696 102.1 54.1 -64.6 -16.5 13.7 41.0 -1.7 32 32 A A G < S+ 0 0 0 -3,-1.2 8,-0.4 7,-0.3 2,-0.3 0.393 83.4 116.9 -98.5 1.7 15.5 38.4 0.4 33 33 A A < + 0 0 26 -3,-1.7 6,-0.2 6,-0.3 3,-0.1 -0.542 29.7 168.8 -75.8 128.8 19.0 39.9 -0.1 34 34 A H S S+ 0 0 70 1,-0.4 2,-0.3 4,-0.3 -1,-0.2 0.659 82.7 13.0 -97.0 -29.7 20.9 41.3 2.8 35 35 A N S S+ 0 0 83 3,-0.4 -1,-0.4 -24,-0.2 3,-0.4 -0.982 119.9 2.4-144.1 147.8 24.0 41.6 0.6 36 36 A G S S- 0 0 58 -2,-0.3 -3,-0.1 1,-0.2 -24,-0.0 -0.341 106.8 -50.6 71.8-154.6 24.6 41.4 -3.1 37 37 A A S S+ 0 0 64 1,-0.1 2,-0.3 -5,-0.0 -4,-0.2 0.669 113.5 31.8 -94.3 -20.0 21.7 40.9 -5.6 38 38 A L - 0 0 40 -3,-0.4 -3,-0.4 -27,-0.3 -4,-0.3 -0.913 50.1-176.2-140.0 156.5 19.8 37.9 -4.1 39 39 A G E -C 29 0A 0 -10,-1.6 -10,-2.0 -2,-0.3 2,-0.5 -0.906 39.4 -90.3-139.4 175.3 18.9 36.1 -0.8 40 40 A L E -CD 28 138A 0 98,-2.9 98,-2.2 -8,-0.4 2,-0.5 -0.773 32.4-163.5 -91.5 128.9 17.1 32.9 -0.0 41 41 A K E -CD 27 137A 49 -14,-3.2 -14,-1.9 -2,-0.5 2,-0.6 -0.963 2.1-165.3-107.3 122.9 13.3 33.0 0.5 42 42 A I E -CD 26 136A 0 94,-2.9 94,-2.6 -2,-0.5 -16,-0.2 -0.948 30.4-122.5-105.1 115.2 11.8 30.0 2.3 43 43 A G - 0 0 11 -18,-2.4 3,-0.5 -2,-0.6 92,-0.1 -0.265 21.5-123.6 -68.1 141.5 8.0 30.3 1.7 44 44 A G S S+ 0 0 22 89,-0.4 89,-0.3 1,-0.2 91,-0.1 -0.099 77.3 68.2 -71.7 171.3 5.6 30.4 4.6 45 45 A G S S+ 0 0 52 87,-3.0 2,-0.3 89,-0.2 -1,-0.2 0.171 101.1 32.7 109.2 -16.6 2.6 28.2 5.3 46 46 A K S S- 0 0 95 -3,-0.5 2,-0.2 86,-0.3 84,-0.1 -0.966 92.2 -86.4-160.9 156.6 4.4 25.0 6.1 47 47 A A + 0 0 32 -2,-0.3 2,-0.3 82,-0.1 82,-0.2 -0.495 61.2 154.0 -66.0 136.6 7.6 23.8 7.7 48 48 A A E + H 0 128B 0 80,-1.9 80,-2.7 -2,-0.2 2,-0.3 -0.988 11.7 151.8-162.3 157.1 10.4 23.6 5.1 49 49 A G E - H 0 127B 0 -2,-0.3 -27,-1.7 78,-0.2 -26,-0.7 -0.930 17.7-151.7-167.6-165.1 14.1 23.8 4.6 50 50 A G E +GH 21 126B 0 76,-2.0 76,-3.2 -2,-0.3 2,-0.3 -0.926 15.3 163.7-167.4-178.8 17.2 22.9 2.7 51 51 A G E -GH 20 125B 0 -31,-1.4 -31,-3.0 -2,-0.3 2,-0.3 -0.991 21.5-121.4 176.3-170.6 20.9 22.3 3.0 52 52 A Q E - H 0 124B 8 72,-2.1 72,-2.9 -2,-0.3 2,-0.2 -0.984 28.9-101.9-156.8 156.9 24.1 21.0 1.8 53 53 A D E - H 0 123B 93 -2,-0.3 70,-0.2 70,-0.2 -2,-0.0 -0.573 34.7-160.1 -76.6 146.4 26.9 18.6 2.7 54 54 A I - 0 0 2 68,-2.9 2,-1.7 -2,-0.2 -47,-0.1 -0.934 13.7-142.7-137.6 118.1 30.0 20.2 4.0 55 55 A P - 0 0 90 0, 0.0 66,-0.1 0, 0.0 2,-0.1 -0.484 31.1-174.1 -81.3 81.8 33.5 18.6 4.1 56 56 A L - 0 0 14 -2,-1.7 -2,-0.0 1,-0.1 6,-0.0 -0.327 22.9-118.2 -79.1 153.4 34.9 19.8 7.3 57 57 A K > - 0 0 98 1,-0.1 3,-0.5 -2,-0.1 57,-0.2 -0.632 31.6-114.6 -82.0 147.4 38.5 19.2 8.6 58 58 A P T 3 S+ 0 0 60 0, 0.0 58,-0.2 0, 0.0 3,-0.1 -0.382 93.7 19.1 -75.9 161.8 39.0 17.3 11.9 59 59 A N T 3 S+ 0 0 101 56,-1.9 2,-0.3 55,-0.3 57,-0.1 0.824 98.9 131.1 48.3 43.0 40.4 19.0 15.1 60 60 A T < - 0 0 18 -3,-0.5 54,-2.6 55,-0.2 2,-0.5 -0.955 58.4-126.7-133.4 140.4 39.6 22.4 13.6 61 61 A T E -E 113 0A 22 85,-0.4 85,-2.3 -2,-0.3 2,-0.3 -0.774 32.2-174.5 -90.3 128.3 37.8 25.5 15.0 62 62 A Y E -EF 112 145A 0 50,-3.0 50,-2.3 -2,-0.5 2,-0.5 -0.916 18.9-147.7-123.5 149.1 34.9 26.8 12.9 63 63 A I E -EF 111 144A 4 81,-2.2 81,-2.3 -2,-0.3 2,-0.5 -0.972 10.9-161.6-112.8 128.5 32.6 29.8 13.0 64 64 A L E +EF 110 143A 0 46,-2.7 46,-2.3 -2,-0.5 2,-0.3 -0.954 20.0 166.1-105.2 127.6 29.1 29.5 11.8 65 65 A G E +EF 109 142A 0 77,-2.4 77,-2.4 -2,-0.5 2,-0.3 -0.978 6.5 165.8-138.8 155.2 27.3 32.8 11.0 66 66 A A E -E 108 0A 0 42,-1.8 42,-2.1 -2,-0.3 2,-0.4 -0.977 26.9-135.1-162.0 155.6 24.1 33.8 9.1 67 67 A W E +EF 107 139A 20 72,-2.0 72,-2.3 -2,-0.3 2,-0.3 -0.948 36.2 158.7-110.3 137.1 21.7 36.7 8.5 68 68 A A E +EF 106 138A 0 38,-2.2 38,-2.0 -2,-0.4 2,-0.3 -0.991 16.7 175.3-152.2 159.2 18.0 36.1 8.6 69 69 A K E - F 0 137A 47 68,-2.4 68,-3.3 -2,-0.3 2,-0.3 -0.933 27.4-128.5-159.4 145.0 14.6 37.7 9.1 70 70 A F E - F 0 136A 0 32,-2.8 66,-0.2 -2,-0.3 64,-0.0 -0.743 18.8-140.6 -83.5 142.9 11.0 36.7 8.9 71 71 A D S S+ 0 0 61 64,-2.8 2,-0.3 -2,-0.3 65,-0.1 0.427 86.1 16.4 -86.1 2.0 8.9 39.0 6.6 72 72 A S S S- 0 0 66 63,-0.4 60,-0.1 60,-0.0 62,-0.0 -0.945 109.5 -62.1-161.4 163.5 6.0 38.9 9.1 73 73 A K - 0 0 166 -2,-0.3 61,-0.3 1,-0.1 2,-0.2 -0.350 56.9-149.9 -57.0 120.9 5.5 37.8 12.7 74 74 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 29,-0.0 -0.531 17.6-149.1 -88.5 162.9 6.3 34.1 13.0 75 75 A A S S+ 0 0 86 -2,-0.2 2,-0.1 59,-0.1 -2,-0.0 0.768 84.8 9.5 -90.1 -37.9 4.9 31.5 15.4 76 76 A G S S- 0 0 28 1,-0.1 2,-0.3 52,-0.0 52,-0.0 0.003 89.6 -82.9-117.6-138.7 8.0 29.4 15.6 77 77 A T - 0 0 48 -2,-0.1 53,-1.7 50,-0.0 52,-0.6 -0.801 12.7-126.7-134.7 170.7 11.6 29.7 14.5 78 78 A F E -IJ 100 128B 0 22,-2.4 22,-2.8 -2,-0.3 2,-0.4 -0.994 31.9-159.6-116.8 130.4 14.2 29.4 11.7 79 79 A D E -IJ 99 127B 29 48,-3.1 48,-3.1 -2,-0.4 2,-0.5 -0.917 15.3-160.0-118.1 137.1 17.2 27.3 12.6 80 80 A V E -IJ 98 126B 0 18,-2.5 18,-2.8 -2,-0.4 2,-0.4 -0.974 28.1-176.7-110.6 123.3 20.7 27.2 11.0 81 81 A V E -IJ 97 125B 8 44,-2.8 44,-2.9 -2,-0.5 2,-0.5 -0.971 29.3-164.8-132.8 131.2 22.4 23.9 12.0 82 82 A V E +IJ 96 124B 2 14,-2.3 14,-3.1 -2,-0.4 2,-0.3 -0.978 30.7 174.2-105.2 128.2 25.7 22.1 11.5 83 83 A Q E +IJ 95 123B 26 40,-2.4 40,-2.5 -2,-0.5 2,-0.3 -0.986 9.7 146.1-141.0 144.1 25.3 18.5 12.3 84 84 A Y E -I 94 0B 4 10,-1.8 10,-2.7 -2,-0.3 2,-0.3 -0.971 41.0-105.6-166.3 159.4 27.4 15.3 12.2 85 85 A H E -I 93 0B 66 -2,-0.3 34,-3.0 8,-0.2 35,-0.9 -0.722 31.7-132.6 -85.7 141.9 28.2 12.0 13.9 86 86 A L B -K 118 0C 45 6,-3.8 2,-0.8 -2,-0.3 32,-0.2 -0.380 22.7-114.2 -75.1 167.7 31.4 11.6 15.9 87 87 A K S S+ 0 0 132 30,-1.6 2,-0.2 4,-0.1 30,-0.1 -0.826 71.8 119.4-105.6 84.2 33.5 8.5 15.3 88 88 A D S > S- 0 0 61 -2,-0.8 3,-0.9 4,-0.0 -3,-0.0 -0.594 86.6 -72.2-118.4-168.3 33.2 6.8 18.6 89 89 A A T 3 S+ 0 0 99 -2,-0.2 -2,-0.0 1,-0.2 0, 0.0 0.914 133.0 27.6 -52.9 -49.2 31.7 3.4 19.3 90 90 A N T 3 S- 0 0 130 -3,-0.0 -1,-0.2 0, 0.0 -3,-0.1 0.168 107.2-112.7-106.2 19.2 28.1 4.5 18.5 91 91 A N < - 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