==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBOHYDRATE-BINDING MODULE 19-OCT-04 1W9W . COMPND 2 MOLECULE: BH0236 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS; . AUTHOR A.B.BORASTON,A.L.VAN BUEREN . 134 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6430.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 44.8 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 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.0 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+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 . 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 0 PARALLEL BRIDGES PER LADDER . 2 1 1 1 0 2 2 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 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 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 7 A D 0 0 164 0, 0.0 2,-0.1 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 -0.9 52.0 -3.2 18.2 2 8 A L - 0 0 90 46,-0.1 2,-0.4 47,-0.0 46,-0.2 -0.415 360.0-135.1 -66.0 150.3 48.2 -2.5 17.8 3 9 A K B -a 48 0A 47 44,-2.6 46,-2.2 -2,-0.1 6,-0.1 -0.943 9.6-129.2-113.2 143.0 47.4 0.3 15.3 4 10 A N > - 0 0 76 -2,-0.4 3,-1.0 44,-0.2 46,-0.1 -0.813 13.3-164.8 -95.4 113.3 44.9 3.0 16.0 5 11 A P T 3 S+ 0 0 0 0, 0.0 127,-3.0 0, 0.0 4,-0.2 0.663 84.1 64.1 -69.1 -15.7 42.3 3.4 13.2 6 12 A Y T 3 S+ 0 0 28 125,-0.2 2,-0.3 2,-0.1 128,-0.1 0.383 100.5 54.6 -99.2 -0.9 41.1 6.8 14.4 7 13 A E S < S- 0 0 132 -3,-1.0 125,-0.3 123,-0.1 123,-0.1 -0.793 109.6 -72.1-115.5 170.7 44.4 8.5 13.9 8 14 A R - 0 0 148 -2,-0.3 2,-0.5 123,-0.1 123,-0.2 -0.332 38.4-158.9 -67.4 136.8 46.2 8.5 10.6 9 15 A I E -G 130 0B 12 121,-2.8 121,-2.2 -4,-0.2 2,-0.3 -0.977 23.9-124.9-106.3 131.7 47.8 5.3 9.3 10 16 A Q E > -G 129 0B 67 -2,-0.5 3,-2.0 119,-0.2 119,-0.3 -0.605 9.6-137.8 -77.5 133.0 50.5 6.0 6.7 11 17 A A T 3 S+ 0 0 0 117,-1.6 3,-0.4 -2,-0.3 118,-0.2 0.887 104.1 58.3 -60.6 -35.4 49.9 4.0 3.5 12 18 A E T 3 S+ 0 0 47 116,-0.6 -1,-0.3 20,-0.3 2,-0.1 0.530 84.9 78.7 -70.4 -10.0 53.6 3.3 3.4 13 19 A A < + 0 0 50 -3,-2.0 -1,-0.2 2,-0.0 -2,-0.1 -0.084 68.3 146.5 -90.7 37.3 53.5 1.6 6.8 14 20 A Y - 0 0 66 -3,-0.4 31,-0.2 -2,-0.1 3,-0.1 -0.341 45.6-151.8 -77.1 156.9 52.1 -1.7 5.3 15 21 A D S S+ 0 0 73 29,-3.5 2,-0.3 1,-0.3 30,-0.2 0.670 82.0 7.4-100.0 -18.4 52.9 -5.1 6.7 16 22 A A E S+B 44 0A 31 28,-1.2 28,-2.6 2,-0.0 2,-0.3 -0.969 70.0 173.7-151.8 161.5 52.4 -6.9 3.4 17 23 A M E -B 43 0A 79 -2,-0.3 2,-0.3 26,-0.2 26,-0.2 -0.994 21.2-144.6-161.0 165.6 51.7 -5.9 -0.2 18 24 A S E S-B 42 0A 51 24,-2.9 24,-1.7 -2,-0.3 -2,-0.0 -0.924 78.3 -12.3-142.6 121.9 51.3 -6.9 -3.7 19 25 A G S S+ 0 0 43 -2,-0.3 2,-0.2 1,-0.3 22,-0.1 0.530 96.9 117.4 80.1 11.8 52.3 -4.9 -6.8 20 26 A I - 0 0 8 22,-0.2 2,-0.3 17,-0.1 -1,-0.3 -0.667 41.0-163.8-112.9 168.6 53.0 -1.6 -5.2 21 27 A Q E -H 35 0B 112 14,-2.0 14,-2.1 -2,-0.2 2,-0.3 -0.939 14.6-130.8-140.5 156.9 56.1 0.8 -4.7 22 28 A T E +H 34 0B 60 -2,-0.3 2,-0.3 12,-0.2 12,-0.2 -0.874 24.2 168.3-113.3 155.8 56.9 3.8 -2.5 23 29 A E E -H 33 0B 59 10,-1.9 10,-2.3 -2,-0.3 2,-0.2 -0.947 45.6 -81.0-150.0 162.5 58.3 7.2 -3.3 24 30 A G E -H 32 0B 49 -2,-0.3 8,-0.3 8,-0.2 2,-0.2 -0.498 49.7-140.2 -62.5 132.7 58.8 10.6 -1.4 25 31 A T - 0 0 14 6,-2.4 6,-0.1 -2,-0.2 69,-0.1 -0.636 14.8-150.0 -92.6 159.6 55.5 12.5 -1.5 26 32 A D + 0 0 125 -2,-0.2 3,-0.1 4,-0.1 -1,-0.1 0.513 62.2 117.5 -96.1 -15.5 55.1 16.3 -2.0 27 33 A D S > S- 0 0 13 1,-0.2 3,-1.9 2,-0.1 2,-0.3 -0.014 84.0 -76.5 -53.1 158.2 51.9 16.4 0.1 28 34 A D T 3 S+ 0 0 135 1,-0.2 -1,-0.2 68,-0.0 -2,-0.1 -0.447 121.0 33.5 -58.5 119.1 51.7 18.4 3.4 29 35 A G T 3 S- 0 0 86 -2,-0.3 -1,-0.2 -3,-0.1 2,-0.1 0.006 97.2-132.3 121.8 -23.8 53.6 16.4 6.1 30 36 A G < + 0 0 34 -3,-1.9 2,-0.1 1,-0.1 -4,-0.1 -0.401 59.1 107.4 69.6-153.3 56.4 14.8 3.9 31 37 A G S S- 0 0 48 -6,-0.1 -6,-2.4 -2,-0.1 2,-0.2 -0.436 74.3 -50.9 74.7-155.8 57.2 11.1 4.2 32 38 A D E -H 24 0B 63 -8,-0.3 -20,-0.3 96,-0.1 2,-0.3 -0.669 36.7-154.0-112.4 160.0 56.3 8.7 1.4 33 39 A N E -H 23 0B 0 -10,-2.3 -10,-1.9 -2,-0.2 2,-0.3 -0.874 25.1-118.8-117.7 161.5 53.2 7.7 -0.6 34 40 A I E +HI 22 127B 0 93,-2.7 93,-1.5 -2,-0.3 2,-0.3 -0.664 45.4 156.0 -89.7 159.3 52.5 4.3 -2.2 35 41 A G E +H 21 0B 0 -14,-2.1 -14,-2.0 -2,-0.3 91,-0.1 -0.932 36.7 79.6-165.4-172.9 52.1 4.3 -6.0 36 42 A W + 0 0 102 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.904 67.0 170.5 57.8 41.1 52.4 2.3 -9.1 37 43 A I + 0 0 0 88,-0.8 87,-2.5 -3,-0.1 88,-0.4 -0.730 9.9 177.9 -91.0 134.4 49.0 0.9 -8.1 38 44 A N > - 0 0 53 -2,-0.4 3,-2.8 85,-0.2 78,-0.2 -0.870 44.1 -69.8-131.3 160.4 47.1 -1.3 -10.6 39 45 A D T 3 S+ 0 0 67 80,-0.5 78,-0.3 83,-0.3 3,-0.1 -0.246 123.2 22.8 -47.9 126.9 43.8 -3.2 -10.6 40 46 A G T 3 S+ 0 0 38 76,-3.2 -1,-0.3 1,-0.3 77,-0.1 0.171 92.4 124.9 97.0 -16.7 44.2 -6.2 -8.2 41 47 A D < - 0 0 20 -3,-2.8 75,-3.1 75,-0.1 -1,-0.3 -0.293 36.7-179.0 -71.1 160.5 47.1 -4.7 -6.1 42 48 A W E -BC 18 115A 58 -24,-1.7 -24,-2.9 73,-0.2 2,-0.3 -0.993 25.6-146.3-154.6 165.1 46.8 -4.4 -2.4 43 49 A V E -BC 17 114A 0 71,-2.0 71,-2.4 -2,-0.3 2,-0.4 -0.992 16.4-148.7-132.8 139.3 48.3 -3.4 1.0 44 50 A K E -BC 16 113A 32 -28,-2.6 -29,-3.5 -2,-0.3 -28,-1.2 -0.941 6.6-167.9-112.9 135.0 47.8 -5.1 4.4 45 51 A Y E > - C 0 112A 0 67,-3.0 67,-2.8 -2,-0.4 3,-0.5 -0.984 20.1-145.3-121.6 111.2 47.9 -3.3 7.8 46 52 A E E 3 + 0 0 67 -2,-0.5 65,-0.2 65,-0.2 64,-0.1 -0.453 67.0 10.9 -82.0 149.6 48.1 -5.7 10.7 47 53 A R E 3 + 0 0 112 1,-0.2 -44,-2.6 -2,-0.1 2,-0.8 0.781 66.6 172.9 56.9 42.5 46.5 -5.4 14.1 48 54 A V E < -aC 3 110A 0 62,-2.8 62,-2.8 -3,-0.5 2,-0.7 -0.702 18.4-157.6 -78.1 108.6 44.2 -2.5 13.4 49 55 A H E - C 0 109A 53 -46,-2.2 2,-0.5 -2,-0.8 60,-0.3 -0.809 9.5-166.3-103.2 110.7 42.2 -2.3 16.7 50 56 A F E - C 0 108A 1 58,-3.1 58,-2.3 -2,-0.7 3,-0.1 -0.808 9.9-179.7 -91.5 127.1 38.8 -0.6 16.6 51 57 A E S S+ 0 0 145 -2,-0.5 2,-0.3 56,-0.2 -1,-0.1 0.578 74.1 28.0-102.6 -20.6 37.3 0.2 20.0 52 58 A R S S- 0 0 128 54,-0.1 -1,-0.2 56,-0.1 56,-0.1 -0.932 100.6 -80.8-136.3 164.2 34.2 1.7 18.6 53 59 A D - 0 0 98 -2,-0.3 2,-0.4 -3,-0.1 53,-0.2 -0.328 41.2-145.4 -63.4 139.9 32.1 1.3 15.4 54 60 A A E +J 105 0B 4 51,-2.8 51,-1.8 80,-0.2 80,-0.3 -0.841 20.3 177.6-106.0 145.5 33.5 3.1 12.3 55 61 A S E + 0 0 65 78,-3.0 48,-1.4 -2,-0.4 2,-0.3 0.491 63.7 21.4-125.3 -9.5 31.1 4.5 9.8 56 62 A S E -JK 102 133B 17 77,-1.7 77,-2.1 46,-0.3 2,-0.4 -0.973 56.9-145.1-150.6 168.1 33.5 6.2 7.3 57 63 A I E -JK 101 132B 0 44,-2.0 44,-1.9 -2,-0.3 2,-0.5 -0.998 7.9-153.7-136.8 138.5 37.1 6.3 6.0 58 64 A E E -JK 100 131B 41 73,-2.8 73,-1.9 -2,-0.4 2,-0.4 -0.953 15.3-170.5-111.7 126.5 39.1 9.3 4.8 59 65 A V E -JK 99 130B 0 40,-2.3 40,-2.6 -2,-0.5 2,-0.7 -0.992 20.0-141.3-126.8 133.2 41.9 8.6 2.3 60 66 A R E +JK 98 129B 43 69,-2.3 68,-2.7 -2,-0.4 69,-0.5 -0.816 43.6 159.2 -90.9 112.3 44.6 11.0 1.0 61 67 A V E -JK 97 127B 0 36,-2.8 36,-2.2 -2,-0.7 2,-0.3 -0.891 30.1-165.3-141.7 159.8 44.9 10.2 -2.6 62 68 A A E - K 0 126B 0 64,-2.1 64,-2.6 -2,-0.3 2,-0.3 -0.975 9.3-178.1-145.3 150.5 46.1 11.5 -6.0 63 69 A S E -J 92 0B 0 29,-0.9 27,-2.3 32,-0.4 29,-1.1 -0.935 25.0-174.2-154.3 138.0 45.6 10.4 -9.6 64 70 A D S S+ 0 0 87 -2,-0.3 29,-0.1 27,-0.2 25,-0.1 0.261 81.1 57.2-104.2 9.1 46.7 11.4 -13.0 65 71 A T S S- 0 0 23 59,-0.3 26,-0.2 27,-0.1 3,-0.1 -0.530 113.2 -75.3-123.8-176.4 44.4 8.9 -14.7 66 72 A P S S- 0 0 85 0, 0.0 23,-0.5 0, 0.0 2,-0.2 0.722 76.7-144.3 -56.5 -19.6 40.6 8.2 -14.6 67 73 A G - 0 0 5 56,-0.4 52,-0.5 21,-0.2 2,-0.3 -0.553 14.2-137.4 97.3-154.9 41.3 6.7 -11.2 68 74 A G E -D 87 0A 9 19,-1.8 19,-4.1 -2,-0.2 2,-0.3 -0.929 20.8 -77.3-176.6-162.9 39.8 3.8 -9.5 69 75 A R E -DE 86 117A 98 48,-2.8 48,-2.5 -2,-0.3 2,-0.6 -0.954 20.4-136.4-131.8 159.2 38.5 2.5 -6.2 70 76 A I E -DE 85 116A 0 15,-3.3 15,-1.6 -2,-0.3 2,-0.4 -0.924 16.5-157.1-113.1 118.0 39.7 1.3 -2.8 71 77 A E E -DE 84 115A 8 44,-3.1 44,-2.3 -2,-0.6 2,-0.6 -0.781 6.4-147.7 -90.9 134.4 38.1 -1.7 -1.2 72 78 A I E +DE 83 114A 0 11,-2.2 10,-2.9 -2,-0.4 11,-0.7 -0.914 33.1 153.0-101.2 115.5 38.4 -2.2 2.5 73 79 A R E -DE 81 113A 44 40,-2.3 40,-2.6 -2,-0.6 2,-0.3 -0.810 28.2-139.0-131.6 176.3 38.4 -5.8 3.5 74 80 A T E S+ E 0 112A 25 6,-0.6 2,-1.8 -2,-0.3 38,-0.2 -0.907 70.2 19.6-134.6 160.6 39.8 -7.8 6.4 75 81 A G S S- 0 0 49 36,-1.3 37,-0.1 -2,-0.3 -2,-0.0 -0.310 125.1 -3.2 85.3 -52.1 41.6 -11.1 6.9 76 82 A S S > S- 0 0 40 -2,-1.8 3,-1.7 35,-0.1 37,-0.2 -0.919 85.2 -88.1-157.1 169.6 42.8 -11.4 3.4 77 83 A P T 3 S+ 0 0 35 0, 0.0 -2,-0.1 0, 0.0 -34,-0.0 0.628 130.6 43.7 -63.1 -18.7 42.5 -9.6 0.1 78 84 A T T 3 S+ 0 0 122 -4,-0.0 3,-0.1 -5,-0.0 -3,-0.1 0.004 92.3 122.5-108.2 21.6 39.3 -11.6 -0.7 79 85 A G S < S- 0 0 16 -3,-1.7 -4,-0.1 1,-0.2 -7,-0.0 -0.212 77.7 -53.7 -77.9 174.8 38.0 -11.1 2.9 80 86 A T - 0 0 109 -6,-0.2 -6,-0.6 1,-0.1 2,-0.5 -0.191 56.2-119.5 -63.1 137.8 34.6 -9.5 3.5 81 87 A L E +D 73 0A 77 -8,-0.2 -8,-0.2 1,-0.1 -1,-0.1 -0.647 32.7 174.8 -78.1 122.2 34.1 -6.1 2.0 82 88 A L E - 0 0 41 -10,-2.9 22,-2.2 -2,-0.5 2,-0.3 0.472 61.5 -44.1-105.5 -8.6 33.4 -3.5 4.6 83 89 A G E -DF 72 103A 12 -11,-0.7 -11,-2.2 20,-0.2 -1,-0.3 -0.936 51.0-141.6 161.7 173.2 33.3 -0.5 2.4 84 90 A D E -D 71 0A 70 18,-1.0 2,-0.3 -2,-0.3 -13,-0.2 -0.969 0.5-153.6-155.5 164.9 34.9 1.3 -0.6 85 91 A V E -D 70 0A 5 -15,-1.6 -15,-3.3 -2,-0.3 2,-0.4 -0.984 17.5-134.3-139.1 147.8 35.8 4.7 -1.9 86 92 A Q E -D 69 0A 141 -2,-0.3 -17,-0.3 -17,-0.2 14,-0.1 -0.788 14.4-152.2-100.6 134.7 36.3 5.9 -5.4 87 93 A V E -D 68 0A 0 -19,-4.1 -19,-1.8 -2,-0.4 2,-0.2 -0.964 16.0-160.9-106.7 121.0 39.3 8.0 -6.2 88 94 A P - 0 0 51 0, 0.0 -21,-0.2 0, 0.0 -23,-0.1 -0.535 36.2 -74.7 -94.2 168.3 38.8 10.3 -9.1 89 95 A N - 0 0 77 -23,-0.5 -25,-0.2 -2,-0.2 36,-0.0 -0.362 45.4-175.9 -53.1 143.3 41.3 12.1 -11.3 90 96 A T - 0 0 19 -27,-2.3 -26,-0.1 2,-0.2 -1,-0.1 0.246 51.8 -91.4-130.5 2.3 42.7 14.9 -9.2 91 97 A G S S+ 0 0 52 -28,-0.8 2,-0.3 -26,-0.2 -27,-0.2 0.298 93.3 5.8 109.7 -10.3 45.0 16.7 -11.6 92 98 A G E > S-J 63 0B 11 -29,-1.1 3,-1.1 3,-0.3 -29,-0.9 -0.924 74.8 -95.6 167.9 156.9 48.3 14.9 -11.0 93 99 A W E 3 S+ 0 0 86 -2,-0.3 -1,-0.1 1,-0.2 -29,-0.1 0.733 128.6 35.9 -61.6 -29.2 50.3 12.1 -9.3 94 100 A Q E 3 S+ 0 0 36 -69,-0.1 2,-0.7 -3,-0.1 -1,-0.2 -0.112 88.3 107.5-118.3 33.7 51.2 14.7 -6.6 95 101 A Q E < - 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