==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 01-FEB-08 3C5P . COMPND 2 MOLECULE: PROTEIN BAS0735 OF UNKNOWN FUNCTION; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS STR.; . AUTHOR Y.KIM,G.JOACHIMIAK,P.GORNICKI,A.JOACHIMIAK,MIDWEST CENTER FO . 1163 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50208.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 764 65.7 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 . 530 45.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 17 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 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 . 83 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.4 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 5 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 . 6 5 3 6 2 14 14 18 1 5 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 2 12 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 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 X 0 0 225 0, 0.0 2,-0.4 0, 0.0 137,-0.1 0.000 360.0 360.0 360.0 -58.5 49.1 -1.9 21.7 2 2 A T - 0 0 25 135,-0.7 3,-0.1 1,-0.1 57,-0.1 -0.949 360.0-175.7-109.3 138.7 47.8 1.7 22.1 3 3 A N + 0 0 58 -2,-0.4 56,-3.3 1,-0.3 57,-0.6 0.906 56.8 34.1-105.3 -50.5 49.9 4.4 20.6 4 4 A I E +A 58 0A 4 54,-0.2 156,-3.4 55,-0.1 2,-0.4 -0.948 53.4 177.9-119.3 126.6 48.8 7.9 21.2 5 5 A I E -AB 57 159A 0 52,-2.7 52,-3.4 -2,-0.5 2,-0.4 -0.982 9.9-168.2-131.8 123.7 47.1 9.1 24.3 6 6 A K E -AB 56 158A 7 152,-2.7 152,-2.1 -2,-0.4 2,-0.5 -0.878 10.0-159.1-112.6 137.5 46.2 12.8 24.7 7 7 A I E -AB 55 157A 0 48,-3.1 48,-2.6 -2,-0.4 2,-0.4 -0.980 12.8-164.1-117.2 126.7 45.0 14.8 27.8 8 8 A R E -AB 54 156A 1 148,-2.9 148,-2.3 -2,-0.5 2,-0.4 -0.896 6.1-173.3-114.4 134.2 43.2 18.1 27.2 9 9 A A E -AB 53 155A 0 44,-3.5 44,-2.6 -2,-0.4 2,-0.4 -0.981 4.8-177.3-124.9 138.0 42.5 20.8 29.8 10 10 A S E -AB 52 154A 0 144,-2.5 144,-2.1 -2,-0.4 2,-0.5 -0.999 13.8-166.3-138.5 138.9 40.4 23.9 29.3 11 11 A V E +AB 51 153A 0 40,-3.2 39,-1.8 -2,-0.4 40,-1.7 -0.987 28.3 159.3-121.0 119.5 39.6 26.8 31.4 12 12 A F E - B 0 152A 0 140,-1.7 140,-2.2 -2,-0.5 37,-0.1 -0.959 42.1-130.8-141.5 155.4 36.7 28.9 30.2 13 13 A I - 0 0 16 -2,-0.3 22,-2.7 138,-0.2 23,-0.3 -0.949 19.5-156.2-100.6 120.2 34.0 31.5 31.3 14 14 A P + 0 0 9 0, 0.0 23,-0.7 0, 0.0 -1,-0.1 0.832 66.6 79.4 -65.0 -35.4 30.6 30.3 30.1 15 15 A X S S- 0 0 68 21,-0.2 21,-1.7 20,-0.1 20,-0.6 -0.127 83.5-122.0 -63.2 163.9 28.9 33.8 30.0 16 16 A S S S+ 0 0 42 1,-0.2 18,-3.2 19,-0.2 2,-0.3 0.851 95.9 19.4 -71.1 -32.4 29.3 36.3 27.2 17 17 A W B S-E 33 0B 56 16,-0.3 16,-0.2 18,-0.0 -1,-0.2 -0.991 81.1-115.2-143.1 142.4 30.5 38.9 29.7 18 18 A T - 0 0 26 14,-2.9 3,-0.1 -2,-0.3 16,-0.1 -0.196 57.0 -66.2 -70.6 167.0 32.0 38.9 33.1 19 19 A E - 0 0 123 1,-0.1 13,-0.2 12,-0.1 2,-0.2 -0.299 63.2-106.9 -50.3 132.6 30.3 40.4 36.2 20 20 A A - 0 0 52 -3,-0.1 2,-0.4 11,-0.1 11,-0.2 -0.457 35.3-164.8 -68.4 132.4 30.1 44.2 35.7 21 21 A K E -F 30 0C 109 9,-2.3 9,-2.6 -2,-0.2 2,-0.4 -0.956 3.9-154.7-114.2 143.4 32.5 46.4 37.9 22 22 A X E -F 29 0C 110 -2,-0.4 2,-0.6 7,-0.2 7,-0.2 -0.954 3.3-159.5-114.0 133.5 32.2 50.1 38.5 23 23 A D >> - 0 0 73 5,-1.6 4,-2.5 -2,-0.4 3,-0.5 -0.925 3.1-162.4-104.0 111.9 35.1 52.4 39.4 24 24 A X T 34 S+ 0 0 152 -2,-0.6 -1,-0.1 1,-0.2 5,-0.0 0.791 86.5 66.6 -64.9 -21.1 33.7 55.6 41.0 25 25 A E T 34 S+ 0 0 175 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.926 118.4 18.8 -60.6 -47.0 37.1 57.3 40.3 26 26 A T T <4 S- 0 0 61 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.2 0.668 98.3-125.3-101.4 -26.2 36.7 57.2 36.5 27 27 A G < + 0 0 23 -4,-2.5 -3,-0.1 1,-0.3 -2,-0.1 0.387 63.5 139.8 94.3 -2.6 33.0 56.7 36.2 28 28 A Q - 0 0 54 -5,-0.4 -5,-1.6 51,-0.1 2,-0.4 -0.267 46.4-150.7 -79.6 163.3 33.5 53.7 34.1 29 29 A V E -FG 22 78C 41 49,-1.2 49,-2.5 -7,-0.2 2,-0.4 -0.995 25.0-171.0-128.9 122.6 31.8 50.4 34.0 30 30 A I E +FG 21 77C 34 -9,-2.6 -9,-2.3 -2,-0.4 2,-0.3 -0.902 15.5 165.2-122.2 141.2 34.0 47.5 32.8 31 31 A Q E - G 0 76C 37 45,-1.9 45,-3.4 -2,-0.4 2,-0.3 -0.986 25.1-132.3-147.4 157.0 33.5 43.9 31.9 32 32 A F E - G 0 75C 24 -2,-0.3 -14,-2.9 43,-0.2 43,-0.2 -0.738 31.1-101.2-105.0 151.0 35.6 41.3 30.1 33 33 A E B -E 17 0B 24 41,-2.2 -16,-0.3 -2,-0.3 41,-0.2 -0.436 35.7-155.9 -76.1 141.9 34.5 39.0 27.3 34 34 A G - 0 0 2 -18,-3.2 -18,-0.2 -2,-0.2 -1,-0.1 -0.071 29.3-101.3 -99.9-158.8 33.7 35.4 28.0 35 35 A D - 0 0 0 -22,-2.7 -19,-0.2 -20,-0.6 -20,-0.1 0.361 36.6-147.3-117.6 2.0 33.6 32.2 26.0 36 36 A S + 0 0 29 -21,-1.7 2,-0.3 -23,-0.3 -21,-0.2 0.784 59.2 101.7 46.0 48.1 29.9 32.1 25.4 37 37 A R - 0 0 12 -23,-0.7 -2,-0.1 -24,-0.2 -1,-0.1 -0.993 62.5-127.5-161.2 155.8 29.8 28.3 25.5 38 38 A E - 0 0 102 -2,-0.3 2,-0.3 1,-0.2 -25,-0.0 -0.083 58.5 -52.7 -90.7-163.8 28.9 25.2 27.5 39 39 A F S S+ 0 0 59 -2,-0.1 -1,-0.2 2,-0.0 130,-0.0 -0.592 71.1 139.2 -76.0 134.0 31.1 22.2 28.2 40 40 A T - 0 0 23 -2,-0.3 3,-0.3 -3,-0.1 315,-0.0 -0.891 49.0-141.4-171.1 148.9 32.6 20.5 25.2 41 41 A P S S+ 0 0 20 0, 0.0 3,-0.3 0, 0.0 115,-0.1 0.493 88.9 79.1 -88.4 -3.8 35.9 18.9 24.2 42 42 A H + 0 0 43 1,-0.2 313,-0.2 313,-0.1 314,-0.0 -0.041 59.9 101.6-100.1 33.1 35.9 20.2 20.7 43 43 A A > + 0 0 0 -3,-0.3 3,-1.4 311,-0.1 5,-0.5 0.060 41.7 144.3-111.1 23.4 37.0 23.7 21.3 44 44 A V T 3 S- 0 0 10 -3,-0.3 -2,-0.0 1,-0.3 8,-0.0 -0.400 78.9 -3.7 -66.1 136.6 40.7 23.6 20.3 45 45 A N T 3 S+ 0 0 10 1,-0.1 -1,-0.3 -2,-0.1 205,-0.1 0.675 101.2 116.1 59.5 15.6 42.1 26.7 18.6 46 46 A T S < S- 0 0 2 -3,-1.4 -2,-0.1 203,-0.0 -1,-0.1 0.572 76.4-133.2 -92.7 -9.9 38.6 28.1 18.8 47 47 A X S S+ 0 0 37 -4,-0.3 25,-0.4 1,-0.1 -3,-0.1 0.694 71.1 122.8 64.3 19.3 39.6 30.9 21.1 48 48 A R + 0 0 3 -5,-0.5 2,-0.3 23,-0.1 -1,-0.1 -0.248 59.9 63.3-103.8 42.8 36.6 30.1 23.3 49 49 A S S S- 0 0 4 -37,-0.1 -37,-0.3 -15,-0.1 22,-0.2 -0.946 70.9-137.4-159.9 147.3 38.7 29.5 26.5 50 50 A R S S+ 0 0 28 -39,-1.8 21,-1.4 -2,-0.3 2,-0.3 0.854 96.7 14.3 -70.6 -36.2 40.9 31.6 28.8 51 51 A V E +AC 11 70A 2 -40,-1.7 -40,-3.2 19,-0.3 2,-0.4 -0.996 67.8 179.4-144.5 140.9 43.5 28.8 29.1 52 52 A E E +AC 10 69A 8 17,-2.2 17,-2.9 -2,-0.3 2,-0.3 -0.998 3.9 173.3-147.3 132.3 43.9 25.6 27.0 53 53 A Q E -AC 9 68A 1 -44,-2.6 -44,-3.5 -2,-0.4 2,-0.4 -0.992 8.1-175.2-149.2 137.3 46.5 22.9 27.3 54 54 A E E -AC 8 67A 1 13,-2.2 13,-2.1 -2,-0.3 2,-0.4 -0.995 4.3-167.9-134.4 125.3 47.0 19.5 25.6 55 55 A V E -AC 7 66A 1 -48,-2.6 -48,-3.1 -2,-0.4 2,-0.5 -0.952 8.3-161.0-110.5 135.4 49.6 16.9 26.4 56 56 A V E -AC 6 65A 0 9,-3.8 9,-3.0 -2,-0.4 2,-0.5 -0.975 4.1-158.5-120.1 120.3 50.2 14.0 24.1 57 57 A V E -AC 5 64A 0 -52,-3.4 -52,-2.7 -2,-0.5 2,-0.6 -0.873 9.1-165.8 -90.6 127.6 51.9 10.9 25.2 58 58 A D E >> +AC 4 63A 0 5,-3.0 5,-1.9 -2,-0.5 4,-1.2 -0.941 13.4 177.3-120.0 108.5 53.3 9.0 22.2 59 59 A F T 45S+ 0 0 17 -56,-3.3 -1,-0.2 -2,-0.6 -55,-0.1 0.883 81.1 59.1 -82.4 -39.0 54.3 5.4 23.0 60 60 A Y T 45S+ 0 0 103 -57,-0.6 -1,-0.2 1,-0.2 -56,-0.1 0.890 120.2 30.3 -49.9 -42.0 55.3 4.5 19.5 61 61 A K T 45S- 0 0 39 -58,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.635 102.8-127.4 -91.1 -21.3 57.8 7.4 19.6 62 62 A Q T <5 + 0 0 94 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.988 68.1 123.8 60.4 63.0 58.6 7.3 23.4 63 63 A E E < -C 58 0A 89 -5,-1.9 -5,-3.0 2,-0.0 2,-0.5 -0.993 56.3-145.1-150.1 143.5 57.8 11.1 23.6 64 64 A V E -C 57 0A 24 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.985 20.8-172.5-110.0 129.2 55.7 13.6 25.4 65 65 A F E -C 56 0A 23 -9,-3.0 -9,-3.8 -2,-0.5 2,-0.3 -0.944 4.2-163.4-117.7 144.6 54.5 16.6 23.4 66 66 A S E -C 55 0A 73 -2,-0.4 2,-0.4 -11,-0.2 -11,-0.2 -0.911 9.7-164.3-127.6 152.2 52.7 19.6 24.9 67 67 A Y E -C 54 0A 26 -13,-2.1 -13,-2.2 -2,-0.3 2,-0.4 -1.000 11.7-174.6-135.9 133.9 50.6 22.4 23.5 68 68 A A E +C 53 0A 31 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.982 7.9 162.4-134.0 133.2 49.7 25.6 25.5 69 69 A N E -C 52 0A 34 -17,-2.9 -17,-2.2 -2,-0.4 2,-0.4 -0.987 23.1-152.7-146.1 160.6 47.5 28.6 24.8 70 70 A T E -C 51 0A 3 -2,-0.3 -19,-0.3 -19,-0.2 -20,-0.2 -0.980 25.6-126.3-123.3 143.2 45.7 31.5 26.3 71 71 A G - 0 0 4 -21,-1.4 2,-0.5 -2,-0.4 20,-0.5 0.051 36.2 -88.8 -69.8-172.9 42.5 33.1 24.8 72 72 A I - 0 0 39 -25,-0.4 2,-0.5 18,-0.1 18,-0.2 -0.878 33.5-142.3-101.1 137.9 42.2 36.8 24.0 73 73 A T E - H 0 89C 15 16,-2.9 16,-2.3 -2,-0.5 2,-0.5 -0.872 17.1-173.6 -96.7 128.1 40.9 39.2 26.7 74 74 A T E - H 0 88C 17 -2,-0.5 -41,-2.2 14,-0.2 2,-0.5 -0.982 7.7-158.3-116.9 122.7 38.6 41.9 25.6 75 75 A E E -GH 32 87C 22 12,-2.2 12,-1.5 -2,-0.5 2,-0.6 -0.888 3.6-154.6-103.2 134.0 37.6 44.6 28.0 76 76 A K E -GH 31 86C 39 -45,-3.4 -45,-1.9 -2,-0.5 2,-0.5 -0.944 13.5-169.3-105.2 117.0 34.5 46.5 27.3 77 77 A V E -GH 30 85C 10 8,-2.5 8,-2.2 -2,-0.6 2,-0.7 -0.942 11.2-159.2-111.3 124.2 34.5 49.9 28.9 78 78 A I E -GH 29 84C 60 -49,-2.5 -49,-1.2 -2,-0.5 6,-0.2 -0.904 21.0-146.5 -99.9 114.8 31.4 52.1 29.1 79 79 A S > - 0 0 22 4,-2.8 3,-2.1 -2,-0.7 -52,-0.1 -0.338 23.8-111.0 -76.1 158.9 32.6 55.7 29.6 80 80 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -53,-0.1 0.939 120.5 60.8 -48.9 -50.7 30.7 58.3 31.6 81 81 A D T 3 S- 0 0 124 1,-0.1 3,-0.1 2,-0.0 -2,-0.0 0.562 120.7-113.1 -58.2 -8.9 30.0 60.1 28.3 82 82 A G S < S+ 0 0 42 -3,-2.1 -1,-0.1 1,-0.3 -3,-0.0 -0.151 74.1 130.8 105.7 -37.8 28.2 56.9 27.3 83 83 A S - 0 0 48 -5,-0.1 -4,-2.8 1,-0.1 2,-0.4 -0.080 49.5-138.2 -46.7 141.7 30.6 55.8 24.5 84 84 A V E -H 78 0C 82 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.876 19.7-173.5-106.9 141.7 31.8 52.2 24.6 85 85 A N E -H 77 0C 79 -8,-2.2 -8,-2.5 -2,-0.4 2,-0.3 -0.996 9.7-152.5-138.3 132.1 35.4 51.1 23.9 86 86 A K E -H 76 0C 121 -2,-0.4 2,-0.4 -10,-0.2 -10,-0.2 -0.773 8.5-169.8-104.4 149.7 37.1 47.8 23.6 87 87 A R E -H 75 0C 127 -12,-1.5 -12,-2.2 -2,-0.3 2,-0.4 -0.992 9.7-148.1-136.1 148.1 40.7 46.9 24.3 88 88 A T E +H 74 0C 107 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.908 23.1 153.7-124.7 134.4 42.4 43.8 23.5 89 89 A G E -H 73 0C 15 -16,-2.3 -16,-2.9 -2,-0.4 2,-0.4 -0.982 27.2-138.4-146.9 166.8 45.3 41.8 25.2 90 90 A K - 0 0 93 -2,-0.3 -18,-0.1 -18,-0.2 28,-0.1 -0.960 21.4-124.1-131.7 121.3 46.6 38.3 25.5 91 91 A A - 0 0 14 -20,-0.5 -21,-0.2 -2,-0.4 27,-0.1 -0.160 36.6-103.3 -45.9 145.5 47.9 36.5 28.6 92 92 A S - 0 0 65 1,-0.1 3,-0.2 -23,-0.1 25,-0.1 -0.360 17.3-148.9 -65.2 153.9 51.4 35.1 28.5 93 93 A T > + 0 0 59 1,-0.1 3,-1.2 -25,-0.1 -1,-0.1 0.089 67.1 110.3-109.6 21.1 51.8 31.4 28.1 94 94 A E T 3 S+ 0 0 155 1,-0.3 -1,-0.1 3,-0.0 22,-0.1 0.769 79.8 44.6 -65.7 -27.4 55.1 31.2 30.0 95 95 A N T 3 S+ 0 0 99 20,-0.4 20,-1.1 -3,-0.2 2,-0.6 -0.033 84.3 95.2-116.0 27.0 53.5 29.4 33.0 96 96 A I E < +I 114 0D 8 -3,-1.2 2,-0.2 18,-0.3 18,-0.2 -0.868 62.9 152.4-109.9 93.4 51.5 26.8 31.1 97 97 A V E -I 113 0D 61 16,-2.3 16,-2.4 -2,-0.6 2,-0.5 -0.727 49.3-140.6-127.6 168.3 53.9 23.9 31.2 98 98 A C E +I 112 0D 24 -2,-0.2 2,-0.2 14,-0.2 14,-0.2 -0.977 42.2 166.9-132.2 111.1 54.3 20.2 31.2 99 99 A T E +I 111 0D 48 12,-2.8 12,-3.5 -2,-0.5 -2,-0.0 -0.766 37.2 38.3-135.1 163.5 57.0 19.2 33.6 100 100 A D E - 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