==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 06-DEC-12 4IAB . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES UNIFORMIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 547 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28808.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 350 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 253 46.3 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 . 16 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 38 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 6.8 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 . 4 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 . 0 0 0 7 5 8 0 8 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 . 0 0 0 0 0 0 0 0 4 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 0 A G 0 0 139 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.7 8.3 71.9 123.4 2 23 A Q - 0 0 170 1,-0.0 3,-0.1 0, 0.0 2,-0.0 -0.890 360.0-122.3-112.8 135.5 10.7 74.8 123.5 3 24 A E - 0 0 104 -2,-0.4 -1,-0.0 1,-0.2 0, 0.0 -0.349 61.4 -68.4 -63.3 155.4 10.1 78.6 123.1 4 25 A S - 0 0 76 1,-0.2 -1,-0.2 2,-0.1 64,-0.0 -0.241 42.9-169.9 -50.3 127.6 12.2 80.0 120.2 5 26 A A + 0 0 62 -3,-0.1 2,-2.0 1,-0.1 -1,-0.2 0.270 50.6 118.9 -94.4 5.6 15.9 80.0 121.0 6 27 A E + 0 0 177 63,-0.1 2,-0.3 2,-0.1 65,-0.1 -0.483 50.1 84.3 -85.6 74.1 16.7 82.2 118.0 7 28 A F S S- 0 0 41 -2,-2.0 63,-0.1 63,-0.1 64,-0.1 -0.946 84.0-106.0-157.2 159.0 18.2 85.3 119.6 8 29 A R - 0 0 188 -2,-0.3 -2,-0.1 1,-0.0 62,-0.1 -0.851 49.2-112.7 -92.7 114.3 21.7 86.1 120.8 9 30 A P - 0 0 111 0, 0.0 2,-0.2 0, 0.0 62,-0.1 -0.237 33.5-157.8 -56.4 133.2 21.5 85.9 124.6 10 31 A A - 0 0 34 1,-0.0 2,-2.1 0, 0.0 3,-0.4 -0.700 31.5 -99.7-103.9 164.8 21.9 89.2 126.4 11 32 A E + 0 0 144 -2,-0.2 -1,-0.0 1,-0.2 0, 0.0 -0.379 70.0 136.2 -85.4 60.9 23.0 89.8 129.9 12 33 A L + 0 0 6 -2,-2.1 -1,-0.2 30,-0.0 29,-0.2 0.826 37.3 97.1 -76.3 -38.1 19.5 90.3 131.3 13 34 A A + 0 0 34 -3,-0.4 2,-0.3 30,-0.1 29,-0.2 -0.342 59.8 80.5 -59.9 136.5 19.8 88.2 134.5 14 35 A G E S-A 41 0A 22 27,-2.5 27,-2.9 2,-0.1 2,-0.6 -0.925 83.5 -73.9 156.1 175.2 20.6 90.3 137.5 15 36 A I E -A 40 0A 14 115,-0.4 115,-3.1 -2,-0.3 2,-0.4 -0.964 51.2-163.9-102.3 125.8 19.3 92.6 140.2 16 37 A W E -AB 39 129A 0 23,-2.9 23,-2.5 -2,-0.6 2,-0.5 -0.880 10.3-147.5-118.6 139.2 18.5 96.0 138.6 17 38 A Q E -AB 38 128A 4 111,-2.9 111,-2.5 -2,-0.4 21,-0.2 -0.923 21.8-122.6-111.4 128.8 17.8 99.3 140.3 18 39 A L E - B 0 127A 15 19,-3.1 17,-3.0 -2,-0.5 19,-0.3 -0.455 31.9-162.3 -69.5 136.1 15.5 101.8 138.8 19 40 A C E -AB 34 126A 11 107,-3.1 107,-0.5 15,-0.3 2,-0.3 -0.770 10.7-172.7-115.6 160.6 17.0 105.2 138.1 20 41 A H E -A 33 0A 80 13,-2.8 13,-3.0 -2,-0.3 2,-0.5 -0.830 30.0 -99.2-140.4-178.3 15.7 108.7 137.5 21 42 A Y E -A 32 0A 120 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.947 33.8-165.5-117.0 124.3 17.1 112.0 136.5 22 43 A V E +A 31 0A 66 9,-2.8 9,-2.5 -2,-0.5 2,-0.3 -0.940 9.9 175.5-120.6 129.1 17.8 114.7 139.1 23 44 A S - 0 0 47 -2,-0.4 7,-0.1 7,-0.3 -2,-0.0 -0.961 26.7-151.6-128.7 144.5 18.4 118.4 138.6 24 45 A E S S+ 0 0 203 -2,-0.3 -1,-0.1 1,-0.0 6,-0.0 0.618 84.7 69.0 -84.6 -14.9 18.9 121.1 141.3 25 46 A I S > S- 0 0 103 3,-0.2 3,-1.4 1,-0.1 -1,-0.0 -0.912 84.5-124.9-117.4 134.1 17.5 123.6 138.8 26 47 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.793 99.8 26.7 -44.1 -54.7 13.8 123.9 137.5 27 48 A D T 3 S+ 0 0 157 2,-0.1 0, 0.0 0, 0.0 0, 0.0 0.149 98.9 95.5-110.1 20.9 14.2 123.8 133.7 28 49 A V S < S- 0 0 78 -3,-1.4 -3,-0.2 1,-0.0 2,-0.1 -0.909 77.8-107.2-116.9 136.6 17.3 121.9 133.2 29 50 A P - 0 0 118 0, 0.0 -7,-0.1 0, 0.0 -4,-0.1 -0.333 39.8-125.8 -65.1 144.1 17.5 118.1 132.5 30 51 A G - 0 0 23 -9,-0.2 2,-0.3 -7,-0.1 -7,-0.3 -0.206 11.3-113.5 -88.3 172.7 18.8 116.0 135.3 31 52 A I E -A 22 0A 106 -9,-2.5 -9,-2.8 1,-0.1 2,-0.1 -0.748 45.5 -82.1-106.3 160.3 21.6 113.5 135.8 32 53 A L E +A 21 0A 55 -2,-0.3 -11,-0.2 -11,-0.2 -1,-0.1 -0.337 52.9 167.8 -67.7 126.0 21.1 109.8 136.5 33 54 A K E -A 20 0A 95 -13,-3.0 -13,-2.8 -2,-0.1 2,-0.1 -0.992 34.7-109.1-136.9 148.7 20.5 108.9 140.1 34 55 A P E -A 19 0A 16 0, 0.0 -15,-0.3 0, 0.0 158,-0.1 -0.430 34.4-167.4 -78.4 148.1 19.3 105.6 141.7 35 56 A S E - 0 0 7 -17,-3.0 244,-0.1 2,-0.2 158,-0.1 -0.152 35.1 -83.3-118.0-150.0 15.9 105.3 143.2 36 57 A N E S+ 0 0 25 16,-0.1 16,-2.9 242,-0.1 2,-0.4 0.269 88.1 91.4-109.3 11.4 13.9 102.8 145.4 37 58 A T E - C 0 51A 0 -19,-0.3 -19,-3.1 14,-0.2 2,-0.4 -0.863 50.4-165.2-119.6 142.7 12.7 100.1 143.0 38 59 A F E -AC 17 50A 0 12,-3.4 12,-2.7 -2,-0.4 2,-0.5 -0.946 10.3-157.9-128.3 141.5 14.3 96.8 142.0 39 60 A K E -AC 16 49A 3 -23,-2.5 -23,-2.9 -2,-0.4 2,-0.7 -0.989 10.4-157.8-117.0 118.8 13.8 94.4 139.2 40 61 A V E -AC 15 48A 12 8,-3.0 8,-1.9 -2,-0.5 2,-0.7 -0.903 8.2-174.8 -95.3 111.0 15.0 90.8 139.8 41 62 A L E -AC 14 47A 1 -27,-2.9 -27,-2.5 -2,-0.7 6,-0.2 -0.934 25.4-148.5-100.7 98.2 15.6 89.0 136.5 42 63 A S > - 0 0 8 4,-2.8 3,-1.4 -2,-0.7 24,-0.1 -0.264 21.3-118.3 -73.8 158.1 16.5 85.6 137.9 43 64 A D T 3 S+ 0 0 98 1,-0.2 -1,-0.1 2,-0.1 -30,-0.1 0.697 114.4 56.6 -60.5 -20.3 18.9 83.1 136.3 44 65 A D T 3 S- 0 0 55 2,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.067 124.6 -94.2-109.6 27.8 15.9 80.7 136.1 45 66 A G S < S+ 0 0 22 -3,-1.4 21,-2.6 1,-0.2 2,-0.3 0.634 79.5 129.4 83.1 17.6 13.5 83.0 134.1 46 67 A R E - D 0 65A 123 19,-0.3 -4,-2.8 30,-0.0 2,-0.4 -0.819 38.9-156.2-107.0 144.0 11.4 84.7 136.7 47 68 A I E +CD 41 64A 0 17,-2.4 17,-2.4 -2,-0.3 2,-0.4 -0.974 13.1 174.2-121.2 134.1 10.8 88.4 137.1 48 69 A V E -CD 40 63A 29 -8,-1.9 -8,-3.0 -2,-0.4 2,-0.5 -0.984 12.0-162.4-135.7 130.5 9.9 90.4 140.2 49 70 A N E +CD 39 62A 9 13,-2.9 12,-2.6 -2,-0.4 13,-1.4 -0.932 20.6 168.7-103.1 131.8 9.5 94.2 140.6 50 71 A F E -CD 38 60A 0 -12,-2.7 -12,-3.4 -2,-0.5 2,-0.4 -0.989 20.1-149.5-146.7 155.1 9.6 95.5 144.1 51 72 A T E -CD 37 59A 0 8,-2.4 8,-2.5 -2,-0.3 -14,-0.2 -0.976 14.5-130.8-127.1 133.1 9.8 98.9 145.8 52 73 A X - 0 0 3 -16,-2.9 226,-0.2 -2,-0.4 5,-0.1 -0.433 9.8-161.1 -71.5 149.3 11.2 100.0 149.1 53 74 A I > - 0 0 39 3,-0.5 3,-2.7 -2,-0.1 226,-0.0 -0.857 32.3-117.2-133.3 102.9 9.3 102.1 151.4 54 75 A P T 3 S+ 0 0 80 0, 0.0 3,-0.1 0, 0.0 118,-0.1 0.016 95.3 2.4 -45.2 132.5 11.8 103.7 153.8 55 76 A G T 3 S+ 0 0 61 1,-0.2 2,-0.2 116,-0.1 118,-0.1 0.466 125.3 76.8 67.1 3.0 11.1 102.6 157.4 56 77 A K S < S- 0 0 87 -3,-2.7 -3,-0.5 114,-0.1 2,-0.2 -0.748 94.7 -66.3-134.2 178.6 8.3 100.3 156.2 57 78 A D - 0 0 63 -2,-0.2 2,-0.1 -5,-0.1 210,-0.0 -0.483 50.8-125.1 -69.7 130.9 7.7 96.9 154.6 58 79 A A - 0 0 4 -2,-0.2 210,-0.5 -6,-0.1 2,-0.4 -0.391 28.3-141.2 -67.7 157.7 8.9 96.8 150.9 59 80 A I E -De 51 268A 17 -8,-2.5 -8,-2.4 208,-0.1 2,-0.4 -0.976 9.8-130.6-131.2 135.1 6.3 95.7 148.4 60 81 A I E +D 50 0A 22 208,-2.6 -10,-0.3 -2,-0.4 3,-0.1 -0.680 23.4 179.8 -73.5 132.9 6.2 93.6 145.3 61 82 A T E + 0 0 0 -12,-2.6 21,-1.7 -2,-0.4 22,-1.1 0.550 63.8 3.2-113.3 -9.2 4.5 95.5 142.5 62 83 A G E +DF 49 81A 0 -13,-1.4 -13,-2.9 19,-0.2 -1,-0.4 -0.944 60.5 173.5-171.4 144.8 4.7 92.9 139.7 63 84 A Y E +DF 48 80A 81 17,-1.6 16,-2.3 -2,-0.3 17,-1.0 -0.990 19.8 106.9-155.2 162.5 5.8 89.4 139.0 64 85 A G E -DF 47 78A 6 -17,-2.4 -17,-2.4 -2,-0.3 2,-0.3 -0.931 60.8 -54.9 170.0-148.3 5.9 86.7 136.4 65 86 A T E -DF 46 77A 52 12,-1.8 12,-3.0 -19,-0.3 2,-0.3 -0.790 41.2-151.5-116.5 163.9 8.2 85.0 134.0 66 87 A Y E - F 0 76A 30 -21,-2.6 2,-0.3 -2,-0.3 10,-0.2 -0.975 10.2-176.2-139.1 159.4 10.5 86.5 131.3 67 88 A Q E - F 0 75A 53 8,-2.0 8,-2.6 -2,-0.3 2,-0.1 -0.948 27.6-122.7-155.2 122.0 11.9 85.3 128.0 68 89 A Q E + F 0 74A 13 -2,-0.3 6,-0.3 6,-0.3 3,-0.1 -0.458 27.9 178.4 -66.4 142.8 14.3 86.9 125.6 69 90 A L E + 0 0 53 4,-2.6 2,-0.2 1,-0.3 5,-0.2 0.752 60.5 0.4-114.7 -44.6 12.7 87.2 122.1 70 91 A T E > S- F 0 73A 71 3,-1.9 3,-0.9 -63,-0.1 -1,-0.3 -0.783 89.8 -80.2-138.0 179.6 15.2 89.0 119.9 71 92 A D T 3 S+ 0 0 63 -2,-0.2 -64,-0.1 1,-0.2 3,-0.0 0.816 130.4 21.8 -57.9 -28.5 18.7 90.4 120.3 72 93 A N T 3 S+ 0 0 90 25,-0.1 24,-2.4 -62,-0.0 2,-0.3 0.071 115.5 65.2-133.4 33.5 17.2 93.5 121.8 73 94 A S E < +FG 70 95A 12 -3,-0.9 -4,-2.6 22,-0.3 -3,-1.9 -0.997 46.5 176.5-149.0 151.2 13.8 92.6 123.2 74 95 A Y E -FG 68 94A 0 20,-2.2 20,-3.5 -2,-0.3 2,-0.4 -0.951 22.2-126.6-142.5 158.6 12.3 90.4 125.8 75 96 A K E -FG 67 93A 30 -8,-2.6 -8,-2.0 -2,-0.3 2,-0.5 -0.893 5.1-152.4-108.1 145.4 8.8 89.7 127.2 76 97 A E E -FG 66 92A 5 16,-2.3 16,-2.3 -2,-0.4 2,-1.1 -0.982 10.5-153.4-106.2 118.3 7.5 89.8 130.7 77 98 A S E -FG 65 91A 28 -12,-3.0 -12,-1.8 -2,-0.5 2,-0.4 -0.843 23.8-155.3 -93.8 97.0 4.7 87.4 131.1 78 99 A I E -FG 64 90A 4 12,-2.2 11,-1.3 -2,-1.1 12,-0.6 -0.639 25.6-176.7 -86.9 126.8 3.0 89.3 133.9 79 100 A E E S- 0 0 93 -16,-2.3 10,-0.8 -2,-0.4 2,-0.4 0.947 78.0 -8.2 -77.4 -61.7 0.7 87.4 136.3 80 101 A K E -F 63 0A 91 -17,-1.0 -17,-1.6 8,-0.2 -1,-0.4 -0.993 58.9-177.5-141.8 141.1 -0.3 90.5 138.3 81 102 A N E -F 62 0A 5 -2,-0.4 -19,-0.2 -19,-0.2 7,-0.2 -0.897 7.2-176.3-139.9 109.3 1.0 94.1 138.3 82 103 A I S S+ 0 0 17 -21,-1.7 191,-0.4 -2,-0.3 -20,-0.1 0.696 88.6 53.9 -82.4 -16.6 -0.5 96.5 140.8 83 104 A H S S+ 0 0 52 -22,-1.1 -1,-0.2 1,-0.2 -21,-0.1 0.913 128.1 18.6 -74.0 -42.8 1.6 99.4 139.3 84 105 A L S > S+ 0 0 14 -23,-0.3 3,-2.1 1,-0.1 -1,-0.2 -0.712 71.9 175.1-130.1 77.3 0.2 98.7 135.8 85 106 A P G > S+ 0 0 45 0, 0.0 3,-1.8 0, 0.0 -4,-0.1 0.725 72.1 72.8 -66.4 -20.0 -3.0 96.6 136.2 86 107 A X G 3 S+ 0 0 38 1,-0.3 26,-0.1 3,-0.0 -2,-0.0 0.735 92.1 61.4 -66.4 -16.5 -3.8 96.6 132.4 87 108 A L G X S+ 0 0 13 -3,-2.1 3,-1.9 -6,-0.2 -9,-0.3 0.474 73.3 130.1 -84.6 -1.3 -0.8 94.2 132.0 88 109 A D T < S- 0 0 45 -3,-1.8 -8,-0.2 1,-0.3 -9,-0.2 -0.325 83.9 -1.9 -60.0 131.3 -2.3 91.4 134.2 89 110 A H T 3 S+ 0 0 154 -11,-1.3 2,-0.3 -10,-0.8 -1,-0.3 0.732 116.6 106.0 59.2 28.4 -2.2 88.0 132.5 90 111 A K E < S-G 78 0A 82 -3,-1.9 -12,-2.2 -12,-0.6 2,-0.4 -0.852 72.6-110.7-129.0 164.7 -0.6 89.6 129.5 91 112 A D E -G 77 0A 92 -2,-0.3 2,-0.5 -14,-0.2 -14,-0.2 -0.810 23.5-161.5 -92.5 136.6 2.8 89.8 127.8 92 113 A N E -G 76 0A 10 -16,-2.3 -16,-2.3 -2,-0.4 2,-0.6 -0.988 10.8-145.8-114.9 127.1 4.6 93.0 127.8 93 114 A I E -G 75 0A 93 -2,-0.5 2,-0.5 16,-0.2 16,-0.4 -0.838 14.2-164.5 -96.5 123.3 7.4 93.3 125.2 94 115 A L E -G 74 0A 2 -20,-3.5 -20,-2.2 -2,-0.6 2,-0.4 -0.917 9.1-151.8-109.6 123.3 10.4 95.4 126.4 95 116 A E E -GH 73 107A 90 12,-2.8 12,-2.0 -2,-0.5 2,-0.3 -0.838 28.3-169.1 -87.4 135.8 12.9 96.7 123.9 96 117 A F E - 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