==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-MAY-13 4KMQ . COMPND 2 MOLECULE: LMO2446 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR A.S.HALAVATY,G.MINASOV,E.V.FILIPPOVA,I.DUBROVSKA,J.WINSOR, . 1058 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37506.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 716 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 302 28.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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-2), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 108 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 2 0 1 0 1 0 1 0 2 2 2 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 4 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 0 PARALLEL BRIDGES PER LADDER . 10 8 9 9 5 7 6 2 2 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 . 1 1 1 3 5 1 1 1 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 33 A D 0 0 113 0, 0.0 2,-0.3 0, 0.0 37,-0.0 0.000 360.0 360.0 360.0 145.8 59.3 52.9 52.8 2 34 A G E -A 39 0A 9 37,-2.5 37,-1.7 38,-0.1 2,-0.3 -0.990 360.0-117.6 179.4-171.9 56.6 55.3 51.8 3 35 A E E -A 38 0A 12 -2,-0.3 2,-0.3 35,-0.2 35,-0.2 -0.970 24.4-171.8-148.9 150.2 53.1 56.6 51.5 4 36 A Y E +A 37 0A 110 33,-2.3 33,-2.5 -2,-0.3 2,-0.3 -0.940 16.7 156.9-158.1 136.6 51.0 57.5 48.5 5 37 A H + 0 0 2 -2,-0.3 15,-0.2 31,-0.2 31,-0.1 -0.969 5.2 176.2-149.8 135.3 47.7 59.1 47.5 6 38 A S > - 0 0 29 13,-2.7 3,-0.8 29,-0.3 13,-0.2 -0.865 22.7-147.1-143.0 109.0 46.8 60.7 44.2 7 39 A P T 3 S+ 0 0 7 0, 0.0 14,-2.5 0, 0.0 -1,-0.1 0.743 93.2 29.7 -52.0 -38.9 43.1 61.8 44.0 8 40 A Y T > S- 0 0 32 1,-0.3 3,-2.5 12,-0.2 4,-0.3 0.598 83.4-165.0-100.5 -9.3 42.4 61.2 40.3 9 41 A G T < S- 0 0 15 -3,-0.8 532,-0.4 1,-0.3 -1,-0.3 -0.454 76.1 -25.4 59.5-129.0 44.8 58.3 39.7 10 42 A D T 3 S- 0 0 48 -2,-0.2 530,-2.3 530,-0.1 -1,-0.3 0.327 86.6-121.0 -93.8 6.1 45.0 58.0 35.9 11 43 A D < + 0 0 23 -3,-2.5 2,-0.2 528,-0.2 -2,-0.1 0.802 49.6 175.4 57.9 34.2 41.6 59.6 35.6 12 44 A D - 0 0 10 -4,-0.3 -1,-0.2 3,-0.2 5,-0.1 -0.467 31.4-143.3 -72.2 138.4 40.3 56.5 33.7 13 45 A L S S+ 0 0 58 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 0.895 95.7 36.4 -68.8 -37.1 36.6 56.6 33.0 14 46 A Y S S+ 0 0 63 -3,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.713 119.8 26.1 -93.4 -24.2 36.1 52.9 33.6 15 47 A T - 0 0 74 -5,-0.0 2,-0.3 0, 0.0 -3,-0.2 -0.831 62.6-136.0-135.5 171.0 38.4 52.0 36.5 16 48 A V - 0 0 102 -2,-0.3 -7,-0.1 -5,-0.1 -8,-0.0 -0.945 18.6-124.6-129.0 148.0 40.1 53.5 39.5 17 49 A Q > - 0 0 74 -2,-0.3 3,-0.8 -11,-0.1 -11,-0.0 -0.531 37.1-110.5 -77.1 163.7 43.6 53.1 40.9 18 50 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 0.361 110.4 55.9 -84.7 12.3 43.6 51.9 44.5 19 51 A T T 3 S+ 0 0 11 -13,-0.2 -13,-2.7 55,-0.1 -10,-0.2 -0.163 82.7 119.5-132.2 38.3 44.8 55.3 46.0 20 52 A E < - 0 0 6 -3,-0.8 15,-2.5 -15,-0.2 2,-0.4 -0.371 64.3-108.8 -99.4 172.7 42.2 57.7 44.6 21 53 A R E -B 34 0A 2 -14,-2.5 13,-0.2 13,-0.2 -2,-0.1 -0.860 39.9-119.3 -98.6 141.6 39.7 60.1 46.2 22 54 A S E S+B 33 0A 69 11,-2.8 11,-3.1 -2,-0.4 2,-0.2 -0.991 99.4 24.6-135.8 123.3 36.1 59.1 45.8 23 55 A P S S- 0 0 38 0, 0.0 -1,-0.2 0, 0.0 10,-0.0 0.680 85.6-148.3 -71.2 159.9 34.2 60.8 44.4 24 56 A R S S+ 0 0 46 1,-0.3 -2,-0.1 -2,-0.2 8,-0.0 0.906 93.5 24.1 -61.4 -42.7 36.9 62.4 42.4 25 57 A D S S- 0 0 45 84,-0.1 -1,-0.3 -4,-0.0 87,-0.1 -0.812 93.8-145.1-126.4 89.2 35.1 65.7 42.2 26 58 A P - 0 0 2 0, 0.0 86,-1.2 0, 0.0 2,-0.2 -0.242 9.7-157.3 -64.3 140.5 32.8 65.9 45.1 27 59 A K B > -e 112 0B 56 84,-0.2 3,-1.6 1,-0.1 55,-0.4 -0.613 43.2 -68.3-103.6 167.9 29.4 67.6 45.0 28 60 A A T 3 S+ 0 0 29 84,-2.6 55,-0.2 1,-0.2 -1,-0.1 -0.300 119.7 16.9 -57.0 136.2 27.5 68.9 47.9 29 61 A G T 3 S+ 0 0 44 53,-2.6 2,-0.4 1,-0.2 -1,-0.2 0.480 92.0 124.3 81.1 3.0 26.2 66.2 50.3 30 62 A E < - 0 0 67 -3,-1.6 52,-0.4 52,-0.2 -1,-0.2 -0.839 64.7-120.2 -98.5 130.7 28.5 63.4 49.0 31 63 A D - 0 0 63 -2,-0.4 2,-0.6 50,-0.2 50,-0.2 -0.511 27.6-140.4 -69.3 131.4 30.7 61.6 51.6 32 64 A V E - C 0 80A 0 48,-2.3 47,-2.8 -2,-0.2 48,-0.6 -0.867 18.9-172.8-104.3 117.3 34.4 62.0 50.6 33 65 A I E -BC 22 78A 33 -11,-3.1 -11,-2.8 -2,-0.6 2,-0.5 -0.881 9.9-156.1-109.8 136.9 36.8 59.1 51.0 34 66 A L E -BC 21 77A 0 43,-2.7 43,-2.3 -2,-0.4 2,-0.6 -0.962 6.9-153.8-112.2 122.4 40.5 59.2 50.5 35 67 A N E + C 0 76A 24 -15,-2.5 2,-0.3 -2,-0.5 -29,-0.3 -0.873 22.1 177.3 -98.3 124.7 42.3 55.9 49.7 36 68 A I E - C 0 75A 0 39,-2.3 39,-3.1 -2,-0.6 2,-0.3 -0.956 14.6-153.9-130.1 145.1 45.9 55.9 50.8 37 69 A T E -AC 4 74A 6 -33,-2.5 -33,-2.3 -2,-0.3 2,-0.3 -0.898 7.9-174.5-121.6 153.4 48.6 53.3 50.7 38 70 A T E -AC 3 73A 4 35,-1.9 35,-2.5 -2,-0.3 -35,-0.2 -0.962 21.2-113.7-136.8 154.1 51.8 52.8 52.8 39 71 A W E S+A 2 0A 76 -37,-1.7 -37,-2.5 -2,-0.3 33,-0.2 -0.984 73.6 25.0-149.7 152.2 54.6 50.3 52.5 40 72 A P S S- 0 0 27 0, 0.0 2,-0.5 0, 0.0 32,-0.2 0.685 85.0-109.8 -80.4-179.9 56.0 48.1 53.6 41 73 A I + 0 0 68 30,-0.3 2,-0.3 -2,-0.1 -2,-0.1 -0.644 57.8 152.1 -74.5 124.0 53.4 46.3 55.7 42 74 A E > - 0 0 90 -2,-0.5 3,-0.7 -3,-0.0 2,-0.1 -0.993 46.6-108.6-152.3 150.9 54.4 46.9 59.4 43 75 A N T 3 S+ 0 0 164 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.443 97.6 43.0 -77.9 153.3 52.8 47.1 62.8 44 76 A G T 3 S+ 0 0 23 1,-0.3 53,-2.2 -2,-0.1 54,-0.3 0.584 76.4 150.7 89.3 9.9 52.6 50.6 64.4 45 77 A Q E < -F 96 0C 23 -3,-0.7 2,-0.4 51,-0.2 -1,-0.3 -0.514 26.1-166.3 -79.5 142.9 51.6 52.5 61.3 46 78 A D E -F 95 0C 85 49,-2.6 49,-2.1 -2,-0.2 2,-0.4 -0.996 3.5-173.2-127.1 131.5 49.6 55.7 61.5 47 79 A V E +F 94 0C 2 -2,-0.4 16,-3.2 16,-0.4 2,-0.3 -0.998 17.2 156.4-128.7 128.4 47.9 57.3 58.5 48 80 A W E -FG 93 62C 47 45,-2.3 45,-2.8 -2,-0.4 2,-0.4 -0.942 34.8-124.7-147.7 169.2 46.2 60.6 58.8 49 81 A V E -FG 92 61C 0 12,-2.4 12,-1.8 -2,-0.3 2,-0.5 -0.973 11.8-161.2-123.6 125.6 45.0 63.7 56.9 50 82 A E E +F 91 0C 64 41,-2.8 41,-2.4 -2,-0.4 2,-0.3 -0.955 34.2 155.8-103.3 127.6 46.0 67.3 57.6 51 83 A W E -F 90 0C 28 -2,-0.5 7,-2.6 7,-0.3 2,-0.3 -0.950 37.9-138.7-153.0 166.7 43.6 69.7 56.0 52 84 A T E -FH 89 57C 43 37,-2.7 37,-2.1 -2,-0.3 2,-0.5 -0.943 8.5-155.2-127.0 148.3 41.8 73.0 55.8 53 85 A K E > S-FH 88 56C 65 3,-2.3 3,-1.9 -2,-0.3 35,-0.2 -0.989 86.7 -15.7-123.4 116.3 38.2 73.9 55.0 54 86 A N T 3 S- 0 0 84 33,-3.0 -1,-0.1 -2,-0.5 34,-0.1 0.886 131.3 -52.6 55.1 40.9 37.7 77.4 53.6 55 87 A G T 3 S+ 0 0 66 32,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.334 113.9 118.8 80.7 -5.7 41.3 78.3 54.8 56 88 A V E < -H 53 0C 91 -3,-1.9 -3,-2.3 1,-0.0 -1,-0.2 -0.830 68.7-117.8 -98.8 125.5 40.6 77.1 58.4 57 89 A A E -H 52 0C 80 -2,-0.5 -5,-0.2 -5,-0.2 2,-0.2 -0.336 33.0-156.3 -61.3 131.6 42.7 74.3 59.8 58 90 A Q - 0 0 53 -7,-2.6 -7,-0.3 1,-0.1 2,-0.2 -0.549 29.6 -83.4-102.7 168.5 40.5 71.3 60.8 59 91 A E - 0 0 170 -2,-0.2 -1,-0.1 1,-0.1 -10,-0.0 -0.552 59.9 -96.3 -69.5 138.2 41.1 68.5 63.2 60 92 A N - 0 0 87 -2,-0.2 2,-0.5 1,-0.1 -10,-0.2 -0.210 34.2-135.7 -55.1 143.8 43.3 65.8 61.7 61 93 A V E -G 49 0C 28 -12,-1.8 -12,-2.4 -3,-0.1 2,-0.4 -0.951 14.6-139.7-106.2 125.6 41.3 62.8 60.2 62 94 A T E -G 48 0C 111 -2,-0.5 16,-0.4 -14,-0.2 -14,-0.3 -0.696 14.3-132.8 -87.5 131.0 42.7 59.4 61.1 63 95 A A - 0 0 6 -16,-3.2 -16,-0.4 -2,-0.4 2,-0.3 -0.593 14.2-142.8 -81.8 147.1 42.7 56.7 58.3 64 96 A A E -D 76 0A 62 12,-3.0 12,-2.7 -2,-0.2 -18,-0.0 -0.841 27.0-100.8-108.9 145.0 41.4 53.3 59.0 65 97 A Y E +D 75 0A 193 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.360 37.0 176.3 -65.5 146.2 43.0 50.1 57.5 66 98 A D E - 0 0 70 8,-3.5 2,-0.3 1,-0.4 9,-0.2 0.730 56.5 -38.0-113.6 -65.3 41.1 48.6 54.5 67 99 A Y E -D 74 0A 101 7,-1.2 7,-3.5 2,-0.0 -1,-0.4 -0.971 48.0-121.5-157.8 164.3 43.1 45.7 53.2 68 100 A N E +D 73 0A 94 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.889 26.6 176.1-108.7 144.5 46.7 44.5 52.6 69 101 A S E > -D 72 0A 69 3,-2.8 3,-2.2 -2,-0.4 2,-0.3 -0.933 56.9 -39.6-151.4 124.3 48.0 43.5 49.1 70 102 A G T 3 S- 0 0 75 -2,-0.3 -29,-0.1 1,-0.3 -2,-0.0 -0.447 125.8 -17.6 67.1-120.7 51.6 42.6 48.2 71 103 A N T 3 S+ 0 0 94 -2,-0.3 2,-0.3 -31,-0.1 -30,-0.3 0.335 123.9 83.5 -97.6 1.8 54.0 44.8 50.1 72 104 A N E < - D 0 69A 34 -3,-2.2 -3,-2.8 -32,-0.2 2,-0.4 -0.794 60.2-148.2-118.8 153.9 51.3 47.5 50.8 73 105 A T E -CD 38 68A 8 -35,-2.5 -35,-1.9 -2,-0.3 2,-0.4 -0.925 20.5-148.2-111.1 137.9 48.5 48.4 53.3 74 106 A Y E -CD 37 67A 34 -7,-3.5 -8,-3.5 -2,-0.4 -7,-1.2 -0.927 17.1-173.0-111.0 137.0 45.5 50.3 51.9 75 107 A W E -CD 36 65A 24 -39,-3.1 -39,-2.3 -2,-0.4 2,-0.4 -0.882 17.1-143.6-127.8 156.2 43.6 52.7 54.1 76 108 A K E -CD 35 64A 88 -12,-2.7 -12,-3.0 -2,-0.3 2,-0.5 -0.987 10.0-168.7-124.3 124.9 40.5 54.8 54.0 77 109 A A E -C 34 0A 0 -43,-2.3 -43,-2.7 -2,-0.4 2,-0.7 -0.963 13.7-148.9-109.1 129.2 40.2 58.4 55.5 78 110 A D E +C 33 0A 82 -2,-0.5 -45,-0.2 -16,-0.4 3,-0.1 -0.891 18.6 178.4-106.4 109.4 36.6 59.7 55.7 79 111 A L E - 0 0 13 -47,-2.8 -46,-0.1 -2,-0.7 -1,-0.1 0.566 37.7-141.2 -82.3 -11.1 36.5 63.5 55.3 80 112 A G E -C 32 0A 22 -48,-0.6 -48,-2.3 2,-0.0 -1,-0.3 -0.427 35.9 -35.9 84.6-160.1 32.7 63.5 55.5 81 113 A K - 0 0 143 -50,-0.2 2,-0.3 -2,-0.1 -50,-0.2 -0.675 52.5-160.0-104.0 156.1 30.3 65.7 53.5 82 114 A F - 0 0 11 -52,-0.4 -53,-2.6 -55,-0.4 2,-0.3 -0.805 14.7-118.1-132.5 167.1 30.5 69.3 52.4 83 115 A E > - 0 0 140 -2,-0.3 3,-2.3 -55,-0.2 28,-0.2 -0.763 46.7 -82.3-104.7 154.9 28.4 72.2 51.2 84 116 A K T 3 S+ 0 0 63 -2,-0.3 28,-0.2 1,-0.3 142,-0.1 -0.261 118.3 29.2 -51.5 133.8 28.4 73.9 47.8 85 117 A G T 3 S+ 0 0 25 26,-2.9 -1,-0.3 1,-0.3 144,-0.1 0.080 83.0 137.3 100.4 -23.2 31.3 76.5 47.9 86 118 A D < - 0 0 14 -3,-2.3 25,-2.7 24,-0.1 2,-0.6 -0.350 40.7-154.6 -63.3 133.8 33.5 74.7 50.4 87 119 A E E - I 0 110C 73 23,-0.2 -33,-3.0 -3,-0.1 -32,-0.5 -0.967 13.4-168.7-112.3 113.6 37.2 74.7 49.4 88 120 A I E -FI 53 109C 0 21,-2.7 21,-2.4 -2,-0.6 2,-0.4 -0.905 9.1-178.0-111.9 127.6 39.1 71.8 50.9 89 121 A T E +FI 52 108C 33 -37,-2.1 -37,-2.7 -2,-0.5 2,-0.3 -0.995 14.6 171.2-126.0 127.1 42.8 71.4 50.9 90 122 A Y E -FI 51 107C 1 17,-2.5 17,-2.5 -2,-0.4 2,-0.4 -0.946 27.2-157.8-139.9 159.5 44.5 68.3 52.3 91 123 A T E -F 50 0C 23 -41,-2.4 -41,-2.8 -2,-0.3 2,-0.3 -0.999 19.5-144.7-133.7 124.8 47.8 66.4 52.7 92 124 A T E -FI 49 104C 0 12,-1.9 12,-2.2 -2,-0.4 2,-0.3 -0.737 22.7-171.4 -91.5 142.7 47.8 62.7 53.4 93 125 A K E -FI 48 103C 34 -45,-2.8 -45,-2.3 -2,-0.3 2,-0.4 -0.989 15.6-168.2-139.7 150.8 50.5 61.4 55.7 94 126 A G E +FI 47 102C 4 8,-2.5 8,-3.1 -2,-0.3 2,-0.3 -0.998 12.8 164.5-139.5 136.3 52.0 58.1 56.9 95 127 A S E -F 46 0C 10 -49,-2.1 -49,-2.6 -2,-0.4 2,-0.5 -0.987 25.7-139.9-148.9 150.5 54.4 57.4 59.7 96 128 A T E > S-F 45 0C 45 4,-0.4 3,-1.4 -2,-0.3 -51,-0.2 -0.965 84.7 -13.9-119.8 122.1 55.5 54.2 61.7 97 129 A N T 3 S- 0 0 134 -53,-2.2 -1,-0.2 -2,-0.5 -52,-0.1 0.876 124.4 -60.5 55.0 42.8 56.1 54.5 65.4 98 130 A G T 3 S+ 0 0 69 -54,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.620 108.1 123.7 63.8 18.5 56.1 58.3 65.3 99 131 A G < - 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