==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID BINDING PROTEIN 07-AUG-08 3E3C . COMPND 2 MOLECULE: L0044; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.JOBICHEN,J.SIVARAMAN . 236 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11710.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 70.3 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 . 126 53.4 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 24 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 5.9 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+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 . 0 4 0 4 6 0 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 0 0 0 0 0 0 2 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 -6 A G 0 0 94 0, 0.0 2,-0.1 0, 0.0 87,-0.1 0.000 360.0 360.0 360.0 146.3 17.1 37.5 11.5 2 -5 A L - 0 0 76 85,-0.1 87,-0.2 87,-0.1 85,-0.1 -0.418 360.0-174.8 -73.4 147.4 16.7 34.1 13.0 3 -4 A V E -A 88 0A 71 85,-1.2 85,-2.1 83,-0.1 83,-0.1 -0.997 36.3 -91.0-143.9 144.4 18.6 31.1 11.4 4 -3 A P E +A 87 0A 95 0, 0.0 2,-0.3 0, 0.0 83,-0.2 -0.345 60.6 155.9 -56.9 123.2 18.5 27.3 12.1 5 -2 A R E -A 86 0A 65 81,-2.8 81,-3.1 -2,-0.1 2,-0.4 -0.965 50.6 -87.1-147.8 160.3 21.2 26.6 14.7 6 -1 A G E > -A 85 0A 22 -2,-0.3 3,-3.2 79,-0.2 4,-0.3 -0.586 33.2-135.3 -72.2 123.6 22.0 24.0 17.3 7 0 A S G > S+ 0 0 4 77,-1.9 3,-1.2 -2,-0.4 -1,-0.2 0.715 104.0 71.0 -50.6 -20.0 20.3 25.0 20.5 8 1 A M G 3 S+ 0 0 47 76,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.437 81.6 71.7 -79.1 1.6 23.6 24.1 22.1 9 2 A I G < + 0 0 96 -3,-3.2 -1,-0.2 2,-0.1 -2,-0.2 0.606 69.6 126.4 -89.6 -13.5 25.1 27.2 20.6 10 3 A M < - 0 0 24 -3,-1.2 80,-0.1 -4,-0.3 2,-0.1 -0.105 67.5-114.0 -45.6 135.1 23.2 29.4 23.0 11 4 A K - 0 0 79 79,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.404 36.8-101.8 -70.1 151.0 25.4 31.9 24.9 12 5 A D S S+ 0 0 70 -3,-0.1 2,-0.3 -2,-0.1 22,-0.2 -0.452 76.8 75.2 -72.6 149.7 25.6 31.2 28.6 13 6 A G E S-B 33 0A 0 20,-2.0 20,-2.2 103,-0.2 2,-0.4 -0.948 81.1 -44.1 147.2-167.2 23.5 33.5 30.7 14 7 A I E -BC 32 115A 0 101,-3.0 100,-2.6 -2,-0.3 101,-1.2 -0.873 49.4-163.7-105.9 133.8 20.0 34.4 31.9 15 8 A Y E -BC 31 113A 5 16,-3.7 16,-2.3 -2,-0.4 2,-0.4 -0.866 17.0-134.8-119.2 152.2 17.1 34.5 29.4 16 9 A S E -BC 30 112A 18 96,-3.2 96,-2.7 -2,-0.3 2,-0.4 -0.801 31.4-160.9 -97.2 143.4 13.6 35.9 29.5 17 10 A I E +BC 29 111A 11 12,-2.4 12,-2.3 -2,-0.4 2,-0.4 -0.987 20.4 179.6-139.2 139.8 11.0 33.5 28.2 18 11 A I E +BC 28 110A 74 92,-2.1 92,-2.8 -2,-0.4 2,-0.3 -0.994 16.1 173.9-131.4 137.0 7.4 33.6 26.8 19 12 A F E -BC 27 109A 22 8,-2.6 8,-1.8 -2,-0.4 2,-0.4 -0.975 20.4-158.9-146.6 159.4 5.4 30.6 25.7 20 13 A I E -BC 26 108A 59 88,-1.6 88,-2.7 -2,-0.3 6,-0.2 -0.999 17.3-145.9-139.3 134.2 2.0 29.5 24.5 21 14 A S E > - C 0 107A 7 4,-2.2 3,-1.4 -2,-0.4 86,-0.2 -0.292 34.1-100.6 -92.5 179.3 0.6 25.9 24.5 22 15 A N T 3 S+ 0 0 52 84,-1.4 85,-0.1 1,-0.3 50,-0.1 0.713 123.3 65.1 -71.4 -20.2 -1.7 24.1 22.2 23 16 A E T 3 S- 0 0 79 48,-0.4 -1,-0.3 83,-0.3 3,-0.1 0.444 119.2-115.5 -79.2 -0.2 -4.4 24.8 24.7 24 17 A D < + 0 0 123 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.767 69.6 140.0 71.2 28.0 -3.8 28.5 23.8 25 18 A S - 0 0 47 46,-0.4 -4,-2.2 45,-0.0 2,-0.3 -0.809 39.2-145.2-103.4 145.6 -2.6 29.4 27.2 26 19 A C E +B 20 0A 97 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.720 18.5 172.8-109.2 160.0 0.4 31.8 27.8 27 20 A G E -B 19 0A 18 -8,-1.8 -8,-2.6 -2,-0.3 2,-0.3 -0.977 14.1-153.3-159.3 155.0 3.1 31.9 30.4 28 21 A E E +B 18 0A 90 -2,-0.3 15,-0.4 -10,-0.2 2,-0.3 -0.932 26.6 138.3-131.4 155.4 6.3 33.8 31.1 29 22 A G E -B 17 0A 7 -12,-2.3 -12,-2.4 -2,-0.3 2,-0.3 -0.973 43.2 -83.4-173.6-172.8 9.4 32.8 33.1 30 23 A I E -BD 16 41A 3 11,-2.2 11,-2.1 -2,-0.3 2,-0.4 -0.878 28.4-166.3-116.7 147.6 13.2 32.8 33.4 31 24 A L E -BD 15 40A 19 -16,-2.3 -16,-3.7 -2,-0.3 2,-0.4 -0.997 1.8-163.0-135.6 131.9 15.7 30.4 31.9 32 25 A I E -BD 14 39A 5 7,-3.9 7,-2.2 -2,-0.4 2,-0.4 -0.933 1.9-168.7-117.1 137.2 19.4 29.9 32.9 33 26 A K E +BD 13 38A 12 -20,-2.2 -20,-2.0 -2,-0.4 5,-0.2 -0.987 15.9 158.5-125.7 125.1 22.0 28.2 30.8 34 27 A N S S- 0 0 56 3,-2.4 -1,-0.1 -2,-0.4 4,-0.1 0.548 71.6 -31.3-107.6-103.8 25.4 27.3 32.1 35 28 A G S S- 0 0 40 -23,-0.1 15,-0.0 0, 0.0 -2,-0.0 0.834 123.5 -37.7 -81.1 -92.3 27.5 24.6 30.4 36 29 A N S S+ 0 0 78 -3,-0.1 15,-3.2 14,-0.0 2,-0.3 0.386 115.9 114.5-108.1 -5.4 24.9 22.1 29.0 37 30 A M E - E 0 50A 51 13,-0.2 -3,-2.4 11,-0.1 2,-0.5 -0.488 45.4-172.1 -73.1 131.4 22.8 22.7 32.2 38 31 A I E +DE 33 49A 17 11,-2.6 11,-1.8 -2,-0.3 2,-0.4 -0.980 11.3 164.1-128.9 118.9 19.5 24.4 31.7 39 32 A T E +DE 32 48A 9 -7,-2.2 -7,-3.9 -2,-0.5 2,-0.3 -0.979 12.2 127.6-133.5 144.6 17.4 25.5 34.7 40 33 A G E +DE 31 47A 0 7,-2.1 7,-2.4 -2,-0.4 2,-0.3 -0.911 19.3 177.9-169.3-165.0 14.5 27.8 34.9 41 34 A G E -DE 30 46A 3 -11,-2.1 -11,-2.2 5,-0.3 5,-0.3 -0.896 15.7-137.1 162.0 169.1 10.9 28.3 36.1 42 35 A D - 0 0 27 3,-3.4 -13,-0.1 -2,-0.3 106,-0.1 -0.546 55.9 -65.6-132.4-162.2 7.9 30.5 36.5 43 36 A I S S+ 0 0 69 -15,-0.4 3,-0.1 -2,-0.2 105,-0.1 0.671 131.9 24.8 -69.2 -14.4 5.3 31.2 39.2 44 37 A A S S+ 0 0 3 1,-0.3 20,-2.6 22,-0.1 21,-1.5 0.649 123.4 26.9-122.1 -23.6 3.9 27.6 39.1 45 38 A S E - F 0 63A 9 18,-0.3 -3,-3.4 19,-0.2 2,-0.3 -0.950 54.0-152.7-141.9 161.3 6.6 25.3 37.7 46 39 A V E -EF 41 62A 0 16,-2.3 16,-2.9 -2,-0.3 2,-0.4 -0.898 14.8-155.9-128.5 158.4 10.4 24.9 37.4 47 40 A Y E +EF 40 61A 21 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.3 -0.991 12.3 179.6-147.4 140.8 12.5 23.1 34.9 48 41 A Q E +EF 39 60A 6 12,-1.9 12,-2.9 -2,-0.4 2,-0.3 -0.948 14.8 147.3-132.6 152.3 15.9 21.4 34.4 49 42 A G E -EF 38 59A 5 -11,-1.8 -11,-2.6 -2,-0.3 2,-0.5 -0.941 37.0-121.1-177.0 156.5 17.6 19.7 31.6 50 43 A V E -E 37 0A 70 8,-0.5 8,-0.3 -2,-0.3 -13,-0.2 -0.946 34.4-112.9-116.5 120.7 20.9 19.0 30.0 51 44 A L - 0 0 4 -15,-3.2 5,-0.1 -2,-0.5 -14,-0.0 -0.284 40.2-158.7 -50.0 110.0 21.7 20.0 26.4 52 45 A S + 0 0 27 -2,-0.2 4,-0.1 3,-0.1 -1,-0.1 0.967 23.7 174.8 -58.8 -97.1 22.0 16.6 24.8 53 46 A E S S+ 0 0 117 2,-0.9 3,-0.1 0, 0.0 -2,-0.0 0.966 87.0 31.8 76.6 75.0 23.9 16.2 21.5 54 47 A D S S+ 0 0 71 1,-0.5 2,-0.3 0, 0.0 -2,-0.0 0.256 125.7 44.1 126.7 -1.9 23.9 12.5 21.1 55 48 A E S S- 0 0 163 3,-0.0 -2,-0.9 0, 0.0 -1,-0.5 -0.955 99.3 -79.7-158.3 166.5 20.6 12.0 22.9 56 49 A D - 0 0 127 -2,-0.3 2,-0.8 -4,-0.1 28,-0.0 -0.634 49.5-117.2 -77.4 127.9 17.1 13.6 22.9 57 50 A I E - G 0 82A 9 25,-0.7 25,-3.6 -2,-0.4 2,-0.5 -0.543 33.8-164.3 -70.4 106.0 17.1 16.8 25.0 58 51 A I E - G 0 81A 30 -2,-0.8 2,-0.7 -8,-0.3 -8,-0.5 -0.822 7.0-160.5 -97.5 126.3 14.7 16.1 27.9 59 52 A L E -FG 49 80A 16 21,-3.1 21,-2.2 -2,-0.5 2,-0.6 -0.909 13.0-144.8-108.5 108.8 13.5 19.0 29.9 60 53 A H E -FG 48 79A 85 -12,-2.9 -12,-1.9 -2,-0.7 2,-0.5 -0.628 14.0-162.1 -77.8 115.9 12.1 17.9 33.3 61 54 A V E -FG 47 78A 5 17,-2.5 17,-1.7 -2,-0.6 2,-0.5 -0.876 6.4-172.5-103.7 123.5 9.2 20.1 34.3 62 55 A H E -F 46 0A 50 -16,-2.9 -16,-2.3 -2,-0.5 2,-0.4 -0.955 16.5-142.7-120.9 117.7 8.1 20.1 38.0 63 56 A R E +F 45 0A 8 -2,-0.5 -18,-0.3 -18,-0.2 3,-0.1 -0.624 24.6 169.8 -75.7 124.2 4.9 21.8 39.1 64 57 A Y + 0 0 43 -20,-2.6 2,-0.3 -2,-0.4 -19,-0.2 0.375 67.1 48.9-116.7 1.3 5.5 23.4 42.5 65 58 A N > + 0 0 25 -21,-1.5 3,-1.0 3,-0.1 -1,-0.2 -0.774 51.2 173.8-145.1 95.2 2.3 25.5 42.8 66 59 A Y T 3 S+ 0 0 123 -2,-0.3 4,-0.1 1,-0.2 -1,-0.1 0.480 73.9 77.8 -80.9 -1.8 -1.0 23.7 42.0 67 60 A E T 3 S+ 0 0 183 2,-0.1 -1,-0.2 -23,-0.0 -23,-0.1 0.590 93.2 62.9 -79.6 -10.3 -3.0 26.8 43.1 68 61 A I S < S- 0 0 48 -3,-1.0 -3,-0.1 -24,-0.1 -1,-0.0 -0.945 94.6-111.4-116.9 135.9 -2.0 28.2 39.6 69 62 A P - 0 0 100 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.116 26.6-120.4 -61.1 160.5 -3.1 26.6 36.3 70 63 A S > - 0 0 8 1,-0.1 3,-0.8 -4,-0.1 -43,-0.0 -0.859 14.9-128.0-103.7 138.2 -0.6 24.9 34.0 71 64 A V T 3 S+ 0 0 21 -2,-0.4 -46,-0.4 1,-0.3 -48,-0.4 0.733 116.5 35.4 -56.0 -19.4 -0.2 26.2 30.5 72 65 A L T 3 S- 0 0 6 -51,-0.1 -1,-0.3 -50,-0.1 34,-0.0 0.502 101.6-132.4-110.9 -9.8 -0.8 22.5 29.5 73 66 A N < + 0 0 89 -3,-0.8 -2,-0.1 1,-0.1 0, 0.0 0.886 59.8 138.7 58.1 41.5 -3.3 21.5 32.2 74 67 A I - 0 0 34 2,-0.1 3,-0.1 4,-0.0 -1,-0.1 0.808 47.6-151.3 -84.5 -31.7 -1.3 18.3 32.9 75 68 A E + 0 0 104 1,-0.2 2,-0.3 -9,-0.0 -9,-0.0 0.765 66.7 45.3 65.8 28.8 -1.8 18.6 36.7 76 69 A Q S S- 0 0 123 -15,-0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.969 99.5 -56.5-177.3 176.6 1.5 16.8 37.5 77 70 A D + 0 0 73 -2,-0.3 2,-0.3 -14,-0.1 -15,-0.2 -0.399 59.1 159.6 -70.5 148.1 5.2 16.5 36.6 78 71 A Y E -G 61 0A 38 -17,-1.7 -17,-2.5 -2,-0.1 2,-0.4 -0.926 33.4-106.7-156.7 179.1 6.1 15.7 32.9 79 72 A Q E -G 60 0A 62 -2,-0.3 21,-2.7 -19,-0.2 2,-0.4 -0.954 16.7-157.7-124.4 138.3 8.8 15.9 30.3 80 73 A L E -GH 59 99A 16 -21,-2.2 -21,-3.1 -2,-0.4 2,-0.7 -0.897 18.3-133.0-110.9 140.7 9.3 18.2 27.3 81 74 A V E -GH 58 98A 22 17,-2.5 17,-0.7 -2,-0.4 -23,-0.2 -0.844 18.9-148.8 -95.8 118.3 11.4 17.2 24.3 82 75 A I E -G 57 0A 24 -25,-3.6 -25,-0.7 -2,-0.7 15,-0.1 -0.772 20.0-118.2 -91.3 123.5 13.7 20.0 23.3 83 76 A P - 0 0 40 0, 0.0 -76,-0.1 0, 0.0 -1,-0.1 -0.112 8.3-136.4 -54.3 151.8 14.6 20.2 19.6 84 77 A K S S+ 0 0 99 -78,-0.1 -77,-1.9 -77,-0.1 -76,-0.4 0.817 91.6 50.9 -79.7 -31.2 18.2 19.8 18.6 85 78 A K E +A 6 0A 136 -79,-0.2 2,-0.3 -78,-0.1 -79,-0.2 -0.806 68.1 178.8-108.7 148.9 17.8 22.7 16.1 86 79 A V E -A 5 0A 7 -81,-3.1 -81,-2.8 -2,-0.3 2,-0.6 -0.994 33.4-116.0-148.5 149.4 16.4 26.2 16.8 87 80 A L E +AI 4 94A 83 7,-1.2 7,-1.9 -2,-0.3 2,-0.3 -0.773 59.1 147.3 -85.3 119.2 15.8 29.4 15.0 88 81 A S E -AI 3 93A 7 -85,-2.1 -85,-1.2 -2,-0.6 5,-0.3 -0.982 42.9-156.3-157.1 167.1 18.0 32.0 16.6 89 82 A N - 0 0 46 3,-3.1 -87,-0.1 -2,-0.3 -86,-0.0 -0.363 58.6 -81.8-118.2-162.0 20.3 35.1 16.7 90 83 A D S S+ 0 0 107 -2,-0.2 -79,-0.3 1,-0.2 3,-0.1 0.708 132.0 20.8 -81.5 -19.8 23.0 35.9 19.3 91 84 A N S S+ 0 0 68 1,-0.1 22,-2.4 -81,-0.1 2,-0.3 0.292 121.7 55.4-130.1 8.2 20.2 37.2 21.6 92 85 A N E + J 0 112A 37 20,-0.2 -3,-3.1 2,-0.0 2,-0.3 -0.981 48.2 157.4-144.2 155.1 17.0 35.5 20.4 93 86 A L E -IJ 88 111A 6 18,-1.4 18,-3.3 -2,-0.3 2,-0.3 -0.952 15.7-160.1-171.0 152.8 15.6 32.1 19.7 94 87 A T E +IJ 87 110A 45 -7,-1.9 -7,-1.2 -2,-0.3 2,-0.3 -0.963 14.0 174.3-137.8 154.0 12.3 30.3 19.4 95 88 A L E - 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