==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 13-DEC-08 2KC0 . COMPND 2 MOLECULE: LIPOPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS; . AUTHOR F.CANTINI,D.VEGGI,S.DRAGONETTI,S.SAVINO,M.SCARSELLI, . 242 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13884.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 66.1 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 . 115 47.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 5 2.1 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 . 22 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 0 0 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 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 . 2 0 1 0 2 4 1 0 3 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 1 0 0 0 1 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 14 A A > 0 0 90 0, 0.0 3,-1.3 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 135.4 3.2 -12.1 16.5 2 15 A G T 3> + 0 0 36 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.428 360.0 92.2 -65.8 0.2 -0.5 -10.9 16.3 3 16 A L H 3> S+ 0 0 16 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.918 86.8 48.9 -55.2 -45.3 -0.6 -12.4 12.7 4 17 A A H X> S+ 0 0 23 -3,-1.3 4,-2.0 2,-0.2 3,-0.6 0.880 108.5 52.8 -66.6 -38.9 -1.9 -15.6 14.1 5 18 A D H 3> S+ 0 0 85 -4,-0.4 4,-2.7 1,-0.2 3,-0.3 0.977 108.3 51.0 -56.9 -53.3 -4.6 -13.8 16.2 6 19 A A H 3< S+ 0 0 5 -4,-2.2 45,-0.5 1,-0.2 -1,-0.2 0.556 114.3 43.3 -69.3 -12.5 -5.8 -11.9 13.0 7 20 A L H << S+ 0 0 11 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.729 120.9 39.1 -95.5 -31.7 -6.2 -15.3 11.0 8 21 A T H < S+ 0 0 107 -4,-2.0 -2,-0.2 -3,-0.3 -3,-0.2 0.754 126.0 16.5 -89.0 -27.1 -7.8 -17.3 13.9 9 22 A A S < S- 0 0 40 -4,-2.7 42,-0.2 -5,-0.2 2,-0.1 -0.931 78.5-104.9-142.1 156.9 -10.1 -14.6 15.4 10 23 A P - 0 0 79 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.463 29.5-140.3 -73.9 163.3 -11.7 -11.2 14.5 11 24 A L - 0 0 19 1,-0.2 8,-0.0 8,-0.2 41,-0.0 -0.291 65.5 -18.5-103.6-168.4 -10.4 -7.9 16.0 12 25 A D > - 0 0 54 1,-0.2 3,-0.5 -2,-0.1 41,-0.2 -0.109 64.6-168.7 -40.3 108.2 -12.5 -4.9 17.1 13 26 A H T 3 + 0 0 166 1,-0.2 -1,-0.2 -3,-0.1 6,-0.0 0.370 65.1 84.6 -95.4 3.0 -15.8 -5.6 15.3 14 27 A K T 3 + 0 0 176 5,-0.0 -1,-0.2 2,-0.0 -2,-0.1 0.810 65.4 179.1 -66.7 -37.8 -17.7 -2.3 15.8 15 28 A D < + 0 0 56 -3,-0.5 -2,-0.1 1,-0.1 4,-0.0 0.790 20.7 156.0 13.1 105.9 -15.9 -0.6 12.8 16 29 A K S S- 0 0 180 2,-0.0 -1,-0.1 0, 0.0 -2,-0.0 0.026 84.3 -6.5-126.2 15.8 -17.1 3.0 12.2 17 30 A G S S- 0 0 62 106,-0.0 107,-0.3 3,-0.0 2,-0.2 -0.160 131.1 -15.2-170.5 -79.8 -14.0 4.3 10.3 18 31 A L + 0 0 36 105,-0.1 72,-0.1 104,-0.1 3,-0.1 -0.821 66.4 127.1-149.1 115.7 -11.1 1.8 10.2 19 32 A Q S S+ 0 0 33 -2,-0.2 33,-2.3 -8,-0.0 34,-1.9 0.096 85.0 20.5-133.8 9.6 -10.7 -1.4 12.3 20 33 A S E S-A 51 0A 33 31,-0.3 2,-0.3 32,-0.3 31,-0.2 -0.904 72.9-116.7-161.9 176.1 -10.2 -3.7 9.2 21 34 A L E -A 50 0A 5 29,-1.9 29,-1.9 -2,-0.2 2,-0.3 -0.997 25.7-122.6-134.0 142.3 -9.3 -3.7 5.4 22 35 A T E -A 49 0A 81 -2,-0.3 27,-0.3 27,-0.2 98,-0.2 -0.641 17.0-171.1 -86.9 134.6 -11.5 -4.8 2.4 23 36 A L > + 0 0 1 25,-2.6 4,-1.6 -2,-0.3 3,-0.4 0.277 46.3 120.7-109.4 13.6 -10.3 -7.6 0.0 24 37 A D T 4 S+ 0 0 66 24,-0.4 -1,-0.1 1,-0.3 5,-0.1 0.524 89.1 31.3 -64.7 -6.4 -12.9 -7.3 -2.9 25 38 A Q T 4 S+ 0 0 140 -3,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.546 105.6 71.6-120.0 -21.4 -10.1 -6.6 -5.5 26 39 A S T 4 S+ 0 0 18 -3,-0.4 2,-0.3 -4,-0.1 -2,-0.2 0.829 110.7 33.4 -58.0 -34.7 -7.3 -8.7 -3.8 27 40 A V S < S- 0 0 5 -4,-1.6 -1,-0.1 19,-0.1 2,-0.1 -0.965 89.9-111.8-125.1 145.2 -9.4 -11.8 -4.9 28 41 A R > - 0 0 130 -2,-0.3 18,-1.0 1,-0.1 3,-0.7 -0.377 32.6-111.3 -59.2 150.4 -11.6 -12.5 -8.0 29 42 A K T 3 S+ 0 0 96 1,-0.2 -1,-0.1 16,-0.1 18,-0.1 0.597 119.4 33.2 -61.6 -12.4 -15.4 -12.9 -7.6 30 43 A N T 3 S+ 0 0 138 16,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.550 102.7 96.9-114.0 -17.8 -14.9 -16.7 -8.4 31 44 A E < - 0 0 45 -3,-0.7 15,-1.2 15,-0.1 2,-0.4 -0.389 64.5-122.1 -96.3 160.5 -11.5 -17.6 -6.9 32 45 A K E -BC 45 68B 64 36,-2.6 36,-2.9 13,-0.2 2,-0.4 -0.762 20.0-161.0 -98.8 133.6 -10.0 -19.1 -3.7 33 46 A L E -BC 44 67B 0 11,-3.0 11,-2.5 -2,-0.4 2,-0.4 -0.955 6.3-174.7-118.6 127.9 -7.6 -17.3 -1.4 34 47 A K E +BC 43 66B 62 32,-2.2 32,-2.6 -2,-0.4 2,-0.3 -0.997 6.6 177.9-119.5 127.9 -5.3 -19.1 1.2 35 48 A L E +BC 42 65B 1 7,-2.6 7,-2.2 -2,-0.4 2,-0.3 -0.921 5.0 176.2-118.9 152.2 -3.2 -17.0 3.6 36 49 A A E +BC 41 64B 28 28,-2.7 28,-1.6 -2,-0.3 5,-0.3 -0.982 9.2 147.5-157.9 145.2 -0.9 -18.3 6.4 37 50 A A E > +B 40 0B 21 3,-2.1 3,-1.9 -2,-0.3 -30,-0.1 -0.860 61.7 0.3-167.7 147.8 1.6 -17.3 9.1 38 51 A Q T 3 S- 0 0 137 1,-0.3 -34,-0.2 -2,-0.2 3,-0.1 0.802 130.5 -37.1 49.2 44.6 3.0 -18.1 12.6 39 52 A G T 3 S+ 0 0 90 1,-0.3 -1,-0.3 -36,-0.0 2,-0.2 0.368 122.7 87.6 91.8 -0.3 0.8 -21.1 13.3 40 53 A A E < -B 37 0B 11 -3,-1.9 -3,-2.1 2,-0.0 2,-0.3 -0.803 50.6-164.4-126.2 168.0 -2.5 -19.9 11.6 41 54 A E E -B 36 0B 119 -5,-0.3 2,-0.4 -2,-0.2 -5,-0.3 -0.980 10.1-147.7-155.8 133.2 -4.1 -19.8 8.1 42 55 A K E -B 35 0B 47 -7,-2.2 -7,-2.6 -2,-0.3 2,-0.5 -0.920 11.8-167.4-107.0 131.7 -7.0 -17.9 6.5 43 56 A T E +B 34 0B 87 -2,-0.4 -9,-0.2 -9,-0.2 2,-0.2 -0.954 30.5 122.1-128.3 112.3 -9.3 -19.5 3.8 44 57 A Y E -B 33 0B 20 -11,-2.5 -11,-3.0 -2,-0.5 2,-0.3 -0.702 26.5-177.7-150.6-172.3 -11.6 -17.3 1.8 45 58 A G E +B 32 0B 25 -13,-0.3 2,-2.6 -2,-0.2 -13,-0.2 -0.959 55.1 40.0 178.5-178.6 -12.7 -16.1 -1.7 46 59 A N S S- 0 0 90 -15,-1.2 -15,-0.1 -18,-1.0 -19,-0.1 -0.285 121.7 -20.7 60.0 -59.4 -15.1 -13.8 -3.8 47 60 A G S S+ 0 0 34 -2,-2.6 -23,-0.2 -18,-0.1 -1,-0.1 -0.344 84.2 132.1 174.1 87.9 -14.9 -10.7 -1.5 48 61 A D - 0 0 66 -25,-0.1 -25,-2.6 -2,-0.0 -24,-0.4 -0.084 35.6-126.7-120.3-138.0 -13.9 -10.7 2.2 49 62 A S E -A 22 0A 28 -27,-0.3 2,-0.3 -26,-0.2 -27,-0.2 -0.892 8.8-119.4-164.1 176.1 -11.5 -8.8 4.5 50 63 A L E -A 21 0A 8 -29,-1.9 -29,-1.9 -2,-0.2 2,-0.3 -0.966 31.5-130.5-141.9 130.2 -8.6 -8.8 7.1 51 64 A N E +A 20 0A 34 -45,-0.5 -31,-0.3 -2,-0.3 -42,-0.1 -0.637 30.9 165.2 -93.3 138.2 -9.2 -7.4 10.6 52 65 A T > + 0 0 9 -33,-2.3 3,-1.3 -2,-0.3 -32,-0.3 0.426 33.3 120.2-132.7 -2.5 -6.7 -4.9 12.3 53 66 A G T 3 S+ 0 0 17 -34,-1.9 2,-0.3 1,-0.2 -33,-0.1 0.814 80.6 31.3 -29.0 -78.6 -8.6 -3.4 15.4 54 67 A K T 3 S+ 0 0 155 -35,-0.1 -1,-0.2 -3,-0.0 2,-0.2 -0.110 96.4 107.1 -93.0 37.5 -6.3 -4.3 18.4 55 68 A L S < S- 0 0 47 -3,-1.3 -3,-0.1 -2,-0.3 -44,-0.0 -0.636 75.7 -86.0-103.7 165.4 -2.9 -4.2 16.6 56 69 A K - 0 0 164 -2,-0.2 3,-0.3 1,-0.1 2,-0.2 -0.193 42.9-114.3 -64.9 162.9 -0.1 -1.6 16.9 57 70 A N S S+ 0 0 78 1,-0.2 31,-0.2 29,-0.0 -1,-0.1 -0.488 82.4 20.1 -90.8 167.9 0.1 1.7 14.9 58 71 A D S S+ 0 0 70 -2,-0.2 2,-0.3 1,-0.1 30,-0.2 0.737 95.2 107.9 46.1 46.4 2.5 2.8 12.2 59 72 A K E - D 0 87B 104 28,-2.4 28,-2.9 -3,-0.3 2,-0.4 -0.968 63.1-115.7-144.1 163.1 4.1 -0.6 11.2 60 73 A V E - D 0 86B 58 -2,-0.3 2,-0.3 26,-0.2 26,-0.2 -0.830 22.0-153.1-100.1 133.7 4.3 -3.3 8.5 61 74 A S E - D 0 85B 19 24,-2.8 24,-2.3 -2,-0.4 2,-0.4 -0.864 12.3-137.3-105.2 146.2 3.0 -6.9 8.9 62 75 A R E + D 0 84B 193 -2,-0.3 2,-0.3 22,-0.2 22,-0.2 -0.854 25.1 174.1-108.2 130.6 4.4 -9.9 6.9 63 76 A F E - D 0 83B 13 20,-0.6 20,-2.2 -2,-0.4 2,-0.4 -0.994 28.6-139.9-144.9 145.2 2.4 -12.7 5.3 64 77 A D E +CD 36 82B 100 -28,-1.6 -28,-2.7 -2,-0.3 2,-0.3 -0.770 38.4 164.0 -89.0 134.7 2.6 -15.9 3.1 65 78 A F E -CD 35 81B 2 16,-1.8 16,-1.8 -2,-0.4 2,-0.3 -0.992 25.7-161.9-147.4 163.7 -0.3 -16.3 0.5 66 79 A I E -CD 34 80B 20 -32,-2.6 -32,-2.2 -2,-0.3 2,-0.5 -0.992 12.0-148.2-143.4 138.4 -1.6 -18.0 -2.6 67 80 A R E +CD 33 79B 45 12,-2.7 12,-1.9 -2,-0.3 2,-0.2 -0.946 40.2 145.6-106.6 122.1 -4.5 -17.2 -5.1 68 81 A Q E -C 32 0B 16 -36,-2.9 -36,-2.6 -2,-0.5 2,-0.3 -0.756 33.3-145.7-142.4 175.3 -6.0 -20.4 -6.6 69 82 A I E - D 0 76B 63 7,-0.9 7,-1.3 -2,-0.2 2,-0.5 -0.981 24.3-113.0-148.3 158.4 -9.2 -22.2 -7.9 70 83 A E E - D 0 75B 104 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.840 27.3-166.5 -90.5 129.0 -10.7 -25.7 -7.9 71 84 A V E > S- D 0 74B 64 3,-2.9 3,-2.1 -2,-0.5 -2,-0.0 -0.966 74.3 -23.7-118.3 114.8 -10.9 -27.4 -11.4 72 85 A D T 3 S- 0 0 166 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.828 127.9 -51.5 51.7 33.9 -13.1 -30.5 -11.6 73 86 A G T 3 S+ 0 0 57 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.476 116.6 119.1 84.3 4.9 -12.5 -31.0 -7.8 74 87 A Q E < -D 71 0B 128 -3,-2.1 -3,-2.9 2,-0.0 2,-0.5 -0.803 58.4-134.4-106.0 143.2 -8.7 -30.7 -8.3 75 88 A L E -D 70 0B 89 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.866 20.0-176.9-107.6 122.6 -6.5 -28.0 -6.6 76 89 A I E -D 69 0B 41 -7,-1.3 2,-1.5 -2,-0.5 -7,-0.9 -0.980 26.2-136.0-119.6 130.9 -3.9 -25.9 -8.5 77 90 A T E + 0 0 67 -2,-0.4 25,-0.6 1,-0.2 3,-0.2 -0.614 31.5 176.5 -84.0 82.9 -1.6 -23.3 -6.9 78 91 A L E - 0 0 61 -2,-1.5 24,-1.9 1,-0.2 2,-0.3 0.944 59.3 -1.0 -63.3 -58.8 -1.9 -20.7 -9.6 79 92 A E E -DE 67 101B 48 -12,-1.9 -12,-2.7 22,-0.2 2,-0.3 -0.977 64.7-172.8-140.3 131.1 0.1 -17.7 -8.1 80 93 A S E +DE 66 100B 35 20,-1.8 19,-2.3 -2,-0.3 20,-0.9 -0.906 21.7 114.7-126.2 147.5 2.0 -17.2 -4.8 81 94 A G E -DE 65 98B 14 -16,-1.8 -16,-1.8 -2,-0.3 2,-0.5 -0.905 55.7 -39.7-172.6-162.4 3.7 -14.3 -3.0 82 95 A E E -DE 64 97B 51 15,-2.2 15,-1.3 -2,-0.2 2,-0.8 -0.813 31.8-154.3-100.8 122.5 4.0 -11.8 -0.1 83 96 A F E -DE 63 96B 2 -20,-2.2 2,-0.7 -2,-0.5 -20,-0.6 -0.881 18.1-165.7 -90.1 98.4 0.9 -10.1 1.4 84 97 A Q E -DE 62 95B 23 11,-2.0 11,-1.4 -2,-0.8 2,-0.6 -0.817 4.8-168.6 -99.4 109.8 2.5 -6.9 2.8 85 98 A V E -DE 61 94B 11 -24,-2.3 -24,-2.8 -2,-0.7 2,-0.5 -0.842 6.2-160.2-114.3 108.5 0.1 -5.2 5.2 86 99 A Y E -DE 60 93B 19 7,-2.6 7,-1.6 -2,-0.6 2,-0.5 -0.734 4.3-168.7 -89.8 126.5 0.6 -1.6 6.5 87 100 A K E +DE 59 92B 26 -28,-2.9 -28,-2.4 -2,-0.5 5,-0.2 -0.963 18.9 160.4-110.2 123.5 -1.2 -0.5 9.7 88 101 A Q - 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