==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHITIN BINDING PROTEIN 15-AUG-11 2LHS . COMPND 2 MOLECULE: CBP21; . SOURCE 2 ORGANISM_SCIENTIFIC: SERRATIA MARCESCENS; . AUTHOR F.L.AACHMANN,V.G.EIJSINK,G.VAAJE-KOLSTAD . 170 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7762.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 24.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 23 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 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 0 PARALLEL BRIDGES PER LADDER . 2 1 0 1 0 0 1 1 0 1 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 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 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 H 0 0 83 0, 0.0 83,-0.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 106.1 0.7 0.5 -2.3 2 2 A G E -A 83 0A 1 28,-0.4 2,-0.3 30,-0.3 30,-0.3 -0.844 360.0-124.3 160.9 177.3 2.4 -2.9 -2.5 3 3 A Y E -A 82 0A 41 79,-2.5 79,-3.0 -2,-0.3 2,-0.6 -0.953 15.9-112.2-145.8 163.9 1.0 -6.4 -2.1 4 4 A V E > -A 81 0A 2 -2,-0.3 5,-0.9 77,-0.2 77,-0.2 -0.887 21.2-164.6-100.7 122.0 1.7 -9.6 -0.0 5 5 A E E 5S+ 0 0 67 75,-2.7 -1,-0.2 -2,-0.6 76,-0.1 0.898 71.6 43.6 -74.2 -42.4 3.0 -12.4 -2.3 6 6 A S E 5S+A 80 0A 50 74,-1.0 74,-2.6 1,-0.3 -1,-0.4 -0.951 104.8 41.1-153.5 130.2 2.3 -15.1 0.3 7 7 A P T 5S- 0 0 12 0, 0.0 2,-0.6 0, 0.0 -1,-0.3 0.464 105.1-129.2 -65.2 132.1 -0.1 -15.5 2.1 8 8 A A T 5 - 0 0 12 -2,-0.1 157,-0.2 -3,-0.1 -3,-0.1 -0.463 21.2-144.0 -66.4 111.1 -1.8 -14.5 -1.2 9 9 A S >< - 0 0 2 -5,-0.9 4,-3.1 -2,-0.6 3,-0.3 -0.315 26.2-107.0 -72.2 157.5 -4.3 -11.7 -0.4 10 10 A R H > S+ 0 0 2 153,-3.1 4,-1.6 1,-0.2 154,-0.1 0.770 122.0 60.1 -55.4 -24.7 -7.6 -11.5 -2.2 11 11 A A H > S+ 0 0 0 152,-0.4 4,-1.2 2,-0.2 -1,-0.2 0.972 110.9 36.9 -66.1 -54.6 -6.1 -8.5 -4.0 12 12 A Y H > S+ 0 0 49 -3,-0.3 4,-2.1 1,-0.2 3,-0.2 0.886 113.8 58.6 -66.2 -37.2 -3.2 -10.6 -5.5 13 13 A Q H <>S+ 0 0 0 -4,-3.1 5,-2.6 1,-0.2 6,-1.5 0.846 99.9 57.9 -62.5 -33.3 -5.6 -13.6 -5.9 14 14 A a H ><5S+ 0 0 1 -4,-1.6 3,-1.1 4,-0.2 -1,-0.2 0.907 107.4 46.1 -65.0 -39.4 -7.8 -11.4 -8.2 15 15 A K H 3<5S+ 0 0 94 -4,-1.2 -2,-0.2 10,-0.3 -1,-0.2 0.888 109.5 54.2 -70.0 -35.5 -4.9 -10.8 -10.5 16 16 A L T 3<5S- 0 0 82 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.419 116.4-123.1 -74.6 2.6 -4.1 -14.5 -10.4 17 17 A Q T < 5S+ 0 0 166 -3,-1.1 -3,-0.2 -5,-0.2 -2,-0.1 0.649 86.2 115.4 58.2 23.4 -7.8 -14.9 -11.5 18 18 A L S - 0 0 9 1,-0.2 2,-2.9 36,-0.1 3,-0.6 0.842 51.1-173.4 -67.8 -32.5 -12.3 -6.6 -8.3 23 23 A G T 3 S+ 0 0 40 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 -0.343 76.0 30.8 72.2 -63.6 -12.3 -4.9 -11.7 24 24 A S T >> S+ 0 0 61 -2,-2.9 4,-2.3 31,-0.2 3,-2.1 0.905 116.0 53.1 -88.1 -52.6 -9.2 -2.8 -10.9 25 25 A V T <4 S+ 0 0 0 -3,-0.6 -10,-0.3 30,-0.4 -1,-0.1 0.663 97.2 68.9 -66.0 -15.3 -7.2 -4.9 -8.5 26 26 A Q T 34 S+ 0 0 40 -12,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.537 111.7 31.5 -84.3 -3.0 -7.2 -7.9 -10.9 27 27 A Y T <4 S+ 0 0 165 -3,-2.1 -2,-0.2 1,-0.2 -1,-0.1 0.686 136.5 23.6-117.2 -35.6 -5.0 -6.0 -13.3 28 28 A E >< + 0 0 80 -4,-2.3 3,-1.2 1,-0.1 -1,-0.2 -0.841 64.5 173.7-127.0 94.1 -3.0 -3.9 -10.7 29 29 A P G > S+ 0 0 9 0, 0.0 3,-0.9 0, 0.0 -27,-0.2 0.769 74.5 65.5 -74.0 -20.6 -3.0 -5.6 -7.3 30 30 A Q G 3 S+ 0 0 46 1,-0.2 -28,-0.4 -29,-0.1 54,-0.1 0.391 72.9 96.4 -83.7 9.3 -0.5 -3.2 -5.7 31 31 A S G < + 0 0 31 -3,-1.2 -1,-0.2 -30,-0.2 2,-0.1 0.621 55.3 120.2 -66.7 -16.1 -3.1 -0.4 -6.0 32 32 A V < + 0 0 2 -3,-0.9 2,-0.3 -30,-0.3 -30,-0.3 -0.332 29.6 145.2 -64.0 125.3 -4.2 -1.1 -2.5 33 33 A E + 0 0 38 -2,-0.1 2,-0.2 -32,-0.1 127,-0.1 -0.965 13.3 165.7-152.9 153.6 -3.8 1.9 -0.1 34 34 A G - 0 0 8 -2,-0.3 125,-0.4 126,-0.1 2,-0.4 -0.800 32.5 -89.8-154.4-167.7 -5.9 3.1 2.9 35 35 A L - 0 0 107 123,-0.3 123,-0.3 -2,-0.2 3,-0.2 -0.945 29.2-118.4-123.9 142.0 -5.7 5.5 5.9 36 36 A K S S+ 0 0 66 121,-3.0 123,-0.1 -2,-0.4 121,-0.1 -0.321 75.3 92.0 -65.1 157.0 -4.6 5.0 9.5 37 37 A G > - 0 0 33 1,-0.3 4,-3.0 -2,-0.0 5,-0.3 0.373 59.4-171.4 132.2 7.0 -7.2 5.6 12.2 38 38 A F T 4 - 0 0 47 1,-0.3 -1,-0.3 3,-0.2 -2,-0.0 -0.501 61.1 -1.2 -75.8 139.6 -8.6 2.1 12.8 39 39 A P T >4 S+ 0 0 64 0, 0.0 3,-1.0 0, 0.0 -1,-0.3 -0.993 133.7 40.2 -91.9 -15.6 -11.0 1.5 14.5 40 40 A Q T 34 S+ 0 0 195 1,-0.3 -2,-0.2 0, 0.0 -3,-0.0 0.845 135.0 19.3 -69.2 -36.7 -12.1 4.9 15.8 41 41 A A T 3< S+ 0 0 79 -4,-3.0 -1,-0.3 0, 0.0 -3,-0.2 -0.202 109.1 116.6-120.1 30.3 -11.6 7.0 12.7 42 42 A G S < S- 0 0 25 -3,-1.0 3,-0.1 -5,-0.3 6,-0.1 -0.298 72.1 -68.4 -91.4-178.0 -11.6 3.9 10.5 43 43 A P - 0 0 14 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 -0.067 57.9 -87.8 -62.1 171.8 -14.0 2.8 7.8 44 44 A A > - 0 0 47 1,-0.2 3,-2.1 3,-0.1 8,-0.2 -0.320 59.7 -78.7 -74.9 160.0 -17.6 1.8 8.2 45 45 A D T 3 S+ 0 0 69 1,-0.3 63,-0.3 2,-0.2 -1,-0.2 -0.360 124.3 27.9 -60.7 138.7 -18.3 -1.8 9.1 46 46 A G T 3 S+ 0 0 2 61,-2.8 -1,-0.3 -3,-0.1 61,-0.2 0.402 115.9 66.9 83.7 -4.7 -18.2 -4.0 5.9 47 47 A H <>> + 0 0 55 -3,-2.1 5,-2.1 60,-0.3 4,-0.5 0.152 68.1 103.6-124.0 10.0 -15.7 -1.5 4.5 48 48 A I T >45S+ 0 0 11 59,-0.6 3,-0.9 1,-0.2 113,-0.3 0.952 88.6 34.4 -65.7 -49.8 -12.9 -2.3 7.0 49 49 A A T 345S+ 0 0 0 1,-0.2 -1,-0.2 58,-0.1 114,-0.2 0.749 117.4 57.2 -76.1 -21.5 -10.7 -4.4 4.7 50 50 A S T >45S- 0 0 1 7,-0.1 3,-1.3 112,-0.1 -1,-0.2 0.521 101.5-133.9 -82.8 -8.0 -11.7 -2.1 1.8 51 51 A A T <<5 - 0 0 7 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.825 68.5 -64.4 52.2 33.5 -10.5 1.0 3.6 52 52 A D T 3 S+ 0 0 103 -2,-0.4 3,-1.6 1,-0.3 4,-0.4 0.821 100.5 60.0 -62.2 -34.4 -15.3 0.6 -3.8 55 55 A T G 3 S+ 0 0 40 1,-0.3 -30,-0.4 2,-0.1 -1,-0.3 0.613 110.5 43.7 -70.7 -11.5 -12.5 -1.2 -5.8 56 56 A F G < S+ 0 0 10 -3,-1.4 3,-0.4 -6,-0.2 4,-0.3 0.113 83.4 102.1-115.4 13.1 -11.7 -3.1 -2.6 57 57 A F S X> S+ 0 0 66 -3,-1.6 4,-2.6 1,-0.3 3,-1.5 0.924 82.9 48.9 -70.7 -37.1 -15.3 -3.8 -1.6 58 58 A E T 34 S+ 0 0 32 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.645 102.1 66.1 -69.4 -15.3 -15.1 -7.4 -2.8 59 59 A L T 34 S+ 0 0 5 -3,-0.4 -1,-0.3 1,-0.1 104,-0.2 0.583 112.2 31.8 -86.9 -7.7 -11.9 -7.5 -0.8 60 60 A D T <4 S+ 0 0 0 -3,-1.5 2,-0.6 -4,-0.3 47,-0.3 0.706 109.6 69.9-113.2 -33.5 -14.0 -7.1 2.4 61 61 A Q < + 0 0 78 -4,-2.6 2,-0.3 45,-0.1 -1,-0.1 -0.732 62.2 160.0 -94.3 121.7 -17.2 -8.9 1.4 62 62 A Q - 0 0 7 -2,-0.6 -3,-0.0 43,-0.4 -4,-0.0 -0.921 31.9-151.9-129.4 161.0 -17.0 -12.7 1.0 63 63 A T >> - 0 0 54 -2,-0.3 3,-1.6 41,-0.1 4,-0.5 -0.849 44.3-104.5-118.4 161.5 -19.3 -15.6 1.0 64 64 A P T 34 S+ 0 0 67 0, 0.0 40,-0.1 0, 0.0 5,-0.1 0.556 119.9 37.5 -70.0 0.0 -17.6 -18.8 2.3 65 65 A T T 34 S+ 0 0 126 3,-0.1 39,-0.0 1,-0.0 4,-0.0 0.208 92.2 88.7-127.3 9.3 -17.4 -20.2 -1.3 66 66 A R T <4 S+ 0 0 93 -3,-1.6 2,-0.3 2,-0.1 -46,-0.2 0.821 89.5 34.7 -82.3 -31.2 -16.6 -17.0 -3.3 67 67 A W S < S- 0 0 15 -4,-0.5 2,-0.5 -48,-0.1 -48,-0.1 -0.797 96.3 -86.8-119.6 164.9 -12.7 -17.1 -3.1 68 68 A N - 0 0 71 -50,-0.4 2,-1.1 -2,-0.3 97,-0.3 -0.578 39.9-148.4 -67.5 120.1 -10.0 -19.7 -3.0 69 69 A K - 0 0 24 -2,-0.5 97,-0.3 97,-0.1 2,-0.1 -0.847 21.3-134.4 -94.7 103.1 -9.8 -20.6 0.7 70 70 A L E -c 166 0B 37 95,-1.6 97,-2.8 -2,-1.1 2,-1.0 -0.354 7.8-129.0 -65.2 135.1 -6.1 -21.4 0.8 71 71 A N E +c 167 0B 125 95,-0.2 2,-0.2 -2,-0.1 97,-0.2 -0.756 49.8 147.8 -89.6 100.9 -5.4 -24.5 2.7 72 72 A L E -c 168 0B 49 -2,-1.0 97,-1.1 95,-0.9 2,-0.3 -0.759 38.9-116.1-130.3 173.9 -2.7 -23.5 5.2 73 73 A K E -c 169 0B 102 -2,-0.2 97,-0.2 95,-0.2 64,-0.2 -0.788 21.5-113.4-114.6 157.1 -1.7 -24.5 8.7 74 74 A T S S+ 0 0 7 95,-2.0 65,-0.1 -2,-0.3 -1,-0.1 -0.356 81.7 48.0 -77.1 167.1 -1.5 -22.8 12.1 75 75 A G E S+ B 0 137A 19 62,-2.5 62,-2.5 -2,-0.1 60,-0.1 -0.637 105.2 10.9 94.1-160.6 1.9 -22.2 13.6 76 76 A P E + B 0 136A 98 0, 0.0 2,-0.3 0, 0.0 60,-0.2 -0.295 68.8 165.7 -59.1 132.6 4.9 -20.7 11.7 77 77 A N E - B 0 135A 28 58,-2.6 58,-2.1 -5,-0.1 2,-0.3 -0.916 32.7-115.9-138.6 161.7 4.1 -19.2 8.3 78 78 A S E - B 0 134A 53 -2,-0.3 2,-0.4 56,-0.2 56,-0.2 -0.755 17.6-163.8-103.4 149.8 6.0 -16.9 6.0 79 79 A F E - B 0 133A 2 54,-3.0 54,-2.4 -2,-0.3 2,-0.6 -0.904 9.8-177.2-137.1 101.0 4.8 -13.4 5.1 80 80 A T E -AB 6 132A 17 -74,-2.6 -75,-2.7 -2,-0.4 -74,-1.0 -0.907 6.6-164.0-108.3 114.7 6.6 -12.0 2.0 81 81 A W E -AB 4 131A 1 50,-2.3 50,-1.8 -2,-0.6 2,-0.5 -0.770 8.4-156.7 -98.9 146.7 5.7 -8.4 1.0 82 82 A K E -AB 3 130A 43 -79,-3.0 -79,-2.5 -2,-0.3 2,-0.4 -0.988 18.2-165.3-125.3 110.4 6.5 -6.9 -2.4 83 83 A L E -A 2 0A 16 46,-2.7 -81,-0.2 -2,-0.5 -53,-0.0 -0.881 26.0-166.8-107.4 135.7 6.6 -3.1 -2.2 84 84 A T S S+ 0 0 83 -83,-0.8 2,-0.4 -2,-0.4 -82,-0.1 0.150 76.6 77.1 -98.9 16.1 6.6 -0.6 -5.1 85 85 A A - 0 0 19 44,-0.2 44,-0.2 -84,-0.2 -2,-0.1 -0.992 60.9-161.2-131.2 135.0 7.7 2.1 -2.6 86 86 A R + 0 0 149 -2,-0.4 43,-0.1 42,-0.1 -1,-0.1 0.553 60.7 108.4 -87.7 -12.0 11.2 2.7 -1.2 87 87 A H S S- 0 0 58 1,-0.1 -2,-0.1 39,-0.1 42,-0.1 -0.207 75.5 -85.1 -71.5 160.7 9.9 4.8 1.7 88 88 A S - 0 0 13 38,-0.1 66,-2.4 65,-0.1 67,-0.8 -0.166 29.4-138.9 -69.8 156.0 9.9 3.5 5.4 89 89 A T E -DE 125 153B 1 36,-1.7 35,-1.8 64,-0.3 36,-0.7 -0.703 7.9-166.5-102.6 159.2 7.4 1.5 7.3 90 90 A T E S- 0 0 46 62,-2.8 2,-0.3 1,-0.4 63,-0.2 0.479 70.4 -4.0-117.9 -14.7 6.3 2.1 10.9 91 91 A S E - 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