==== 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 CHITIN-BINDING PROTEIN 05-MAR-12 4ALS . COMPND 2 MOLECULE: CHITIN BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR M.GUDMUNDSSON,M.WU,T.ISHIDA,M.H.MOMENI,G.VAAJE-KOLSTAD,V.EIJ . 166 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7635.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 31.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 13 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 2.4 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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 0 1 1 0 0 1 2 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 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 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 29 A H 0 0 56 0, 0.0 83,-2.0 0, 0.0 82,-1.3 0.000 360.0 360.0 360.0 127.2 -6.2 6.4 -19.1 2 30 A G E -A 82 0A 0 31,-1.4 33,-0.3 80,-0.3 2,-0.3 -0.982 360.0-153.9-172.6 163.9 -6.0 3.2 -17.1 3 31 A Y E -A 81 0A 34 78,-2.2 78,-2.8 -2,-0.3 2,-0.7 -0.934 33.4-100.6-142.3 162.6 -7.8 0.3 -15.5 4 32 A V E > +A 80 0A 0 -2,-0.3 5,-2.3 76,-0.2 76,-0.3 -0.825 33.8 179.4 -87.1 117.0 -7.2 -2.2 -12.7 5 33 A A E 5 +C 8 0B 21 74,-2.5 3,-0.4 -2,-0.7 75,-0.2 0.660 59.0 68.6 -88.6 -23.6 -6.2 -5.5 -14.3 6 34 A S E 5S+A 79 0A 60 73,-1.4 73,-2.8 1,-0.5 -1,-0.3 -0.932 110.2 19.2-151.8 123.0 -5.7 -7.5 -11.1 7 35 A P T 5S- 0 0 7 0, 0.0 -1,-0.5 0, 0.0 72,-0.1 0.672 118.3-114.1 -61.1 143.5 -8.0 -8.2 -9.4 8 36 A G B 5 -C 5 0B 4 -3,-0.4 154,-0.4 -2,-0.2 -3,-0.2 -0.179 28.0-125.9 -55.8 133.3 -9.8 -7.5 -12.7 9 37 A S >< - 0 0 0 -5,-2.3 4,-2.7 152,-0.2 152,-0.3 -0.305 23.8-107.0 -73.0 164.9 -12.1 -4.5 -12.5 10 38 A R H > S+ 0 0 2 150,-2.8 4,-0.5 1,-0.2 151,-0.1 0.917 123.6 44.4 -58.3 -42.4 -15.8 -4.7 -13.5 11 39 A A H >4 S+ 0 0 4 149,-0.5 3,-1.3 1,-0.2 4,-0.3 0.928 111.4 52.2 -66.3 -48.2 -14.9 -2.7 -16.7 12 40 A F H >4 S+ 0 0 20 1,-0.3 3,-2.0 -8,-0.3 6,-0.6 0.886 102.7 58.5 -57.0 -42.6 -11.8 -4.7 -17.5 13 41 A F H 3< S+ 0 0 16 -4,-2.7 9,-1.6 1,-0.3 8,-1.2 0.700 96.8 65.1 -62.5 -17.6 -13.6 -8.0 -17.2 14 42 A G T << S+ 0 0 2 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.602 94.3 75.8 -76.2 -14.7 -15.9 -6.7 -20.0 15 43 A S S < >S- 0 0 11 -3,-2.0 5,-2.4 -4,-0.3 3,-0.4 -0.537 92.7-111.5 -95.7 163.4 -12.9 -6.7 -22.4 16 44 A S T > 5S+ 0 0 91 13,-0.6 3,-1.8 1,-0.2 -1,-0.1 0.876 119.6 57.2 -60.8 -36.1 -11.3 -9.5 -24.3 17 45 A A T 3 5S+ 0 0 75 1,-0.3 -1,-0.2 2,-0.1 -4,-0.1 0.852 107.7 50.0 -61.2 -32.7 -8.1 -9.1 -22.1 18 46 A G T > 5S- 0 0 6 -6,-0.6 3,-0.7 -3,-0.4 -1,-0.3 0.318 121.8-110.3 -87.0 6.6 -10.4 -9.6 -19.2 19 47 A G T < 5 - 0 0 46 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.542 48.2 -88.9 80.3 8.8 -11.9 -12.8 -20.7 20 48 A N T 3 - 0 0 4 1,-0.3 3,-1.9 -3,-0.2 33,-0.2 0.158 43.4-146.4-117.3 14.2 -20.7 -3.4 -20.4 26 54 A G G > S+ 0 0 37 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 -0.276 77.6 2.8 58.6-133.5 -21.0 -0.8 -23.1 27 55 A R G >> S+ 0 0 73 27,-2.5 4,-2.9 1,-0.3 3,-1.2 0.707 119.3 77.3 -61.7 -20.7 -17.8 1.1 -23.8 28 56 A A G <4 S+ 0 0 0 -3,-1.9 -1,-0.3 26,-0.3 -2,-0.2 0.739 80.3 69.9 -64.7 -20.7 -15.9 -1.0 -21.2 29 57 A Q G <4 S+ 0 0 76 -3,-1.9 -13,-0.6 2,-0.2 -1,-0.3 0.893 119.5 16.0 -57.8 -37.0 -15.8 -3.8 -23.8 30 58 A W T <4 S+ 0 0 189 -3,-1.2 -2,-0.2 -4,-0.3 -1,-0.2 0.687 139.0 26.4-113.6 -26.3 -13.3 -1.8 -25.8 31 59 A E >< + 0 0 58 -4,-2.9 3,-2.2 1,-0.1 -2,-0.2 -0.416 53.0 156.7-141.7 63.4 -11.9 0.9 -23.6 32 60 A P T 3 S+ 0 0 5 0, 0.0 3,-0.5 0, 0.0 -20,-0.2 0.666 76.2 68.7 -62.4 -12.6 -12.1 -0.0 -19.9 33 61 A Q T 3 S+ 0 0 41 1,-0.2 -31,-1.4 -32,-0.1 51,-0.1 0.456 83.4 75.6 -76.6 -6.0 -9.3 2.6 -19.4 34 62 A S < + 0 0 8 -3,-2.2 2,-1.8 -33,-0.2 -1,-0.2 0.134 48.6 120.7-105.6 22.5 -11.6 5.5 -20.2 35 63 A I + 0 0 2 -3,-0.5 123,-2.1 -33,-0.3 2,-0.4 -0.559 40.8 157.5 -88.0 78.2 -13.7 6.0 -17.1 36 64 A E E +D 157 0C 60 -2,-1.8 121,-0.2 121,-0.2 -2,-0.0 -0.892 5.2 148.2-111.5 130.4 -12.6 9.6 -16.4 37 65 A A E -D 156 0C 6 119,-2.3 119,-2.7 -2,-0.4 4,-0.1 -0.961 53.0 -71.2-150.3 163.1 -14.5 12.2 -14.4 38 66 A P E > -D 155 0C 71 0, 0.0 3,-0.8 0, 0.0 117,-0.3 -0.206 64.5 -89.3 -54.1 149.7 -13.7 15.1 -12.2 39 67 A K T 3 S+ 0 0 62 115,-3.0 3,-0.1 1,-0.2 117,-0.1 -0.214 111.2 26.4 -54.5 150.9 -12.2 14.3 -8.8 40 68 A N T 3 S+ 0 0 134 1,-0.2 2,-0.8 -3,-0.1 -1,-0.2 0.781 77.4 148.9 60.6 30.6 -14.7 13.7 -6.0 41 69 A T < + 0 0 31 -3,-0.8 -1,-0.2 -4,-0.1 9,-0.0 -0.877 7.4 154.5 -90.2 112.1 -17.5 12.6 -8.3 42 70 A F + 0 0 48 -2,-0.8 2,-0.5 -3,-0.1 66,-0.3 -0.497 11.3 171.2-138.9 66.0 -19.5 10.1 -6.2 43 71 A I > - 0 0 101 3,-0.3 3,-2.5 64,-0.1 7,-0.1 -0.672 41.1-110.4 -84.9 125.7 -23.0 10.0 -7.5 44 72 A T T 3 S+ 0 0 69 -2,-0.5 63,-0.2 1,-0.3 62,-0.1 -0.297 103.9 13.2 -57.4 132.5 -25.1 7.3 -6.0 45 73 A G T 3 S+ 0 0 17 61,-3.0 -1,-0.3 59,-0.1 62,-0.1 0.453 119.2 73.9 78.0 2.2 -25.9 4.6 -8.6 46 74 A K <>> + 0 0 103 -3,-2.5 4,-0.8 60,-0.4 5,-0.5 0.051 59.3 104.5-131.6 21.8 -23.2 6.1 -10.9 47 75 A L T 45S+ 0 0 1 59,-0.3 3,-0.4 2,-0.2 113,-0.1 0.941 80.3 49.1 -69.6 -47.6 -20.0 5.0 -9.2 48 76 A A T 45S+ 0 0 2 1,-0.2 112,-0.3 10,-0.1 -1,-0.2 0.868 123.1 32.5 -63.3 -36.0 -19.1 2.2 -11.6 49 77 A S T >45S- 0 0 0 7,-0.1 3,-2.4 -4,-0.1 -1,-0.2 0.538 95.5-137.3 -92.2 -8.3 -19.6 4.4 -14.7 50 78 A A T 3<5 - 0 0 5 -4,-0.8 -3,-0.2 -3,-0.4 -2,-0.1 0.715 66.1 -71.3 50.6 23.7 -18.5 7.6 -13.0 51 79 A G T 3 + 0 0 111 1,-0.3 3,-2.2 -4,-0.2 4,-0.3 0.791 64.3 66.9 -49.3 -39.7 -24.1 3.2 -18.0 57 85 A P G > S+ 0 0 51 0, 0.0 3,-1.3 0, 0.0 -1,-0.3 0.801 89.7 67.2 -58.4 -25.7 -24.5 -0.6 -18.2 58 86 A L G < S+ 0 0 2 -3,-1.9 -2,-0.2 1,-0.2 -10,-0.1 0.710 86.9 70.5 -63.7 -17.8 -21.8 -0.9 -15.5 59 87 A D G < + 0 0 29 -3,-2.2 47,-0.3 -4,-0.3 -1,-0.2 0.589 66.6 114.1 -82.3 -9.2 -24.1 0.7 -12.9 60 88 A E < - 0 0 101 -3,-1.3 2,-0.4 -4,-0.3 44,-0.1 -0.330 51.3-161.9 -58.5 140.9 -26.5 -2.2 -12.6 61 89 A Q + 0 0 18 42,-0.1 2,-0.3 4,-0.1 -2,-0.1 -0.888 28.1 132.0-138.1 105.0 -26.2 -3.7 -9.1 62 90 A T - 0 0 39 -2,-0.4 4,-0.4 41,-0.1 3,-0.3 -0.920 63.0-106.4-136.2 168.6 -27.4 -7.1 -8.0 63 91 A A S S+ 0 0 41 -2,-0.3 40,-0.1 1,-0.2 3,-0.0 0.771 118.0 29.4 -64.5 -25.5 -25.7 -9.9 -6.0 64 92 A T S S+ 0 0 126 1,-0.1 -1,-0.2 38,-0.0 39,-0.0 0.416 91.6 93.4-117.2 -0.0 -25.1 -12.0 -9.1 65 93 A R S S+ 0 0 54 -3,-0.3 2,-0.3 2,-0.1 -2,-0.1 0.864 82.4 51.6 -64.1 -38.8 -24.8 -9.6 -12.1 66 94 A W S S- 0 0 4 -4,-0.4 2,-0.3 -44,-0.1 -44,-0.1 -0.744 83.3-110.2-112.2 148.2 -20.9 -9.3 -12.0 67 95 A H - 0 0 73 -2,-0.3 2,-0.4 -57,-0.1 95,-0.3 -0.525 36.0-152.7 -68.7 131.6 -18.0 -11.7 -12.0 68 96 A K - 0 0 46 -2,-0.3 2,-0.5 93,-0.1 95,-0.3 -0.866 10.1-135.3-106.6 143.5 -16.1 -11.7 -8.7 69 97 A T E -e 163 0C 38 93,-1.9 95,-2.7 -2,-0.4 2,-0.4 -0.830 28.2-123.4 -87.8 130.6 -12.4 -12.5 -8.1 70 98 A N E +e 164 0C 124 -2,-0.5 2,-0.3 93,-0.2 95,-0.2 -0.643 46.4 158.1 -73.2 126.4 -12.0 -14.8 -5.1 71 99 A I E -e 165 0C 21 93,-2.4 95,-2.7 -2,-0.4 2,-0.2 -0.858 32.7-126.0-138.8 171.0 -9.7 -13.1 -2.5 72 100 A T - 0 0 87 -2,-0.3 62,-0.1 93,-0.2 2,-0.1 -0.673 33.6 -95.6-109.8 169.9 -8.9 -13.3 1.2 73 101 A T S S+ 0 0 44 -2,-0.2 -1,-0.1 63,-0.1 63,-0.1 -0.283 90.6 45.9 -69.4 172.9 -8.8 -10.6 3.9 74 102 A G E S+ B 0 134A 18 60,-2.8 60,-2.8 -2,-0.1 58,-0.1 -0.511 105.2 12.2 85.5-158.5 -5.5 -9.1 4.6 75 103 A P E - B 0 133A 91 0, 0.0 2,-0.4 0, 0.0 58,-0.2 -0.209 61.6-175.4 -58.6 139.5 -3.0 -7.9 2.0 76 104 A L E - B 0 132A 21 56,-2.8 56,-2.5 -5,-0.1 2,-0.4 -0.992 19.9-136.1-134.8 127.2 -4.2 -7.6 -1.6 77 105 A D E - B 0 131A 103 -2,-0.4 2,-0.5 54,-0.2 54,-0.2 -0.697 18.5-161.6 -81.8 130.0 -2.0 -6.7 -4.6 78 106 A I E - B 0 130A 0 52,-3.6 52,-2.7 -2,-0.4 2,-0.5 -0.961 3.8-167.2-111.0 128.7 -3.6 -4.2 -7.0 79 107 A T E -AB 6 129A 31 -73,-2.8 -74,-2.5 -2,-0.5 -73,-1.4 -0.971 1.5-168.3-119.3 119.7 -2.2 -3.9 -10.5 80 108 A W E -AB 4 128A 0 48,-2.7 48,-2.2 -2,-0.5 2,-0.5 -0.782 8.0-155.1 -93.6 145.8 -3.1 -1.0 -12.8 81 109 A N E -AB 3 127A 44 -78,-2.8 -78,-2.2 -2,-0.3 2,-0.6 -0.997 9.9-156.0-116.7 129.8 -2.4 -0.9 -16.5 82 110 A L E -A 2 0A 4 44,-2.9 -80,-0.3 -2,-0.5 3,-0.3 -0.908 16.8-176.3-108.5 118.0 -2.1 2.6 -17.9 83 111 A T S S+ 0 0 63 -82,-1.3 2,-0.4 -2,-0.6 -81,-0.2 0.737 89.9 27.0 -80.4 -23.5 -2.7 3.0 -21.7 84 112 A A S S- 0 0 36 -83,-2.0 -1,-0.3 -51,-0.1 2,-0.1 -0.917 86.7-143.0-138.4 107.4 -1.9 6.8 -21.3 85 113 A Q - 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