==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGAND BINDING PROTEIN 13-APR-04 1T0V . COMPND 2 MOLECULE: BILIN-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PIERIS BRASSICAE; . AUTHOR J.L.MILLS,G.LIU,A.SKERRA,T.SZYPERSKI,NORTHEAST STRUCTURAL . 184 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12085.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 97 52.7 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 . 41 22.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 25 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 8.2 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 1 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 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 . 4 2 2 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 1 A D 0 0 147 0, 0.0 2,-0.4 0, 0.0 124,-0.0 0.000 360.0 360.0 360.0 103.1 -11.0 14.4 0.2 2 2 A V + 0 0 22 124,-0.2 124,-1.3 2,-0.0 2,-0.3 -0.922 360.0 173.4-133.9 106.7 -12.1 11.7 2.7 3 3 A Y E +A 125 0A 115 -2,-0.4 2,-0.3 122,-0.2 122,-0.2 -0.872 2.5 164.0-115.3 147.7 -12.9 12.7 6.2 4 4 A H E -A 124 0A 64 120,-2.0 120,-2.1 -2,-0.3 2,-0.3 -0.933 33.9-104.5-151.5 170.6 -14.4 10.7 9.0 5 5 A D S S- 0 0 144 -2,-0.3 2,-0.2 118,-0.2 118,-0.1 -0.796 80.9 -3.3-104.6 146.2 -14.9 10.7 12.8 6 6 A G S S- 0 0 31 -2,-0.3 2,-0.1 3,-0.0 -2,-0.1 -0.565 105.0 -42.0 80.2-140.3 -12.9 8.6 15.2 7 7 A A S S- 0 0 64 1,-0.3 117,-0.1 -2,-0.2 109,-0.1 -0.386 92.1 -31.2-112.7-168.7 -10.3 6.2 13.9 8 8 A a S S- 0 0 43 107,-0.4 -1,-0.3 -2,-0.1 3,-0.1 -0.080 71.6-117.7 -45.0 144.4 -10.1 3.7 11.0 9 9 A P - 0 0 41 0, 0.0 2,-0.6 0, 0.0 106,-0.1 0.052 46.8 -60.4 -75.0-170.7 -13.6 2.3 10.2 10 10 A E + 0 0 189 143,-0.1 2,-0.3 2,-0.0 -2,-0.0 -0.669 66.9 154.1 -79.7 116.8 -14.6 -1.4 10.4 11 11 A V - 0 0 22 -2,-0.6 102,-0.1 -3,-0.1 -3,-0.0 -0.888 37.7-139.5-149.1 112.1 -12.5 -3.4 8.1 12 12 A K - 0 0 183 -2,-0.3 3,-0.1 1,-0.0 -2,-0.0 -0.624 26.6-147.3 -75.4 113.6 -11.8 -7.1 8.5 13 13 A P - 0 0 20 0, 0.0 89,-0.3 0, 0.0 90,-0.1 -0.183 39.4 -60.6 -75.0 171.5 -8.1 -7.7 7.6 14 14 A V - 0 0 6 87,-2.8 68,-2.1 1,-0.1 3,-0.4 -0.253 41.3-141.1 -54.0 135.2 -6.7 -10.8 6.0 15 15 A D S S+ 0 0 101 1,-0.3 2,-0.2 66,-0.3 -1,-0.1 0.894 92.8 2.4 -65.8 -41.4 -7.3 -13.8 8.3 16 16 A N S S- 0 0 81 65,-0.1 -1,-0.3 2,-0.0 65,-0.2 -0.706 78.5-150.6-151.6 91.9 -3.9 -15.2 7.4 17 17 A F - 0 0 22 63,-1.7 2,-0.5 -3,-0.4 86,-0.0 -0.423 12.9-164.3 -66.4 134.0 -1.7 -13.1 5.1 18 18 A D > - 0 0 82 -2,-0.1 4,-0.8 1,-0.1 3,-0.4 -0.988 21.4-164.4-126.5 125.0 0.6 -15.1 2.9 19 19 A W T 4 + 0 0 52 -2,-0.5 -1,-0.1 1,-0.2 28,-0.1 0.336 67.9 106.7 -85.1 6.2 3.6 -13.6 1.1 20 20 A S T 4 S- 0 0 76 1,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.947 104.9 -4.2 -47.1 -62.3 3.6 -16.9 -0.9 21 21 A Q T 4 S+ 0 0 102 -3,-0.4 2,-1.9 1,-0.1 -2,-0.1 0.835 116.6 86.9 -99.5 -49.2 2.2 -15.2 -4.0 22 22 A Y S < S+ 0 0 4 -4,-0.8 2,-0.3 84,-0.1 -1,-0.1 -0.331 83.1 67.4 -57.4 84.3 1.6 -11.7 -2.8 23 23 A H + 0 0 77 -2,-1.9 2,-0.3 2,-0.1 25,-0.1 -0.940 54.4 70.2-175.6-169.0 5.0 -10.4 -3.6 24 24 A G S S- 0 0 22 23,-0.4 2,-0.5 -2,-0.3 23,-0.1 -0.609 100.1 -9.4 81.6-136.6 7.5 -9.6 -6.3 25 25 A K + 0 0 98 -2,-0.3 2,-0.3 21,-0.2 21,-0.2 -0.891 68.9 175.9-104.3 125.4 6.8 -6.6 -8.5 26 26 A W - 0 0 8 19,-0.6 19,-0.4 -2,-0.5 2,-0.4 -0.923 13.9-155.6-127.5 152.2 3.4 -5.0 -8.2 27 27 A W E -C 132 0B 73 105,-1.8 105,-2.2 -2,-0.3 107,-0.1 -0.985 29.1-102.5-130.6 139.7 2.0 -1.9 -9.9 28 28 A E E +C 131 0B 19 -2,-0.4 103,-0.3 103,-0.3 135,-0.0 -0.151 40.2 170.0 -56.2 152.5 -0.8 0.4 -8.6 29 29 A V + 0 0 0 101,-1.8 2,-0.9 133,-0.1 -1,-0.1 0.452 65.2 10.6-126.5 -88.8 -4.2 -0.1 -10.3 30 30 A A S S+ 0 0 4 132,-0.3 2,-0.4 101,-0.1 132,-0.3 -0.801 78.2 152.4-105.1 89.9 -7.2 1.7 -8.8 31 31 A K - 0 0 19 130,-1.4 98,-0.1 -2,-0.9 -3,-0.0 -0.978 55.7 -86.7-123.2 131.3 -5.8 4.1 -6.2 32 32 A Y - 0 0 17 -2,-0.4 128,-0.1 96,-0.3 -1,-0.1 0.086 31.7-130.2 -31.9 136.3 -7.5 7.3 -5.2 33 33 A P - 0 0 42 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.393 44.6-139.5 -75.0 4.1 -6.5 10.2 -7.5 34 34 A S - 0 0 22 3,-0.2 5,-0.0 2,-0.1 93,-0.0 0.227 19.8 -86.8 56.5 171.1 -5.8 12.1 -4.3 35 35 A P S S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.985 127.6 28.7 -75.0 -66.0 -6.7 15.8 -3.9 36 36 A N S S- 0 0 146 2,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.769 111.6-126.7 -65.8 -26.0 -3.6 17.5 -5.3 37 37 A G + 0 0 20 1,-0.2 2,-0.5 -5,-0.0 -3,-0.2 0.972 41.6 170.5 75.3 82.2 -3.2 14.5 -7.5 38 38 A K + 0 0 110 -5,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.968 17.2 120.9-129.4 115.0 0.3 13.2 -7.1 39 39 A Y - 0 0 49 -2,-0.5 24,-1.7 22,-0.1 2,-0.2 -0.973 35.7-158.3-162.4 168.2 1.3 9.8 -8.6 40 40 A G - 0 0 4 22,-0.3 2,-1.5 -2,-0.3 22,-0.1 -0.707 3.4-166.4-161.8 103.0 3.6 8.1 -11.0 41 41 A K + 0 0 27 -2,-0.2 129,-0.2 1,-0.2 124,-0.1 -0.585 69.9 86.3 -91.6 72.6 3.0 4.7 -12.5 42 42 A b + 0 0 46 -2,-1.5 2,-0.2 127,-0.1 -1,-0.2 -0.129 64.2 102.4-163.0 47.0 6.6 4.1 -13.8 43 43 A G - 0 0 14 17,-0.2 2,-0.4 -3,-0.1 17,-0.2 -0.721 58.0-131.3-127.9 177.6 8.5 2.5 -10.9 44 44 A W + 0 0 179 15,-1.4 2,-0.4 -2,-0.2 -17,-0.1 -0.971 24.4 175.4-138.2 118.7 9.7 -0.8 -9.8 45 45 A A - 0 0 7 -2,-0.4 -19,-0.6 -19,-0.4 2,-0.3 -0.972 7.0-167.6-126.6 139.8 9.2 -2.2 -6.3 46 46 A E E -E 57 0C 118 11,-0.6 11,-1.3 -2,-0.4 2,-0.5 -0.839 16.6-132.5-123.7 161.0 10.1 -5.6 -4.9 47 47 A Y E -E 56 0C 25 -2,-0.3 -23,-0.4 9,-0.2 9,-0.2 -0.955 20.2-171.6-119.8 114.6 9.2 -7.5 -1.8 48 48 A T E -E 55 0C 71 7,-1.6 7,-3.0 -2,-0.5 2,-0.3 -0.897 23.4-123.9-108.5 132.4 11.9 -9.2 0.2 49 49 A P E +E 54 0C 100 0, 0.0 5,-0.3 0, 0.0 -2,-0.0 -0.536 26.4 177.3 -75.0 134.7 11.2 -11.6 3.1 50 50 A E - 0 0 121 3,-4.5 3,-0.4 -2,-0.3 4,-0.1 -0.218 66.5 -71.2-130.0 41.2 12.8 -10.7 6.4 51 51 A G S S- 0 0 63 1,-0.2 2,-1.0 2,-0.1 3,-0.1 0.972 115.3 -12.4 67.0 88.3 11.4 -13.4 8.6 52 52 A K S S+ 0 0 140 1,-0.1 2,-0.2 22,-0.1 -1,-0.2 -0.266 131.7 74.6 87.1 -47.4 7.8 -12.7 9.1 53 53 A S - 0 0 16 -2,-1.0 -3,-4.5 -3,-0.4 2,-0.4 -0.625 69.6-148.9 -97.2 157.1 8.2 -9.2 7.7 54 54 A V E -EF 49 73C 5 19,-1.7 19,-2.2 -5,-0.3 17,-0.0 -0.966 14.7-134.3-131.4 114.9 8.6 -8.4 4.0 55 55 A K E -E 48 0C 92 -7,-3.0 -7,-1.6 -2,-0.4 2,-0.4 -0.297 20.7-163.8 -64.4 149.3 10.7 -5.4 3.0 56 56 A V E -E 47 0C 10 -9,-0.2 15,-2.8 2,-0.0 2,-0.5 -0.977 8.5-172.4-142.5 124.5 9.2 -3.1 0.3 57 57 A S E -EG 46 70C 44 -11,-1.3 -11,-0.6 -2,-0.4 2,-0.4 -0.971 5.6-170.3-122.2 118.8 11.0 -0.5 -1.8 58 58 A R E + G 0 69C 58 11,-0.6 11,-1.6 -2,-0.5 2,-0.3 -0.901 11.0 165.7-111.0 136.2 9.0 1.8 -4.1 59 59 A Y E + G 0 68C 97 -2,-0.4 -15,-1.4 9,-0.2 2,-0.3 -0.908 15.2 123.9-153.4 120.2 10.7 4.1 -6.6 60 60 A D E - G 0 67C 11 7,-1.5 7,-3.7 -2,-0.3 2,-0.7 -0.902 59.1 -89.3-158.3-177.7 9.1 6.0 -9.5 61 61 A V E - G 0 66C 8 -2,-0.3 2,-0.6 5,-0.3 3,-0.4 -0.888 35.4-160.1-111.4 101.0 8.6 9.4 -11.0 62 62 A I S S- 0 0 17 3,-2.2 -22,-0.3 -2,-0.7 108,-0.0 -0.718 72.5 -28.2 -83.9 117.0 5.5 11.1 -9.6 63 63 A H S S- 0 0 127 -24,-1.7 -1,-0.3 -2,-0.6 107,-0.1 0.914 130.1 -38.9 38.4 79.8 4.4 13.8 -11.9 64 64 A G S S+ 0 0 38 105,-1.2 2,-0.2 -3,-0.4 -1,-0.2 0.888 121.1 108.1 37.2 61.5 7.8 14.7 -13.4 65 65 A K S S- 0 0 130 105,-0.1 -3,-2.2 107,-0.0 2,-0.4 -0.764 74.5-119.4-167.7 115.8 9.4 14.2 -10.0 66 66 A E E -G 61 0C 129 -5,-0.3 2,-0.3 -2,-0.2 -5,-0.3 -0.434 42.6-177.6 -61.4 112.7 11.7 11.4 -8.8 67 67 A Y E +G 60 0C 80 -7,-3.7 -7,-1.5 -2,-0.4 2,-0.3 -0.755 13.5 179.0-113.8 160.9 9.9 9.8 -5.9 68 68 A F E +G 59 0C 108 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.856 6.9 166.1-164.9 125.1 10.7 7.0 -3.5 69 69 A M E +G 58 0C 92 -11,-1.6 -11,-0.6 -2,-0.3 2,-0.2 -0.895 9.5 172.6-147.9 112.8 9.0 5.4 -0.5 70 70 A E E +G 57 0C 47 -2,-0.3 -13,-0.2 -13,-0.2 19,-0.2 -0.598 4.3 159.3-112.5 174.4 9.9 2.1 1.1 71 71 A G - 0 0 3 -15,-2.8 17,-0.2 -2,-0.2 2,-0.1 -0.554 35.0-116.6 165.3 127.7 8.8 0.3 4.2 72 72 A T - 0 0 27 15,-0.4 15,-1.5 -17,-0.2 2,-0.7 -0.416 26.9-127.6 -75.0 150.6 8.8 -3.2 5.6 73 73 A A E +FH 54 86C 0 -19,-2.2 -19,-1.7 13,-0.2 13,-0.2 -0.897 36.4 168.6-104.9 112.6 5.6 -5.1 6.2 74 74 A Y E - H 0 85C 99 11,-2.2 11,-1.7 -2,-0.7 2,-0.5 -0.930 39.5-105.3-125.7 149.2 5.3 -6.5 9.7 75 75 A P E - H 0 84C 11 0, 0.0 9,-0.3 0, 0.0 8,-0.1 -0.595 21.4-158.5 -75.0 121.2 2.4 -8.0 11.7 76 76 A V S S- 0 0 66 7,-4.6 8,-0.1 -2,-0.5 7,-0.1 0.955 74.6 -24.3 -61.9 -52.6 1.2 -5.6 14.3 77 77 A G S S+ 0 0 46 6,-0.6 6,-0.0 1,-0.4 0, 0.0 0.094 123.9 35.4-126.6-121.5 -0.4 -8.4 16.4 78 78 A D - 0 0 113 1,-0.2 -1,-0.4 -2,-0.1 -2,-0.1 -0.173 66.6-143.9 -44.4 118.6 -1.6 -11.8 15.5 79 79 A S S S+ 0 0 64 1,-0.1 -62,-0.3 -4,-0.1 -1,-0.2 0.894 97.6 51.4 -53.9 -43.7 0.7 -13.0 12.8 80 80 A K S S+ 0 0 151 -64,-0.1 -63,-1.7 -5,-0.1 -1,-0.1 0.989 99.9 64.5 -56.2 -78.6 -2.2 -14.7 11.1 81 81 A I S S- 0 0 59 -65,-0.2 -66,-0.3 -68,-0.0 -67,-0.1 0.047 94.8-110.0 -43.0 157.5 -4.7 -11.9 10.9 82 82 A G + 0 0 0 -68,-2.1 -5,-0.3 20,-0.2 -6,-0.3 0.904 66.0 130.8 -57.4-104.1 -3.6 -8.9 8.7 83 83 A K + 0 0 97 1,-0.2 -7,-4.6 -8,-0.1 2,-0.6 0.940 35.3 168.4 44.2 64.1 -2.8 -5.9 10.9 84 84 A I E -HI 75 99C 3 15,-1.6 15,-1.1 -9,-0.3 2,-0.3 -0.924 21.1-154.8-112.9 108.6 0.5 -5.4 9.1 85 85 A Y E -HI 74 98C 38 -11,-1.7 -11,-2.2 -2,-0.6 2,-0.6 -0.623 7.4-141.2 -84.1 139.0 2.1 -2.0 9.8 86 86 A H E -HI 73 97C 17 11,-2.0 11,-1.9 -2,-0.3 2,-0.6 -0.898 11.4-138.3-104.6 120.0 4.5 -0.5 7.3 87 87 A S E - 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