==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 18-JAN-06 2FQP . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN BP2299; . SOURCE 2 ORGANISM_SCIENTIFIC: BORDETELLA PERTUSSIS TOHAMA I; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 376 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18087.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 273 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 176 46.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 57 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 4.3 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 . 4 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 4 8 0 4 4 4 4 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 . 4 0 0 8 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 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 X 0 0 246 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.1 23.9 131.9 58.7 2 2 A K - 0 0 93 3,-0.0 3,-0.1 0, 0.0 0, 0.0 -0.957 360.0-123.0-153.8 130.4 21.8 128.8 58.9 3 3 A R - 0 0 111 -2,-0.3 25,-0.1 1,-0.1 24,-0.1 -0.359 44.8 -95.8 -65.8 149.2 22.4 125.2 58.5 4 4 A P - 0 0 62 0, 0.0 25,-2.4 0, 0.0 2,-0.3 -0.320 45.6-104.3 -62.2 151.8 20.3 123.4 55.9 5 5 A G B -a 29 0A 48 23,-0.2 2,-0.2 -3,-0.1 25,-0.2 -0.584 23.7-121.9 -79.0 139.7 17.2 121.7 57.2 6 6 A A - 0 0 13 23,-2.2 18,-0.2 -2,-0.3 -1,-0.0 -0.574 32.8-127.1 -69.2 144.0 16.9 117.9 57.5 7 7 A I E -E 23 0B 87 16,-2.8 16,-2.4 -2,-0.2 2,-0.4 -0.868 17.2-153.1-108.0 119.2 14.0 116.6 55.5 8 8 A P E -E 22 0B 65 0, 0.0 2,-0.4 0, 0.0 14,-0.2 -0.766 10.3-175.0 -91.2 133.1 11.3 114.4 57.0 9 9 A T E -E 21 0B 66 12,-2.6 12,-2.9 -2,-0.4 2,-0.6 -0.982 21.6-138.4-121.2 117.3 9.3 111.9 54.9 10 10 A V E +E 20 0B 75 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.645 25.4 173.8 -76.3 116.9 6.5 110.1 56.8 11 11 A Q E + 0 0 53 8,-2.7 2,-0.3 -2,-0.6 9,-0.2 0.795 69.0 11.8 -88.9 -34.5 6.5 106.5 55.7 12 12 A I E +E 19 0B 18 7,-1.3 7,-3.0 150,-0.1 -1,-0.3 -0.987 56.7 170.4-145.5 138.5 3.8 105.1 58.1 13 13 A D E +E 18 0B 97 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.762 29.5 131.6-153.4 99.7 1.3 107.0 60.3 14 14 A N S S- 0 0 41 3,-2.9 80,-0.1 -2,-0.3 -2,-0.0 -0.599 70.9 -64.2-136.5-166.5 -1.3 104.8 61.9 15 15 A E S S+ 0 0 168 -2,-0.2 3,-0.1 1,-0.2 0, 0.0 0.758 129.4 27.0 -53.5 -28.3 -3.0 103.9 65.3 16 16 A R S S+ 0 0 85 1,-0.2 78,-2.6 77,-0.1 2,-0.3 0.769 121.4 18.2-112.3 -34.7 0.2 102.7 66.8 17 17 A V E - F 0 93B 2 76,-0.2 -3,-2.9 2,-0.0 2,-0.4 -0.940 44.5-150.9-143.4 155.1 3.2 104.3 65.2 18 18 A K E -EF 13 92B 70 74,-1.8 74,-3.0 -2,-0.3 2,-0.5 -0.984 21.7-165.9-123.4 122.6 4.5 107.2 63.1 19 19 A V E -EF 12 91B 0 -7,-3.0 -8,-2.7 -2,-0.4 -7,-1.3 -0.946 8.3-179.1-116.3 121.4 7.6 106.3 61.1 20 20 A T E -EF 10 90B 5 70,-2.5 70,-3.0 -2,-0.5 2,-0.5 -0.972 21.7-143.8-125.3 128.0 9.5 109.2 59.6 21 21 A E E -EF 9 89B 31 -12,-2.9 -12,-2.6 -2,-0.4 2,-0.5 -0.833 19.2-158.1 -84.6 130.1 12.7 109.0 57.4 22 22 A W E -EF 8 88B 54 66,-3.2 66,-1.8 -2,-0.5 2,-0.6 -0.948 6.2-167.5-112.9 118.2 14.9 111.9 58.3 23 23 A R E -EF 7 87B 103 -16,-2.4 -16,-2.8 -2,-0.5 64,-0.2 -0.936 4.4-159.8-112.9 118.0 17.4 112.9 55.6 24 24 A F E - F 0 86B 0 62,-3.4 62,-1.8 -2,-0.6 -18,-0.2 -0.834 9.2-142.5 -99.5 119.4 20.2 115.3 56.6 25 25 A P > - 0 0 32 0, 0.0 3,-2.6 0, 0.0 55,-0.2 -0.310 52.3 -71.8 -59.5 160.0 22.1 117.3 54.0 26 26 A P T 3 S+ 0 0 57 0, 0.0 57,-0.2 0, 0.0 59,-0.1 -0.369 127.9 9.7 -48.4 127.5 25.8 117.7 54.8 27 27 A G T 3 S+ 0 0 17 53,-1.2 56,-0.1 55,-0.9 58,-0.1 0.494 103.6 146.9 78.5 4.4 26.0 120.1 57.7 28 28 A G < - 0 0 0 -3,-2.6 52,-3.0 54,-0.2 2,-0.3 -0.189 28.3-165.9 -82.7 164.1 22.2 119.8 58.1 29 29 A E B -aB 5 79A 51 -25,-2.4 -23,-2.2 50,-0.2 50,-0.2 -0.974 28.3-134.5-144.2 161.1 20.1 120.0 61.3 30 30 A T - 0 0 36 48,-2.0 49,-0.1 -2,-0.3 2,-0.1 0.769 47.7-126.3 -76.0 -30.6 16.6 119.3 62.7 31 31 A G - 0 0 25 47,-0.2 47,-0.4 2,-0.1 -1,-0.1 -0.044 50.3 -50.5 81.8 159.8 16.2 122.6 64.6 32 32 A W S S+ 0 0 129 45,-0.2 2,-0.3 -2,-0.1 45,-0.2 -0.412 72.5 159.8 -63.5 143.0 15.3 122.3 68.3 33 33 A H E -I 76 0C 54 43,-1.8 43,-1.9 -2,-0.1 2,-0.4 -0.973 35.4-127.3-156.8 162.9 12.3 120.0 69.0 34 34 A R E -I 75 0C 135 -2,-0.3 2,-0.6 41,-0.2 41,-0.2 -0.976 24.4-128.6-116.5 131.6 10.8 118.1 71.9 35 35 A H - 0 0 4 39,-2.9 38,-2.8 -2,-0.4 39,-0.1 -0.706 19.6-172.7 -81.9 119.3 10.0 114.4 71.5 36 36 A S + 0 0 69 -2,-0.6 2,-0.3 36,-0.2 -1,-0.2 0.536 68.0 40.6 -89.2 -5.2 6.3 113.8 72.5 37 37 A X S S- 0 0 37 34,-0.1 36,-0.1 57,-0.1 57,-0.1 -0.967 91.4 -96.5-138.5 150.1 6.6 110.0 72.3 38 38 A D - 0 0 38 55,-0.4 55,-2.7 -2,-0.3 2,-0.3 -0.386 56.4-167.8 -54.3 145.9 9.0 107.2 73.1 39 39 A Y E -GH 70 92B 6 31,-2.2 31,-1.9 53,-0.2 2,-0.4 -0.957 26.2-139.9-146.1 157.2 10.9 106.5 69.9 40 40 A V E -GH 69 91B 1 51,-2.2 51,-2.9 -2,-0.3 2,-0.5 -0.967 14.6-153.9-115.4 134.0 13.2 104.1 68.1 41 41 A V E -GH 68 90B 2 27,-3.0 27,-1.7 -2,-0.4 49,-0.2 -0.962 8.5-174.1-108.9 121.5 16.0 105.2 65.8 42 42 A V E - H 0 89B 0 47,-3.2 47,-2.4 -2,-0.5 25,-0.1 -0.929 21.5-143.2-108.6 102.1 17.2 102.9 63.1 43 43 A P E - H 0 88B 0 0, 0.0 22,-3.1 0, 0.0 45,-0.3 -0.421 19.0-173.6 -65.3 140.5 20.2 104.5 61.4 44 44 A X S S+ 0 0 7 43,-2.5 2,-0.3 20,-0.2 44,-0.2 0.404 74.3 50.4-105.9 -6.0 20.5 104.0 57.7 45 45 A T S S- 0 0 36 42,-0.8 2,-0.6 2,-0.1 20,-0.1 -0.970 78.9-131.5-132.3 140.7 24.0 105.6 57.6 46 46 A T + 0 0 81 -2,-0.3 17,-0.2 17,-0.2 15,-0.0 -0.879 62.7 91.9 -93.3 125.4 27.1 104.8 59.7 47 47 A G E S-C 62 0A 10 15,-1.9 15,-2.4 -2,-0.6 2,-0.1 -0.932 72.4 -64.8 168.2 169.9 28.5 108.1 61.0 48 48 A P E -C 61 0A 30 0, 0.0 2,-0.4 0, 0.0 34,-0.3 -0.448 33.9-164.3 -76.8 147.8 28.6 110.7 63.7 49 49 A L E -C 60 0A 2 11,-2.3 11,-3.1 -2,-0.1 2,-0.6 -0.961 16.3-136.7-122.2 149.9 25.7 112.9 64.8 50 50 A L E -CD 59 79A 37 29,-2.9 29,-2.7 -2,-0.4 2,-0.6 -0.942 19.6-160.1-107.4 119.5 26.2 116.0 66.9 51 51 A L E -CD 58 78A 31 7,-2.8 7,-1.9 -2,-0.6 2,-0.6 -0.911 3.5-163.0-108.2 119.9 23.5 116.2 69.6 52 52 A E E +CD 57 77A 62 25,-2.9 25,-1.9 -2,-0.6 5,-0.2 -0.904 18.2 167.5-103.0 120.3 22.8 119.6 71.2 53 53 A T E > -C 56 0A 52 3,-3.0 3,-0.9 -2,-0.6 23,-0.1 -0.736 53.7 -90.2-124.6 169.1 21.0 119.5 74.5 54 54 A P T 3 S+ 0 0 88 0, 0.0 3,-0.1 0, 0.0 22,-0.1 0.846 125.1 43.6 -51.0 -33.8 20.4 122.1 77.1 55 55 A E T 3 S- 0 0 172 1,-0.2 2,-0.3 0, 0.0 -3,-0.0 0.596 123.8 -55.7 -90.6 -13.6 23.6 121.1 79.0 56 56 A G E < -C 53 0A 35 -3,-0.9 -3,-3.0 2,-0.0 2,-0.4 -0.995 54.3 -75.0 166.3-167.6 26.0 120.7 76.1 57 57 A S E -C 52 0A 75 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.996 37.6-180.0-131.8 132.2 27.0 119.1 72.8 58 58 A V E -C 51 0A 82 -7,-1.9 -7,-2.8 -2,-0.4 2,-0.5 -0.974 27.7-126.2-134.2 147.4 28.3 115.6 72.2 59 59 A T E -C 50 0A 96 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.811 27.9-166.9 -87.0 125.4 29.3 113.5 69.2 60 60 A S E -C 49 0A 40 -11,-3.1 -11,-2.3 -2,-0.5 2,-0.6 -0.967 14.0-137.8-116.7 133.5 27.4 110.2 69.0 61 61 A Q E -C 48 0A 134 -2,-0.4 2,-0.3 -13,-0.2 -15,-0.0 -0.813 21.0-166.3 -96.4 114.2 28.6 107.4 66.7 62 62 A L E -C 47 0A 6 -15,-2.4 -15,-1.9 -2,-0.6 2,-0.4 -0.776 6.8-153.8-100.0 148.6 25.8 105.7 64.9 63 63 A T > - 0 0 72 3,-0.4 3,-2.4 -2,-0.3 -17,-0.2 -0.978 30.8-105.2-120.2 130.9 26.0 102.4 63.0 64 64 A R T 3 S+ 0 0 118 -2,-0.4 -20,-0.2 1,-0.3 -18,-0.1 -0.250 105.6 9.6 -52.0 130.7 23.7 101.6 60.1 65 65 A G T 3 S+ 0 0 3 -22,-3.1 2,-0.8 1,-0.2 -1,-0.3 0.496 95.4 117.3 79.5 2.7 21.1 99.1 61.2 66 66 A V < - 0 0 70 -3,-2.4 -3,-0.4 -23,-0.1 -1,-0.2 -0.896 53.3-158.7-105.5 100.4 22.0 99.3 64.9 67 67 A S + 0 0 10 -2,-0.8 2,-0.3 -25,-0.1 -25,-0.2 -0.270 15.2 179.4 -80.5 160.5 18.9 100.6 66.6 68 68 A Y E -G 41 0B 68 -27,-1.7 -27,-3.0 -2,-0.0 2,-0.3 -0.973 16.9-134.3-151.0 163.3 18.4 102.4 69.8 69 69 A T E -G 40 0B 48 -2,-0.3 -29,-0.2 -29,-0.2 -31,-0.0 -0.923 12.5-171.9-123.8 149.5 15.5 103.9 71.8 70 70 A R E -G 39 0B 97 -31,-1.9 -31,-2.2 -2,-0.3 2,-0.1 -0.970 27.9-111.5-134.6 147.8 15.1 107.2 73.7 71 71 A P > - 0 0 69 0, 0.0 3,-1.3 0, 0.0 -36,-0.2 -0.397 37.8 -81.8 -85.4 160.6 12.2 108.2 76.0 72 72 A E T 3 S+ 0 0 106 1,-0.2 -36,-0.2 -36,-0.1 -34,-0.1 -0.256 110.7 46.9 -44.4 134.8 9.4 110.7 75.7 73 73 A G T 3 + 0 0 28 -38,-2.8 -1,-0.2 1,-0.3 -37,-0.1 0.211 66.4 147.4 112.5 -9.3 10.7 114.2 76.7 74 74 A V < - 0 0 13 -3,-1.3 -39,-2.9 -39,-0.1 2,-0.4 -0.323 26.9-166.9 -54.6 130.8 14.1 114.4 74.8 75 75 A E E +I 34 0C 87 -41,-0.2 2,-0.3 2,-0.0 -41,-0.2 -0.997 30.0 116.8-123.5 122.1 14.7 118.1 73.9 76 76 A H E -I 33 0C 10 -43,-1.9 -43,-1.8 -2,-0.4 2,-0.4 -0.989 56.3-117.9-168.1 172.1 17.5 118.7 71.4 77 77 A N E - D 0 52A 8 -25,-1.9 -25,-2.9 -2,-0.3 2,-0.5 -0.972 30.8-152.5-118.4 136.6 18.9 119.8 68.1 78 78 A V E - D 0 51A 6 -2,-0.4 -48,-2.0 -47,-0.4 2,-0.4 -0.969 11.9-170.7-120.0 132.5 20.5 117.2 65.9 79 79 A I E -BD 29 50A 2 -29,-2.7 -29,-2.9 -2,-0.5 -50,-0.2 -0.919 23.1-141.2-125.9 139.4 23.2 118.0 63.4 80 80 A N - 0 0 0 -52,-3.0 -53,-1.2 -2,-0.4 -31,-0.1 -0.874 19.5-176.2 -95.2 103.8 24.9 116.1 60.7 81 81 A P + 0 0 63 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.438 50.0 97.7 -83.9 2.1 28.6 117.2 60.9 82 82 A S S S- 0 0 36 -34,-0.3 -55,-0.9 2,-0.2 -54,-0.2 -0.341 80.4-119.6 -91.6 171.9 29.7 115.2 57.9 83 83 A D S S+ 0 0 110 -57,-0.2 2,-0.3 273,-0.1 -1,-0.1 0.302 93.3 58.9 -90.4 4.7 30.3 116.1 54.2 84 84 A T S S- 0 0 44 -59,-0.1 -57,-0.2 273,-0.0 -2,-0.2 -0.902 97.5 -79.7-135.6 162.0 27.7 113.6 53.1 85 85 A E - 0 0 72 -2,-0.3 2,-0.4 -59,-0.1 -2,-0.1 -0.306 38.9-154.7 -65.2 141.0 24.0 112.9 53.6 86 86 A F E -F 24 0B 3 -62,-1.8 -62,-3.4 -4,-0.1 2,-0.4 -0.971 12.1-170.5-119.0 134.0 23.0 111.2 56.8 87 87 A V E +F 23 0B 18 -2,-0.4 -43,-2.5 -64,-0.2 -42,-0.8 -0.974 11.0 165.7-130.5 136.5 19.8 109.2 57.0 88 88 A F E -FH 22 43B 8 -66,-1.8 -66,-3.2 -2,-0.4 2,-0.5 -0.980 29.0-132.1-141.0 156.7 17.8 107.5 59.8 89 89 A V E -FH 21 42B 0 -47,-2.4 -47,-3.2 -2,-0.3 2,-0.5 -0.946 21.3-158.3-106.6 125.2 14.4 106.1 60.3 90 90 A E E -FH 20 41B 12 -70,-3.0 -70,-2.5 -2,-0.5 2,-0.6 -0.926 3.5-164.1-110.3 125.8 12.6 107.3 63.4 91 91 A I E -FH 19 40B 0 -51,-2.9 -51,-2.2 -2,-0.5 2,-0.4 -0.932 7.1-163.9-114.6 105.9 9.7 105.1 64.8 92 92 A E E -FH 18 39B 22 -74,-3.0 -74,-1.8 -2,-0.6 2,-0.6 -0.792 12.8-138.9 -95.2 137.5 7.5 107.0 67.3 93 93 A I E -F 17 0B 5 -55,-2.7 -55,-0.4 -2,-0.4 -76,-0.2 -0.830 16.8-140.0-101.9 117.2 5.2 104.9 69.5 94 94 A K 0 0 65 -78,-2.6 -57,-0.1 -2,-0.6 -79,-0.0 -0.406 360.0 360.0 -77.2 151.7 1.8 106.4 70.0 95 95 A A 0 0 127 -2,-0.1 -1,-0.2 0, 0.0 -58,-0.0 0.732 360.0 360.0-103.4 360.0 0.1 106.3 73.4 96 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 97 3 B R 0 0 163 0, 0.0 25,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 158.4 18.8 75.6 55.0 98 4 B P - 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