==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 08-SEP-06 2IAH . COMPND 2 MOLECULE: FERRIPYOVERDINE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.WIRTH,F.PATTUS,D.COBESSI . 760 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 546 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 363 47.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 71 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 2 1 1 0 1 0 1 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 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 . 6 7 0 0 4 2 3 1 4 2 0 2 3 2 2 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 44 A Q 0 0 129 0, 0.0 2,-0.5 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 149.5 -22.3 56.8 184.1 2 45 A E - 0 0 142 45,-0.2 2,-0.3 46,-0.1 45,-0.2 -0.790 360.0-163.2 -91.9 129.8 -22.2 53.2 185.6 3 46 A V E -A 46 0A 45 43,-2.2 43,-1.8 -2,-0.5 2,-0.5 -0.810 19.2-118.0-113.6 152.1 -25.1 51.0 184.5 4 47 A E E -A 45 0A 134 -2,-0.3 2,-0.3 41,-0.3 41,-0.3 -0.788 35.3-166.0 -93.6 130.6 -26.4 47.7 186.0 5 48 A F E +A 44 0A 11 39,-2.8 39,-1.6 -2,-0.5 2,-0.1 -0.830 25.1 171.8-120.7 151.7 -26.3 44.7 183.7 6 49 A D E +A 43 0A 64 -2,-0.3 37,-0.2 37,-0.2 -2,-0.0 -0.609 21.1 148.8-156.4 90.3 -27.7 41.1 183.6 7 50 A I E -A 42 0A 4 35,-2.1 35,-2.0 -2,-0.1 3,-0.1 -0.909 25.6-160.1-131.4 104.4 -27.0 39.2 180.3 8 51 A P - 0 0 82 0, 0.0 2,-0.2 0, 0.0 31,-0.1 -0.191 43.1 -67.0 -71.7 168.6 -26.6 35.3 180.4 9 52 A P S S+ 0 0 71 0, 0.0 2,-0.3 0, 0.0 31,-0.2 -0.407 72.8 136.5 -62.2 129.2 -24.9 33.3 177.6 10 53 A Q E -B 39 0B 52 29,-0.5 29,-2.7 -2,-0.2 2,-0.1 -0.937 63.3 -50.2-158.4 173.5 -26.8 33.2 174.3 11 54 A A E >> -B 38 0B 58 -2,-0.3 3,-1.9 27,-0.2 4,-1.1 -0.387 62.8-117.7 -55.6 124.7 -26.2 33.5 170.5 12 55 A L H 3> S+ 0 0 1 25,-1.0 4,-1.4 22,-0.3 3,-0.2 0.718 107.5 56.1 -41.8 -44.1 -24.1 36.7 170.2 13 56 A G H 3> S+ 0 0 13 21,-0.3 4,-1.7 24,-0.2 -1,-0.3 0.787 105.0 51.4 -64.1 -33.0 -26.6 38.7 168.1 14 57 A S H <> S+ 0 0 67 -3,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.848 109.6 51.1 -70.2 -36.6 -29.4 38.4 170.7 15 58 A A H X S+ 0 0 0 -4,-1.1 4,-1.0 -3,-0.2 -2,-0.2 0.740 108.3 51.5 -74.0 -26.6 -27.1 39.6 173.4 16 59 A L H X S+ 0 0 1 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.894 109.7 49.2 -73.4 -42.8 -26.0 42.6 171.4 17 60 A Q H X S+ 0 0 66 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.817 115.4 44.7 -63.3 -32.9 -29.7 43.6 170.8 18 61 A E H X S+ 0 0 33 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.680 104.4 63.0 -86.1 -21.8 -30.3 43.2 174.5 19 62 A F H < S+ 0 0 5 -4,-1.0 4,-0.4 2,-0.2 -2,-0.2 0.903 99.7 54.9 -64.3 -43.4 -27.1 45.1 175.4 20 63 A G H >X>S+ 0 0 12 -4,-1.6 5,-1.5 1,-0.2 4,-0.9 0.871 109.2 46.7 -58.0 -41.9 -28.5 48.2 173.7 21 64 A R H 3<5S+ 0 0 87 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.866 114.5 47.1 -66.2 -39.1 -31.6 48.0 175.9 22 65 A Q T 3<5S+ 0 0 67 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.323 123.9 31.7 -89.7 7.8 -29.6 47.5 179.1 23 66 A A T <45S- 0 0 16 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.336 101.9-119.7-139.8 0.0 -27.1 50.3 178.4 24 67 A D T <5S+ 0 0 157 -4,-0.9 2,-0.3 1,-0.2 -3,-0.2 0.904 72.1 126.5 52.6 48.4 -29.3 52.9 176.4 25 68 A I < - 0 0 31 -5,-1.5 2,-0.5 -6,-0.2 -1,-0.2 -0.948 63.6-118.1-132.0 150.4 -27.0 52.6 173.4 26 69 A Q E -c 69 0C 48 42,-1.4 44,-2.1 -2,-0.3 2,-0.5 -0.783 29.0-153.4 -87.8 130.8 -27.5 51.9 169.7 27 70 A V E -c 70 0C 25 -2,-0.5 2,-0.5 42,-0.2 44,-0.2 -0.925 9.9-170.7-114.4 119.5 -25.7 48.7 168.5 28 71 A L E +c 71 0C 17 42,-2.1 44,-2.0 -2,-0.5 2,-0.3 -0.929 21.7 148.6-111.7 120.5 -24.6 48.3 164.9 29 72 A Y E -c 72 0C 42 -2,-0.5 380,-0.5 42,-0.2 44,-0.1 -0.994 48.3-113.3-151.5 149.6 -23.3 44.8 163.8 30 73 A R > - 0 0 44 42,-0.6 3,-1.3 -2,-0.3 4,-0.4 -0.797 23.1-148.4 -87.7 114.1 -23.2 42.5 160.8 31 74 A P G >> S+ 0 0 11 0, 0.0 4,-1.9 0, 0.0 3,-1.0 0.793 95.7 56.8 -51.5 -36.0 -25.3 39.4 161.5 32 75 A E G 34 S+ 0 0 49 1,-0.3 4,-0.4 2,-0.2 447,-0.0 0.765 104.4 51.5 -70.4 -28.2 -23.1 37.2 159.3 33 76 A E G <4 S+ 0 0 34 -3,-1.3 -1,-0.3 1,-0.1 4,-0.2 0.518 119.7 38.8 -77.4 -6.7 -20.0 38.1 161.4 34 77 A V T <4 S+ 0 0 5 -3,-1.0 -21,-0.3 -4,-0.4 -22,-0.3 0.615 89.6 81.8-124.0 -22.9 -22.0 37.2 164.5 35 78 A R S < S+ 0 0 83 -4,-1.9 -3,-0.1 1,-0.2 -2,-0.1 0.816 98.9 46.9 -58.0 -33.9 -24.1 34.1 163.7 36 79 A N S S+ 0 0 125 -4,-0.4 -1,-0.2 -25,-0.1 -2,-0.1 0.876 104.0 73.1 -74.6 -41.3 -21.1 31.9 164.3 37 80 A K - 0 0 22 -4,-0.2 -25,-1.0 -26,-0.1 2,-0.3 -0.115 65.7-147.8 -78.4 171.4 -20.0 33.5 167.6 38 81 A R E -B 11 0B 169 -27,-0.2 2,-0.3 -26,-0.1 -27,-0.2 -0.998 17.9-113.8-145.1 141.5 -21.6 33.3 171.1 39 82 A S E -B 10 0B 3 -29,-2.7 -29,-0.5 -2,-0.3 2,-0.2 -0.560 23.3-136.9 -84.5 135.5 -21.9 35.7 174.0 40 83 A S - 0 0 43 15,-1.4 2,-0.1 -2,-0.3 17,-0.1 -0.542 35.9 -88.4 -86.5 156.1 -20.1 35.2 177.4 41 84 A A - 0 0 66 -2,-0.2 2,-0.4 -32,-0.1 -1,-0.1 -0.383 41.7-176.3 -71.3 134.6 -21.9 35.9 180.7 42 85 A I E +A 7 0A 9 -35,-2.0 -35,-2.1 -2,-0.1 2,-0.3 -1.000 6.8 168.2-130.0 134.2 -21.8 39.3 182.3 43 86 A K E +A 6 0A 92 -2,-0.4 2,-0.2 -37,-0.2 -37,-0.2 -0.955 34.7 53.3-146.8 124.0 -23.3 40.3 185.7 44 87 A G E S-A 5 0A 29 -39,-1.6 -39,-2.8 -2,-0.3 2,-0.9 -0.817 84.9 -60.6 146.1 177.2 -22.8 43.5 187.7 45 88 A K E S+A 4 0A 126 -41,-0.3 2,-0.3 -2,-0.2 -41,-0.3 -0.828 71.0 158.6 -95.5 99.9 -22.9 47.3 187.8 46 89 A L E -A 3 0A 45 -43,-1.8 -43,-2.2 -2,-0.9 -2,-0.1 -0.816 47.5 -98.0-127.8 159.7 -20.3 48.3 185.2 47 90 A E > - 0 0 42 -2,-0.3 4,-3.1 -45,-0.2 3,-0.3 -0.561 39.6-121.6 -70.6 137.5 -19.2 51.0 182.9 48 91 A P H > S+ 0 0 52 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.863 111.1 48.1 -49.5 -48.1 -20.5 50.6 179.3 49 92 A N H > S+ 0 0 73 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.874 116.9 43.0 -63.1 -40.5 -17.0 50.5 177.7 50 93 A Q H > S+ 0 0 45 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.881 113.3 52.2 -71.5 -40.7 -15.8 48.0 180.3 51 94 A A H X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.839 107.2 51.6 -65.3 -36.8 -18.9 45.9 180.1 52 95 A I H X S+ 0 0 7 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.843 108.6 51.1 -71.4 -34.1 -18.9 45.5 176.3 53 96 A T H < S+ 0 0 94 -4,-1.1 -2,-0.2 2,-0.2 -1,-0.2 0.886 110.4 49.0 -69.4 -40.2 -15.2 44.3 176.3 54 97 A E H >< S+ 0 0 93 -4,-1.7 3,-1.1 1,-0.2 -2,-0.2 0.867 110.0 52.5 -65.0 -39.6 -16.1 41.6 179.0 55 98 A L H 3< S+ 0 0 1 -4,-1.8 -15,-1.4 1,-0.2 -2,-0.2 0.882 110.2 47.6 -61.9 -42.4 -19.0 40.5 176.9 56 99 A L T ><>S+ 0 0 10 -4,-1.7 3,-1.1 -17,-0.1 5,-0.6 0.072 82.0 141.9 -92.0 23.3 -16.9 40.1 173.8 57 100 A R T < 5 + 0 0 58 -3,-1.1 -17,-0.1 1,-0.2 -3,-0.1 -0.396 66.5 16.5 -66.8 139.8 -14.1 38.1 175.5 58 101 A G T 3 5S+ 0 0 90 -2,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.656 107.2 84.7 74.2 18.8 -12.6 35.2 173.6 59 102 A T T < 5S- 0 0 42 -3,-1.1 -2,-0.1 2,-0.1 -1,-0.1 0.572 84.4-134.3-120.9 -20.9 -13.9 36.4 170.2 60 103 A G T 5 + 0 0 73 -4,-0.5 2,-0.4 1,-0.2 15,-0.2 0.824 47.1 159.1 65.5 35.3 -11.3 39.0 169.0 61 104 A A < - 0 0 17 -5,-0.6 -1,-0.2 13,-0.1 13,-0.2 -0.777 36.2-130.7 -96.8 130.1 -14.0 41.5 168.0 62 105 A S E -D 73 0C 84 11,-2.1 11,-1.7 -2,-0.4 2,-0.4 -0.493 15.2-158.4 -76.9 143.4 -13.2 45.2 167.6 63 106 A V E -D 72 0C 53 9,-0.2 2,-0.5 -2,-0.2 9,-0.2 -0.995 4.2-167.5-122.4 128.7 -15.4 47.8 169.2 64 107 A D E -D 71 0C 65 7,-2.0 7,-1.8 -2,-0.4 2,-0.6 -0.962 10.0-150.4-120.1 115.8 -15.3 51.4 168.0 65 108 A F E +D 70 0C 83 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.752 27.7 154.7 -91.1 120.5 -17.0 54.1 170.1 66 109 A Q E > -D 69 0C 53 3,-1.8 3,-1.1 -2,-0.6 2,-0.2 -0.912 59.8 -37.8-147.4 118.2 -18.5 57.1 168.3 67 110 A G T 3 S- 0 0 89 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.510 115.5 -30.5 73.4-135.4 -21.3 59.3 169.6 68 111 A N T 3 S+ 0 0 89 -2,-0.2 -42,-1.4 -3,-0.1 2,-0.3 -0.007 126.8 70.3-105.2 26.4 -24.1 57.5 171.5 69 112 A A E < -cD 26 66C 22 -3,-1.1 -3,-1.8 -44,-0.2 2,-0.4 -0.957 63.8-149.4-140.0 156.3 -23.6 54.3 169.4 70 113 A I E -cD 27 65C 26 -44,-2.1 -42,-2.1 -2,-0.3 2,-0.3 -0.987 7.6-148.2-130.6 141.7 -21.0 51.6 169.0 71 114 A T E -cD 28 64C 43 -7,-1.8 -7,-2.0 -2,-0.4 2,-0.4 -0.859 8.0-153.7-111.0 143.9 -20.0 49.4 166.0 72 115 A I E -cD 29 63C 3 -44,-2.0 -42,-0.6 -2,-0.3 2,-0.4 -0.960 10.5-177.8-121.3 126.9 -18.7 45.8 166.1 73 116 A S E - D 0 62C 52 -11,-1.7 -11,-2.1 -2,-0.4 2,-0.6 -0.991 14.6-161.8-124.9 132.1 -16.5 44.1 163.6 74 117 A V 0 0 45 -2,-0.4 -13,-0.1 -13,-0.2 -14,-0.0 -0.640 360.0 360.0-109.8 71.5 -15.4 40.4 163.7 75 118 A A 0 0 125 -2,-0.6 -1,-0.1 -15,-0.2 -14,-0.1 0.386 360.0 360.0-149.2 360.0 -12.4 40.5 161.3 76 ! 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 77 139 A T 0 0 96 0, 0.0 11,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -52.5 -7.6 36.0 152.5 78 140 A I - 0 0 107 1,-0.1 131,-0.0 9,-0.1 105,-0.0 -0.548 360.0-163.7 -72.2 134.7 -4.1 34.9 151.5 79 141 A T > + 0 0 5 -2,-0.2 3,-1.1 3,-0.0 5,-0.3 0.702 50.4 114.3 -95.0 -24.0 -4.0 31.4 150.2 80 142 A E T 3 S+ 0 0 31 1,-0.2 -2,-0.1 2,-0.1 102,-0.0 -0.253 88.7 5.0 -53.1 128.5 -0.2 30.7 150.5 81 143 A D T 3 S+ 0 0 83 1,-0.1 -1,-0.2 3,-0.1 -3,-0.0 0.852 94.8 116.2 63.2 41.1 0.5 28.0 153.1 82 144 A S < - 0 0 70 -3,-1.1 -2,-0.1 2,-0.2 3,-0.1 0.676 68.6-138.6-104.7 -26.5 -3.1 27.1 153.8 83 145 A G + 0 0 36 -4,-0.3 2,-0.3 1,-0.3 -3,-0.1 0.465 65.7 120.8 76.6 4.0 -3.2 23.5 152.6 84 146 A S - 0 0 21 -5,-0.3 29,-0.4 2,-0.1 30,-0.4 -0.703 59.8-158.6-106.3 148.1 -6.6 24.4 151.1 85 147 A Y S S+ 0 0 0 -2,-0.3 26,-0.2 481,-0.2 24,-0.1 0.189 78.8 81.0 -99.1 13.3 -8.0 24.4 147.6 86 148 A T S S- 0 0 11 530,-0.1 -2,-0.1 24,-0.1 24,-0.1 -0.931 79.2-120.1-120.3 143.8 -10.7 26.9 148.7 87 149 A P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 -9,-0.1 -0.314 7.6-150.9 -75.7 163.5 -10.5 30.7 149.1 88 150 A G S S- 0 0 39 -11,-0.4 2,-0.3 1,-0.3 -10,-0.1 0.877 74.0 -2.6 -91.8 -66.0 -11.0 32.6 152.3 89 151 A T - 0 0 30 -12,-0.2 2,-0.4 10,-0.1 -1,-0.3 -0.978 58.7-155.9-136.4 145.6 -12.3 36.0 151.1 90 152 A I B +E 98 0D 5 8,-3.1 8,-2.3 -2,-0.3 3,-0.1 -0.979 19.7 167.9-126.3 127.3 -12.9 37.7 147.8 91 153 A A + 0 0 42 -2,-0.4 6,-0.1 6,-0.2 4,-0.1 -0.033 56.8 100.2-120.7 27.4 -12.9 41.4 146.9 92 154 A T S S+ 0 0 13 2,-0.1 102,-0.1 1,-0.1 -1,-0.1 0.832 77.8 50.9 -82.2 -34.7 -12.9 40.9 143.2 93 155 A A S S- 0 0 10 3,-0.2 101,-0.1 1,-0.1 -1,-0.1 0.952 136.3 -10.1 -71.5 -55.2 -16.6 41.5 142.5 94 156 A T S S- 0 0 2 2,-0.4 -2,-0.1 100,-0.1 3,-0.1 0.475 90.4-106.1-125.6 -11.1 -17.5 44.7 144.3 95 157 A R S S+ 0 0 19 1,-0.4 2,-0.4 -4,-0.1 -3,-0.1 0.034 85.2 123.2 94.8 -22.6 -14.3 45.5 146.4 96 158 A L S S- 0 0 11 1,-0.1 2,-1.0 315,-0.1 -1,-0.4 -0.596 72.5-119.2 -71.4 127.3 -16.3 44.5 149.5 97 159 A V + 0 0 86 -2,-0.4 2,-0.2 -6,-0.1 -6,-0.2 -0.564 52.5 161.3 -78.2 99.5 -14.4 41.7 151.3 98 160 A L B -E 90 0D 3 -8,-2.3 -8,-3.1 -2,-1.0 -3,-0.0 -0.746 41.3-112.3-121.5 161.8 -16.9 38.8 151.2 99 161 A T >> - 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