==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN, TRANSPORT PROTEIN 05-OCT-12 4HFI . COMPND 2 MOLECULE: PROTON-GATED ION CHANNEL; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOEOBACTER VIOLACEUS; . AUTHOR L.SAUGUET,P.J.CORRINGER,M.DELARUE . 1555 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 62775.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1172 75.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 379 24.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 1.0 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 . 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 . 150 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 455 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.4 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 10 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 5 RESIDUES PER ALPHA HELIX . 0 5 0 0 5 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 . 10 5 5 0 0 0 0 5 0 5 5 1 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 5 0 0 5 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 5 A V 0 0 144 0, 0.0 66,-0.1 0, 0.0 68,-0.0 0.000 360.0 360.0 360.0 145.0 27.6 -7.7 -8.8 2 6 A S - 0 0 65 1,-0.1 66,-0.2 66,-0.0 0, 0.0 -0.885 360.0 -85.6-132.0 159.3 28.7 -4.1 -8.3 3 7 A P - 0 0 11 0, 0.0 -1,-0.1 0, 0.0 42,-0.0 -0.239 57.6 -83.2 -65.9 159.2 28.0 -1.5 -5.5 4 8 A P - 0 0 3 0, 0.0 8,-0.1 0, 0.0 40,-0.0 -0.367 51.2-114.8 -61.1 135.6 24.8 0.7 -5.6 5 9 A P - 0 0 74 0, 0.0 2,-0.2 0, 0.0 41,-0.2 -0.477 29.3-110.7 -73.7 144.8 25.3 3.8 -7.9 6 10 A P - 0 0 46 0, 0.0 6,-0.0 0, 0.0 0, 0.0 -0.554 11.6-147.7 -77.1 138.7 25.3 7.2 -6.2 7 11 A I S S- 0 0 123 -2,-0.2 0, 0.0 3,-0.0 0, 0.0 0.878 93.4 -6.7 -67.2 -39.0 22.3 9.6 -7.0 8 12 A A S S- 0 0 81 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.664 115.8 -67.6-116.6 -79.7 24.6 12.7 -6.6 9 13 A D S S+ 0 0 142 2,-0.1 0, 0.0 125,-0.0 0, 0.0 0.141 84.0 140.7-164.2 8.5 28.2 11.9 -5.3 10 14 A E - 0 0 56 1,-0.1 125,-0.1 124,-0.1 2,-0.1 -0.099 54.5-109.4 -62.4 149.6 27.3 10.8 -1.8 11 15 A P - 0 0 59 0, 0.0 2,-0.6 0, 0.0 125,-0.2 -0.471 37.3-101.6 -78.5 156.0 29.1 8.0 0.0 12 16 A L E -a 136 0A 7 123,-2.9 125,-2.9 -2,-0.1 2,-0.6 -0.686 34.2-145.1 -79.3 121.4 27.1 4.7 0.6 13 17 A T E -a 137 0A 63 -2,-0.6 2,-0.6 123,-0.2 31,-0.4 -0.784 11.7-166.9 -89.0 119.5 25.9 4.6 4.3 14 18 A V E -a 138 0A 0 123,-2.7 125,-2.2 -2,-0.6 2,-0.3 -0.947 13.2-147.6-108.1 108.7 25.9 1.1 5.8 15 19 A N E -aB 139 42A 58 27,-3.4 27,-1.9 -2,-0.6 2,-0.3 -0.648 21.4-165.0 -77.9 131.7 24.0 1.1 9.1 16 20 A T E +aB 140 41A 0 123,-2.9 125,-2.9 -2,-0.3 2,-0.3 -0.829 17.4 176.2-121.4 162.1 25.4 -1.4 11.6 17 21 A G E - B 0 40A 0 23,-1.3 23,-2.7 -2,-0.3 2,-0.4 -0.957 12.9-157.4-161.3 142.1 24.4 -3.1 14.8 18 22 A I E - B 0 39A 0 -2,-0.3 128,-2.0 21,-0.2 2,-0.5 -0.998 6.2-170.8-126.3 123.6 25.9 -5.8 17.1 19 23 A Y E -cB 146 38A 44 19,-2.3 19,-2.7 -2,-0.4 2,-0.3 -0.951 20.8-137.8-117.1 108.6 23.7 -7.8 19.5 20 24 A L E +cB 147 37A 0 126,-2.3 128,-2.7 -2,-0.5 17,-0.2 -0.478 30.1 167.4 -70.2 124.5 25.7 -9.9 22.0 21 25 A I E S+ 0 0 11 15,-2.6 2,-0.3 1,-0.4 16,-0.2 0.776 71.1 12.1-100.5 -45.6 24.4 -13.5 22.5 22 26 A E E - B 0 36A 10 14,-2.6 14,-2.5 129,-0.1 2,-0.4 -0.999 53.5-172.6-140.9 141.9 27.4 -14.9 24.4 23 27 A C E + B 0 35A 0 129,-0.4 129,-0.3 -2,-0.3 2,-0.3 -0.998 30.4 145.7-130.6 123.2 30.6 -13.5 26.0 24 28 A Y E + B 0 34A 11 10,-2.1 10,-2.9 -2,-0.4 129,-0.1 -0.956 36.4 37.4-154.3 167.9 33.2 -16.0 27.2 25 29 A S E - 0 0 52 -2,-0.3 2,-1.1 8,-0.2 -1,-0.1 0.876 51.2-173.2 51.6 57.7 36.9 -16.8 27.7 26 30 A L E - 0 0 22 128,-0.2 2,-0.7 7,-0.2 7,-0.2 -0.722 11.3-162.8 -79.0 105.0 38.4 -13.5 28.8 27 31 A D E >> - B 0 32A 70 5,-2.4 5,-1.6 -2,-1.1 4,-1.4 -0.862 12.0-169.1 -94.4 109.0 42.0 -14.5 28.7 28 32 A D T 45S+ 0 0 24 -2,-0.7 82,-0.2 2,-0.2 -1,-0.2 0.888 86.9 48.6 -65.0 -44.3 44.1 -11.9 30.7 29 33 A K T 45S+ 0 0 100 1,-0.2 -1,-0.2 213,-0.1 215,-0.1 0.912 120.5 36.2 -63.1 -46.5 47.5 -13.3 29.6 30 34 A A T 45S- 0 0 31 2,-0.1 -1,-0.2 213,-0.1 -2,-0.2 0.636 101.5-134.2 -80.7 -18.5 46.5 -13.3 25.8 31 35 A E T <5 + 0 0 16 -4,-1.4 77,-2.5 1,-0.2 2,-0.3 0.883 64.0 123.5 60.2 43.3 44.4 -10.1 26.2 32 36 A T E < -BD 27 107A 1 -5,-1.6 -5,-2.4 75,-0.2 2,-0.3 -0.845 42.2-170.0-127.8 162.9 41.6 -11.8 24.3 33 37 A F E - D 0 106A 2 73,-1.4 73,-3.0 -2,-0.3 2,-0.3 -0.971 21.6-126.3-150.9 146.4 37.9 -12.6 24.7 34 38 A K E -BD 24 105A 53 -10,-2.9 -10,-2.1 -2,-0.3 2,-0.3 -0.781 25.7-168.9 -99.3 143.3 35.5 -14.7 22.7 35 39 A V E -BD 23 104A 1 69,-2.5 69,-2.3 -2,-0.3 2,-0.4 -0.985 17.5-169.2-134.8 142.9 32.2 -13.3 21.4 36 40 A N E +BD 22 103A 6 -14,-2.5 -15,-2.6 -2,-0.3 -14,-2.6 -0.989 36.6 142.7-129.1 113.7 29.0 -14.8 19.8 37 41 A A E -BD 20 102A 0 65,-2.5 65,-3.3 -2,-0.4 2,-0.4 -0.944 51.2-101.9-148.4 170.2 26.7 -12.2 18.4 38 42 A F E -BD 19 101A 4 -19,-2.7 -19,-2.3 -2,-0.3 2,-0.5 -0.823 28.4-158.3 -94.7 135.0 24.3 -11.0 15.7 39 43 A L E -BD 18 100A 0 61,-3.2 61,-2.3 -2,-0.4 2,-0.4 -0.986 9.5-165.2-115.7 118.3 25.7 -8.5 13.2 40 44 A S E -BD 17 99A 9 -23,-2.7 -23,-1.3 -2,-0.5 2,-0.3 -0.883 5.1-173.0-106.2 136.4 23.0 -6.4 11.4 41 45 A L E -BD 16 98A 5 57,-2.7 57,-3.5 -2,-0.4 2,-0.3 -0.986 3.8-179.6-130.0 140.5 23.7 -4.5 8.2 42 46 A S E +BD 15 97A 20 -27,-1.9 -27,-3.4 -2,-0.3 2,-0.3 -0.986 11.5 148.8-144.8 131.6 21.4 -2.0 6.3 43 47 A W E - D 0 96A 5 53,-1.1 53,-3.0 -2,-0.3 2,-0.5 -0.974 43.3-103.6-154.6 161.3 21.9 0.1 3.1 44 48 A K E + D 0 95A 74 -31,-0.4 2,-0.4 -2,-0.3 51,-0.2 -0.821 30.7 174.8 -96.0 120.9 20.0 1.5 0.1 45 49 A D > - 0 0 3 49,-3.1 3,-1.8 -2,-0.5 4,-0.2 -0.886 9.4-171.2-126.4 94.6 20.3 -0.3 -3.2 46 50 A R G > S+ 0 0 115 -2,-0.4 3,-1.6 1,-0.3 -1,-0.1 0.747 82.0 67.9 -56.1 -30.7 17.9 1.4 -5.7 47 51 A R G 3 S+ 0 0 111 1,-0.3 -1,-0.3 47,-0.1 47,-0.1 0.634 100.1 52.2 -65.0 -16.7 18.4 -1.4 -8.4 48 52 A L G < S+ 0 0 23 -3,-1.8 46,-0.3 46,-0.1 -1,-0.3 0.417 83.7 122.6 -98.6 -4.5 16.6 -3.7 -5.9 49 53 A A < + 0 0 50 -3,-1.6 2,-0.3 44,-0.3 44,-0.2 -0.270 37.9 178.3 -62.4 144.4 13.5 -1.3 -5.6 50 54 A F - 0 0 26 42,-2.5 44,-0.1 41,-0.2 -2,-0.1 -0.950 33.5-109.2-145.0 162.5 10.1 -2.7 -6.5 51 55 A D > - 0 0 55 -2,-0.3 4,-1.9 1,-0.1 6,-0.3 -0.833 21.1-150.8 -93.7 126.6 6.4 -1.8 -6.6 52 56 A P H >>S+ 0 0 50 0, 0.0 4,-2.0 0, 0.0 5,-0.5 0.877 95.3 51.6 -66.9 -35.4 4.3 -3.7 -3.8 53 57 A V H 45S+ 0 0 131 2,-0.2 5,-0.0 1,-0.2 -2,-0.0 0.927 113.8 42.7 -64.1 -50.2 1.1 -3.6 -5.9 54 58 A R H 45S+ 0 0 211 1,-0.2 -1,-0.2 2,-0.1 -4,-0.0 0.894 120.6 40.5 -63.8 -47.3 2.8 -5.1 -9.1 55 59 A S H <5S- 0 0 47 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.768 96.9-135.2 -74.8 -32.2 4.8 -7.8 -7.2 56 60 A G T <5S+ 0 0 66 -4,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.623 73.3 93.6 81.3 16.4 2.1 -8.8 -4.7 57 61 A V < - 0 0 65 -5,-0.5 -1,-0.3 -6,-0.3 -2,-0.2 -0.958 60.5-156.0-136.8 151.8 4.7 -8.7 -1.8 58 62 A R S S+ 0 0 206 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.557 86.6 34.9-101.3 -14.4 5.8 -6.1 0.8 59 63 A V - 0 0 57 32,-0.1 2,-0.4 -7,-0.1 32,-0.2 -0.982 67.4-148.8-140.7 148.2 9.2 -7.7 1.3 60 64 A K E -E 90 0A 64 30,-2.0 30,-2.3 -2,-0.3 2,-0.5 -0.985 9.4-152.8-124.6 124.5 11.8 -9.6 -0.9 61 65 A T E +E 89 0A 94 -2,-0.4 2,-0.2 28,-0.2 28,-0.2 -0.872 19.4 180.0-100.7 121.9 14.1 -12.4 0.4 62 66 A Y - 0 0 70 26,-1.0 26,-0.3 -2,-0.5 -2,-0.0 -0.732 28.8-118.1-115.8 165.6 17.4 -12.9 -1.4 63 67 A E >> - 0 0 126 -2,-0.2 3,-1.3 1,-0.1 4,-0.8 -0.767 37.0-111.3 -96.4 145.4 20.4 -15.3 -1.1 64 68 A P G >4 S+ 0 0 40 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.818 117.5 51.9 -48.9 -37.3 23.8 -13.5 -0.3 65 69 A E G 34 S+ 0 0 140 1,-0.2 4,-0.1 3,-0.1 -3,-0.0 0.750 100.1 63.8 -69.9 -29.1 25.2 -14.4 -3.8 66 70 A A G <4 S+ 0 0 62 -3,-1.3 2,-0.2 2,-0.0 -1,-0.2 0.746 108.8 34.5 -68.4 -30.0 22.1 -13.0 -5.6 67 71 A I S << S- 0 0 7 -4,-0.8 2,-0.3 -3,-0.5 -19,-0.0 -0.798 91.2 -90.9-125.3 167.9 22.8 -9.4 -4.5 68 72 A W - 0 0 26 -2,-0.2 -3,-0.1 -66,-0.2 -2,-0.0 -0.641 42.2-175.5 -78.2 131.4 25.6 -6.9 -3.7 69 73 A I - 0 0 40 -2,-0.3 2,-0.1 -4,-0.1 0, 0.0 -0.996 28.5-111.5-129.2 131.1 26.7 -7.1 0.0 70 74 A P - 0 0 5 0, 0.0 2,-1.5 0, 0.0 -27,-0.0 -0.379 28.9-118.1 -64.4 139.6 29.3 -4.7 1.6 71 75 A E - 0 0 100 58,-0.2 58,-0.6 1263,-0.1 2,-0.5 -0.664 41.5-177.0 -79.3 88.2 32.6 -6.5 2.7 72 76 A I E +H 128 0B 7 -2,-1.5 2,-0.3 56,-0.1 56,-0.2 -0.802 4.2 175.5 -92.7 128.4 32.4 -5.8 6.4 73 77 A R E -H 127 0B 32 54,-2.8 54,-3.0 -2,-0.5 2,-0.4 -0.869 30.3-118.9-129.1 163.8 35.3 -6.9 8.5 74 78 A F E -H 126 0B 5 -2,-0.3 3,-0.4 52,-0.2 52,-0.2 -0.877 14.2-157.2-102.1 135.2 36.5 -6.7 12.1 75 79 A V S S+ 0 0 12 50,-2.6 2,-0.9 -2,-0.4 -1,-0.2 0.979 86.6 46.6 -71.6 -60.0 39.9 -5.0 12.8 76 80 A N S S+ 0 0 4 49,-0.2 31,-3.1 31,-0.1 2,-0.3 -0.292 83.4 118.1 -86.6 49.4 40.8 -6.6 16.1 77 81 A V B -F 106 0A 5 -2,-0.9 29,-0.2 -3,-0.4 3,-0.1 -0.895 60.3-139.0-115.5 145.3 40.1 -10.3 15.5 78 82 A E S S- 0 0 11 27,-2.1 2,-0.3 -2,-0.3 -1,-0.2 0.984 91.3 -0.1 -60.9 -58.8 42.7 -13.3 15.6 79 83 A N S S- 0 0 77 26,-0.2 26,-0.3 1,-0.1 -1,-0.1 -0.784 102.6 -71.3-123.9 165.3 41.1 -14.9 12.5 80 84 A A - 0 0 53 -2,-0.3 -1,-0.1 1250,-0.1 25,-0.1 -0.291 67.2 -90.2 -57.7 141.3 38.2 -13.9 10.3 81 85 A R - 0 0 53 1,-0.1 2,-0.9 23,-0.1 23,-0.2 -0.164 29.4-120.6 -55.4 145.3 34.8 -14.3 12.0 82 86 A D E - G 0 103A 79 21,-2.6 21,-1.6 -3,-0.1 2,-0.4 -0.848 49.0-178.1 -87.2 104.1 32.9 -17.6 11.7 83 87 A A E - G 0 102A 40 -2,-0.9 2,-0.4 19,-0.2 19,-0.2 -0.927 26.8-173.6-120.3 143.2 29.7 -16.2 10.2 84 88 A D E - G 0 101A 90 17,-2.4 17,-2.6 -2,-0.4 2,-0.3 -0.998 28.8-126.2-129.5 122.1 26.3 -17.7 9.1 85 89 A V E - G 0 100A 52 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.543 25.8-179.9 -70.2 127.5 23.7 -15.5 7.2 86 90 A V E - 0 0 8 13,-3.1 2,-0.3 1,-0.3 14,-0.2 0.849 61.6 -11.6 -93.4 -51.5 20.4 -15.6 9.0 87 91 A D E - G 0 99A 20 12,-1.8 12,-2.3 2,-0.0 2,-0.4 -0.994 42.3-164.7-157.2 148.5 18.3 -13.3 6.7 88 92 A I E + G 0 98A 3 -2,-0.3 -26,-1.0 -26,-0.3 2,-0.4 -0.988 22.6 178.3-132.8 116.6 18.4 -10.8 3.8 89 93 A S E -EG 61 97A 3 8,-2.3 8,-2.8 -2,-0.4 2,-0.4 -0.989 14.0-158.2-127.6 134.5 15.2 -8.7 3.3 90 94 A V E -EG 60 96A 0 -30,-2.3 -30,-2.0 -2,-0.4 6,-0.2 -0.955 9.0-149.6-115.8 126.5 14.5 -5.9 0.8 91 95 A S > - 0 0 30 4,-2.0 3,-2.2 -2,-0.4 -41,-0.2 -0.437 38.5 -95.1 -84.4 164.3 11.8 -3.2 1.3 92 96 A P T 3 S+ 0 0 39 0, 0.0 -42,-2.5 0, 0.0 -33,-0.1 0.795 124.7 54.1 -53.4 -31.7 10.0 -1.7 -1.8 93 97 A D T 3 S- 0 0 74 -44,-0.2 -44,-0.3 2,-0.1 -45,-0.1 0.276 125.5 -98.8 -85.8 9.7 12.4 1.3 -1.9 94 98 A G < + 0 0 0 -3,-2.2 -49,-3.1 -46,-0.3 2,-0.7 0.680 68.5 155.3 81.3 21.4 15.5 -0.9 -2.0 95 99 A T E -D 44 0A 42 -51,-0.2 -4,-2.0 -4,-0.1 2,-0.3 -0.744 31.8-150.4 -82.7 111.2 16.4 -0.8 1.7 96 100 A V E -DG 43 90A 0 -53,-3.0 -53,-1.1 -2,-0.7 2,-0.5 -0.700 9.9-162.6 -87.5 134.7 18.3 -4.0 2.4 97 101 A Q E -DG 42 89A 88 -8,-2.8 -8,-2.3 -2,-0.3 2,-0.4 -0.965 12.3-174.2-120.4 107.2 18.2 -5.6 5.9 98 102 A Y E -DG 41 88A 19 -57,-3.5 -57,-2.7 -2,-0.5 2,-0.4 -0.866 4.2-177.9-104.1 137.2 21.1 -8.1 6.4 99 103 A L E +DG 40 87A 13 -12,-2.3 -13,-3.1 -2,-0.4 -12,-1.8 -0.983 5.7 168.0-140.7 125.6 21.4 -10.3 9.5 100 104 A E E -DG 39 85A 3 -61,-2.3 -61,-3.2 -2,-0.4 2,-0.5 -0.959 27.0-138.6-131.7 150.5 24.2 -12.8 10.4 101 105 A R E +DG 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