==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 07-OCT-10 3P51 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NITROSOSPIRA MULTIFORMIS; . AUTHOR A.KUZIN,Y.CHEN,J.SEETHARAMAN,S.SAHDEV,R.XIAO,C.CICCOSANTI,D. . 145 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7331.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 101 69.7 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 . 48 33.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 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 . 12 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 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 . 0 0 0 2 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A P 0 0 46 0, 0.0 112,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 173.9 18.1 30.4 52.5 2 3 A K E -A 112 0A 158 110,-0.2 2,-0.3 2,-0.0 110,-0.2 -0.985 360.0-155.6-151.6 160.3 17.7 28.3 55.7 3 4 A V E -A 111 0A 10 108,-2.3 108,-2.1 -2,-0.3 2,-0.3 -0.951 5.1-167.1-132.8 156.2 16.4 25.0 57.0 4 5 A Y E +A 110 0A 113 -2,-0.3 2,-0.4 106,-0.2 106,-0.2 -0.942 11.1 170.0-147.0 122.6 15.2 23.9 60.4 5 6 A N E +A 109 0A 14 104,-2.4 104,-2.7 -2,-0.3 2,-0.3 -0.994 3.9 172.5-135.3 144.7 14.7 20.3 61.5 6 7 A S E +A 108 0A 52 -2,-0.4 2,-0.3 102,-0.2 102,-0.2 -0.977 6.9 179.3-150.0 156.1 14.0 18.8 64.9 7 8 A I E -A 107 0A 44 100,-1.8 100,-2.8 -2,-0.3 2,-0.5 -0.962 28.8-117.8-148.6 161.9 13.1 15.6 66.7 8 9 A V E -A 106 0A 93 -2,-0.3 2,-0.5 98,-0.2 98,-0.2 -0.938 27.6-157.3-105.4 131.3 12.4 14.2 70.2 9 10 A V E -A 105 0A 1 96,-3.5 96,-2.4 -2,-0.5 2,-2.3 -0.924 18.4-129.9-113.3 128.2 14.9 11.5 71.4 10 11 A D S S+ 0 0 40 129,-1.1 94,-0.1 -2,-0.5 133,-0.0 -0.413 77.5 83.1 -80.0 69.4 13.9 9.0 74.1 11 12 A A S S- 0 0 0 -2,-2.3 -2,-0.2 94,-0.0 128,-0.1 -0.963 87.8 -86.5-160.9 153.5 17.0 9.4 76.3 12 13 A P >> - 0 0 24 0, 0.0 4,-2.0 0, 0.0 3,-0.8 -0.318 39.2-117.3 -67.3 151.1 18.1 11.9 79.0 13 14 A V H 3> S+ 0 0 3 91,-0.4 4,-2.9 1,-0.3 5,-0.2 0.825 112.5 59.1 -61.3 -34.6 19.8 15.0 77.7 14 15 A E H 3> S+ 0 0 117 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.863 108.7 46.0 -61.0 -37.2 23.1 14.2 79.5 15 16 A R H <> S+ 0 0 116 -3,-0.8 4,-1.4 2,-0.2 -2,-0.2 0.907 113.1 47.5 -72.8 -44.4 23.3 10.9 77.5 16 17 A V H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 3,-0.4 0.944 114.0 48.1 -62.6 -45.9 22.5 12.5 74.2 17 18 A W H X S+ 0 0 10 -4,-2.9 4,-2.1 1,-0.2 3,-0.2 0.937 106.3 56.9 -59.4 -46.3 25.0 15.3 74.7 18 19 A S H < S+ 0 0 80 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.845 110.4 47.0 -54.3 -32.6 27.7 12.8 75.8 19 20 A R H < S+ 0 0 64 -4,-1.4 -1,-0.2 -3,-0.4 3,-0.2 0.864 123.4 27.6 -78.2 -38.2 27.2 11.1 72.4 20 21 A I H < S+ 0 0 2 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.1 0.469 90.5 97.6-105.0 -2.4 27.2 14.1 70.1 21 22 A R < + 0 0 86 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.1 0.565 63.2 85.7 -73.2 -9.1 29.4 16.6 72.0 22 23 A N > - 0 0 45 3,-0.3 3,-2.1 -3,-0.2 23,-0.2 -0.827 62.4-156.8-102.2 111.5 32.6 15.9 70.1 23 24 A F T 3 S+ 0 0 1 21,-2.5 -1,-0.1 -2,-0.7 22,-0.1 0.767 97.3 48.2 -56.4 -25.3 33.1 17.8 66.8 24 25 A H T 3 S+ 0 0 35 1,-0.1 2,-0.6 -3,-0.1 -1,-0.3 0.434 98.2 75.1 -98.5 0.9 35.5 15.1 65.7 25 26 A D < + 0 0 62 -3,-2.1 -3,-0.3 19,-0.1 3,-0.2 -0.887 42.7 152.2-113.5 101.2 33.3 12.1 66.6 26 27 A F > + 0 0 7 -2,-0.6 3,-2.0 1,-0.1 7,-0.2 0.096 33.2 119.5-109.3 19.8 30.5 11.8 64.0 27 28 A S T 3 + 0 0 66 1,-0.3 -1,-0.1 -8,-0.1 -7,-0.1 0.620 61.0 75.1 -63.4 -11.1 30.1 8.0 64.5 28 29 A W T 3 S+ 0 0 7 1,-0.2 -1,-0.3 -3,-0.2 110,-0.2 0.505 92.7 51.3 -82.1 -5.5 26.5 8.6 65.7 29 30 A A <> + 0 0 0 -3,-2.0 4,-2.0 1,-0.1 3,-0.3 -0.535 62.6 155.2-127.1 67.9 25.3 9.2 62.1 30 31 A P T 4 + 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.675 61.3 70.9 -71.7 -17.9 26.6 6.2 60.2 31 32 A S T 4 S+ 0 0 67 99,-0.2 100,-0.1 1,-0.1 3,-0.1 0.967 120.1 9.9 -63.8 -54.0 23.9 6.4 57.4 32 33 A L T 4 S+ 0 0 39 -3,-0.3 2,-0.8 1,-0.1 -1,-0.1 0.835 119.1 71.2 -95.9 -37.6 25.2 9.5 55.7 33 34 A I < + 0 0 14 -4,-2.0 -1,-0.1 1,-0.2 3,-0.1 -0.722 47.7 163.7 -89.2 108.9 28.6 10.1 57.4 34 35 A K + 0 0 153 -2,-0.8 2,-0.3 1,-0.3 -1,-0.2 0.726 68.7 13.8 -94.9 -27.5 31.0 7.4 56.2 35 36 A S - 0 0 44 2,-0.0 19,-2.0 -9,-0.0 2,-0.4 -0.992 54.6-169.3-150.4 144.2 34.2 9.1 57.4 36 37 A C E -B 53 0A 33 -2,-0.3 2,-0.5 17,-0.2 17,-0.2 -0.894 14.9-172.2-137.5 103.6 35.1 12.0 59.6 37 38 A K E -B 52 0A 138 15,-2.9 15,-2.4 -2,-0.4 2,-0.2 -0.855 23.0-125.0-104.5 129.2 38.7 13.3 59.5 38 39 A K E -B 51 0A 122 -2,-0.5 2,-0.4 13,-0.2 13,-0.3 -0.452 29.7-171.3 -61.6 134.8 40.3 15.8 61.8 39 40 A V E -B 50 0A 54 11,-2.4 11,-1.4 -2,-0.2 -1,-0.0 -0.999 47.6 -2.5-133.8 136.0 41.9 18.8 60.0 40 41 A G S S- 0 0 48 -2,-0.4 10,-0.1 9,-0.1 2,-0.1 -0.094 98.2 -48.7 76.1 178.0 44.0 21.5 61.5 41 42 A G S S+ 0 0 59 7,-0.1 9,-0.2 8,-0.1 -2,-0.1 -0.291 89.7 67.7 -81.8 169.6 44.8 21.9 65.1 42 43 A G - 0 0 28 7,-0.1 8,-0.2 -2,-0.1 -3,-0.1 0.246 69.2-107.2 94.8 140.8 42.5 21.8 68.1 43 44 A G > - 0 0 39 6,-0.1 3,-1.8 4,-0.1 6,-0.2 -0.043 52.1 -66.9 -88.2-166.0 40.4 18.9 69.5 44 45 A G T 3 S+ 0 0 7 1,-0.3 -21,-2.5 -21,-0.1 -19,-0.1 0.520 133.7 35.9 -65.1 -7.7 36.7 18.1 69.5 45 46 A Y T 3 S+ 0 0 108 -23,-0.2 2,-0.7 -22,-0.1 -1,-0.3 0.173 90.2 112.6-127.1 15.2 35.7 21.1 71.6 46 47 A S X - 0 0 50 -3,-1.8 3,-2.6 17,-0.0 15,-0.2 -0.805 67.8-129.4 -98.2 111.8 38.2 23.6 70.3 47 48 A V T 3 S+ 0 0 82 -2,-0.7 15,-0.2 1,-0.3 3,-0.1 -0.386 99.3 38.8 -60.2 127.3 36.8 26.5 68.4 48 49 A G T 3 S+ 0 0 42 13,-2.1 -1,-0.3 1,-0.4 14,-0.1 0.095 85.2 133.2 113.2 -18.3 38.7 26.7 65.1 49 50 A A < - 0 0 0 -3,-2.6 12,-3.2 -6,-0.2 -1,-0.4 -0.268 39.8-157.4 -61.4 154.1 38.9 22.9 64.8 50 51 A R E -BC 39 60A 87 -11,-1.4 -11,-2.4 -8,-0.2 2,-0.3 -0.893 11.4-169.6-133.6 162.8 38.1 21.5 61.4 51 52 A R E -BC 38 59A 14 8,-2.3 8,-2.6 -2,-0.3 2,-0.5 -0.993 16.2-144.3-149.3 152.5 36.9 18.3 59.9 52 53 A L E -BC 37 58A 55 -15,-2.4 -15,-2.9 -2,-0.3 2,-0.4 -0.988 20.8-163.5-116.8 122.3 36.4 16.7 56.5 53 54 A L E >> S-BC 36 57A 6 4,-2.6 3,-2.6 -2,-0.5 4,-2.5 -0.889 70.2 -9.2-108.9 137.1 33.4 14.4 56.1 54 55 A N T 34 S- 0 0 44 -19,-2.0 -1,-0.2 -2,-0.4 -18,-0.1 0.726 117.7 -75.8 53.8 21.7 32.9 11.8 53.3 55 56 A G T 34 S+ 0 0 53 -20,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.646 130.6 61.7 69.2 15.5 36.0 13.4 51.7 56 57 A E T <4 S+ 0 0 86 -3,-2.6 2,-0.7 1,-0.2 -2,-0.2 0.578 75.5 78.8-147.4 -23.4 33.9 16.4 50.6 57 58 A F E < -C 53 0A 14 -4,-2.5 -4,-2.6 21,-0.2 2,-0.7 -0.874 55.5-167.7 -94.4 113.8 32.4 18.4 53.4 58 59 A L E -CD 52 77A 29 19,-1.8 18,-2.8 -2,-0.7 19,-1.3 -0.897 13.0-178.1-100.4 111.0 35.0 20.7 55.0 59 60 A D E -CD 51 75A 5 -8,-2.6 -8,-2.3 -2,-0.7 2,-0.4 -0.842 15.4-159.5-107.6 144.6 33.6 22.1 58.3 60 61 A T E -CD 50 74A 23 14,-2.3 14,-2.3 -2,-0.3 2,-0.5 -0.984 24.1-124.2-118.0 134.0 35.1 24.6 60.8 61 62 A L E + D 0 73A 1 -12,-3.2 -13,-2.1 -2,-0.4 12,-0.3 -0.644 35.0 169.5 -74.0 119.0 33.9 24.8 64.5 62 63 A I E + 0 0 68 10,-2.4 2,-0.3 -2,-0.5 11,-0.2 0.568 63.7 11.2-110.8 -14.9 32.9 28.5 65.0 63 64 A A E - D 0 72A 35 9,-1.7 9,-3.1 -17,-0.1 -1,-0.4 -0.940 57.8-175.8-161.5 145.5 31.2 28.3 68.3 64 65 A Y E - D 0 71A 44 -2,-0.3 2,-0.4 7,-0.2 7,-0.2 -0.994 2.4-171.8-144.5 133.7 30.8 25.7 71.1 65 66 A S E >> + D 0 70A 26 5,-2.7 5,-2.0 -2,-0.3 4,-0.7 -0.944 13.4 177.6-132.0 112.2 28.7 25.8 74.3 66 67 A E T 45S+ 0 0 109 -2,-0.4 -1,-0.1 3,-0.2 5,-0.0 0.890 90.3 50.9 -72.3 -40.8 28.9 23.2 77.0 67 68 A I T 45S+ 0 0 138 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 0.895 121.8 30.8 -68.0 -38.8 26.4 25.1 79.1 68 69 A E T 45S- 0 0 102 2,-0.1 28,-0.4 29,-0.0 -1,-0.2 0.504 104.9-126.8 -95.5 -5.4 23.9 25.5 76.3 69 70 A R T <5 + 0 0 58 -4,-0.7 27,-1.9 1,-0.2 2,-0.4 0.978 59.1 143.1 57.6 60.0 24.8 22.2 74.6 70 71 A R E < -DE 65 95A 65 -5,-2.0 -5,-2.7 25,-0.2 2,-0.4 -0.989 36.6-167.8-135.3 141.4 25.3 23.8 71.2 71 72 A I E -DE 64 94A 7 23,-2.4 23,-2.7 -2,-0.4 2,-0.4 -0.997 11.2-175.0-125.2 126.9 27.8 23.2 68.4 72 73 A X E +DE 63 93A 48 -9,-3.1 -10,-2.4 -2,-0.4 -9,-1.7 -0.976 9.1 167.4-124.5 141.9 28.0 25.8 65.5 73 74 A Y E -DE 61 92A 10 19,-2.1 19,-3.1 -2,-0.4 2,-0.4 -0.982 31.3-125.4-148.6 155.4 30.1 25.4 62.4 74 75 A S E -DE 60 91A 25 -14,-2.3 -14,-2.3 -2,-0.3 2,-0.8 -0.818 21.4-136.2 -95.2 141.8 30.7 26.9 59.0 75 76 A X E +D 59 0A 18 15,-1.2 15,-0.4 -2,-0.4 -16,-0.2 -0.888 26.2 177.2 -94.0 106.7 30.6 24.6 56.0 76 77 A D E + 0 0 47 -18,-2.8 2,-0.3 -2,-0.8 -17,-0.2 0.783 66.3 10.6 -84.2 -31.2 33.7 25.8 54.0 77 78 A E E +D 58 0A 93 -19,-1.3 -19,-1.8 6,-0.1 -1,-0.2 -0.990 69.8 153.5-143.1 153.4 33.5 23.2 51.2 78 79 A G - 0 0 10 -2,-0.3 6,-0.3 -21,-0.2 -21,-0.2 -0.977 43.9 -83.0-167.0 167.0 30.8 20.7 50.1 79 80 A P S > S- 0 0 27 0, 0.0 3,-2.7 0, 0.0 -23,-0.0 -0.377 73.4 -49.4 -72.4 155.3 29.4 18.8 47.1 80 81 A S T 3 S+ 0 0 76 1,-0.3 4,-0.0 2,-0.3 0, 0.0 -0.379 126.5 34.9 -55.1 140.1 27.0 20.5 44.8 81 82 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.3 0, 0.0 39,-0.2 -0.921 130.0 39.9 -94.0 19.7 24.5 22.0 45.5 82 83 A V S < S+ 0 0 2 -3,-2.7 -2,-0.3 37,-0.1 8,-0.1 -0.036 82.8 133.1-112.6 32.2 26.3 23.3 48.6 83 84 A S S >> S- 0 0 32 -6,-0.1 4,-2.0 1,-0.1 3,-1.4 -0.357 71.8-109.5 -74.2 162.9 29.8 23.8 47.0 84 85 A S T 34 S+ 0 0 70 -6,-0.3 -1,-0.1 1,-0.3 -7,-0.1 0.620 117.4 63.6 -71.8 -10.4 31.6 27.1 47.7 85 86 A G T 34 S+ 0 0 77 1,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.688 112.9 32.1 -82.6 -20.2 30.9 28.1 44.1 86 87 A E T <4 S+ 0 0 59 -3,-1.4 30,-0.6 1,-0.2 31,-0.3 0.694 123.7 27.6-113.1 -22.1 27.2 28.1 44.7 87 88 A I E < - F 0 115A 10 -4,-2.0 2,-0.3 28,-0.1 28,-0.2 -0.909 58.9-166.7-131.8 164.5 26.7 29.2 48.3 88 89 A Y E + F 0 114A 140 26,-2.2 26,-2.9 -2,-0.3 -12,-0.1 -0.972 63.1 26.6-145.0 163.3 28.5 31.3 50.9 89 90 A N E + 0 0 118 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.874 69.6 180.0 53.7 43.9 28.4 31.9 54.7 90 91 A Y E - 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