==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 11-FEB-03 1NXZ . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN HI0303; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR F.FOROUHAR,J.SHEN,R.XIAO,T.B.ACTON,B.ROST,G.T.MONTELIONE, . 491 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22331.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 313 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 67 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 8.4 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 . 34 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 24.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.8 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 0 1 1 1 1 2 2 0 0 0 0 1 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 5 4 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 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 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 R 0 0 219 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.8 32.4 84.0 22.4 2 3 A I - 0 0 54 1,-0.1 37,-0.1 37,-0.1 2,-0.1 -0.712 360.0-116.3 -88.5 128.1 32.1 84.8 18.7 3 4 A P - 0 0 39 0, 0.0 37,-2.4 0, 0.0 2,-0.4 -0.370 25.2-132.9 -65.1 138.2 28.7 86.4 17.6 4 5 A R E -a 40 0A 19 135,-0.2 2,-0.4 35,-0.2 37,-0.2 -0.771 21.8-170.4 -95.0 136.1 26.6 84.3 15.2 5 6 A I E -a 41 0A 3 35,-2.2 37,-1.5 -2,-0.4 2,-0.3 -0.980 15.1-138.8-132.9 125.2 25.1 86.0 12.1 6 7 A Y E -a 42 0A 46 -2,-0.4 14,-0.4 35,-0.2 37,-0.2 -0.605 14.4-152.5 -81.4 136.5 22.5 84.6 9.6 7 8 A H - 0 0 15 35,-2.5 4,-0.1 -2,-0.3 12,-0.1 -0.948 13.0-138.5-115.5 127.8 23.0 85.2 5.9 8 9 A P S S+ 0 0 82 0, 0.0 2,-0.3 0, 0.0 35,-0.1 0.445 83.7 38.4 -56.9 -10.5 20.0 85.4 3.5 9 10 A I S S- 0 0 115 0, 0.0 -2,-0.1 0, 0.0 35,-0.0 -0.977 100.8 -73.2-146.1 159.1 21.7 83.4 0.8 10 11 A S - 0 0 61 -2,-0.3 34,-0.0 1,-0.2 32,-0.0 -0.261 30.8-171.0 -54.4 127.4 24.1 80.5 0.3 11 12 A L > + 0 0 2 -4,-0.1 3,-1.6 3,-0.1 -1,-0.2 0.295 40.3 135.4-100.0 4.0 27.7 81.3 1.3 12 13 A E T 3 S- 0 0 87 1,-0.3 3,-0.1 31,-0.0 56,-0.0 -0.350 80.9 -1.2 -59.2 125.4 28.9 78.0 -0.1 13 14 A N T 3 S+ 0 0 152 1,-0.2 2,-0.4 -2,-0.1 -1,-0.3 0.877 100.6 137.9 60.5 39.4 32.0 78.6 -2.2 14 15 A Q < - 0 0 98 -3,-1.6 -1,-0.2 1,-0.1 3,-0.1 -0.937 39.3-168.2-116.2 139.9 31.9 82.3 -1.5 15 16 A T S S+ 0 0 109 -2,-0.4 50,-2.3 1,-0.3 2,-0.3 0.820 72.3 3.3 -94.2 -38.3 35.0 84.3 -0.7 16 17 A Q E +B 64 0A 97 48,-0.3 -1,-0.3 35,-0.0 2,-0.3 -0.977 64.0 167.8-146.7 157.1 33.5 87.6 0.5 17 18 A C E -B 63 0A 18 46,-1.8 46,-2.8 -2,-0.3 2,-0.5 -0.982 34.1-110.9-162.4 165.4 30.0 89.0 1.0 18 19 A Y E -B 62 0A 125 -2,-0.3 44,-0.2 44,-0.2 3,-0.1 -0.902 38.8-120.4-104.2 134.1 28.0 91.9 2.5 19 20 A L - 0 0 11 42,-2.3 42,-0.3 -2,-0.5 -12,-0.1 -0.328 39.2 -90.4 -69.1 156.7 25.9 91.1 5.6 20 21 A S > - 0 0 35 -14,-0.4 4,-3.2 1,-0.1 5,-0.2 -0.071 42.0 -99.4 -59.8 169.2 22.2 91.7 5.3 21 22 A E H > S+ 0 0 141 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.926 124.6 44.8 -59.0 -47.7 20.8 95.1 6.4 22 23 A D H > S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.933 116.5 45.9 -64.2 -45.0 19.7 93.8 9.8 23 24 A A H > S+ 0 0 5 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.916 111.9 51.6 -63.7 -43.7 23.0 91.9 10.4 24 25 A A H X S+ 0 0 11 -4,-3.2 4,-3.1 1,-0.2 5,-0.5 0.937 111.1 47.5 -59.1 -48.2 25.0 94.9 9.2 25 26 A N H X>S+ 0 0 45 -4,-2.4 4,-2.1 -5,-0.2 5,-1.6 0.910 113.7 48.1 -60.1 -42.2 23.2 97.2 11.6 26 27 A H H <>S+ 0 0 72 -4,-2.3 5,-3.1 3,-0.2 6,-0.4 0.936 117.5 41.3 -63.9 -46.0 23.6 94.8 14.5 27 28 A V H <5S+ 0 0 0 -4,-2.9 6,-2.5 3,-0.2 -2,-0.2 0.919 126.3 31.0 -67.4 -48.3 27.4 94.3 13.8 28 29 A A H <5S+ 0 0 18 -4,-3.1 -3,-0.2 4,-0.2 -2,-0.2 0.869 133.1 25.4 -81.7 -41.3 28.3 97.9 13.0 29 30 A R T <5S+ 0 0 200 -4,-2.1 -3,-0.2 -5,-0.5 -2,-0.1 0.888 129.0 33.4 -93.1 -46.6 25.8 99.9 15.2 30 31 A V T - 0 0 84 -2,-0.2 3,-1.4 1,-0.2 19,-0.2 -0.420 37.9 -68.0 -96.5 176.0 35.9 97.0 13.9 35 36 A E T 3 S+ 0 0 89 1,-0.2 19,-0.2 21,-0.2 -1,-0.2 -0.328 117.7 37.8 -64.2 144.7 37.7 95.3 11.0 36 37 A G T 3 S+ 0 0 38 17,-2.5 -1,-0.2 1,-0.4 2,-0.2 0.269 82.5 132.8 97.7 -11.3 39.5 92.1 11.9 37 38 A E < - 0 0 92 -3,-1.4 16,-2.1 1,-0.1 -1,-0.4 -0.491 57.1-120.1 -73.8 143.3 36.9 90.9 14.3 38 39 A Q E - C 0 52A 107 14,-0.2 2,-0.3 -2,-0.2 14,-0.2 -0.578 31.0-177.5 -84.9 148.4 35.8 87.3 13.9 39 40 A L E - C 0 51A 2 12,-2.4 12,-3.1 -2,-0.2 2,-0.6 -0.955 22.3-139.0-139.4 154.2 32.2 86.4 13.1 40 41 A E E -aC 4 50A 34 -37,-2.4 -35,-2.2 -2,-0.3 2,-0.2 -0.903 28.3-173.4-119.9 100.2 30.4 83.0 12.8 41 42 A L E -aC 5 49A 0 8,-1.9 8,-3.2 -2,-0.6 2,-0.3 -0.495 8.7-175.3 -91.8 162.1 28.0 83.1 9.9 42 43 A F E -aC 6 48A 0 -37,-1.5 -35,-2.5 6,-0.2 6,-0.2 -0.967 17.0-161.7-154.3 142.3 25.5 80.5 8.7 43 44 A D - 0 0 15 4,-0.6 5,-0.1 -2,-0.3 103,-0.1 0.280 58.3 -92.7-111.9 10.1 23.2 80.3 5.7 44 45 A G S S+ 0 0 28 100,-0.4 102,-0.2 3,-0.4 100,-0.1 0.576 98.4 111.9 90.3 11.3 20.7 77.7 6.8 45 46 A S S S- 0 0 40 2,-0.3 100,-0.2 100,-0.1 3,-0.1 0.288 97.2-103.7 -97.5 8.2 22.5 74.8 5.2 46 47 A N S S+ 0 0 27 98,-2.4 25,-2.1 1,-0.3 2,-0.3 0.568 91.7 109.9 79.4 8.2 23.4 73.3 8.6 47 48 A H E - D 0 70A 38 97,-0.4 -4,-0.6 23,-0.2 -3,-0.4 -0.850 59.1-142.4-117.7 153.9 26.9 74.7 8.1 48 49 A I E -CD 42 69A 17 21,-2.6 21,-2.3 -2,-0.3 -6,-0.2 -0.854 6.0-155.8-112.1 150.5 28.9 77.5 9.8 49 50 A Y E -C 41 0A 1 -8,-3.2 -8,-1.9 -2,-0.3 19,-0.2 -0.871 11.3-147.1-126.9 94.1 31.3 79.9 8.0 50 51 A P E +C 40 0A 37 0, 0.0 16,-2.5 0, 0.0 17,-0.8 -0.450 33.7 171.9 -62.3 132.5 33.9 81.4 10.2 51 52 A A E -CE 39 65A 1 -12,-3.1 -12,-2.4 14,-0.2 2,-0.4 -0.862 29.0-137.6-137.7 172.2 34.6 84.9 8.8 52 53 A K E -CE 38 64A 86 12,-1.7 12,-2.9 -2,-0.3 2,-0.2 -0.997 27.0-114.5-135.9 138.2 36.4 88.2 9.5 53 54 A I E + E 0 63A 3 -16,-2.1 -17,-2.5 -2,-0.4 10,-0.3 -0.509 30.5 174.5 -69.9 134.4 35.2 91.7 8.9 54 55 A I E S+ 0 0 59 8,-2.6 2,-0.2 1,-0.4 9,-0.2 0.357 73.7 20.7-119.7 -2.4 37.2 93.5 6.2 55 56 A E E + E 0 62A 71 7,-1.3 7,-2.6 -21,-0.1 2,-0.4 -0.763 63.8 176.1-169.1 118.4 35.1 96.6 6.2 56 57 A S E + E 0 61A 23 -2,-0.2 2,-0.3 5,-0.2 5,-0.2 -0.977 16.9 143.3-133.0 121.3 32.8 98.0 8.9 57 58 A N E > - E 0 60A 65 3,-2.0 3,-1.5 -2,-0.4 -29,-0.1 -0.900 62.7 -77.1-146.1 174.9 30.9 101.4 8.7 58 59 A K T 3 S+ 0 0 177 -2,-0.3 -29,-0.1 1,-0.3 3,-0.1 0.742 126.0 15.7 -46.9 -33.7 27.6 103.1 9.6 59 60 A K T 3 S+ 0 0 130 1,-0.2 -1,-0.3 -31,-0.1 2,-0.2 -0.058 121.4 48.2-138.4 40.8 25.7 101.5 6.7 60 61 A S E < - E 0 57A 32 -3,-1.5 -3,-2.0 -36,-0.2 2,-0.5 -0.781 47.3-170.6-177.2 128.3 27.8 98.6 5.3 61 62 A V E - E 0 56A 2 -42,-0.3 -42,-2.3 -2,-0.2 2,-0.4 -0.946 10.2-171.5-130.8 113.9 29.6 95.5 6.6 62 63 A K E -BE 18 55A 49 -7,-2.6 -8,-2.6 -2,-0.5 -7,-1.3 -0.830 9.0-171.5-103.9 141.2 31.8 93.4 4.3 63 64 A V E -BE 17 53A 0 -46,-2.8 -46,-1.8 -2,-0.4 2,-0.5 -0.928 22.1-131.5-133.8 157.2 33.3 90.1 5.4 64 65 A E E -BE 16 52A 82 -12,-2.9 -12,-1.7 -2,-0.3 2,-0.6 -0.937 23.8-134.5-109.8 121.3 35.7 87.5 4.2 65 66 A I E - E 0 51A 19 -50,-2.3 -14,-0.2 -2,-0.5 3,-0.1 -0.646 22.9-178.8 -76.1 116.7 34.6 83.9 4.4 66 67 A L - 0 0 87 -16,-2.5 2,-0.3 -2,-0.6 -15,-0.2 0.650 56.3 -33.4 -92.6 -17.7 37.4 81.8 5.9 67 68 A G - 0 0 28 -17,-0.8 2,-0.3 2,-0.0 -1,-0.2 -0.990 47.1-117.5-179.7-176.5 35.8 78.3 5.7 68 69 A R + 0 0 90 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.2 -0.935 29.9 169.7-149.4 121.2 32.8 76.1 5.9 69 70 A E E -D 48 0A 108 -21,-2.3 -21,-2.6 -2,-0.3 2,-0.1 -0.994 37.0-106.5-140.6 144.6 32.1 73.3 8.4 70 71 A L E +D 47 0A 116 -2,-0.4 -23,-0.2 -23,-0.2 2,-0.1 -0.413 34.8 173.3 -65.3 133.0 29.2 71.0 9.3 71 72 A A - 0 0 14 -25,-2.1 2,-0.6 -2,-0.1 73,-0.3 -0.613 10.0-169.8-145.0 76.3 27.7 72.0 12.7 72 73 A D + 0 0 85 1,-0.2 71,-0.1 -2,-0.1 -25,-0.0 -0.595 23.5 155.0 -74.3 110.0 24.6 69.9 13.3 73 74 A K + 0 0 79 -2,-0.6 2,-0.3 2,-0.1 393,-0.2 0.054 39.9 118.8-120.6 20.6 22.6 71.2 16.2 74 75 A E - 0 0 12 -28,-0.1 2,-0.1 1,-0.1 29,-0.1 -0.626 66.6-116.0 -90.9 147.8 19.3 69.8 15.0 75 76 A S - 0 0 12 27,-0.3 165,-0.1 -2,-0.3 -1,-0.1 -0.434 19.2-127.2 -75.6 152.9 17.2 67.2 16.8 76 77 A H S S+ 0 0 124 160,-0.1 2,-0.5 -2,-0.1 -1,-0.1 0.420 92.3 81.3 -81.7 4.5 16.8 63.8 15.1 77 78 A L S S- 0 0 6 25,-0.1 2,-0.6 111,-0.0 -2,-0.2 -0.931 75.5-141.5-111.6 129.7 13.0 64.4 15.5 78 79 A K - 0 0 90 -2,-0.5 111,-3.2 25,-0.1 2,-0.5 -0.800 19.6-172.8 -93.3 121.7 11.1 66.5 13.0 79 80 A I E -f 189 0B 0 -2,-0.6 25,-2.1 23,-0.3 26,-1.5 -0.958 9.8-170.8-118.1 125.2 8.4 68.6 14.7 80 81 A H E -fg 190 105B 7 109,-3.0 111,-2.4 -2,-0.5 2,-0.5 -0.956 15.9-152.6-113.9 111.5 5.9 70.7 12.6 81 82 A L E -fg 191 106B 0 24,-2.6 26,-3.1 -2,-0.6 2,-0.8 -0.738 9.6-164.1 -89.3 127.9 3.9 73.0 14.9 82 83 A G E -fg 192 107B 0 109,-3.4 111,-2.9 -2,-0.5 2,-0.6 -0.894 19.0-175.7-110.9 97.8 0.4 74.0 13.8 83 84 A Q E -fg 193 108B 0 24,-1.6 26,-3.2 -2,-0.8 2,-0.3 -0.865 17.8-143.3-104.5 117.7 -0.3 77.0 16.1 84 85 A V E - 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