==== 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 UNKNOWN FUNCTION 14-JAN-03 1NNV . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN HI1450; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR L.M.PARSONS,J.ORBAN,STRUCTURE 2 FUNCTION PROJECT (S2F) . 107 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 60 56.1 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 . 20 18.7 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 . 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 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 18.7 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+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 1 0 0 0 0 0 1 0 0 0 0 0 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 0 2 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 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 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 M 0 0 209 0, 0.0 3,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 80.9 190.8 -12.9 -2.7 2 2 A T + 0 0 153 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.425 360.0 27.9-118.7 -7.1 193.6 -11.4 -0.6 3 3 A T S S- 0 0 84 1,-0.1 3,-0.1 0, 0.0 0, 0.0 -0.463 78.5-111.1-132.3-155.8 191.8 -11.0 2.7 4 4 A E S S+ 0 0 172 1,-0.3 2,-0.5 -2,-0.2 -1,-0.1 0.743 96.3 43.0-113.2 -48.8 188.9 -12.6 4.6 5 5 A I - 0 0 104 90,-0.1 2,-0.4 91,-0.0 -1,-0.3 -0.904 68.1-170.2-107.6 125.2 186.1 -10.0 4.6 6 6 A K - 0 0 149 -2,-0.5 2,-0.1 -3,-0.1 0, 0.0 -0.925 8.6-146.7-117.2 139.5 185.3 -8.1 1.5 7 7 A K - 0 0 151 -2,-0.4 2,-0.4 1,-0.1 86,-0.0 -0.262 22.8-103.7 -91.6-178.4 183.0 -5.1 1.1 8 8 A L - 0 0 35 -2,-0.1 -1,-0.1 1,-0.0 86,-0.1 -0.872 33.0-106.5-112.3 143.9 180.8 -4.0 -1.8 9 9 A D > - 0 0 102 -2,-0.4 4,-3.6 1,-0.1 5,-0.4 -0.280 29.6-116.6 -64.1 149.8 181.5 -1.3 -4.4 10 10 A P H > S+ 0 0 74 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.932 117.2 35.7 -52.0 -53.3 179.4 2.0 -4.0 11 11 A D H > S+ 0 0 133 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.834 118.1 54.2 -71.2 -33.4 177.7 1.5 -7.4 12 12 A T H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.957 111.0 42.9 -65.5 -52.5 177.6 -2.3 -7.0 13 13 A A H X S+ 0 0 0 -4,-3.6 4,-2.6 1,-0.2 5,-0.2 0.932 116.9 47.4 -59.7 -48.0 175.8 -2.2 -3.6 14 14 A I H X S+ 0 0 50 -4,-1.9 4,-3.0 -5,-0.4 -1,-0.2 0.891 109.4 55.6 -60.9 -40.7 173.4 0.5 -4.8 15 15 A D H X S+ 0 0 113 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.958 111.8 41.1 -56.9 -55.4 172.8 -1.4 -8.0 16 16 A I H X S+ 0 0 50 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.953 117.8 46.6 -58.7 -53.4 171.7 -4.6 -6.2 17 17 A A H X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.883 107.2 59.7 -57.3 -40.4 169.7 -2.7 -3.6 18 18 A Y H X S+ 0 0 92 -4,-3.0 4,-1.3 1,-0.3 3,-0.5 0.929 106.1 46.2 -54.2 -49.2 168.1 -0.6 -6.2 19 19 A D H X S+ 0 0 95 -4,-1.9 4,-1.7 1,-0.2 -1,-0.3 0.818 110.1 55.6 -63.9 -30.8 166.6 -3.6 -8.0 20 20 A I H X S+ 0 0 13 -4,-1.5 4,-2.4 1,-0.2 5,-0.5 0.791 104.8 52.2 -72.6 -27.8 165.5 -4.9 -4.5 21 21 A F H X S+ 0 0 0 -4,-1.8 4,-0.7 -3,-0.5 -1,-0.2 0.782 110.8 48.2 -77.2 -27.9 163.6 -1.7 -3.9 22 22 A L H < S+ 0 0 95 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.812 122.5 32.5 -80.1 -34.1 161.8 -2.1 -7.3 23 23 A E H < S+ 0 0 136 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.2 0.818 125.4 41.1 -92.1 -37.5 160.8 -5.7 -6.7 24 24 A M H < S+ 0 0 48 -4,-2.4 4,-0.4 -5,-0.2 2,-0.4 0.943 87.2 95.8 -76.3 -50.6 160.4 -5.7 -2.9 25 25 A A < + 0 0 22 -4,-0.7 2,-0.1 -5,-0.5 -1,-0.0 -0.185 68.1 82.8 -45.6 96.5 158.6 -2.3 -2.6 26 26 A G S > S- 0 0 26 -2,-0.4 3,-0.7 0, 0.0 -1,-0.1 -0.311 95.5 -3.0-158.1-115.3 155.0 -3.6 -2.6 27 27 A E T 3 S+ 0 0 184 1,-0.2 -2,-0.1 -3,-0.2 -3,-0.1 0.844 125.2 62.4 -66.5 -34.3 152.7 -5.1 0.0 28 28 A N T 3 S+ 0 0 103 -4,-0.4 2,-0.3 2,-0.1 -1,-0.2 0.770 98.6 70.7 -62.2 -25.7 155.4 -4.9 2.6 29 29 A L S < S- 0 0 4 -3,-0.7 5,-0.1 -5,-0.2 59,-0.1 -0.658 100.1 -94.6 -94.9 150.4 155.4 -1.1 2.1 30 30 A D > - 0 0 68 -2,-0.3 4,-1.7 1,-0.1 -1,-0.1 -0.355 31.0-127.7 -63.1 137.2 152.6 1.2 3.2 31 31 A P H >> S+ 0 0 101 0, 0.0 4,-1.9 0, 0.0 3,-1.3 0.954 107.6 46.5 -49.2 -64.8 150.0 2.0 0.5 32 32 A A H 3> S+ 0 0 73 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.876 113.0 51.5 -47.2 -43.4 150.1 5.8 0.7 33 33 A D H 3> S+ 0 0 33 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.802 105.2 57.4 -66.2 -28.7 153.9 5.6 0.7 34 34 A I H X S+ 0 0 117 -4,-1.9 4,-2.1 2,-0.2 3,-1.8 0.976 110.7 50.2 -57.9 -60.7 151.8 6.1 -4.4 36 36 A L H 3X S+ 0 0 68 -4,-2.0 4,-3.5 1,-0.3 -1,-0.2 0.874 109.4 52.9 -46.1 -44.4 154.0 9.0 -3.4 37 37 A F H 3< S+ 0 0 21 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.769 109.4 50.8 -64.2 -26.3 157.1 6.9 -4.4 38 38 A N H << S+ 0 0 111 -3,-1.8 -2,-0.2 -4,-1.0 -1,-0.2 0.857 118.4 35.0 -79.9 -38.0 155.4 6.4 -7.7 39 39 A L H < S+ 0 0 113 -4,-2.1 2,-0.6 1,-0.3 -2,-0.2 0.866 127.2 36.2 -83.7 -40.2 154.7 10.0 -8.4 40 40 A Q S < S+ 0 0 55 -4,-3.5 -1,-0.3 -5,-0.3 -2,-0.0 -0.912 86.5 83.4-121.8 106.2 157.8 11.5 -6.8 41 41 A F S S+ 0 0 31 -2,-0.6 36,-0.2 -3,-0.2 -1,-0.1 0.235 79.5 61.2-163.9 -38.6 161.0 9.5 -7.2 42 42 A E S > S+ 0 0 183 2,-0.2 3,-0.8 -3,-0.2 -2,-0.1 0.993 119.7 26.6 -64.5 -63.3 162.5 10.4 -10.5 43 43 A E T 3 S+ 0 0 141 1,-0.3 -1,-0.2 33,-0.0 2,-0.1 0.786 135.5 38.8 -70.5 -27.9 163.0 14.1 -9.8 44 44 A R T 3 S+ 0 0 99 31,-0.0 2,-0.4 35,-0.0 -1,-0.3 -0.466 82.9 154.9-120.9 59.1 163.2 13.4 -6.1 45 45 A G < - 0 0 30 -3,-0.8 2,-0.4 31,-0.2 31,-0.2 -0.729 15.8-179.5 -91.7 134.6 165.2 10.1 -6.0 46 46 A G E +A 75 0A 4 29,-1.3 29,-1.9 -2,-0.4 37,-0.1 -0.975 19.0 149.5-138.0 123.8 167.2 9.2 -3.0 47 47 A V E +A 74 0A 38 -2,-0.4 2,-0.4 27,-0.3 27,-0.2 -0.459 18.0 177.5-150.3 68.8 169.4 6.1 -2.4 48 48 A E E -A 73 0A 109 25,-0.9 25,-2.1 34,-0.1 2,-1.1 -0.625 25.4-138.2 -80.4 129.6 172.3 6.9 -0.1 49 49 A F E +A 72 0A 54 -2,-0.4 23,-0.2 23,-0.2 2,-0.1 -0.725 33.3 175.1 -90.4 94.0 174.6 4.0 0.7 50 50 A V E -A 71 0A 55 -2,-1.1 21,-1.2 21,-0.8 2,-0.1 -0.287 24.6-113.0 -90.0 178.6 175.3 4.3 4.5 51 51 A E - 0 0 155 1,-0.2 19,-0.1 19,-0.2 -1,-0.1 -0.423 39.9 -74.8-104.5-178.2 177.2 2.0 6.8 52 52 A T - 0 0 20 17,-0.5 2,-0.3 -2,-0.1 -1,-0.2 -0.235 45.5-157.8 -73.2 165.7 176.2 -0.1 9.7 53 53 A A - 0 0 48 1,-0.1 3,-0.3 13,-0.1 11,-0.3 -0.869 27.1-125.4-139.2 171.9 175.4 1.3 13.2 54 54 A D S > S+ 0 0 135 -2,-0.3 2,-1.0 1,-0.2 3,-0.7 0.751 102.0 69.4 -90.0 -28.7 175.2 0.2 16.8 55 55 A D T 3 + 0 0 106 1,-0.2 4,-0.3 8,-0.1 -1,-0.2 -0.216 69.4 104.0 -84.9 46.2 171.6 1.3 17.4 56 56 A W T >>> + 0 0 9 -2,-1.0 2,-3.6 -3,-0.3 3,-1.0 0.846 54.2 80.5 -92.1 -42.4 170.3 -1.4 15.1 57 57 A E T <45S+ 0 0 107 -3,-0.7 6,-0.2 1,-0.2 -1,-0.2 -0.293 93.6 51.1 -65.8 64.4 168.9 -3.8 17.8 58 58 A E T 345S+ 0 0 112 -2,-3.6 -1,-0.2 4,-0.2 -2,-0.1 0.236 107.9 38.6-161.9 -48.7 165.8 -1.7 18.1 59 59 A E T <45S+ 0 0 99 -3,-1.0 -2,-0.1 -4,-0.3 -3,-0.1 0.972 127.6 26.5 -79.9 -73.2 164.2 -1.1 14.7 60 60 A I T <5S- 0 0 42 -4,-0.5 -3,-0.1 2,-0.2 -1,-0.1 0.818 110.8-117.8 -61.6 -30.1 164.6 -4.4 12.8 61 61 A G S - 0 0 78 -2,-0.4 3,-0.9 3,-0.1 -13,-0.1 -0.580 39.1-131.0 -73.3 121.3 177.8 -6.4 13.3 66 66 A P T 3 S+ 0 0 40 0, 0.0 -13,-0.1 0, 0.0 -1,-0.1 -0.223 85.5 15.6 -69.9 162.4 179.0 -2.8 12.5 67 67 A E T 3 S+ 0 0 170 1,-0.2 3,-0.1 2,-0.2 -2,-0.0 0.716 115.1 81.4 46.0 22.7 181.5 -2.1 9.7 68 68 A E S < S+ 0 0 64 -3,-0.9 27,-0.4 1,-0.1 2,-0.3 0.184 82.2 59.6-137.2 13.0 180.5 -5.6 8.5 69 69 A Y S S- 0 0 56 24,-0.2 2,-0.7 25,-0.1 -17,-0.5 -0.998 77.5-118.1-146.2 147.2 177.2 -4.9 6.7 70 70 A A E - B 0 92A 0 22,-3.1 22,-2.3 -2,-0.3 2,-0.6 -0.766 27.8-159.2 -89.7 112.6 176.0 -2.8 3.8 71 71 A E E -AB 50 91A 5 -21,-1.2 -21,-0.8 -2,-0.7 2,-0.4 -0.819 11.1-175.3 -95.6 120.0 173.4 -0.2 4.9 72 72 A V E -AB 49 90A 3 18,-3.5 18,-3.2 -2,-0.6 2,-0.5 -0.954 9.4-168.2-119.7 134.4 171.2 1.1 2.1 73 73 A W E -AB 48 89A 84 -25,-2.1 -25,-0.9 -2,-0.4 2,-0.6 -0.970 2.7-173.3-122.5 117.1 168.6 3.9 2.5 74 74 A V E +AB 47 88A 1 14,-2.7 14,-1.8 -2,-0.5 13,-1.5 -0.915 31.5 120.9-114.7 108.0 166.2 4.5 -0.4 75 75 A G E -AB 46 86A 0 -29,-1.9 -29,-1.3 -2,-0.6 2,-0.4 -0.179 60.2 -69.7-131.5-135.2 164.0 7.6 0.1 76 76 A L - 0 0 9 9,-2.5 9,-0.3 -31,-0.2 8,-0.3 -0.989 41.4-175.0-139.8 125.9 163.1 10.8 -1.7 77 77 A V - 0 0 9 -2,-0.4 2,-0.1 -33,-0.3 -31,-0.1 -0.617 17.0-124.1-114.7 175.7 165.4 13.9 -2.0 78 78 A N > - 0 0 60 -2,-0.2 3,-1.0 -34,-0.1 4,-0.2 -0.211 45.1 -80.2-103.8-164.2 165.0 17.4 -3.4 79 79 A E T 3 S+ 0 0 190 1,-0.2 -35,-0.0 2,-0.1 -2,-0.0 0.492 125.9 62.2 -79.2 -3.1 166.9 19.4 -6.0 80 80 A Q T 3 S- 0 0 135 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.470 110.5-118.4 -99.0 -5.1 169.7 20.1 -3.4 81 81 A D < + 0 0 134 -3,-1.0 2,-0.2 1,-0.0 -2,-0.1 0.934 58.0 138.3 64.9 96.0 170.6 16.4 -3.0 82 82 A E - 0 0 85 -4,-0.2 -34,-0.1 3,-0.0 -5,-0.1 -0.466 47.9-131.7-140.1-148.3 169.9 15.3 0.6 83 83 A M + 0 0 32 -2,-0.2 3,-0.2 -37,-0.1 -6,-0.1 -0.042 55.2 122.9-178.5 58.3 168.5 12.4 2.6 84 84 A D S S+ 0 0 86 -8,-0.3 2,-0.3 1,-0.2 -7,-0.1 0.379 72.3 59.3-106.1 0.3 166.0 13.4 5.3 85 85 A D + 0 0 98 -9,-0.3 -9,-2.5 0, 0.0 2,-0.4 -0.733 66.5 179.2-133.6 85.7 163.1 11.3 3.9 86 86 A V E -B 75 0A 45 -2,-0.3 -11,-0.3 -11,-0.3 3,-0.1 -0.706 12.2-173.9 -89.9 135.6 163.9 7.6 3.8 87 87 A F E S- 0 0 12 -13,-1.5 19,-1.6 -2,-0.4 2,-0.3 0.882 71.4 -3.1 -91.5 -49.7 161.3 5.2 2.5 88 88 A A E -BC 74 105A 0 -14,-1.8 -14,-2.7 17,-0.2 2,-0.4 -0.994 61.6-147.0-148.3 139.1 162.9 1.8 3.2 89 89 A K E -BC 73 104A 16 15,-1.5 15,-2.9 -2,-0.3 2,-0.3 -0.917 13.9-156.8-112.4 132.5 166.4 0.8 4.5 90 90 A F E -BC 72 103A 4 -18,-3.2 -18,-3.5 -2,-0.4 2,-0.5 -0.847 6.1-161.3-110.2 145.8 168.2 -2.3 3.3 91 91 A L E -BC 71 102A 1 11,-0.6 11,-1.4 -2,-0.3 2,-0.5 -0.924 12.1-177.8-127.1 105.6 170.9 -4.4 5.1 92 92 A I E -BC 70 101A 4 -22,-2.3 -22,-3.1 -2,-0.5 2,-0.9 -0.904 32.7-118.9-109.4 127.5 173.0 -6.7 2.9 93 93 A S - 0 0 8 7,-1.0 -24,-0.2 -2,-0.5 8,-0.1 -0.462 21.8-151.2 -64.2 100.4 175.7 -8.9 4.4 94 94 A H S S+ 0 0 34 -2,-0.9 -1,-0.2 -26,-0.3 -25,-0.1 0.867 71.0 86.5 -37.1 -57.2 178.9 -7.7 2.7 95 95 A R S S- 0 0 131 -27,-0.4 -90,-0.1 1,-0.1 -88,-0.0 0.113 80.3-130.2 -44.2 163.0 180.6 -11.1 2.9 96 96 A E S S+ 0 0 167 3,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.904 85.5 77.4 -86.0 -48.7 179.9 -13.6 0.2 97 97 A E S S+ 0 0 131 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 -0.425 103.3 9.1 -65.9 133.5 179.0 -16.6 2.3 98 98 A D S S- 0 0 117 1,-0.2 2,-0.7 -2,-0.1 0, 0.0 0.784 75.2-140.5 61.9 116.8 175.5 -16.4 3.7 99 99 A R + 0 0 121 -7,-0.1 2,-0.9 2,-0.1 -1,-0.2 -0.824 22.3 178.7-113.7 93.4 173.5 -13.6 2.1 100 100 A E + 0 0 110 -2,-0.7 -7,-1.0 2,-0.0 2,-0.5 -0.818 7.4 167.9 -97.9 103.4 171.3 -11.9 4.8 101 101 A F E +C 92 0A 104 -2,-0.9 2,-0.5 -9,-0.2 -9,-0.2 -0.942 0.9 167.3-120.3 110.9 169.4 -9.1 3.2 102 102 A H E -C 91 0A 56 -11,-1.4 -11,-0.6 -2,-0.5 2,-0.3 -0.966 14.1-163.1-128.7 117.2 166.5 -7.5 5.3 103 103 A V E -C 90 0A 21 -2,-0.5 2,-0.5 -13,-0.2 -13,-0.3 -0.699 11.1-138.8 -98.1 150.3 164.9 -4.2 4.4 104 104 A I E -C 89 0A 22 -15,-2.9 -15,-1.5 -2,-0.3 2,-0.5 -0.925 12.1-159.1-112.3 130.1 162.7 -2.1 6.7 105 105 A W E -C 88 0A 28 -2,-0.5 -17,-0.2 1,-0.2 -18,-0.1 -0.923 64.5 -23.2-112.1 130.0 159.5 -0.4 5.5 106 106 A K 0 0 97 -19,-1.6 -1,-0.2 -2,-0.5 -18,-0.1 0.891 360.0 360.0 36.1 89.4 158.0 2.6 7.3 107 107 A K 0 0 207 -3,-0.2 -1,-0.1 -20,-0.1 -2,-0.1 0.799 360.0 360.0 -90.0 360.0 159.4 2.3 10.8