==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 15-JAN-04 1S4C . COMPND 2 MOLECULE: PROTEIN HI0227; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR A.TEPLYAKOV,G.OBMOLOVA,J.TOEDT,G.L.GILLILAND . 592 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 389 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 216 36.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 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 . 48 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 38 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 15 0 8 12 6 2 0 4 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 1 1 0 0 0 0 1 2 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 5 0, 0.0 459,-2.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 154.7 5.2 2.9 30.8 2 2 A I E -AB 123 459A 14 121,-1.8 121,-3.0 457,-0.2 2,-0.4 -0.981 360.0-171.3-122.7 138.3 6.3 -0.7 31.3 3 3 A I E +A 122 0A 0 455,-2.1 2,-0.2 -2,-0.4 119,-0.2 -0.989 30.9 118.9-127.7 131.4 9.6 -2.2 29.9 4 4 A S E -A 121 0A 5 117,-2.9 117,-2.3 -2,-0.4 2,-0.3 -0.812 52.4 -94.0-165.8-165.9 10.1 -5.8 30.1 5 5 A S E > -A 120 0A 3 115,-0.3 3,-1.3 -2,-0.2 115,-0.3 -0.993 8.5-146.1-140.8 133.8 10.7 -9.0 28.2 6 6 A L T 3 S+ 0 0 5 113,-3.0 5,-0.1 -2,-0.3 114,-0.1 0.769 104.7 61.7 -59.6 -26.8 8.4 -11.8 26.9 7 7 A T T 3 S+ 0 0 89 112,-0.4 -1,-0.3 3,-0.1 113,-0.1 0.644 78.6 96.7 -79.6 -15.9 11.3 -14.1 27.7 8 8 A N S X S- 0 0 13 -3,-1.3 3,-1.6 1,-0.1 4,-0.1 -0.612 71.9-142.8 -75.7 134.2 11.3 -13.4 31.4 9 9 A P T 3 S+ 0 0 101 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.642 99.8 44.4 -80.5 -8.4 9.4 -16.1 33.1 10 10 A N T > S+ 0 0 83 1,-0.1 3,-1.6 2,-0.1 -3,-0.1 -0.006 72.5 118.6-113.3 18.6 8.0 -13.6 35.6 11 11 A F T < + 0 0 14 -3,-1.6 -1,-0.1 1,-0.2 4,-0.1 0.692 66.6 67.0 -64.5 -13.2 7.2 -10.8 33.2 12 12 A K T > + 0 0 87 -3,-0.2 3,-1.2 -4,-0.1 2,-0.3 0.572 68.3 112.8 -83.6 -10.5 3.5 -11.0 34.2 13 13 A V T < S+ 0 0 53 -3,-1.6 562,-0.1 1,-0.2 -3,-0.0 -0.455 94.2 2.9 -57.2 121.6 4.0 -9.8 37.8 14 14 A G T 3 S+ 0 0 20 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.243 98.0 133.3 92.1 -22.1 2.3 -6.4 37.9 15 15 A L < - 0 0 20 -3,-1.2 -1,-0.2 -4,-0.1 456,-0.1 -0.395 64.3-109.3 -72.3 138.1 1.0 -6.4 34.4 16 16 A P >> - 0 0 14 0, 0.0 4,-2.4 0, 0.0 3,-0.7 -0.447 35.5-114.6 -56.7 138.5 -2.7 -5.4 33.7 17 17 A K H 3> S+ 0 0 177 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.841 113.2 54.6 -44.8 -42.8 -4.6 -8.6 32.7 18 18 A V H 3> S+ 0 0 16 132,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.906 110.5 46.5 -68.1 -35.4 -5.3 -7.5 29.1 19 19 A I H <> S+ 0 0 0 -3,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.930 109.5 54.0 -72.8 -41.5 -1.7 -6.9 28.6 20 20 A A H X S+ 0 0 14 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.920 108.2 51.0 -51.3 -44.3 -0.7 -10.3 30.1 21 21 A E H X S+ 0 0 127 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.885 109.5 48.7 -67.0 -39.1 -3.1 -12.1 27.7 22 22 A V H X S+ 0 0 6 -4,-1.8 4,-2.8 -5,-0.2 -1,-0.2 0.947 113.0 47.2 -67.4 -42.8 -1.7 -10.4 24.6 23 23 A C H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.877 111.1 51.7 -58.0 -39.9 1.9 -11.3 25.7 24 24 A D H < S+ 0 0 73 -4,-2.6 4,-0.3 -5,-0.2 -1,-0.2 0.866 112.1 48.2 -65.7 -34.9 0.9 -14.9 26.5 25 25 A Y H >< S+ 0 0 94 -4,-1.7 3,-1.5 -5,-0.2 4,-0.3 0.899 107.7 52.8 -70.3 -41.5 -0.6 -14.9 23.0 26 26 A L H >< S+ 0 0 0 -4,-2.8 3,-1.6 1,-0.3 -2,-0.2 0.857 100.4 62.9 -64.2 -30.3 2.5 -13.5 21.4 27 27 A N T 3< S+ 0 0 72 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.637 98.1 58.5 -67.8 -12.1 4.6 -16.2 23.0 28 28 A T T < S+ 0 0 110 -3,-1.5 -1,-0.3 -4,-0.3 2,-0.2 0.453 93.9 89.3 -84.7 -9.7 2.6 -18.8 21.0 29 29 A L S < S- 0 0 44 -3,-1.6 2,-1.4 -4,-0.3 3,-0.2 -0.575 82.5-120.6-101.5 158.8 3.5 -17.3 17.7 30 30 A D >> - 0 0 100 -2,-0.2 4,-0.8 1,-0.2 3,-0.8 -0.762 37.1-176.5 -85.6 93.6 6.3 -17.8 15.2 31 31 A L G >4 S+ 0 0 9 -2,-1.4 3,-0.7 1,-0.2 -1,-0.2 0.885 73.4 58.9 -66.9 -31.8 7.4 -14.2 15.5 32 32 A N G 34 S+ 0 0 115 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.809 109.6 42.4 -60.6 -35.3 10.1 -14.5 12.9 33 33 A A G <4 S+ 0 0 68 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.432 79.9 128.7 -99.7 -8.5 7.7 -15.6 10.2 34 34 A L << - 0 0 24 -4,-0.8 2,-0.2 -3,-0.7 3,-0.1 -0.246 63.3-116.7 -45.5 128.3 4.9 -13.2 10.9 35 35 A E - 0 0 151 1,-0.1 14,-0.2 3,-0.0 -1,-0.1 -0.492 28.5-103.2 -72.8 142.7 3.9 -11.4 7.7 36 36 A N S S+ 0 0 88 -2,-0.2 2,-0.2 12,-0.1 14,-0.2 -0.310 83.3 50.2 -54.1 146.0 4.4 -7.6 7.4 37 37 A G E S-C 49 0A 35 12,-2.2 12,-2.9 -3,-0.1 2,-0.3 -0.748 95.2 -29.0 120.6-171.8 1.1 -5.8 7.7 38 38 A R E -C 48 0A 147 -2,-0.2 2,-0.4 10,-0.2 10,-0.2 -0.649 49.0-171.9 -85.5 138.9 -1.9 -5.6 10.0 39 39 A H E -C 47 0A 46 8,-3.1 8,-2.6 -2,-0.3 2,-0.2 -0.992 14.0-142.0-134.9 127.8 -3.1 -8.6 12.0 40 40 A D E +C 46 0A 94 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.598 23.0 170.0 -91.1 149.1 -6.3 -8.8 14.0 41 41 A I - 0 0 47 4,-2.5 2,-0.3 1,-0.6 5,-0.2 0.621 67.2 -2.7-122.9 -38.4 -6.5 -10.6 17.3 42 42 A N S S- 0 0 72 3,-1.9 -1,-0.6 1,-0.0 0, 0.0 -0.805 80.6 -91.3-137.1 178.0 -9.8 -9.6 18.7 43 43 A D S S+ 0 0 162 -2,-0.3 3,-0.0 1,-0.1 -1,-0.0 0.835 131.4 31.7 -51.7 -43.4 -12.7 -7.5 17.8 44 44 A Q S S+ 0 0 73 1,-0.1 2,-0.5 103,-0.0 -1,-0.1 0.746 113.2 60.2 -93.1 -32.3 -10.8 -4.9 19.8 45 45 A I + 0 0 6 101,-0.1 -4,-2.5 99,-0.0 -3,-1.9 -0.879 49.8 157.5-116.6 132.2 -7.1 -5.6 19.4 46 46 A Y E -CD 40 145A 36 99,-1.1 99,-2.8 -2,-0.5 2,-0.3 -0.842 20.6-147.4-131.3 178.7 -5.0 -5.7 16.4 47 47 A M E -CD 39 144A 2 -8,-2.6 -8,-3.1 -2,-0.3 2,-0.4 -0.981 5.5-144.5-145.3 153.8 -1.3 -5.3 15.7 48 48 A N E -CD 38 143A 52 95,-2.1 95,-2.9 -2,-0.3 2,-0.4 -0.966 16.6-165.5-110.7 133.9 0.9 -4.0 13.0 49 49 A V E +CD 37 142A 2 -12,-2.9 -12,-2.2 -2,-0.4 2,-0.3 -0.932 16.9 159.3-120.1 148.3 4.2 -5.7 12.2 50 50 A M E - D 0 141A 62 91,-2.7 91,-2.6 -2,-0.4 -2,-0.0 -0.989 44.5-131.3-157.3 163.5 7.0 -4.2 10.1 51 51 A E + 0 0 67 -2,-0.3 89,-0.2 89,-0.2 91,-0.0 -0.604 45.4 163.2-117.5 68.7 10.6 -4.2 9.0 52 52 A P - 0 0 35 0, 0.0 87,-2.1 0, 0.0 2,-0.4 -0.117 37.7-112.0 -72.1 176.3 11.4 -0.4 9.2 53 53 A E B -L 138 0B 127 85,-0.2 85,-0.2 80,-0.0 82,-0.1 -0.944 29.7-110.5-110.2 135.6 14.9 1.1 9.3 54 54 A T - 0 0 14 83,-2.7 2,-0.3 -2,-0.4 80,-0.3 -0.440 42.0-164.3 -56.5 134.7 16.2 2.8 12.5 55 55 A A B -m 134 0C 36 78,-2.9 80,-0.9 -2,-0.1 5,-0.1 -0.926 29.5 -86.1-124.5 151.3 16.4 6.5 11.5 56 56 A E > - 0 0 126 -2,-0.3 3,-2.2 78,-0.2 4,-0.4 -0.312 40.4-119.3 -59.7 134.6 18.3 9.3 13.3 57 57 A P G > S+ 0 0 37 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.830 108.9 54.5 -41.1 -52.3 16.3 10.8 16.2 58 58 A S G 3 S+ 0 0 117 1,-0.3 -2,-0.1 3,-0.0 49,-0.0 0.566 98.6 67.3 -69.2 -3.7 16.2 14.5 14.8 59 59 A S G < S+ 0 0 72 -3,-2.2 2,-0.3 2,-0.0 -1,-0.3 0.614 102.1 45.8 -85.9 -13.5 14.7 13.2 11.5 60 60 A K S < S- 0 0 53 -3,-1.7 2,-0.3 -4,-0.4 71,-0.0 -0.845 78.0-115.4-133.5 160.1 11.4 12.1 13.0 61 61 A K - 0 0 87 -2,-0.3 45,-0.2 46,-0.0 2,-0.1 -0.763 26.9-122.8 -96.7 143.0 8.6 13.3 15.4 62 62 A A E -N 105 0C 0 43,-2.2 43,-1.6 -2,-0.3 2,-0.3 -0.410 33.7-156.2 -65.6 160.3 7.8 11.7 18.7 63 63 A E E -NO 104 130C 50 67,-2.6 67,-2.2 41,-0.2 2,-0.3 -0.944 19.9-177.0-138.0 163.3 4.2 10.6 19.1 64 64 A L E -N 103 0C 0 39,-1.3 39,-1.7 -2,-0.3 2,-0.3 -0.901 15.9-144.6-148.3 173.8 1.5 9.9 21.7 65 65 A H - 0 0 4 -2,-0.3 62,-1.6 60,-0.3 63,-0.2 -0.869 9.5-155.2-142.5 160.3 -2.1 8.5 21.4 66 66 A H S S+ 0 0 41 -2,-0.3 -1,-0.1 60,-0.2 82,-0.1 0.760 87.5 30.4-110.2 -37.7 -5.3 9.1 23.2 67 67 A E S S+ 0 0 92 34,-0.1 81,-2.3 80,-0.1 82,-0.4 0.767 111.4 49.7-102.2 -31.4 -7.4 6.0 22.7 68 68 A Y E -E 147 0A 57 79,-0.3 2,-0.3 33,-0.2 -3,-0.1 -0.847 63.6-139.6-108.4 150.3 -5.1 3.1 22.5 69 69 A L E -E 146 0A 0 77,-3.7 77,-2.3 -2,-0.4 2,-0.4 -0.692 24.7-134.4 -85.1 151.6 -2.1 1.8 24.4 70 70 A D E -EF 145 124A 3 54,-2.2 54,-1.7 -2,-0.3 2,-0.5 -0.933 16.0-169.2-102.0 138.0 0.9 0.4 22.5 71 71 A V E -EF 144 123A 0 73,-2.3 73,-3.3 -2,-0.4 2,-0.5 -0.966 19.9-170.5-112.1 108.8 2.6 -2.8 23.3 72 72 A Q E -EF 143 122A 5 50,-2.4 50,-2.2 -2,-0.5 2,-0.4 -0.843 4.6-175.1 -97.2 133.6 5.8 -2.6 21.1 73 73 A V E -EF 142 121A 0 69,-2.9 69,-2.4 -2,-0.5 2,-0.4 -0.995 19.2-139.5-129.8 137.3 7.9 -5.6 20.8 74 74 A L E +E 141 0A 0 46,-1.6 45,-2.9 -2,-0.4 67,-0.3 -0.721 21.3 174.7 -86.2 135.8 11.2 -6.0 19.0 75 75 A I E + 0 0 8 65,-2.9 2,-0.4 1,-0.4 66,-0.2 0.796 66.0 11.7-108.2 -48.9 11.6 -9.3 17.1 76 76 A R E S+E 140 0A 106 64,-2.1 64,-2.0 42,-0.1 -1,-0.4 -0.987 111.2 7.8-136.7 140.9 14.9 -9.0 15.2 77 77 A G S S- 0 0 29 -2,-0.4 2,-0.3 62,-0.2 62,-0.1 -0.614 86.2 -70.8 95.2-152.7 17.7 -6.5 15.5 78 78 A T - 0 0 73 -2,-0.2 2,-0.4 39,-0.1 39,-0.2 -0.981 44.8-173.0-151.3 140.2 18.2 -3.7 18.1 79 79 A E E -P 116 0C 2 37,-2.1 37,-3.7 -2,-0.3 2,-0.4 -0.994 16.3-145.0-144.9 139.6 16.2 -0.6 18.5 80 80 A N E -PQ 115 134C 39 54,-1.3 54,-2.7 -2,-0.4 2,-0.4 -0.842 13.5-172.8-101.9 140.1 16.3 2.7 20.5 81 81 A I E -P 114 0C 0 33,-1.9 33,-3.3 -2,-0.4 2,-0.4 -0.983 15.6-145.5-131.4 118.7 13.1 4.4 21.6 82 82 A E E +PQ 113 131C 19 49,-1.8 49,-2.5 -2,-0.4 2,-0.3 -0.711 29.9 176.4 -78.9 140.7 13.3 7.8 23.2 83 83 A V E -PQ 112 130C 0 29,-2.7 29,-2.2 -2,-0.4 2,-0.4 -0.896 25.7-148.4-142.7 160.6 10.6 8.1 25.8 84 84 A G - 0 0 1 45,-1.3 27,-0.1 -2,-0.3 26,-0.1 -0.992 3.1-168.4-132.9 135.1 9.4 10.5 28.4 85 85 A A + 0 0 1 25,-0.5 2,-0.4 -2,-0.4 380,-0.1 0.499 68.0 84.9 -98.2 -11.3 7.8 9.4 31.7 86 86 A T S S- 0 0 14 23,-0.4 23,-0.1 24,-0.1 158,-0.0 -0.735 98.0 -92.0 -89.6 144.2 6.6 12.9 32.6 87 87 A Y - 0 0 38 -2,-0.4 41,-0.1 1,-0.1 156,-0.1 -0.317 50.2-114.4 -51.6 127.8 3.3 14.1 31.2 88 88 A P - 0 0 9 0, 0.0 2,-1.0 0, 0.0 155,-0.2 -0.028 19.5-110.1 -67.8 163.6 3.9 16.0 28.0 89 89 A N > - 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