==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 01-DEC-04 1Y51 . COMPND 2 MOLECULE: PHOSPHOCARRIER PROTEIN HPR; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR S.SRIDHARAN,A.RAZVI,J.M.SCHOLTZ,J.C.SACCHETTINI . 261 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12441.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 74.7 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 . 62 23.8 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 . 3 1.1 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 . 8 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 3 0 0 0 0 0 3 0 3 0 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 . 4 0 0 3 3 3 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 3 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 2 A A 0 0 69 0, 0.0 63,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 145.3 62.2 26.1 38.9 2 3 A E E +A 63 0A 109 61,-0.2 2,-0.3 2,-0.0 61,-0.2 -0.992 360.0 166.8-149.7 139.3 64.5 23.1 38.8 3 4 A K E -A 62 0A 77 59,-2.1 59,-2.8 -2,-0.3 2,-0.3 -0.958 21.5-143.7-154.7 137.3 65.9 20.8 36.1 4 5 A T E -A 61 0A 80 -2,-0.3 2,-0.3 57,-0.2 57,-0.2 -0.790 20.2-172.1-100.1 147.6 68.7 18.3 35.9 5 6 A F E -A 60 0A 5 55,-2.3 55,-2.5 -2,-0.3 2,-0.5 -0.970 21.3-130.7-133.2 155.7 70.9 17.8 32.8 6 7 A K E -A 59 0A 107 81,-2.8 81,-2.0 -2,-0.3 2,-0.4 -0.919 28.3-125.1-107.2 131.2 73.5 15.4 31.5 7 8 A V B +D 86 0B 3 51,-3.1 50,-1.3 -2,-0.5 79,-0.3 -0.592 31.5 172.5 -80.4 125.3 76.6 16.9 30.2 8 9 A V + 0 0 67 77,-2.5 2,-0.3 -2,-0.4 78,-0.2 0.404 39.9 111.1-115.5 -4.8 77.4 15.7 26.7 9 10 A S > - 0 0 18 76,-1.2 3,-1.8 1,-0.1 48,-0.2 -0.609 66.7-135.7 -72.3 134.4 80.4 17.9 25.8 10 11 A D T 3 S+ 0 0 129 -2,-0.3 46,-0.4 1,-0.3 -1,-0.1 0.784 106.9 42.5 -56.1 -32.5 83.7 16.1 25.4 11 12 A S T 3 S- 0 0 65 1,-0.4 -1,-0.3 44,-0.1 2,-0.1 0.235 106.1-132.5 -99.5 10.2 85.4 18.8 27.4 12 13 A G < - 0 0 0 -3,-1.8 2,-0.7 43,-0.1 -1,-0.4 -0.412 56.0 -35.6 70.0-152.8 82.7 19.3 30.1 13 14 A I S S+ 0 0 3 41,-2.2 41,-0.5 -3,-0.1 2,-0.3 -0.917 93.0 114.7-113.1 102.6 81.6 22.8 30.9 14 15 A H > + 0 0 85 -2,-0.7 4,-2.0 39,-0.1 5,-0.2 -0.878 52.7 7.1-150.5 177.1 84.5 25.2 30.7 15 16 A A H > S- 0 0 48 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.090 117.5 -2.0 46.4-132.8 86.0 28.2 28.8 16 17 A R H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.889 133.0 51.0 -69.5 -41.6 83.9 30.0 26.2 17 18 A P H > S+ 0 0 33 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.907 110.3 50.9 -60.9 -35.2 80.8 27.8 26.3 18 19 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.890 109.5 52.3 -65.7 -38.7 80.7 28.2 30.1 19 20 A T H X S+ 0 0 55 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.927 108.6 48.4 -60.9 -44.9 81.0 32.0 29.5 20 21 A I H X S+ 0 0 63 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.894 109.5 53.5 -66.1 -41.0 78.0 32.0 27.1 21 22 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.935 109.3 48.1 -57.5 -47.3 75.9 30.0 29.6 22 23 A V H X S+ 0 0 10 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.905 109.9 53.1 -60.1 -41.3 76.7 32.6 32.4 23 24 A Q H X S+ 0 0 128 -4,-2.4 4,-0.6 1,-0.2 -2,-0.2 0.917 107.8 50.5 -64.8 -39.3 75.7 35.4 30.0 24 25 A T H >< S+ 0 0 25 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.912 111.0 49.0 -59.0 -46.1 72.4 33.6 29.3 25 26 A A H >< S+ 0 0 0 -4,-2.3 3,-1.6 18,-0.2 -1,-0.2 0.886 104.0 60.9 -59.7 -40.9 71.7 33.3 33.0 26 27 A S H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.618 88.4 72.3 -67.7 -11.1 72.5 37.0 33.5 27 28 A K T << S+ 0 0 122 -3,-1.0 2,-0.3 -4,-0.6 -1,-0.3 0.642 88.0 77.9 -72.8 -18.7 69.7 38.2 31.2 28 29 A W S < S- 0 0 23 -3,-1.6 4,-0.1 -4,-0.2 41,-0.0 -0.688 73.3-138.5-105.2 144.2 67.0 37.2 33.8 29 30 A N S S+ 0 0 103 -2,-0.3 -1,-0.1 2,-0.1 40,-0.0 0.844 78.7 96.7 -64.4 -33.6 65.8 38.9 37.0 30 31 A S S S- 0 0 1 1,-0.1 2,-0.3 36,-0.1 36,-0.2 -0.128 82.9-115.1 -51.7 150.8 65.6 35.6 38.7 31 32 A E E -B 65 0A 121 34,-2.4 34,-2.7 12,-0.0 2,-0.4 -0.718 40.3-164.5 -84.8 139.6 68.4 34.3 41.0 32 33 A I E -B 64 0A 0 -2,-0.3 11,-2.1 32,-0.2 12,-0.6 -0.998 10.0-168.4-136.0 137.8 69.9 31.3 39.3 33 34 A Q E -BC 63 42A 40 30,-2.5 30,-1.8 -2,-0.4 2,-0.4 -0.866 11.4-152.8-127.6 151.9 72.2 28.5 40.6 34 35 A L E -BC 62 41A 0 7,-2.4 7,-2.6 -2,-0.3 2,-0.4 -1.000 15.0-168.0-119.3 132.7 74.2 25.6 39.2 35 36 A E E +BC 61 40A 39 26,-2.7 26,-2.2 -2,-0.4 2,-0.4 -0.949 10.0 173.2-125.0 128.7 75.0 22.6 41.2 36 37 A Y E > S-BC 60 39A 53 3,-2.3 3,-1.5 -2,-0.4 24,-0.1 -0.961 71.1 -16.3-132.9 129.0 77.4 19.8 40.5 37 38 A N T 3 S- 0 0 134 22,-0.5 3,-0.1 -2,-0.4 23,-0.1 0.777 129.9 -45.5 53.2 36.0 78.4 16.9 42.8 38 39 A G T 3 S+ 0 0 69 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.458 114.5 108.5 91.4 4.7 77.0 18.6 45.9 39 40 A K E < -C 36 0A 155 -3,-1.5 -3,-2.3 13,-0.1 2,-0.4 -0.967 49.7-161.2-116.9 127.9 78.4 22.1 45.4 40 41 A T E +C 35 0A 89 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.919 12.1 174.6-114.6 134.0 76.1 25.0 44.4 41 42 A V E -C 34 0A 26 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.5 -0.820 41.1 -91.7-128.6 163.0 77.2 28.2 42.8 42 43 A N E > -C 33 0A 81 -2,-0.3 3,-1.8 -9,-0.2 7,-0.3 -0.681 29.0-148.1 -72.3 119.5 75.6 31.3 41.4 43 44 A L T 3 S+ 0 0 0 -11,-2.1 -18,-0.2 -2,-0.5 -17,-0.2 0.607 96.6 63.5 -71.2 -8.6 75.2 30.7 37.7 44 45 A K T 3 S+ 0 0 64 -12,-0.6 2,-0.6 -19,-0.1 -1,-0.3 0.425 90.0 80.9 -87.8 0.7 75.7 34.4 37.1 45 46 A S <> - 0 0 48 -3,-1.8 4,-2.2 1,-0.2 5,-0.2 -0.916 59.7-170.1-112.0 103.8 79.2 34.1 38.4 46 47 A I H > S+ 0 0 62 -2,-0.6 4,-2.8 1,-0.2 5,-0.3 0.864 87.0 58.4 -64.6 -36.8 81.6 32.7 35.9 47 48 A M H > S+ 0 0 157 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.948 109.8 44.1 -56.0 -45.8 84.4 32.3 38.5 48 49 A G H > S+ 0 0 13 1,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.894 112.3 52.1 -66.3 -42.2 82.1 30.0 40.5 49 50 A V H >< S+ 0 0 0 -4,-2.2 3,-0.8 -7,-0.3 5,-0.4 0.923 111.9 45.1 -62.3 -44.9 80.9 28.1 37.4 50 51 A M H >< S+ 0 0 71 -4,-2.8 3,-1.6 1,-0.2 -1,-0.2 0.865 104.2 65.4 -67.4 -31.1 84.5 27.4 36.3 51 52 A S H 3< S+ 0 0 88 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.760 89.1 67.2 -60.6 -28.3 85.4 26.4 39.9 52 53 A L T << S- 0 0 20 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.703 89.4-149.3 -69.9 -20.2 83.1 23.4 39.7 53 54 A G < - 0 0 54 -3,-1.6 -3,-0.1 -4,-0.3 -2,-0.1 0.905 17.5-160.2 53.2 50.2 85.3 21.8 37.0 54 55 A I - 0 0 5 -41,-0.5 -41,-2.2 -5,-0.4 -1,-0.2 -0.471 7.7-157.6 -71.1 119.7 82.4 20.0 35.4 55 56 A P > - 0 0 53 0, 0.0 3,-1.9 0, 0.0 -48,-0.2 -0.384 28.7 -74.3 -92.0 167.7 83.4 17.1 33.3 56 57 A K T 3 S+ 0 0 124 -46,-0.4 -48,-0.1 1,-0.2 -46,-0.1 -0.301 117.4 22.8 -51.3 137.9 82.0 15.1 30.5 57 58 A G T 3 S+ 0 0 41 -50,-1.3 -1,-0.2 1,-0.3 -49,-0.1 0.346 89.2 141.4 80.1 2.2 79.2 12.8 31.6 58 59 A A < - 0 0 8 -3,-1.9 -51,-3.1 -52,-0.1 2,-0.5 -0.285 48.7-133.4 -66.9 154.3 78.3 14.8 34.7 59 60 A T E -A 6 0A 86 -53,-0.2 -22,-0.5 27,-0.0 2,-0.3 -0.935 30.0-174.7-102.6 130.8 74.8 15.3 35.9 60 61 A I E -AB 5 36A 1 -55,-2.5 -55,-2.3 -2,-0.5 2,-0.4 -0.881 16.1-143.6-123.3 161.5 74.1 18.9 36.9 61 62 A K E -AB 4 35A 75 -26,-2.2 -26,-2.7 -2,-0.3 2,-0.4 -0.994 9.1-165.4-130.0 125.8 71.2 20.7 38.4 62 63 A I E -AB 3 34A 0 -59,-2.8 -59,-2.1 -2,-0.4 2,-0.3 -0.908 8.5-176.6-105.4 139.0 70.0 24.2 37.6 63 64 A T E -AB 2 33A 30 -30,-1.8 -30,-2.5 -2,-0.4 2,-0.3 -0.966 3.4-171.8-131.1 147.9 67.5 26.1 39.8 64 65 A A E - B 0 32A 0 -63,-2.4 2,-0.4 -2,-0.3 -32,-0.2 -0.996 4.3-166.1-140.8 137.8 66.0 29.5 39.3 65 66 A E E + B 0 31A 82 -34,-2.7 -34,-2.4 -2,-0.3 2,-0.3 -0.985 45.3 67.0-130.1 120.3 63.9 31.6 41.7 66 67 A G S > S- 0 0 46 -2,-0.4 3,-1.4 -36,-0.2 4,-0.2 -0.857 89.3 -72.8 154.9 179.4 61.9 34.6 40.5 67 68 A A T 3 S+ 0 0 42 1,-0.3 59,-0.3 -2,-0.3 3,-0.2 0.713 129.1 42.7 -81.2 -14.2 59.0 35.8 38.4 68 69 A D T 3> S+ 0 0 5 57,-0.1 4,-2.3 1,-0.1 -1,-0.3 0.055 77.2 119.9-114.3 28.1 60.8 35.1 35.1 69 70 A A H <> S+ 0 0 10 -3,-1.4 4,-2.7 1,-0.2 5,-0.2 0.856 71.4 54.6 -62.7 -34.8 62.2 31.7 36.2 70 71 A A H > S+ 0 0 34 2,-0.2 4,-2.3 -4,-0.2 -1,-0.2 0.927 109.5 46.5 -68.2 -42.0 60.4 29.8 33.4 71 72 A E H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.889 112.5 52.0 -61.5 -41.6 62.0 32.0 30.8 72 73 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.943 109.7 46.9 -62.1 -48.3 65.3 31.6 32.4 73 74 A M H X S+ 0 0 17 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.903 113.2 49.4 -65.2 -39.9 65.1 27.8 32.5 74 75 A A H X S+ 0 0 30 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.934 112.2 47.7 -62.4 -44.3 64.0 27.7 28.9 75 76 A A H X S+ 0 0 19 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.904 112.2 49.3 -64.4 -41.6 66.8 30.0 27.7 76 77 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.904 109.8 51.6 -66.3 -41.5 69.4 28.0 29.7 77 78 A T H X S+ 0 0 33 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.932 111.5 48.6 -56.1 -45.5 68.1 24.7 28.2 78 79 A D H X S+ 0 0 88 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.912 112.2 47.0 -65.1 -43.8 68.5 26.3 24.8 79 80 A T H X S+ 0 0 20 -4,-2.6 4,-2.1 2,-0.2 6,-0.3 0.905 108.6 54.6 -63.4 -42.4 72.0 27.6 25.5 80 81 A L H <>S+ 0 0 0 -4,-2.7 5,-2.7 1,-0.2 6,-1.4 0.868 115.2 42.0 -59.9 -36.4 73.1 24.2 26.9 81 82 A A H ><5S+ 0 0 67 -4,-1.9 3,-1.7 3,-0.2 -2,-0.2 0.920 113.6 49.6 -72.7 -49.1 71.9 22.7 23.6 82 83 A K H 3<5S+ 0 0 170 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.802 113.2 47.4 -63.0 -31.6 73.3 25.3 21.2 83 84 A E T 3<5S- 0 0 68 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.301 112.6-118.3 -90.3 3.2 76.7 25.1 22.9 84 85 A G T < 5S+ 0 0 41 -3,-1.7 -3,-0.2 -5,-0.1 -2,-0.1 0.776 78.8 120.6 63.2 30.7 76.8 21.3 22.7 85 86 A L < - 0 0 2 -5,-2.7 -77,-2.5 -6,-0.3 -76,-1.2 0.877 66.4 -16.6 -95.4 -44.3 76.9 21.1 26.5 86 87 A A B D 7 0B 6 -6,-1.4 -1,-0.3 -79,-0.3 -79,-0.2 -0.997 360.0 360.0-165.6 160.0 74.0 19.2 28.0 87 88 A E 0 0 168 -81,-2.0 -81,-2.8 -2,-0.3 -10,-0.0 -0.956 360.0 360.0-145.1 360.0 70.5 17.8 27.6 88 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 89 2 B A 0 0 67 0, 0.0 63,-2.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 142.8 49.5 24.2 28.8 90 3 B E E +E 151 0C 102 61,-0.2 2,-0.3 2,-0.0 61,-0.2 -0.996 360.0 164.9-149.1 138.2 52.6 26.5 28.8 91 4 B K E -E 150 0C 73 59,-2.3 59,-2.8 -2,-0.3 2,-0.3 -0.972 22.0-143.5-155.9 137.4 54.8 27.9 26.0 92 5 B T E -E 149 0C 42 -2,-0.3 2,-0.3 57,-0.2 57,-0.2 -0.806 19.1-171.8-100.4 151.5 57.4 30.6 25.7 93 6 B F E -E 148 0C 4 55,-2.2 55,-2.4 -2,-0.3 2,-0.5 -0.972 21.7-130.2-136.0 152.3 57.9 32.8 22.6 94 7 B K E -E 147 0C 105 81,-3.0 81,-1.9 -2,-0.3 2,-0.5 -0.911 29.6-124.5-103.5 129.6 60.3 35.4 21.4 95 8 B V B +H 174 0D 2 51,-3.0 50,-1.9 -2,-0.5 79,-0.3 -0.619 32.3 172.4 -77.8 118.2 58.8 38.6 20.1 96 9 B V + 0 0 65 77,-2.6 2,-0.3 -2,-0.5 78,-0.2 0.484 39.3 111.4-106.5 -6.4 59.9 39.4 16.5 97 10 B S > - 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