==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 19-JUL-12 4G6T . COMPND 2 MOLECULE: TYPE III CHAPERONE PROTEIN SHCA; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SYRINGAE PV. TOMATO; . AUTHOR C.E.STEBBINS,R.JANJUSEVIC,C.M.QUEZADA . 199 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11006.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 74.9 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 . 37 18.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 13 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 36.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 1 1 0 1 0 0 0 0 1 0 1 0 0 0 0 0 1 0 1 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 1 1 1 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 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 0 183 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.6 14.3 15.0 -5.9 2 -1 A V - 0 0 42 185,-0.1 2,-1.4 1,-0.1 3,-0.1 -0.592 360.0-129.1 -76.6 128.7 17.2 17.2 -5.4 3 0 A D > - 0 0 85 -2,-0.4 3,-2.5 1,-0.2 4,-0.2 -0.595 20.6-165.6 -79.9 92.9 17.5 18.8 -2.0 4 1 A M G > S+ 0 0 100 -2,-1.4 3,-2.1 1,-0.3 -1,-0.2 0.718 79.4 74.1 -59.7 -20.8 18.0 22.4 -2.9 5 2 A S G > S+ 0 0 57 1,-0.3 3,-1.7 2,-0.2 -1,-0.3 0.784 81.2 73.2 -61.9 -23.1 19.1 23.3 0.6 6 3 A N G X S+ 0 0 14 -3,-2.5 3,-0.7 1,-0.3 4,-0.4 0.580 79.2 74.3 -68.3 -10.2 22.4 21.6 -0.3 7 4 A L G <> + 0 0 30 -3,-2.1 4,-2.2 1,-0.2 -1,-0.3 0.462 68.0 94.9 -78.3 -1.9 23.2 24.6 -2.5 8 5 A F H <> S+ 0 0 86 -3,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.875 80.9 54.0 -50.3 -42.1 23.9 26.6 0.7 9 6 A Y H <> S+ 0 0 2 -3,-0.7 4,-2.5 2,-0.2 -1,-0.2 0.925 108.3 48.0 -63.3 -45.5 27.6 25.8 0.3 10 7 A K H > S+ 0 0 48 -4,-0.4 4,-3.2 1,-0.2 5,-0.2 0.908 109.6 53.2 -61.2 -46.2 27.8 27.1 -3.2 11 8 A T H X S+ 0 0 74 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.922 110.7 46.8 -55.8 -41.8 26.0 30.3 -2.2 12 9 A L H X S+ 0 0 15 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.921 110.7 52.1 -63.2 -48.3 28.6 30.8 0.6 13 10 A L H X S+ 0 0 3 -4,-2.5 4,-2.7 1,-0.2 12,-0.4 0.893 108.8 51.2 -58.2 -39.7 31.4 30.1 -1.8 14 11 A D H X S+ 0 0 38 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.892 111.0 47.1 -62.2 -42.2 30.0 32.7 -4.2 15 12 A D H X S+ 0 0 73 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.855 112.0 51.2 -66.0 -37.7 29.8 35.3 -1.5 16 13 A F H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.942 109.8 49.4 -63.6 -45.1 33.4 34.4 -0.4 17 14 A S H <>S+ 0 0 1 -4,-2.7 5,-1.8 1,-0.2 4,-0.4 0.903 110.1 51.6 -62.1 -42.3 34.6 34.8 -4.0 18 15 A R H ><5S+ 0 0 195 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.893 110.5 48.1 -64.1 -37.7 32.8 38.2 -4.2 19 16 A S H 3<5S+ 0 0 56 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.881 110.7 49.9 -65.5 -41.6 34.5 39.3 -1.0 20 17 A L T 3<5S- 0 0 1 -4,-2.3 115,-1.6 -5,-0.1 -1,-0.2 0.447 111.0-129.1 -73.5 -4.5 37.9 38.1 -2.4 21 18 A E T < 5 + 0 0 141 -3,-0.7 2,-0.3 -4,-0.4 110,-0.3 0.926 63.6 125.3 47.2 58.6 37.0 40.1 -5.5 22 19 A M S - 0 0 61 4,-3.3 3,-2.0 -2,-0.5 161,-0.1 -0.003 37.7 -81.3 -74.8-174.3 33.2 20.4 -8.8 29 26 A D T 3 S+ 0 0 74 1,-0.3 157,-0.5 2,-0.1 156,-0.1 0.353 130.7 57.6 -78.5 8.3 30.9 17.3 -9.3 30 27 A H T 3 S- 0 0 74 2,-0.2 -1,-0.3 155,-0.2 17,-0.1 0.207 120.4-108.0-111.7 9.6 32.5 15.7 -6.3 31 28 A G S < S+ 0 0 0 -3,-2.0 16,-2.8 1,-0.3 2,-0.3 0.693 79.7 122.7 74.5 25.4 31.5 18.6 -4.1 32 29 A T E -A 46 0A 3 14,-0.2 -4,-3.3 12,-0.0 2,-0.4 -0.827 47.6-159.9-126.7 149.8 35.1 19.9 -3.8 33 30 A C E -A 45 0A 5 12,-2.5 12,-2.2 -2,-0.3 2,-0.3 -0.914 16.4-158.2-128.1 104.9 36.9 23.2 -4.5 34 31 A N E +A 44 0A 34 -2,-0.4 114,-2.4 10,-0.2 2,-0.3 -0.671 17.1 177.2 -87.4 137.0 40.7 22.8 -4.9 35 32 A M E -AB 43 147A 0 8,-3.0 8,-2.4 -2,-0.3 2,-0.4 -0.950 26.8-144.6-139.6 149.1 42.8 25.9 -4.4 36 33 A I E -AB 42 146A 3 110,-2.6 110,-2.0 -2,-0.3 2,-0.5 -0.990 21.3-155.7-112.5 129.8 46.4 26.9 -4.3 37 34 A I E >> -AB 41 145A 0 4,-2.5 4,-2.5 -2,-0.4 3,-2.3 -0.918 69.3 -16.9-111.4 126.3 47.3 29.7 -1.8 38 35 A D T 34 S- 0 0 56 106,-2.5 -1,-0.2 -2,-0.5 107,-0.1 0.746 111.1 -76.5 55.8 33.3 50.3 31.9 -2.2 39 36 A N T 34 S+ 0 0 64 105,-0.2 118,-0.5 2,-0.2 -1,-0.3 0.718 130.2 71.9 47.3 31.6 51.8 29.5 -4.8 40 37 A T T <4 S+ 0 0 53 -3,-2.3 2,-0.4 1,-0.3 -2,-0.2 0.646 79.1 59.9-138.8 -43.1 52.7 27.4 -1.8 41 38 A F E < -A 37 0A 12 -4,-2.5 -4,-2.5 17,-0.0 2,-0.5 -0.855 58.3-145.3-111.6 140.8 49.9 25.6 -0.1 42 39 A A E +A 36 0A 7 -2,-0.4 17,-2.2 17,-0.3 2,-0.3 -0.888 28.9 169.3-100.3 124.5 47.4 23.1 -1.4 43 40 A L E -AC 35 58A 0 -8,-2.4 -8,-3.0 -2,-0.5 2,-0.4 -0.953 14.9-165.8-138.8 143.8 43.9 23.4 0.2 44 41 A T E -AC 34 57A 0 13,-2.9 13,-2.7 -2,-0.3 2,-0.5 -0.999 11.6-150.9-132.4 136.4 40.5 21.9 -0.6 45 42 A L E -AC 33 56A 1 -12,-2.2 -12,-2.5 -2,-0.4 2,-0.4 -0.947 22.6-171.1-100.2 130.6 37.0 22.8 0.5 46 43 A S E -AC 32 55A 0 9,-2.7 9,-3.0 -2,-0.5 2,-0.6 -0.985 17.5-138.1-130.6 128.3 34.8 19.8 0.5 47 44 A C E - C 0 54A 0 -16,-2.8 2,-1.0 -2,-0.4 7,-0.2 -0.741 11.1-168.7 -90.2 119.7 31.0 19.7 1.1 48 45 A D E > + C 0 53A 3 5,-2.7 5,-1.9 -2,-0.6 4,-0.5 -0.788 12.9 174.0-104.6 88.6 29.8 16.9 3.3 49 46 A Y T > 5S+ 0 0 15 -2,-1.0 3,-1.1 1,-0.2 -1,-0.2 0.905 72.2 54.9 -66.7 -41.7 26.1 17.2 2.6 50 47 A A T 3 5S+ 0 0 87 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.827 116.6 37.3 -62.4 -36.9 25.0 14.2 4.6 51 48 A R T 3 5S- 0 0 131 2,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.318 107.5-124.2-100.8 8.1 26.7 15.4 7.8 52 49 A E T < 5 + 0 0 91 -3,-1.1 51,-2.6 -4,-0.5 2,-0.3 0.917 68.7 113.8 53.9 57.3 25.9 19.1 7.2 53 50 A R E < -CD 48 102A 69 -5,-1.9 -5,-2.7 49,-0.3 2,-0.5 -0.996 59.8-133.2-153.7 154.7 29.4 20.4 7.4 54 51 A L E -CD 47 101A 2 47,-2.6 47,-2.6 -2,-0.3 2,-0.4 -0.931 24.5-149.1-107.6 132.3 32.1 22.0 5.2 55 52 A L E -CD 46 100A 8 -9,-3.0 -9,-2.7 -2,-0.5 2,-0.5 -0.867 7.2-159.3-104.1 135.3 35.6 20.6 5.4 56 53 A L E -CD 45 99A 0 43,-3.0 43,-2.2 -2,-0.4 2,-0.4 -0.964 20.8-175.3-105.0 124.0 38.8 22.6 4.9 57 54 A I E -CD 44 98A 9 -13,-2.7 -13,-2.9 -2,-0.5 2,-0.4 -0.974 4.7-174.4-130.8 131.4 41.6 20.2 4.0 58 55 A G E -CD 43 97A 0 39,-2.7 39,-2.6 -2,-0.4 2,-0.6 -0.960 28.9-116.7-129.0 149.2 45.2 21.0 3.6 59 56 A L E - D 0 96A 13 -17,-2.2 -17,-0.3 -2,-0.4 2,-0.3 -0.690 33.1-154.2 -81.2 116.9 48.4 19.2 2.5 60 57 A L - 0 0 5 35,-2.7 35,-0.4 -2,-0.6 63,-0.1 -0.708 10.7-167.8 -89.6 152.0 50.8 19.1 5.4 61 58 A E + 0 0 45 61,-0.3 3,-0.1 -2,-0.3 2,-0.1 -0.542 14.2 177.2-139.1 67.4 54.6 18.8 4.7 62 59 A P - 0 0 26 0, 0.0 64,-0.2 0, 0.0 63,-0.1 -0.416 44.7 -85.1 -65.9 148.5 56.4 18.0 8.0 63 60 A H > - 0 0 109 62,-0.6 3,-2.5 65,-0.3 64,-0.0 -0.297 40.5-117.4 -45.8 130.2 60.1 17.4 8.0 64 61 A K T 3 S+ 0 0 191 1,-0.3 -1,-0.1 -3,-0.1 0, 0.0 0.703 113.8 45.9 -42.6 -27.4 60.9 13.7 7.2 65 62 A D T 3 S+ 0 0 126 2,-0.1 -1,-0.3 3,-0.0 -2,-0.1 0.166 73.0 127.9-114.1 13.6 62.4 13.3 10.7 66 63 A I S < S- 0 0 31 -3,-2.5 2,-0.1 1,-0.1 5,-0.0 -0.616 73.3-107.3 -63.0 129.1 59.8 15.0 12.9 67 64 A P >> - 0 0 81 0, 0.0 4,-1.3 0, 0.0 3,-1.2 -0.418 15.8-128.2 -63.4 140.7 59.1 12.4 15.5 68 65 A Q H 3> S+ 0 0 142 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.831 109.9 64.6 -58.6 -32.8 55.7 10.6 15.0 69 66 A Q H 3> S+ 0 0 170 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.834 99.9 51.7 -55.4 -34.8 55.1 11.4 18.7 70 67 A C H <> S+ 0 0 53 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.904 109.5 48.0 -68.8 -42.2 55.2 15.1 17.9 71 68 A L H X S+ 0 0 9 -4,-1.3 4,-1.8 1,-0.2 -2,-0.2 0.921 109.5 54.1 -66.4 -41.0 52.6 14.7 15.1 72 69 A L H < S+ 0 0 130 -4,-2.9 4,-0.3 2,-0.2 -1,-0.2 0.832 106.9 50.9 -65.2 -30.8 50.4 12.7 17.5 73 70 A A H >< S+ 0 0 65 -4,-1.5 3,-1.7 1,-0.2 4,-0.2 0.936 108.8 51.8 -66.0 -46.2 50.5 15.5 20.0 74 71 A G H >< S+ 0 0 9 -4,-2.2 3,-2.0 1,-0.3 -2,-0.2 0.824 97.2 68.2 -50.6 -38.0 49.5 17.9 17.2 75 72 A A T 3< S+ 0 0 34 -4,-1.8 -1,-0.3 1,-0.3 11,-0.2 0.624 92.9 60.3 -61.2 -21.0 46.6 15.5 16.5 76 73 A L T X> S+ 0 0 95 -3,-1.7 4,-1.7 -4,-0.3 3,-1.1 0.472 73.5 101.7 -83.2 -7.9 45.0 16.6 19.8 77 74 A N H <> S+ 0 0 26 -3,-2.0 4,-2.2 1,-0.3 6,-0.7 0.854 72.9 58.5 -48.3 -41.7 44.8 20.2 18.8 78 75 A P H 3> S+ 0 0 41 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.861 108.5 47.6 -55.7 -41.3 41.0 20.1 18.0 79 76 A L H <4 S+ 0 0 131 -3,-1.1 -2,-0.2 -4,-0.2 -3,-0.1 0.925 111.7 50.2 -61.9 -45.0 40.3 19.0 21.6 80 77 A L H < S- 0 0 116 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.1 0.859 138.9 -10.2 -67.3 -36.1 42.6 21.6 23.1 81 78 A N H < S- 0 0 96 -4,-2.2 -2,-0.2 3,-0.1 -1,-0.2 0.287 88.9-103.7-152.8 12.0 41.2 24.7 21.3 82 79 A A S < S+ 0 0 72 -4,-1.8 -3,-0.1 -5,-0.4 3,-0.1 0.571 80.2 131.9 67.8 14.4 38.8 23.7 18.4 83 80 A G - 0 0 10 -6,-0.7 -1,-0.2 1,-0.2 -2,-0.1 0.029 63.0 -50.2 -81.5-174.4 41.5 24.4 15.9 84 81 A P - 0 0 13 0, 0.0 15,-0.2 0, 0.0 -1,-0.2 -0.245 52.0-151.6 -63.2 156.1 42.7 22.4 13.1 85 82 A G E -E 98 0A 0 13,-2.8 13,-1.6 -8,-0.2 2,-0.3 -0.477 2.6-148.8-109.7-177.2 43.7 18.8 13.3 86 83 A L E +E 97 0A 11 11,-0.2 2,-0.3 -11,-0.2 11,-0.2 -0.984 19.8 153.3-150.9 159.9 46.0 16.5 11.5 87 84 A G E -E 96 0A 29 9,-1.6 9,-2.9 -2,-0.3 2,-0.5 -0.971 40.7 -90.7-170.5 172.5 46.3 12.8 10.5 88 85 A L E -E 95 0A 84 -2,-0.3 2,-0.7 7,-0.2 7,-0.2 -0.819 23.5-148.6 -98.4 128.1 47.8 10.4 8.0 89 86 A D > - 0 0 22 5,-2.2 4,-2.2 -2,-0.5 5,-0.5 -0.851 7.1-161.5 -90.0 119.2 45.9 9.4 5.0 90 87 A E T 4 S+ 0 0 174 -2,-0.7 -1,-0.1 2,-0.2 5,-0.0 0.795 84.2 62.3 -80.1 -24.5 47.0 5.8 4.2 91 88 A K T 4 S+ 0 0 124 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.987 123.0 19.4 -53.0 -61.0 45.8 5.8 0.6 92 89 A S T 4 S- 0 0 45 2,-0.2 -2,-0.2 75,-0.0 -1,-0.2 0.635 94.7-129.4 -88.9 -18.9 48.3 8.6 -0.3 93 90 A G < + 0 0 48 -4,-2.2 2,-0.4 1,-0.3 -3,-0.2 0.550 67.2 130.4 72.0 8.2 50.9 8.4 2.6 94 91 A L - 0 0 16 -5,-0.5 -5,-2.2 72,-0.1 2,-0.3 -0.773 61.2-122.7-100.1 141.0 50.4 12.1 3.0 95 92 A Y E - E 0 88A 58 -35,-0.4 -35,-2.7 -2,-0.4 2,-0.4 -0.632 29.4-157.4 -75.9 134.7 49.7 14.0 6.2 96 93 A H E -DE 59 87A 17 -9,-2.9 -9,-1.6 -2,-0.3 2,-0.3 -0.953 10.1-153.4-117.2 135.1 46.5 16.1 6.0 97 94 A A E +DE 58 86A 0 -39,-2.6 -39,-2.7 -2,-0.4 2,-0.3 -0.713 26.9 179.2 -97.4 148.1 45.5 19.1 8.1 98 95 A Y E -DE 57 85A 99 -13,-1.6 -13,-2.8 -2,-0.3 2,-0.3 -1.000 24.3-174.6-151.2 152.2 41.8 19.6 8.5 99 96 A Q E -D 56 0A 20 -43,-2.2 -43,-3.0 -2,-0.3 2,-0.4 -0.979 15.5-152.5-141.7 141.4 39.1 21.8 10.0 100 97 A S E -D 55 0A 36 -2,-0.3 -45,-0.2 -45,-0.2 -2,-0.0 -0.943 5.6-167.5-114.4 139.4 35.3 21.2 10.0 101 98 A I E -D 54 0A 5 -47,-2.6 -47,-2.6 -2,-0.4 5,-0.1 -0.976 22.6-129.8-123.8 116.6 32.7 23.9 10.1 102 99 A P E >> -D 53 0A 42 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.410 24.2-115.8 -64.3 148.6 29.1 22.9 10.8 103 100 A R G >4 S+ 0 0 42 -51,-2.6 3,-1.5 1,-0.3 -50,-0.1 0.865 114.9 61.9 -51.4 -43.5 26.6 24.3 8.3 104 101 A E G 34 S+ 0 0 139 -52,-0.3 -1,-0.3 1,-0.2 -51,-0.1 0.652 107.9 43.2 -52.4 -27.3 24.9 26.2 11.2 105 102 A K G <4 S+ 0 0 129 -3,-2.2 -1,-0.2 2,-0.0 -2,-0.2 0.448 85.8 121.2-103.4 -0.1 28.1 28.1 11.8 106 103 A L << + 0 0 18 -3,-1.5 2,-0.3 -4,-0.5 -3,-0.0 -0.383 25.4 139.7 -73.3 139.9 29.1 29.0 8.3 107 104 A S > - 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