==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 26-MAR-12 3VQM . COMPND 2 MOLECULE: SMALL HEAT SHOCK PROTEIN STHSP14.0; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TOKODAII; . AUTHOR Y.HANAZONO,K.TAKEDA,K.MIKI . 1528 23 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 67689.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1107 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 563 36.8 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 . 14 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 28 1.8 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 . 330 21.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 4.6 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 2 5 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 6 1 6 10 18 22 25 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 13 2 10 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 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 5 A G 0 0 78 0, 0.0 809,-0.0 0, 0.0 116,-0.0 0.000 360.0 360.0 360.0 130.9 -22.6 -48.9 -11.9 2 6 A K + 0 0 48 1,-0.2 3,-0.1 807,-0.1 806,-0.0 0.822 360.0 111.2 52.0 32.6 -21.9 -47.0 -15.1 3 7 A E > + 0 0 10 2,-0.1 3,-0.7 1,-0.1 -1,-0.2 0.106 57.7 93.1 -97.1 6.1 -18.2 -47.6 -14.8 4 8 A L T 3 S+ 0 0 1 1,-0.2 -1,-0.1 824,-0.0 -2,-0.0 0.661 71.4 63.5 -68.1 -17.8 -19.3 -49.7 -17.8 5 9 A Q T 3 S+ 0 0 29 -3,-0.1 -1,-0.2 2,-0.1 793,-0.1 0.691 83.2 92.9 -85.2 -20.0 -18.4 -46.8 -20.0 6 10 A K S < S- 0 0 92 -3,-0.7 2,-0.2 1,-0.1 794,-0.1 -0.257 82.4-115.7 -60.4 157.6 -14.7 -47.0 -19.1 7 11 A R > - 0 0 72 1,-0.1 3,-1.5 799,-0.0 4,-0.4 -0.656 30.5-100.3 -96.3 162.4 -12.5 -49.1 -21.3 8 12 A S G > S+ 0 0 13 1,-0.3 3,-2.1 -2,-0.2 121,-0.1 0.854 119.7 58.1 -53.7 -45.5 -10.8 -52.2 -20.0 9 13 A E G 3 S+ 0 0 44 1,-0.3 -1,-0.3 63,-0.1 64,-0.2 0.838 103.1 56.0 -50.7 -35.2 -7.4 -50.6 -19.6 10 14 A E G < S+ 0 0 92 -3,-1.5 2,-0.6 2,-0.1 -1,-0.3 0.536 87.2 90.4 -81.8 -5.3 -9.0 -48.1 -17.2 11 15 A L < - 0 0 11 -3,-2.1 62,-0.4 -4,-0.4 2,-0.2 -0.829 66.0-167.4 -94.1 125.5 -10.4 -50.8 -14.9 12 16 A S >> - 0 0 60 -2,-0.6 4,-1.6 60,-0.1 3,-0.7 -0.525 39.5 -97.8-112.5 174.9 -7.9 -51.5 -12.2 13 17 A R H 3> S+ 0 0 38 60,-0.5 4,-2.2 1,-0.2 65,-0.1 0.828 122.6 62.6 -57.4 -31.5 -7.3 -54.2 -9.5 14 18 A G H 3> S+ 0 0 30 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.883 100.9 48.8 -61.6 -43.0 -8.9 -51.7 -7.2 15 19 A F H X> S+ 0 0 33 -3,-0.7 3,-1.6 1,-0.2 4,-1.2 0.967 114.4 44.2 -60.2 -54.9 -12.2 -51.8 -9.1 16 20 A Y H 3X S+ 0 0 1 -4,-1.6 4,-2.3 1,-0.3 -2,-0.2 0.815 105.3 64.1 -63.0 -29.3 -12.3 -55.6 -9.1 17 21 A E H 3< S+ 0 0 68 -4,-2.2 63,-0.5 -5,-0.2 -1,-0.3 0.739 103.5 49.8 -64.8 -21.8 -11.2 -55.6 -5.4 18 22 A L H << S+ 0 0 145 -3,-1.6 -1,-0.2 -4,-0.7 -2,-0.2 0.870 122.7 27.5 -80.6 -39.5 -14.5 -53.9 -4.7 19 23 A V H < S+ 0 0 17 -4,-1.2 -2,-0.2 62,-0.1 -3,-0.1 0.496 94.3 143.5-107.6 -6.4 -16.8 -56.3 -6.6 20 24 A Y < + 0 0 6 -4,-2.3 60,-0.5 -5,-0.2 18,-0.1 -0.681 46.8 33.4 -96.8 148.6 -14.9 -59.6 -6.5 21 25 A P S S- 0 0 0 0, 0.0 17,-0.1 0, 0.0 2,-0.1 0.575 76.7-137.5 -86.4 156.6 -15.7 -62.4 -6.2 22 26 A P - 0 0 0 0, 0.0 15,-1.6 0, 0.0 2,-0.4 -0.451 32.2-154.5 -64.4 150.3 -19.0 -62.7 -8.0 23 27 A V E -A 36 0A 0 13,-0.2 157,-0.9 -2,-0.1 2,-0.4 -0.980 24.9-159.5-141.8 140.6 -21.3 -64.9 -5.9 24 28 A D E -AB 35 179A 0 11,-2.6 11,-3.1 -2,-0.4 2,-0.4 -0.970 14.9-172.1-113.0 135.1 -24.3 -67.2 -6.0 25 29 A M E +AB 34 178A 5 153,-2.6 152,-2.9 -2,-0.4 153,-2.0 -0.982 18.0 146.8-131.8 122.8 -26.3 -67.9 -2.9 26 30 A Y E -AB 33 176A 13 7,-2.1 7,-3.0 -2,-0.4 2,-0.5 -0.945 37.4-125.2-146.8 160.6 -29.1 -70.5 -2.7 27 31 A E E +AB 32 175A 20 148,-1.7 148,-1.5 -2,-0.3 2,-0.3 -0.963 31.8 159.5-114.1 129.0 -30.6 -73.0 -0.4 28 32 A E E > +A 31 0A 48 3,-2.1 3,-0.7 -2,-0.5 146,-0.1 -0.991 64.7 1.8-139.8 144.3 -31.0 -76.6 -1.1 29 33 A G T 3 S- 0 0 68 -2,-0.3 82,-0.1 1,-0.3 3,-0.1 0.871 129.3 -54.4 57.6 41.6 -31.6 -79.6 1.2 30 34 A G T 3 S+ 0 0 9 1,-0.2 80,-2.1 80,-0.1 81,-2.0 0.846 115.4 118.9 58.0 36.2 -31.7 -77.5 4.3 31 35 A Y E < -AC 28 109A 95 -3,-0.7 -3,-2.1 78,-0.2 2,-0.7 -0.995 62.2-139.2-134.3 130.8 -28.3 -76.0 3.4 32 36 A L E -AC 27 108A 0 76,-4.1 76,-3.6 -2,-0.4 2,-0.5 -0.796 28.3-163.7 -82.5 118.0 -27.2 -72.5 2.7 33 37 A V E -AC 26 107A 0 -7,-3.0 -7,-2.1 -2,-0.7 2,-0.6 -0.924 11.0-171.6-111.9 121.8 -24.9 -72.7 -0.3 34 38 A V E -AC 25 106A 2 72,-2.6 72,-2.5 -2,-0.5 2,-0.5 -0.944 6.3-169.8-113.8 114.4 -22.5 -69.9 -1.2 35 39 A V E -AC 24 105A 9 -11,-3.1 -11,-2.6 -2,-0.6 2,-0.4 -0.900 6.9-176.4-109.7 125.8 -20.6 -70.3 -4.5 36 40 A A E -AC 23 104A 1 68,-2.6 68,-2.1 -2,-0.5 2,-1.3 -0.959 29.7-136.4-128.2 137.1 -17.8 -67.9 -5.4 37 41 A D E + C 0 103A 2 -15,-1.6 2,-0.2 -2,-0.4 66,-0.2 -0.724 42.7 152.6 -85.3 91.0 -15.6 -67.5 -8.5 38 42 A L > - 0 0 3 64,-1.8 3,-0.5 -2,-1.3 64,-0.1 -0.510 22.7-176.1-120.4 61.6 -12.2 -67.0 -6.7 39 43 A A T 3 + 0 0 2 -2,-0.2 169,-0.2 1,-0.2 168,-0.1 -0.234 55.2 18.7 -62.2 142.6 -9.7 -68.2 -9.2 40 44 A G T 3 S+ 0 0 17 167,-2.6 2,-0.3 1,-0.2 -1,-0.2 0.810 84.5 125.6 75.3 36.9 -6.0 -68.4 -8.5 41 45 A F < - 0 0 6 -3,-0.5 2,-0.5 166,-0.2 -1,-0.2 -0.844 62.9-110.6-119.1 160.1 -5.6 -68.3 -4.8 42 46 A N >> - 0 0 94 19,-0.4 3,-2.4 -2,-0.3 4,-0.7 -0.804 23.6-137.1 -87.4 128.2 -3.9 -70.6 -2.3 43 47 A K T 34 S+ 0 0 56 -2,-0.5 3,-0.3 1,-0.3 1458,-0.2 0.711 104.3 61.7 -61.2 -20.0 -6.6 -72.4 -0.2 44 48 A E T 34 S+ 0 0 139 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.199 104.7 49.6 -89.0 15.3 -4.4 -71.8 2.9 45 49 A K T <4 S+ 0 0 107 -3,-2.4 2,-0.6 14,-0.0 16,-0.5 0.420 84.4 101.3-124.0 -12.4 -4.9 -68.1 2.3 46 50 A I < - 0 0 5 -4,-0.7 2,-0.6 -3,-0.3 14,-0.3 -0.680 54.0-169.1 -78.6 119.1 -8.7 -68.1 1.8 47 51 A K E +F 59 0B 123 12,-4.3 12,-2.8 -2,-0.6 2,-0.4 -0.894 11.2 169.6-118.5 103.7 -10.2 -66.9 5.1 48 52 A A E +F 58 0B 0 -2,-0.6 1451,-3.6 1451,-0.4 2,-0.3 -0.932 6.6 154.0-114.3 133.3 -14.0 -67.3 5.4 49 53 A R E -F 57 0B 94 8,-1.4 8,-2.9 -2,-0.4 2,-0.7 -0.988 41.6-121.6-150.2 153.2 -15.9 -66.8 8.6 50 54 A V E -F 56 0B 35 -2,-0.3 2,-0.4 6,-0.2 6,-0.3 -0.904 29.5-161.8 -96.8 112.6 -19.4 -65.9 9.7 51 55 A S E >> -F 55 0B 51 4,-2.6 4,-1.5 -2,-0.7 3,-0.7 -0.811 64.1 -11.4 -97.1 137.9 -19.3 -62.8 11.9 52 56 A G T 34 S- 0 0 77 -2,-0.4 -2,-0.1 1,-0.2 0, 0.0 -0.620 110.7 -67.1 72.4-133.6 -22.3 -62.0 14.1 53 57 A Q T 34 S+ 0 0 27 -2,-0.3 36,-2.1 32,-0.1 -1,-0.2 0.402 129.1 44.0-123.3 -4.3 -25.1 -64.4 13.0 54 58 A N T <4 S+ 0 0 53 -3,-0.7 31,-4.1 34,-0.2 2,-0.6 0.494 89.6 82.0-125.6 -14.7 -25.7 -62.9 9.6 55 59 A E E < -FG 51 84B 67 -4,-1.5 -4,-2.6 29,-0.2 2,-0.5 -0.900 46.1-164.3-124.7 111.9 -22.5 -62.2 7.7 56 60 A L E -FG 50 83B 0 27,-2.0 27,-2.6 -2,-0.6 2,-0.6 -0.734 17.8-161.3 -76.8 124.1 -20.3 -64.5 5.7 57 61 A I E -FG 49 82B 7 -8,-2.9 -8,-1.4 -2,-0.5 2,-0.8 -0.951 2.8-162.7-113.1 112.5 -17.0 -62.7 5.2 58 62 A I E +FG 48 81B 0 23,-2.7 23,-2.1 -2,-0.6 2,-0.4 -0.834 15.6 173.8 -99.4 106.7 -14.8 -64.0 2.4 59 63 A E E +FG 47 80B 39 -12,-2.8 -12,-4.3 -2,-0.8 2,-0.3 -0.903 2.5 163.4-113.4 141.7 -11.2 -62.8 2.7 60 64 A A E - G 0 79B 3 19,-1.8 19,-1.6 -2,-0.4 2,-0.4 -0.980 15.9-163.1-157.2 143.3 -8.3 -63.9 0.5 61 65 A E E + G 0 78B 90 -16,-0.5 -19,-0.4 -2,-0.3 2,-0.3 -0.990 11.8 170.5-132.3 136.0 -4.7 -62.7 -0.3 62 66 A R - 0 0 15 15,-2.4 2,-0.5 -2,-0.4 -21,-0.1 -0.985 30.3-122.0-141.4 154.0 -2.4 -63.6 -3.2 63 67 A E - 0 0 171 -2,-0.3 2,-0.5 2,-0.0 -2,-0.0 -0.822 22.6-165.6 -95.7 131.0 0.9 -62.4 -4.5 64 68 A I + 0 0 21 -2,-0.5 2,-0.6 2,-0.0 13,-0.1 -0.930 10.7 174.0-121.6 108.6 1.0 -61.2 -8.1 65 69 A T + 0 0 93 -2,-0.5 -2,-0.0 2,-0.0 0, 0.0 -0.917 4.4 166.7-117.0 106.2 4.4 -60.7 -9.7 66 70 A E - 0 0 29 -2,-0.6 67,-0.1 2,-0.1 65,-0.0 -0.739 17.9-161.6-123.8 83.8 4.3 -59.9 -13.4 67 71 A P + 0 0 69 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.281 51.7 41.3 -65.6 147.3 7.7 -58.6 -14.7 68 72 A G S S- 0 0 50 66,-0.1 2,-0.5 64,-0.1 66,-0.2 -0.751 103.5 -15.9 115.9-163.6 7.9 -56.7 -17.9 69 73 A V E -H 133 0C 71 64,-1.6 64,-1.8 -2,-0.3 2,-0.2 -0.687 64.8-135.2 -83.5 121.3 5.8 -54.0 -19.6 70 74 A K E +H 132 0C 147 -2,-0.5 62,-0.2 62,-0.2 3,-0.1 -0.500 38.9 152.2 -74.4 141.2 2.3 -53.6 -18.0 71 75 A Y E + 0 0 82 60,-2.1 2,-0.4 1,-0.4 61,-0.2 0.521 69.4 22.4-131.6 -46.5 -0.7 -53.3 -20.3 72 76 A L E +H 131 0C 8 59,-2.6 59,-1.7 -62,-0.0 -1,-0.4 -0.996 55.1 172.7-130.8 130.3 -3.7 -54.7 -18.4 73 77 A T E +H 130 0C 38 -2,-0.4 -60,-0.5 -62,-0.4 57,-0.2 -0.804 30.8 125.0-137.4 93.2 -3.9 -55.0 -14.6 74 78 A Q + 0 0 0 55,-0.6 -58,-0.3 -2,-0.3 56,-0.2 0.621 37.8 104.3-121.9 -26.2 -7.4 -56.0 -13.4 75 79 A R S S- 0 0 19 66,-0.2 2,-0.2 -3,-0.1 -62,-0.1 -0.454 71.3-119.3 -71.4 130.3 -7.0 -59.1 -11.3 76 80 A P - 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