==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 28-MAY-07 2Q2G . COMPND 2 MOLECULE: HEAT SHOCK 40 KDA PROTEIN, PUTATIVE (FRAGMENT); . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPTOSPORIDIUM PARVUM IOWA II; . AUTHOR A.K.WERNIMONT,J.LEW,L.LIN,A.HASSANALI,I.KOZIERADZKI, . 337 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20733.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 19.9 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 51 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 3 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 0 4 3 0 1 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 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 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 4 A R 0 0 226 0, 0.0 71,-3.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-176.9 -33.6 41.7 22.7 2 5 A S E -a 72 0A 79 69,-0.2 2,-0.3 59,-0.1 71,-0.2 -0.928 360.0-162.9-177.1 153.7 -33.4 38.5 20.7 3 6 A H E -a 73 0A 60 69,-1.0 71,-2.5 -2,-0.3 2,-0.3 -0.973 24.3-114.6-144.0 155.1 -31.2 35.6 19.8 4 7 A E E -a 74 0A 114 -2,-0.3 71,-0.2 69,-0.2 52,-0.0 -0.720 23.4-174.0 -99.0 144.6 -31.1 32.9 17.0 5 8 A V E -a 75 0A 54 69,-2.9 71,-2.2 -2,-0.3 -2,-0.0 -0.998 29.4-112.4-135.2 130.9 -31.6 29.2 17.3 6 9 A P E -a 76 0A 81 0, 0.0 2,-0.5 0, 0.0 71,-0.2 -0.317 19.9-157.5 -64.5 144.4 -31.2 26.6 14.5 7 10 A L E -a 77 0A 10 69,-3.1 71,-2.2 15,-0.0 2,-0.5 -0.930 16.4-147.8-121.1 101.6 -34.4 24.9 13.3 8 11 A L E +a 78 0A 82 -2,-0.5 2,-0.3 69,-0.2 71,-0.2 -0.599 25.2 168.1 -78.8 122.6 -33.3 21.6 11.7 9 12 A V E -a 79 0A 0 69,-2.4 71,-2.8 -2,-0.5 2,-0.2 -0.820 28.0-121.2-127.1 165.8 -35.4 20.3 8.8 10 13 A T > - 0 0 37 -2,-0.3 4,-2.0 69,-0.2 3,-0.3 -0.683 26.4-114.6-104.8 162.3 -35.1 17.6 6.1 11 14 A L H > S+ 0 0 6 69,-0.3 4,-1.4 1,-0.2 5,-0.2 0.839 118.8 60.0 -62.2 -31.2 -35.0 18.1 2.3 12 15 A E H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.906 105.7 46.9 -63.1 -39.1 -38.3 16.1 2.3 13 16 A E H > S+ 0 0 28 -3,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.887 112.4 48.6 -69.4 -37.7 -39.9 18.8 4.5 14 17 A L H < S+ 0 0 0 -4,-2.0 34,-2.8 2,-0.2 35,-0.2 0.700 113.6 49.5 -75.2 -19.2 -38.6 21.6 2.4 15 18 A Y H < S+ 0 0 18 -4,-1.4 -2,-0.2 32,-0.2 -1,-0.2 0.921 125.7 22.8 -83.3 -50.4 -39.9 19.8 -0.7 16 19 A L H < S- 0 0 109 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.694 105.1-122.4 -91.6 -19.5 -43.4 19.0 0.4 17 20 A G < - 0 0 18 -4,-2.3 2,-0.3 -5,-0.3 29,-0.2 0.053 27.2-145.6 86.7 152.6 -43.9 21.7 3.1 18 21 A K E -C 45 0B 105 27,-1.9 27,-3.3 -4,-0.1 2,-0.5 -0.962 13.8-154.7-159.0 137.5 -44.7 20.6 6.7 19 22 A R E +C 44 0B 146 -2,-0.3 2,-0.3 25,-0.2 25,-0.2 -0.967 38.1 145.5-113.5 123.0 -46.7 21.9 9.6 20 23 A K E -C 43 0B 60 23,-2.3 23,-2.5 -2,-0.5 2,-0.4 -0.981 49.1 -96.9-154.8 168.2 -45.6 20.7 13.0 21 24 A K E -C 42 0B 142 -2,-0.3 2,-0.4 21,-0.2 21,-0.2 -0.731 36.5-167.5 -89.8 132.9 -45.0 21.4 16.7 22 25 A I E -C 41 0B 26 19,-3.6 19,-2.8 -2,-0.4 2,-0.5 -0.935 15.8-135.3-121.6 141.9 -41.6 22.5 17.8 23 26 A K E +C 40 0B 140 -2,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.858 27.4 179.7 -99.5 127.5 -40.1 22.7 21.3 24 27 A V E -C 39 0B 11 15,-2.9 15,-2.3 -2,-0.5 2,-0.3 -0.847 12.7-151.5-121.9 162.4 -38.2 25.8 22.1 25 28 A T E +C 38 0B 70 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.971 18.2 165.3-133.6 147.7 -36.4 26.9 25.3 26 29 A R E -C 37 0B 15 11,-1.6 11,-2.4 -2,-0.3 2,-0.3 -0.987 40.7 -87.2-158.8 159.2 -35.7 30.4 26.7 27 30 A K E +C 36 0B 86 -2,-0.3 36,-2.1 9,-0.2 2,-0.3 -0.536 47.2 168.1 -74.2 126.8 -34.7 32.2 29.9 28 31 A R E -C 35 0B 26 7,-2.3 7,-2.5 -2,-0.3 2,-0.6 -0.997 35.7-120.8-140.8 142.8 -37.5 33.1 32.3 29 32 A F E +C 34 0B 54 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.759 35.8 173.2 -86.7 118.3 -37.5 34.4 35.9 30 33 A I E > -C 33 0B 62 3,-2.8 3,-1.8 -2,-0.6 -2,-0.0 -0.991 69.5 -15.4-128.5 121.7 -39.4 32.0 38.2 31 34 A E T 3 S- 0 0 165 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.937 129.3 -52.4 49.3 51.2 -39.4 32.4 42.0 32 35 A H T 3 S+ 0 0 177 1,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.465 119.9 100.5 67.8 5.1 -36.4 34.8 41.8 33 36 A K E < S-C 30 0B 141 -3,-1.8 -3,-2.8 -5,-0.0 2,-0.3 -0.939 75.5-115.7-124.4 145.2 -34.2 32.5 39.7 34 37 A V E -C 29 0B 77 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.597 41.1-178.9 -75.3 133.5 -33.4 32.3 36.0 35 38 A R E -C 28 0B 135 -7,-2.5 -7,-2.3 -2,-0.3 2,-1.1 -0.929 35.4-118.4-132.5 156.3 -34.7 29.1 34.5 36 39 A N E -C 27 0B 109 -2,-0.3 2,-0.5 -9,-0.2 -9,-0.2 -0.805 39.6-163.6 -95.4 95.3 -34.6 27.5 31.1 37 40 A E E -C 26 0B 73 -11,-2.4 -11,-1.6 -2,-1.1 2,-0.2 -0.709 6.3-146.6 -88.5 125.1 -38.4 27.3 30.3 38 41 A E E +C 25 0B 110 -2,-0.5 2,-0.3 -13,-0.2 -13,-0.2 -0.593 21.3 173.3 -86.3 147.2 -39.6 25.0 27.5 39 42 A N E -C 24 0B 59 -15,-2.3 -15,-2.9 -2,-0.2 2,-0.5 -0.962 27.4-124.0-147.4 157.8 -42.6 26.0 25.4 40 43 A I E +C 23 0B 97 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.935 29.8 177.2-112.0 125.0 -44.2 24.5 22.3 41 44 A V E -C 22 0B 13 -19,-2.8 -19,-3.6 -2,-0.5 2,-0.4 -0.844 25.3-121.5-122.4 161.3 -44.7 26.5 19.2 42 45 A E E -C 21 0B 104 -2,-0.3 2,-0.4 -21,-0.2 -21,-0.2 -0.799 24.1-170.2-102.7 142.7 -46.0 25.7 15.8 43 46 A V E -C 20 0B 3 -23,-2.5 -23,-2.3 -2,-0.4 2,-0.6 -0.982 13.3-153.9-131.6 143.5 -44.0 26.2 12.6 44 47 A E E -C 19 0B 89 -2,-0.4 2,-0.5 -25,-0.2 -25,-0.2 -0.950 13.7-154.5-118.3 107.2 -45.2 26.0 9.0 45 48 A I E -C 18 0B 2 -27,-3.3 -27,-1.9 -2,-0.6 -2,-0.0 -0.747 14.5-144.9 -83.9 124.0 -42.3 25.0 6.7 46 49 A K > - 0 0 68 -2,-0.5 3,-1.9 -29,-0.2 -29,-0.2 -0.682 24.0 -97.2 -92.4 142.0 -43.0 26.3 3.2 47 50 A P T 3 S+ 0 0 56 0, 0.0 -32,-0.2 0, 0.0 -33,-0.1 -0.294 107.2 14.6 -56.8 134.3 -41.9 24.5 -0.0 48 51 A G T 3 S+ 0 0 2 -34,-2.8 95,-0.4 1,-0.2 96,-0.1 0.311 81.2 153.9 86.4 -10.0 -38.6 25.8 -1.4 49 52 A W < - 0 0 41 -3,-1.9 -1,-0.2 -35,-0.2 2,-0.2 -0.207 36.5-135.1 -50.6 144.9 -37.5 27.8 1.7 50 53 A K > - 0 0 90 1,-0.1 3,-1.6 28,-0.0 27,-0.2 -0.622 24.6 -85.3-103.5 164.4 -33.7 28.1 1.7 51 54 A D T 3 S+ 0 0 89 1,-0.2 27,-0.2 -2,-0.2 3,-0.1 -0.425 114.6 38.0 -64.7 138.3 -31.2 27.7 4.5 52 55 A G T 3 S+ 0 0 41 25,-2.0 -1,-0.2 1,-0.4 26,-0.1 0.211 76.6 146.6 104.0 -15.5 -30.8 30.9 6.5 53 56 A T < - 0 0 38 -3,-1.6 24,-2.2 24,-0.1 2,-0.4 -0.360 40.6-141.4 -57.5 126.6 -34.5 31.8 6.4 54 57 A K E -B 76 0A 116 22,-0.2 2,-0.5 -3,-0.1 22,-0.2 -0.803 16.4-167.4-100.9 135.8 -35.4 33.5 9.6 55 58 A L E -B 75 0A 26 20,-2.8 20,-2.8 -2,-0.4 2,-0.7 -0.977 11.6-154.4-120.8 116.6 -38.6 33.1 11.6 56 59 A T E -B 74 0A 89 -2,-0.5 2,-0.9 18,-0.2 18,-0.2 -0.832 5.4-165.7 -98.6 115.4 -39.2 35.7 14.3 57 60 A Y E > -B 73 0A 53 16,-3.3 16,-2.2 -2,-0.7 3,-1.7 -0.836 21.8-137.7 -99.9 99.3 -41.4 34.6 17.2 58 61 A S T 3 S+ 0 0 97 -2,-0.9 14,-0.2 1,-0.3 13,-0.1 -0.299 81.7 5.2 -58.7 132.0 -42.3 37.8 19.1 59 62 A G T 3 S+ 0 0 29 11,-0.2 -1,-0.3 1,-0.1 13,-0.2 0.435 99.7 103.6 75.9 -0.2 -42.2 37.4 22.9 60 63 A E < + 0 0 41 -3,-1.7 12,-0.2 13,-0.1 -2,-0.1 0.369 64.7 88.8 -93.5 4.9 -40.9 33.9 22.8 61 64 A G S S- 0 0 0 10,-2.3 12,-0.2 -4,-0.2 -35,-0.1 -0.003 86.4 -49.9 -89.9-164.7 -37.3 35.0 23.7 62 65 A D - 0 0 57 10,-0.4 9,-3.0 8,-0.2 2,-0.5 -0.322 43.8-132.5 -71.1 149.7 -35.3 35.6 26.9 63 66 A Q - 0 0 30 -36,-2.1 6,-0.1 7,-0.2 -1,-0.1 -0.903 12.8-164.7-103.4 124.4 -36.6 37.7 29.8 64 67 A E S S+ 0 0 156 -2,-0.5 -1,-0.1 5,-0.3 -36,-0.1 0.871 70.6 10.1 -77.0 -41.0 -33.9 40.2 31.1 65 68 A S S > S- 0 0 49 4,-0.1 3,-0.8 -36,-0.0 -1,-0.2 -0.943 94.1 -79.5-137.8 158.1 -35.5 41.1 34.4 66 69 A P T 3 S+ 0 0 80 0, 0.0 2,-0.4 0, 0.0 3,-0.1 -0.302 114.3 4.9 -59.0 137.8 -38.4 39.8 36.6 67 70 A G T 3 S+ 0 0 77 1,-0.2 -3,-0.0 -38,-0.2 0, 0.0 0.027 100.0 122.5 78.5 -31.7 -41.8 41.0 35.3 68 71 A T S < S- 0 0 58 -3,-0.8 -1,-0.2 -2,-0.4 -3,-0.0 -0.268 75.0 -91.9 -64.1 152.3 -40.3 42.7 32.3 69 72 A S - 0 0 111 -3,-0.1 -5,-0.3 1,-0.1 -1,-0.1 -0.464 45.2-109.4 -70.7 131.5 -41.6 41.6 28.9 70 73 A P - 0 0 41 0, 0.0 -7,-0.2 0, 0.0 -8,-0.2 -0.146 28.9-123.9 -57.1 149.5 -39.7 38.8 27.2 71 74 A G - 0 0 11 -9,-3.0 -10,-2.3 1,-0.1 2,-0.3 0.067 39.5 -78.2 -78.6-162.8 -37.6 39.5 24.1 72 75 A D E -a 2 0A 56 -71,-3.0 -69,-1.0 -12,-0.2 2,-0.5 -0.719 29.3-137.4-105.8 155.9 -38.0 37.7 20.8 73 76 A L E -aB 3 57A 1 -16,-2.2 -16,-3.3 -2,-0.3 2,-0.5 -0.931 14.6-159.9-110.5 128.5 -36.9 34.3 19.6 74 77 A V E -aB 4 56A 12 -71,-2.5 -69,-2.9 -2,-0.5 2,-0.4 -0.940 3.2-162.6-113.5 120.1 -35.4 33.9 16.1 75 78 A L E -aB 5 55A 3 -20,-2.8 -20,-2.8 -2,-0.5 2,-0.5 -0.817 5.3-156.1-100.1 139.1 -35.4 30.4 14.4 76 79 A I E -aB 6 54A 25 -71,-2.2 -69,-3.1 -2,-0.4 -22,-0.2 -0.970 19.4-120.8-121.3 122.9 -33.1 29.8 11.5 77 80 A I E +a 7 0A 3 -24,-2.2 -25,-2.0 -2,-0.5 2,-0.4 -0.371 34.3 177.2 -62.0 130.0 -33.7 27.1 8.9 78 81 A Q E -a 8 0A 91 -71,-2.2 -69,-2.4 -27,-0.2 2,-0.5 -0.992 21.7-135.6-137.6 127.1 -30.9 24.6 8.7 79 82 A T E -a 9 0A 38 -2,-0.4 -69,-0.2 -71,-0.2 3,-0.1 -0.718 14.7-132.2 -92.7 127.5 -31.0 21.5 6.5 80 83 A K - 0 0 106 -71,-2.8 -69,-0.3 -2,-0.5 -1,-0.0 -0.348 36.9 -89.7 -72.4 151.3 -29.9 18.1 7.7 81 84 A T - 0 0 144 -71,-0.1 -1,-0.1 -2,-0.1 5,-0.1 -0.367 42.7-145.1 -61.3 136.1 -27.6 16.0 5.6 82 85 A H - 0 0 23 3,-0.5 -1,-0.1 1,-0.1 -3,-0.0 -0.835 8.7-138.8-104.3 144.8 -29.5 13.8 3.2 83 86 A P S S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.627 97.6 24.0 -78.7 -9.1 -28.3 10.3 2.3 84 87 A R S S+ 0 0 84 1,-0.2 11,-0.5 10,-0.0 2,-0.3 0.707 115.4 46.7-122.3 -38.9 -29.2 10.5 -1.4 85 88 A F - 0 0 10 9,-0.1 -3,-0.5 7,-0.0 2,-0.4 -0.823 49.5-156.9-117.3 155.6 -29.3 14.2 -2.6 86 89 A T E -D 93 0C 92 7,-1.9 7,-2.9 -2,-0.3 2,-0.3 -0.989 26.8-134.0-120.7 126.4 -27.2 17.4 -2.3 87 90 A R E -D 92 0C 55 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.684 21.1-176.6 -86.4 138.9 -29.2 20.6 -2.9 88 91 A D E > -D 91 0C 77 3,-2.4 3,-2.6 -2,-0.3 2,-0.5 -0.846 64.1 -62.5-134.7 95.1 -27.7 23.3 -5.2 89 92 A D T 3 S- 0 0 99 -2,-0.4 61,-0.1 1,-0.3 -1,-0.0 -0.527 121.7 -17.3 61.5-113.5 -29.9 26.4 -5.3 90 93 A C T 3 S+ 0 0 19 -2,-0.5 50,-2.0 -3,-0.1 60,-0.7 0.334 125.6 88.4-101.5 7.3 -33.1 25.0 -6.7 91 94 A H E < -D 88 0C 50 -3,-2.6 -3,-2.4 48,-0.2 2,-0.4 -0.564 65.0-141.2-102.0 165.9 -31.5 21.8 -8.1 92 95 A L E -De 87 152C 4 59,-2.4 61,-3.3 -5,-0.2 2,-0.4 -0.995 14.0-155.7-125.8 131.8 -30.8 18.4 -6.6 93 96 A I E -De 86 153C 20 -7,-2.9 -7,-1.9 -2,-0.4 2,-0.4 -0.909 9.0-173.7-110.4 137.2 -27.6 16.5 -7.3 94 97 A X E - 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