==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 07-MAY-13 4KL6 . COMPND 2 MOLECULE: DNA POLYMERASE III, ALPHA SUBUNIT, NUCLEIC ACID B . SOURCE 2 ORGANISM_SCIENTIFIC: NOSTOC PUNCTIFORME; . AUTHOR A.S.ARANKO,J.S.OEEMIG,T.KAJANDER,H.IWAI . 542 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24402.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 395 72.9 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 . 228 42.1 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 . 16 3.0 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-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 . 58 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 7 1 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 . 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 . 18 6 11 8 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 4 4 0 0 0 0 2 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 -1 A G 0 0 67 0, 0.0 74,-0.5 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -75.7 -3.8 9.7 1.2 2 0 A G - 0 0 12 72,-0.2 2,-0.3 542,-0.1 70,-0.1 -0.437 360.0-113.1 94.3-172.4 -3.7 7.3 4.1 3 1 A A - 0 0 1 -2,-0.1 68,-1.9 522,-0.1 2,-0.3 -0.969 8.0-122.8-162.1 167.9 -0.9 5.1 5.4 4 2 A L B -AB 70 524A 0 520,-3.3 520,-2.5 -2,-0.3 66,-0.2 -0.884 33.0 -99.0-124.9 153.4 0.7 1.8 5.9 5 3 A S > - 0 0 4 64,-2.5 3,-2.0 -2,-0.3 15,-0.3 -0.283 42.3-104.4 -66.6 153.8 2.1 -0.2 8.9 6 4 A Y T 3 S+ 0 0 15 516,-0.4 15,-2.5 240,-0.3 16,-0.5 0.832 116.0 46.0 -51.7 -45.7 5.9 -0.2 9.5 7 5 A E T 3 S+ 0 0 31 12,-0.2 2,-0.3 13,-0.2 -1,-0.3 0.365 72.0 131.1 -92.2 6.3 6.6 -3.7 8.2 8 6 A T < - 0 0 15 -3,-2.0 12,-2.3 61,-0.2 2,-0.4 -0.473 62.4-127.6 -50.5 116.1 4.6 -3.4 5.0 9 7 A E E -J 19 0B 45 -2,-0.3 528,-2.3 10,-0.2 2,-0.4 -0.662 24.8-163.2 -85.3 124.8 7.2 -4.8 2.6 10 8 A I E -JK 18 536B 1 8,-3.4 8,-1.9 -2,-0.4 2,-0.4 -0.888 19.7-122.3-109.9 130.1 7.9 -2.6 -0.4 11 9 A L E -J 17 0B 60 524,-1.9 22,-0.6 -2,-0.4 2,-0.4 -0.590 33.5-178.2 -77.0 124.3 9.7 -3.8 -3.5 12 10 A T E > -JL 16 32B 3 4,-0.6 4,-1.4 -2,-0.4 20,-0.2 -0.941 30.0-139.5-119.2 149.4 12.9 -1.8 -4.3 13 11 A V T 4 S+ 0 0 73 18,-2.3 -1,-0.1 -2,-0.4 19,-0.1 0.932 102.9 41.1 -65.4 -49.3 15.3 -2.2 -7.2 14 12 A E T 4 S+ 0 0 99 17,-0.2 -1,-0.1 1,-0.2 16,-0.1 0.922 132.4 16.5 -67.8 -44.8 18.4 -1.7 -5.1 15 13 A Y T 4 S- 0 0 142 1,-0.4 2,-0.2 16,-0.2 -2,-0.2 0.517 89.7-134.8-112.6 -10.5 17.6 -3.7 -2.0 16 14 A G E < S+J 12 0B 27 -4,-1.4 -4,-0.6 2,-0.0 -1,-0.4 -0.538 74.0 8.7 76.3-155.7 14.7 -6.0 -2.8 17 15 A L E S+J 11 0B 73 -6,-0.2 -6,-0.2 -2,-0.2 -8,-0.1 -0.350 72.2 170.8 -64.2 126.6 11.9 -6.0 -0.1 18 16 A L E -J 10 0B 20 -8,-1.9 -8,-3.4 -2,-0.1 2,-0.3 -0.972 38.5-106.1-133.6 149.3 12.2 -3.4 2.6 19 17 A P E > -J 9 0B 18 0, 0.0 4,-2.1 0, 0.0 3,-0.4 -0.581 25.0-133.8 -75.0 137.5 9.8 -2.4 5.3 20 18 A I H > S+ 0 0 0 -12,-2.3 4,-2.7 -15,-0.3 5,-0.3 0.848 105.6 61.6 -61.7 -35.6 8.2 1.0 4.6 21 19 A G H > S+ 0 0 0 -15,-2.5 4,-2.9 -16,-0.3 5,-0.3 0.922 108.1 43.5 -52.1 -45.3 8.8 2.1 8.1 22 20 A K H > S+ 0 0 82 -16,-0.5 4,-2.1 -3,-0.4 6,-0.2 0.905 112.2 51.9 -69.8 -39.5 12.6 1.7 7.5 23 21 A I H <>S+ 0 0 1 -4,-2.1 5,-2.7 1,-0.2 -2,-0.2 0.911 119.5 37.2 -62.7 -38.3 12.4 3.4 4.0 24 22 A V H ><5S+ 0 0 10 -4,-2.7 3,-0.8 3,-0.2 -2,-0.2 0.929 117.8 46.5 -82.0 -46.9 10.7 6.3 5.6 25 23 A E H 3<5S+ 0 0 93 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.870 122.8 36.0 -67.2 -37.6 12.4 6.6 9.0 26 24 A K T 3<5S- 0 0 151 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.393 105.5-133.3 -90.7 4.4 15.9 6.3 7.5 27 25 A R T < 5 - 0 0 50 -3,-0.8 2,-0.4 1,-0.2 -3,-0.2 0.940 32.9-162.0 33.9 66.1 14.7 8.3 4.4 28 26 A I < - 0 0 26 -5,-2.7 2,-0.7 -6,-0.2 -1,-0.2 -0.600 16.4-130.2 -82.2 128.3 16.3 5.7 2.2 29 27 A E + 0 0 137 -2,-0.4 2,-0.3 -3,-0.2 -1,-0.1 -0.694 51.8 140.4 -75.3 116.7 17.0 6.6 -1.4 30 28 A C - 0 0 2 -2,-0.7 16,-2.3 16,-0.2 2,-0.5 -0.961 51.2-111.6-153.7 171.3 15.5 3.8 -3.5 31 29 A T E - M 0 45B 27 -2,-0.3 -18,-2.3 14,-0.2 -17,-0.2 -0.924 32.3-169.7-112.5 124.2 13.6 2.9 -6.6 32 30 A V E -LM 12 44B 0 12,-2.4 12,-1.6 -2,-0.5 2,-0.5 -0.583 24.2-105.6-108.9 172.5 10.2 1.4 -6.3 33 31 A Y E + M 0 43B 70 -22,-0.6 502,-1.8 502,-0.3 2,-0.3 -0.869 37.1 177.4-104.1 132.8 7.9 -0.2 -8.8 34 32 A S E - M 0 42B 1 8,-2.8 8,-2.5 -2,-0.5 2,-0.4 -0.822 20.4-138.5-123.8 169.1 4.8 1.6 -10.2 35 33 A V E - M 0 41B 15 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.992 17.7-143.1-127.6 134.9 2.1 0.9 -12.8 36 34 A D > - 0 0 42 4,-1.9 3,-1.7 -2,-0.4 494,-0.0 -0.268 38.6 -87.6 -88.8-178.2 0.8 3.4 -15.4 37 35 A N T 3 S+ 0 0 137 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.618 126.8 53.7 -64.3 -11.4 -2.8 3.9 -16.7 38 36 A N T 3 S- 0 0 140 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.144 122.0-100.2-112.4 20.7 -2.1 1.2 -19.4 39 37 A G S < S+ 0 0 53 -3,-1.7 2,-0.5 1,-0.2 -2,-0.1 0.595 71.9 148.4 76.9 11.1 -0.9 -1.5 -17.1 40 38 A N - 0 0 92 1,-0.0 -4,-1.9 0, 0.0 2,-0.6 -0.693 40.9-141.0 -82.1 122.4 2.8 -1.0 -17.7 41 39 A I E +M 35 0B 118 -2,-0.5 2,-0.2 -6,-0.2 -6,-0.2 -0.711 35.3 156.4 -79.5 122.4 5.2 -1.8 -14.8 42 40 A Y E -M 34 0B 63 -8,-2.5 -8,-2.8 -2,-0.6 2,-0.3 -0.790 32.7-118.8-133.3-177.9 8.0 0.7 -14.5 43 41 A T E +M 33 0B 69 -2,-0.2 -10,-0.2 -10,-0.2 -31,-0.0 -0.915 28.6 161.7-126.9 154.0 10.4 2.1 -11.9 44 42 A Q E -M 32 0B 16 -12,-1.6 -12,-2.4 -2,-0.3 3,-0.1 -0.970 40.9 -88.8-163.0 156.1 11.1 5.5 -10.4 45 43 A P E -M 31 0B 84 0, 0.0 484,-0.4 0, 0.0 2,-0.4 -0.283 43.7-103.8 -67.9 155.8 12.8 6.9 -7.3 46 44 A V - 0 0 3 -16,-2.3 482,-0.2 1,-0.1 -16,-0.2 -0.703 40.0-176.5 -69.2 131.2 10.9 7.5 -4.1 47 45 A A + 0 0 63 480,-2.9 2,-0.4 -2,-0.4 481,-0.2 0.723 61.7 29.7-106.9 -31.9 10.3 11.3 -4.0 48 46 A Q E -C 527 0A 29 479,-1.6 479,-2.4 2,-0.0 2,-0.6 -0.997 60.2-155.0-128.5 139.1 8.7 11.9 -0.7 49 47 A W E -C 526 0A 72 -2,-0.4 2,-0.7 477,-0.2 477,-0.2 -0.946 20.0-162.0-109.7 108.2 9.1 10.0 2.6 50 48 A H E -C 525 0A 59 475,-2.5 475,-2.0 -2,-0.6 2,-0.9 -0.830 13.9-168.6 -99.6 110.3 5.9 10.6 4.6 51 49 A D E -C 524 0A 81 -2,-0.7 473,-0.2 473,-0.2 -2,-0.0 -0.843 9.7-171.9 -89.8 106.8 5.9 9.9 8.4 52 50 A R E - 0 0 84 471,-2.2 472,-0.2 -2,-0.9 -1,-0.1 0.442 23.1-138.6 -86.7 4.0 2.2 10.1 9.0 53 51 A G E - 0 0 24 470,-0.5 470,-2.7 2,-0.0 2,-0.3 -0.346 56.1 -15.7 69.8-158.0 2.4 10.0 12.8 54 52 A E E S+C 522 0A 63 468,-0.3 2,-0.3 466,-0.1 468,-0.2 -0.623 71.9 155.1 -86.6 137.0 -0.1 7.9 14.8 55 53 A Q E -C 521 0A 92 466,-1.9 466,-2.0 -2,-0.3 2,-0.4 -0.959 49.7 -82.2-151.5 162.9 -3.3 6.7 13.1 56 54 A E E -C 520 0A 102 -2,-0.3 2,-0.4 464,-0.2 16,-0.3 -0.584 45.7-158.2 -75.0 127.8 -5.8 3.8 13.4 57 55 A V E - 0 0 0 462,-2.6 461,-2.8 -2,-0.4 462,-0.5 -0.877 7.1-165.2-112.8 137.6 -4.5 0.7 11.8 58 56 A F E -CD 517 70A 21 12,-2.6 12,-2.1 -2,-0.4 2,-0.6 -0.941 16.4-135.0-120.2 144.9 -6.7 -2.2 10.6 59 57 A E E -CD 516 69A 24 457,-4.3 457,-2.5 -2,-0.4 2,-0.7 -0.912 15.5-161.6-107.4 117.8 -5.4 -5.6 9.7 60 58 A Y E -CD 515 68A 0 8,-3.2 8,-1.6 -2,-0.6 2,-0.6 -0.864 3.9-158.7-103.0 110.4 -6.8 -7.1 6.5 61 59 A C E -CD 514 67A 28 453,-2.0 452,-2.3 -2,-0.7 453,-2.0 -0.803 12.8-147.6 -95.0 120.6 -6.4 -10.8 6.2 62 60 A L E > -C 512 0A 2 4,-2.8 3,-2.3 -2,-0.6 450,-0.3 -0.260 31.1 -95.2 -82.3 168.8 -6.6 -12.1 2.6 63 61 A E T 3 S+ 0 0 118 448,-2.2 449,-0.1 1,-0.3 -1,-0.1 0.900 127.3 51.9 -52.7 -46.0 -8.0 -15.4 1.5 64 62 A D T 3 S- 0 0 44 447,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.324 122.2-110.1 -73.3 10.2 -4.5 -17.0 1.4 65 63 A G S < S+ 0 0 41 -3,-2.3 -2,-0.1 1,-0.2 -1,-0.1 0.519 72.1 141.4 75.5 4.4 -4.1 -15.7 4.9 66 64 A S - 0 0 35 -5,-0.1 -4,-2.8 1,-0.1 2,-0.4 -0.362 44.2-124.8 -76.1 162.9 -1.5 -13.0 4.0 67 65 A L E - D 0 61A 75 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.871 24.6-176.6-121.3 139.8 -1.7 -9.7 5.8 68 66 A I E - D 0 60A 5 -8,-1.6 -8,-3.2 -2,-0.4 2,-0.6 -0.997 14.0-162.5-125.2 127.7 -2.0 -6.0 4.8 69 67 A R E + D 0 59A 35 -2,-0.4 -64,-2.5 -10,-0.2 2,-0.3 -0.920 32.1 132.0-115.3 109.6 -1.9 -3.6 7.7 70 68 A A E -AD 4 58A 0 -12,-2.1 -12,-2.6 -2,-0.6 -66,-0.2 -0.952 58.5 -88.0-148.4 162.9 -3.2 -0.1 6.8 71 69 A T > - 0 0 8 -68,-1.9 3,-1.2 -2,-0.3 14,-0.3 -0.436 51.3-107.6 -63.5 153.8 -5.5 2.8 7.7 72 70 A K T 3 S+ 0 0 73 -16,-0.3 14,-1.7 1,-0.2 15,-0.4 0.780 113.3 52.5 -55.0 -34.2 -9.0 2.4 6.3 73 71 A D T 3 S+ 0 0 88 11,-0.2 2,-0.2 12,-0.1 -1,-0.2 0.449 73.6 116.5 -92.4 -1.8 -8.5 5.0 3.6 74 72 A H < - 0 0 0 -3,-1.2 11,-2.6 -71,-0.2 2,-0.2 -0.514 63.4-127.2 -72.0 132.4 -5.3 3.9 1.8 75 73 A K E -NO 84 543C 69 468,-1.1 468,-3.1 -74,-0.5 2,-0.3 -0.522 26.4-175.0 -84.7 147.7 -6.1 3.1 -1.8 76 74 A F E -NO 83 542C 0 7,-2.7 7,-2.4 466,-0.3 2,-0.3 -0.957 33.2 -94.0-136.6 154.6 -5.2 -0.2 -3.5 77 75 A M E +N 82 0C 26 464,-2.4 19,-2.6 -2,-0.3 2,-0.4 -0.543 37.3 175.8 -77.2 126.4 -5.5 -1.4 -7.1 78 76 A V - 0 0 12 3,-2.9 3,-0.5 -2,-0.3 17,-0.1 -0.989 61.6 -64.9-127.3 121.6 -8.6 -3.4 -8.0 79 77 A D S S- 0 0 134 -2,-0.4 2,-0.8 15,-0.3 -1,-0.1 -0.106 123.7 -5.7 30.5-112.1 -8.8 -4.3 -11.7 80 78 A G S S+ 0 0 73 -3,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.475 126.1 61.9-101.9 63.8 -9.1 -0.9 -13.4 81 79 A Q - 0 0 103 -2,-0.8 -3,-2.9 -3,-0.5 2,-0.5 -0.916 67.8-127.7-176.5 145.3 -9.4 1.3 -10.3 82 80 A M E +N 77 0C 50 -2,-0.3 -5,-0.2 -5,-0.2 -7,-0.1 -0.922 40.3 171.8-100.0 128.3 -7.8 2.6 -7.1 83 81 A L E -N 76 0C 12 -7,-2.4 -7,-2.7 -2,-0.5 460,-0.1 -0.983 41.4 -92.7-137.2 150.3 -10.0 2.2 -4.1 84 82 A P E > -N 75 0C 35 0, 0.0 4,-2.2 0, 0.0 -9,-0.3 -0.323 39.2-125.8 -57.2 138.8 -9.8 2.6 -0.3 85 83 A I H > S+ 0 0 0 -11,-2.6 4,-2.1 -14,-0.3 -12,-0.1 0.846 109.1 56.2 -61.1 -31.0 -8.8 -0.8 1.1 86 84 A D H > S+ 0 0 13 -14,-1.7 4,-3.8 2,-0.2 -1,-0.2 0.921 107.7 48.1 -69.1 -41.4 -11.8 -0.8 3.5 87 85 A E H > S+ 0 0 60 -15,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.911 108.3 54.3 -60.7 -41.8 -14.1 -0.3 0.6 88 86 A I H <>S+ 0 0 1 -4,-2.2 5,-2.0 1,-0.2 4,-0.3 0.897 114.1 43.7 -59.9 -36.9 -12.3 -3.2 -1.3 89 87 A F H ><5S+ 0 0 48 -4,-2.1 3,-1.2 -5,-0.2 -2,-0.2 0.947 113.2 48.3 -72.1 -51.3 -13.1 -5.2 1.9 90 88 A E H 3<5S+ 0 0 128 -4,-3.8 -2,-0.2 1,-0.2 -1,-0.2 0.827 117.4 43.8 -57.0 -33.1 -16.7 -4.0 2.3 91 89 A R T 3<5S- 0 0 126 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.409 104.1-127.1 -95.4 1.0 -17.4 -4.8 -1.4 92 90 A E T < 5 + 0 0 142 -3,-1.2 2,-0.2 -4,-0.3 -3,-0.2 0.870 52.0 158.0 53.3 43.5 -15.6 -8.2 -1.6 93 91 A L < - 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