==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-FEB-07 2JGU . COMPND 2 MOLECULE: DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR D.U.KIM,H.S.CHO . 711 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37376.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 478 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 1.3 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 . 2 0.3 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 . 52 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 209 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.1 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 2 3 0 2 2 1 1 0 1 1 0 3 0 0 0 1 1 0 0 1 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 0 2 4 4 2 1 1 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 . 1 2 1 0 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 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 M 0 0 26 0, 0.0 20,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 160.9 -8.8 11.3 -45.0 2 2 A I E +A 20 0A 16 18,-0.3 127,-1.5 125,-0.2 18,-0.2 -0.814 360.0 171.1-116.6 157.6 -10.7 10.9 -41.8 3 3 A L E - 0 0 2 16,-1.9 339,-0.4 1,-0.5 2,-0.3 0.561 59.8 -19.1-135.2 -27.5 -9.9 12.2 -38.4 4 4 A D E -A 19 0A 14 15,-0.9 15,-1.6 336,-0.1 -1,-0.5 -0.994 44.5-143.0-174.4 172.4 -12.7 11.6 -36.2 5 5 A V E +A 18 0A 7 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.971 25.9 144.4-157.6 134.8 -16.3 10.8 -35.7 6 6 A D E -A 17 0A 25 11,-1.3 11,-2.9 -2,-0.3 2,-0.3 -0.921 32.9-124.8-156.7 171.7 -18.9 11.8 -33.2 7 7 A Y E -A 16 0A 61 -2,-0.3 2,-0.3 9,-0.3 9,-0.3 -0.955 10.4-155.3-130.6 152.0 -22.6 12.5 -33.3 8 8 A I E -A 15 0A 48 7,-2.2 7,-2.7 -2,-0.3 2,-0.7 -0.839 22.1-121.4-117.2 159.8 -24.9 15.4 -32.4 9 9 A T E -A 14 0A 69 -2,-0.3 2,-1.0 5,-0.2 80,-0.0 -0.894 18.3-171.8-108.6 116.9 -28.4 15.3 -31.5 10 10 A E S S- 0 0 93 3,-1.9 3,-0.0 -2,-0.7 -2,-0.0 -0.786 73.9 -47.9-107.0 83.6 -30.7 17.3 -33.6 11 11 A E S S- 0 0 181 -2,-1.0 -1,-0.1 1,-0.2 -2,-0.0 0.926 120.3 -21.5 49.4 86.2 -33.8 16.9 -31.5 12 12 A G S S+ 0 0 47 1,-0.2 -1,-0.2 -3,-0.0 -3,-0.0 0.307 122.9 97.5 79.5 -8.4 -34.6 13.4 -30.4 13 13 A K - 0 0 107 76,-0.1 -3,-1.9 -3,-0.0 2,-0.3 -0.918 69.0-134.3-118.3 139.7 -32.4 12.3 -33.4 14 14 A P E -A 9 0A 15 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.697 19.3-165.2 -93.8 138.3 -28.8 11.2 -33.5 15 15 A V E -A 8 0A 3 -7,-2.7 -7,-2.2 -2,-0.3 2,-0.2 -0.973 11.7-143.5-127.7 127.8 -26.4 12.5 -36.2 16 16 A I E -AB 7 31A 2 15,-2.1 15,-2.0 -2,-0.4 2,-0.4 -0.592 17.0-165.7 -83.8 142.3 -23.0 11.3 -37.2 17 17 A R E -AB 6 30A 45 -11,-2.9 -11,-1.3 -2,-0.2 2,-0.5 -0.981 3.9-155.2-126.7 141.0 -20.4 13.9 -38.2 18 18 A L E -AB 5 29A 5 11,-2.4 11,-1.1 -2,-0.4 2,-0.9 -0.970 7.8-153.2-120.3 132.7 -17.2 13.1 -40.0 19 19 A F E +AB 4 28A 10 -15,-1.6 -16,-1.9 -2,-0.5 -15,-0.9 -0.904 28.4 177.6 -99.7 108.3 -14.1 15.2 -39.8 20 20 A K E -AB 2 27A 43 7,-3.5 7,-2.1 -2,-0.9 2,-0.5 -0.775 26.2-145.2-110.4 159.3 -12.5 14.5 -43.1 21 21 A K E - B 0 26A 21 -20,-2.6 2,-0.3 -2,-0.3 5,-0.3 -0.998 26.9-178.0-116.9 126.8 -9.3 16.1 -44.3 22 22 A E - 0 0 69 3,-3.7 4,-0.1 -2,-0.5 -2,-0.0 -0.662 53.4 -46.8-147.7 103.0 -9.6 16.5 -48.1 23 23 A N S S- 0 0 161 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.725 125.1 -35.4 43.1 48.4 -6.9 17.9 -50.6 24 24 A G S S+ 0 0 65 1,-0.5 2,-0.3 110,-0.0 -1,-0.2 0.397 125.1 111.7 94.4 8.0 -6.1 20.9 -48.4 25 25 A K - 0 0 133 2,-0.0 -3,-3.7 0, 0.0 -1,-0.5 -0.764 52.0-157.6-109.2 159.6 -9.7 21.0 -47.4 26 26 A F E +B 21 0A 62 -2,-0.3 2,-0.4 -5,-0.3 -5,-0.2 -0.998 28.8 144.2-136.0 131.1 -11.2 20.3 -44.1 27 27 A K E -B 20 0A 65 -7,-2.1 -7,-3.5 -2,-0.4 2,-0.4 -0.983 39.7-101.2-167.5-179.3 -14.7 19.3 -43.5 28 28 A I E +B 19 0A 69 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.886 13.0 179.2-119.7 130.4 -17.8 17.9 -42.4 29 29 A E E -B 18 0A 77 -11,-1.1 -11,-2.4 -2,-0.4 2,-0.5 -0.913 13.4-163.0-116.6 132.8 -20.2 15.2 -43.5 30 30 A H E -B 17 0A 93 -2,-0.4 2,-0.5 -13,-0.2 -13,-0.2 -0.992 5.5-161.9-123.7 134.1 -23.3 14.5 -41.4 31 31 A D E +B 16 0A 24 -15,-2.0 -15,-2.1 -2,-0.5 3,-0.1 -0.977 19.6 168.1-122.2 125.2 -25.0 11.4 -42.0 32 32 A R + 0 0 149 -2,-0.5 -1,-0.1 -17,-0.2 -17,-0.0 0.051 60.3 82.6-116.8 15.0 -28.5 10.8 -40.9 33 33 A T S S+ 0 0 130 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 0.301 76.2 97.6-100.4 19.8 -29.6 7.5 -42.6 34 34 A F - 0 0 37 -20,-0.2 -18,-0.1 -3,-0.1 86,-0.0 -0.850 53.6-168.8-108.8 135.0 -27.9 5.5 -39.8 35 35 A R - 0 0 92 -2,-0.4 53,-0.1 1,-0.1 54,-0.1 -0.938 22.7-110.3-126.9 145.1 -29.6 4.0 -36.7 36 36 A P + 0 0 5 0, 0.0 51,-2.0 0, 0.0 2,-0.3 -0.049 44.6 167.8 -59.7 165.2 -28.6 2.3 -33.3 37 37 A Y E -C 86 0B 16 49,-0.3 2,-0.3 74,-0.1 49,-0.2 -0.997 26.6-166.3-173.4 165.2 -29.2 -1.4 -32.7 38 38 A I E -C 85 0B 1 47,-1.2 47,-2.4 -2,-0.3 2,-0.3 -0.970 26.4-114.5-154.8 164.4 -28.8 -4.7 -30.8 39 39 A Y E -CD 84 110B 8 71,-2.0 71,-2.2 -2,-0.3 2,-0.4 -0.808 16.6-159.8-109.4 147.1 -29.5 -8.4 -31.3 40 40 A A E -CD 83 109B 0 43,-0.9 43,-3.7 -2,-0.3 2,-0.5 -0.987 10.6-146.2-127.4 132.9 -31.9 -10.7 -29.6 41 41 A L E - D 0 108B 43 67,-3.4 66,-1.9 -2,-0.4 67,-0.6 -0.836 31.8-140.0 -96.5 133.4 -31.5 -14.4 -29.7 42 42 A L E - D 0 106B 24 -2,-0.5 3,-0.3 39,-0.5 64,-0.2 -0.899 31.0-150.7-131.8 138.8 -34.9 -16.0 -29.7 43 43 A R S S- 0 0 166 62,-3.1 2,-0.3 -2,-0.5 -1,-0.1 0.806 100.6 -10.1 -47.7 -46.5 -37.0 -18.9 -28.4 44 44 A D > - 0 0 86 61,-0.2 3,-3.4 1,-0.1 4,-0.4 -0.818 62.6-135.2-166.9 114.1 -39.1 -18.9 -31.4 45 45 A D G > S+ 0 0 70 -3,-0.3 3,-1.3 -2,-0.3 4,-0.2 0.775 99.9 85.1 -41.5 -23.4 -38.9 -16.3 -34.0 46 46 A S G > S+ 0 0 77 1,-0.3 3,-0.9 2,-0.1 -1,-0.3 0.795 76.5 63.4 -51.6 -32.9 -42.6 -16.6 -33.7 47 47 A K G X + 0 0 15 -3,-3.4 3,-7.0 1,-0.3 4,-0.3 0.868 68.6 109.5 -61.0 -38.4 -42.7 -14.2 -30.7 48 48 A I G < S+ 0 0 52 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.1 0.560 77.1 52.4 -11.9 -36.8 -41.4 -11.4 -32.8 49 49 A E G < S+ 0 0 146 -3,-0.9 3,-0.4 -4,-0.2 4,-0.3 0.798 110.8 47.1 -85.1 -13.6 -44.7 -9.8 -32.6 50 50 A E S X S+ 0 0 97 -3,-7.0 3,-1.1 1,-0.2 2,-0.9 0.961 107.9 54.1 -83.5 -52.0 -44.7 -10.0 -28.8 51 51 A V T 3 S+ 0 0 3 -4,-0.3 -1,-0.2 1,-0.2 -3,-0.1 0.015 96.5 65.9 -75.5 33.4 -41.1 -8.7 -28.2 52 52 A K T 3 S+ 0 0 95 -2,-0.9 13,-0.4 -3,-0.4 -1,-0.2 0.613 81.2 74.5-116.8 -32.0 -41.5 -5.4 -30.2 53 53 A K < + 0 0 152 -3,-1.1 -2,-0.1 -4,-0.3 2,-0.1 0.635 66.1 135.0 -58.2 -14.1 -44.0 -3.7 -27.9 54 54 A I - 0 0 23 -4,-0.2 2,-0.1 10,-0.1 11,-0.1 -0.076 39.9-158.3 -44.3 106.5 -41.3 -3.0 -25.3 55 55 A T - 0 0 76 9,-0.1 9,-0.2 -2,-0.1 2,-0.2 -0.427 11.4-173.0 -92.4 164.9 -41.5 0.5 -24.0 56 56 A G - 0 0 5 7,-2.4 2,-0.2 -2,-0.1 40,-0.1 -0.580 13.7-147.7-129.3-160.4 -39.0 2.7 -22.3 57 57 A E + 0 0 132 5,-0.2 5,-0.3 -2,-0.2 2,-0.1 -0.594 26.4 162.8-178.1 97.7 -39.1 6.0 -20.7 58 58 A R B > +F 61 0C 87 3,-3.1 2,-7.0 -2,-0.2 3,-1.2 0.020 61.0 6.1-102.7-143.6 -36.1 8.1 -20.9 59 59 A H T 3 S- 0 0 160 1,-0.3 3,-0.1 -2,-0.1 -1,-0.1 0.259 128.9 -57.9 -15.2 4.5 -35.6 11.8 -20.3 60 60 A G T 3 S+ 0 0 68 -2,-7.0 -1,-0.3 1,-0.6 2,-0.3 0.561 127.3 92.5 106.1 23.0 -39.2 12.3 -19.1 61 61 A K B < S-F 58 0C 133 -3,-1.2 -3,-3.1 0, 0.0 -1,-0.6 -0.946 83.6 -90.2-146.3 165.9 -40.1 10.9 -22.4 62 62 A I - 0 0 86 -5,-0.3 -5,-0.2 -2,-0.3 2,-0.2 -0.710 27.5-166.2 -93.7 116.4 -40.9 7.6 -24.1 63 63 A V + 0 0 4 -2,-0.6 -7,-2.4 32,-0.1 2,-0.3 -0.599 19.4 174.6 -89.9 150.9 -38.3 5.4 -25.7 64 64 A R - 0 0 155 -9,-0.2 2,-0.9 -2,-0.2 24,-0.2 -0.874 36.9 -91.7-148.2-177.3 -39.6 2.7 -27.9 65 65 A I - 0 0 14 -13,-0.4 22,-0.2 -2,-0.3 21,-0.1 -0.751 40.3-158.2-108.9 93.2 -38.5 -0.0 -30.2 66 66 A V - 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