==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-APR-06 2GUI . COMPND 2 MOLECULE: DNA POLYMERASE III EPSILON SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.Y.PARK,P.D.CARR,D.L.OLLIS,N.E.DIXON . 176 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8892.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 10 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 0 0 2 1 0 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 I 0 0 175 0, 0.0 2,-0.4 0, 0.0 34,-0.0 0.000 360.0 360.0 360.0 -32.7 9.5 49.8 -17.5 2 6 A T - 0 0 103 87,-0.0 34,-0.7 2,-0.0 2,-0.4 -0.964 360.0-141.9-119.7 138.1 9.1 47.8 -14.3 3 7 A R E -A 35 0A 72 -2,-0.4 87,-2.3 85,-0.2 2,-0.4 -0.786 8.4-164.1-101.2 137.6 7.6 44.4 -14.0 4 8 A Q E -Ab 34 90A 35 30,-2.8 30,-3.0 -2,-0.4 2,-0.6 -0.975 7.5-161.0-111.6 134.3 5.4 43.0 -11.3 5 9 A I E -Ab 33 91A 0 85,-2.7 87,-2.5 -2,-0.4 2,-0.6 -0.968 5.0-155.2-117.4 113.8 5.0 39.3 -11.2 6 10 A V E -Ab 32 92A 3 26,-2.9 26,-2.7 -2,-0.6 2,-0.4 -0.825 27.3-174.1 -90.5 122.9 1.9 38.1 -9.2 7 11 A L E +A 31 0A 0 85,-2.2 87,-0.4 -2,-0.6 2,-0.3 -0.905 21.8 171.8-131.9 144.3 2.8 34.7 -8.1 8 12 A D E -A 30 0A 21 22,-2.8 22,-2.7 -2,-0.4 2,-0.3 -0.978 10.3-162.1-141.2 157.2 1.3 31.7 -6.3 9 13 A T E -A 29 0A 3 -2,-0.3 2,-0.4 20,-0.2 20,-0.2 -0.961 9.9-148.9-131.9 155.3 2.3 28.1 -5.6 10 14 A E E -A 28 0A 14 18,-2.2 17,-3.0 -2,-0.3 18,-1.7 -0.928 26.1-174.4-113.5 152.4 0.7 24.9 -4.6 11 15 A T E -A 26 0A 9 -2,-0.4 15,-0.2 15,-0.3 51,-0.1 -0.784 43.6 -99.4-136.6 174.9 2.6 22.5 -2.6 12 16 A T S S- 0 0 0 13,-2.1 43,-3.0 -2,-0.2 46,-0.3 0.551 88.7 -78.0 -72.5 -7.2 2.5 19.0 -1.1 13 17 A G - 0 0 7 12,-0.3 2,-0.3 41,-0.2 -1,-0.2 -0.980 50.2-101.5 142.0-154.0 1.5 20.7 2.2 14 18 A M - 0 0 95 -2,-0.3 2,-0.4 -3,-0.1 7,-0.2 -0.969 21.4-109.8-168.8 152.7 3.2 22.7 4.9 15 19 A N - 0 0 52 5,-2.5 7,-0.1 -2,-0.3 -2,-0.0 -0.777 11.5-156.8 -94.7 134.9 4.5 22.3 8.5 16 20 A Q S S+ 0 0 196 -2,-0.4 2,-0.4 1,-0.1 -1,-0.1 0.680 83.6 48.9 -80.0 -19.0 2.7 24.1 11.3 17 21 A I S S- 0 0 155 2,-0.2 -1,-0.1 3,-0.1 2,-0.0 -0.953 112.1 -8.6-123.1 141.9 5.9 24.0 13.4 18 22 A G S S+ 0 0 64 -2,-0.4 2,-0.2 3,-0.0 -3,-0.1 -0.277 122.0 3.3 72.6-161.5 9.4 25.0 12.4 19 23 A A S > S- 0 0 40 1,-0.2 3,-0.8 2,-0.1 -2,-0.2 -0.397 71.9-143.7 -59.7 122.1 10.3 25.9 8.8 20 24 A H T 3 S+ 0 0 44 1,-0.2 -5,-2.5 -2,-0.2 -1,-0.2 0.706 93.2 44.4 -67.9 -19.5 7.0 25.6 7.0 21 25 A Y T > S+ 0 0 66 -7,-0.2 3,-2.8 3,-0.1 -1,-0.2 0.589 77.0 126.4 -99.9 -15.8 8.5 24.1 3.8 22 26 A E T < S+ 0 0 107 -3,-0.8 3,-0.1 1,-0.3 80,-0.0 -0.205 86.1 4.1 -56.7 124.8 10.9 21.5 5.2 23 27 A G T 3 S+ 0 0 40 1,-0.3 -1,-0.3 -8,-0.0 2,-0.2 0.435 113.7 101.3 83.8 -3.3 10.3 18.1 3.7 24 28 A H < - 0 0 5 -3,-2.8 2,-0.3 -11,-0.1 -1,-0.3 -0.603 57.4-145.7-107.1 172.9 7.6 19.5 1.4 25 29 A K - 0 0 48 -2,-0.2 -13,-2.1 -3,-0.1 2,-0.4 -0.981 19.5-111.8-141.1 149.1 7.7 20.4 -2.3 26 30 A I E +A 11 0A 2 -2,-0.3 -15,-0.3 -15,-0.2 49,-0.1 -0.664 30.5 176.8 -72.6 131.4 6.3 22.9 -4.7 27 31 A I E + 0 0 0 -17,-3.0 21,-2.4 -2,-0.4 2,-0.3 0.510 66.1 21.9-113.6 -10.1 3.9 21.1 -7.1 28 32 A E E -AC 10 47A 2 -18,-1.7 -18,-2.2 19,-0.3 2,-0.4 -0.944 56.9-167.8-156.3 135.8 2.7 24.1 -9.1 29 33 A I E +AC 9 46A 0 17,-2.7 17,-2.2 -2,-0.3 2,-0.4 -0.992 10.5 178.9-120.3 133.3 4.0 27.5 -9.8 30 34 A G E +AC 8 45A 0 -22,-2.7 -22,-2.8 -2,-0.4 2,-0.4 -1.000 6.2 168.7-135.1 131.9 1.7 30.1 -11.4 31 35 A A E -AC 7 44A 0 13,-2.5 13,-2.6 -2,-0.4 2,-0.4 -0.996 15.3-160.6-149.8 136.7 2.8 33.6 -12.1 32 36 A V E -A 6 0A 0 -26,-2.7 -26,-2.9 -2,-0.4 2,-0.4 -0.961 17.4-130.1-126.8 136.6 1.4 36.4 -14.1 33 37 A E E -A 5 0A 26 9,-0.5 7,-2.2 -2,-0.4 8,-0.6 -0.687 20.0-174.3 -91.0 134.5 3.1 39.4 -15.5 34 38 A V E +AD 4 39A 2 -30,-3.0 -30,-2.8 -2,-0.4 2,-0.4 -0.997 4.4 177.8-126.5 125.4 1.8 43.0 -14.9 35 39 A V E > S-AD 3 38A 35 3,-2.8 3,-1.6 -2,-0.4 -32,-0.1 -0.999 72.0 -7.3-131.3 131.6 3.5 46.0 -16.6 36 40 A N T 3 S- 0 0 110 -34,-0.7 -1,-0.2 -2,-0.4 3,-0.1 0.904 130.2 -56.2 48.5 47.8 2.2 49.5 -16.2 37 41 A R T 3 S+ 0 0 122 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.659 117.3 108.4 62.2 22.4 -0.9 48.2 -14.4 38 42 A R E < S-D 35 0A 53 -3,-1.6 -3,-2.8 134,-0.0 2,-0.3 -0.994 73.4-120.4-129.3 134.2 -1.9 45.9 -17.2 39 43 A L E -D 34 0A 66 -2,-0.4 -5,-0.2 -5,-0.2 -7,-0.0 -0.539 20.7-160.5 -63.5 130.3 -1.7 42.2 -17.4 40 44 A T - 0 0 66 -7,-2.2 -1,-0.2 -2,-0.3 -6,-0.1 0.689 27.9-128.1 -86.7 -21.6 0.6 41.4 -20.3 41 45 A G S S+ 0 0 58 -8,-0.6 2,-1.1 1,-0.2 -7,-0.1 0.381 72.3 123.9 84.7 -2.5 -0.6 37.8 -20.7 42 46 A N + 0 0 95 -9,-0.2 -9,-0.5 2,-0.0 -1,-0.2 -0.778 41.7 163.1 -94.7 98.7 2.9 36.5 -20.6 43 47 A N - 0 0 47 -2,-1.1 2,-0.4 -11,-0.2 -11,-0.2 -0.411 37.7-132.8-113.9 176.6 2.7 34.1 -17.7 44 48 A F E +C 31 0A 10 -13,-2.6 -13,-2.5 -2,-0.1 2,-0.3 -0.997 28.8 166.0-134.8 129.3 4.6 31.2 -16.2 45 49 A H E +C 30 0A 75 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.884 2.4 157.1-152.7 116.1 2.9 28.0 -15.2 46 50 A V E -C 29 0A 27 -17,-2.2 -17,-2.7 -2,-0.3 2,-0.4 -0.993 28.5-147.7-138.3 144.1 4.3 24.7 -14.4 47 51 A Y E -C 28 0A 65 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.3 -0.885 29.0-150.2 -99.6 145.9 3.3 21.6 -12.4 48 52 A L - 0 0 1 -21,-2.4 26,-0.2 -2,-0.4 24,-0.1 -0.916 16.2-121.7-126.1 145.7 6.2 19.8 -10.8 49 53 A K - 0 0 71 24,-2.5 26,-0.4 -2,-0.4 -23,-0.1 -0.726 25.9-172.3 -81.6 115.5 7.0 16.3 -9.9 50 54 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.675 23.5-139.2 -87.5 -15.9 7.6 16.3 -6.1 51 55 A D S S+ 0 0 92 1,-0.2 2,-0.3 18,-0.1 -2,-0.1 0.901 81.2 72.3 52.6 36.6 8.9 12.7 -5.5 52 56 A R S S- 0 0 77 14,-0.1 -1,-0.2 -27,-0.0 2,-0.1 -0.912 92.1 -89.9-160.8 167.6 6.8 12.6 -2.3 53 57 A L - 0 0 117 -2,-0.3 2,-0.4 -3,-0.1 12,-0.0 -0.474 35.0-112.5 -81.6 152.1 3.1 12.4 -1.7 54 58 A V - 0 0 10 -2,-0.1 -41,-0.2 10,-0.1 12,-0.1 -0.703 37.9-116.2 -75.8 130.6 0.7 15.3 -1.5 55 59 A D > - 0 0 60 -43,-3.0 4,-2.5 -2,-0.4 5,-0.2 -0.452 22.2-118.6 -66.2 140.1 -0.7 15.5 2.1 56 60 A P H > S+ 0 0 109 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.862 113.9 53.8 -46.5 -43.7 -4.4 14.9 2.3 57 61 A E H > S+ 0 0 142 2,-0.2 4,-0.9 1,-0.2 -44,-0.1 0.934 109.8 47.1 -58.0 -48.8 -5.1 18.4 3.6 58 62 A A H >> S+ 0 0 10 -46,-0.3 4,-2.4 1,-0.2 3,-1.0 0.909 110.3 52.7 -60.0 -43.0 -3.2 20.0 0.7 59 63 A F H 3X S+ 0 0 99 -4,-2.5 4,-2.2 1,-0.3 -1,-0.2 0.852 102.9 59.5 -60.1 -34.9 -5.1 17.8 -1.7 60 64 A G H 3< S+ 0 0 59 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.773 110.9 42.4 -61.3 -27.5 -8.3 19.1 -0.0 61 65 A V H << S+ 0 0 60 -3,-1.0 97,-2.5 -4,-0.9 -2,-0.2 0.909 132.7 13.9 -85.1 -49.9 -7.2 22.6 -1.1 62 66 A H H < S- 0 0 10 -4,-2.4 -3,-0.2 95,-0.2 -2,-0.2 0.592 79.8-139.6-111.5 -13.7 -6.0 22.1 -4.6 63 67 A G < + 0 0 25 -4,-2.2 2,-0.8 -5,-0.4 -4,-0.1 0.673 45.3 153.6 62.9 17.3 -7.1 18.7 -5.8 64 68 A I - 0 0 11 -6,-0.2 -1,-0.2 3,-0.0 2,-0.2 -0.714 36.3-142.1 -84.0 113.7 -3.8 18.0 -7.5 65 69 A A >> - 0 0 41 -2,-0.8 4,-0.9 -3,-0.1 3,-0.6 -0.456 14.3-126.2 -80.2 144.3 -3.4 14.2 -7.5 66 70 A D H >> S+ 0 0 60 1,-0.2 3,-1.1 2,-0.2 4,-0.6 0.892 111.5 56.4 -49.1 -44.4 -0.1 12.4 -7.0 67 71 A E H >4 S+ 0 0 75 1,-0.3 3,-1.0 2,-0.2 4,-0.3 0.852 99.9 59.0 -60.2 -35.8 -0.7 10.6 -10.3 68 72 A F H <4 S+ 0 0 91 -3,-0.6 3,-0.4 1,-0.2 -1,-0.3 0.768 104.7 50.6 -65.7 -25.6 -1.0 13.8 -12.2 69 73 A L H X< S+ 0 0 2 -3,-1.1 3,-1.6 -4,-0.9 -1,-0.2 0.587 83.3 91.2 -91.3 -9.5 2.5 14.9 -11.2 70 74 A L T << S+ 0 0 127 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.1 0.801 92.7 38.6 -58.9 -34.2 4.3 11.8 -12.1 71 75 A D T 3 S+ 0 0 129 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.314 96.1 108.3-100.1 7.3 5.2 12.9 -15.7 72 76 A K S < S- 0 0 39 -3,-1.6 -24,-0.2 1,-0.1 -23,-0.1 -0.358 75.0 -95.4 -86.0 162.1 5.9 16.5 -14.8 73 77 A P - 0 0 44 0, 0.0 -24,-2.5 0, 0.0 2,-0.2 -0.313 38.6-115.0 -69.2 159.9 9.3 18.3 -14.7 74 78 A T >> - 0 0 35 -26,-0.2 4,-1.0 1,-0.1 3,-0.7 -0.536 29.4-105.4 -84.4 161.6 11.2 18.6 -11.5 75 79 A F H >> S+ 0 0 6 -26,-0.4 4,-1.7 1,-0.2 3,-1.0 0.909 122.5 59.4 -50.2 -43.1 11.9 22.0 -9.9 76 80 A A H 3> S+ 0 0 50 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.865 102.3 53.8 -55.0 -37.4 15.5 21.6 -11.1 77 81 A E H <4 S+ 0 0 137 -3,-0.7 -1,-0.3 1,-0.2 4,-0.2 0.732 118.3 32.7 -73.0 -23.3 14.3 21.4 -14.7 78 82 A V H S+ 0 0 128 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.888 113.4 55.6 -65.1 -38.3 13.5 29.7 -16.8 82 86 A F H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.943 109.9 46.0 -58.2 -47.5 11.6 30.5 -13.5 83 87 A M H X S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.913 110.8 52.7 -62.2 -42.7 14.5 32.7 -12.4 84 88 A D H < S+ 0 0 119 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.856 111.5 48.6 -59.5 -35.2 14.7 34.3 -15.8 85 89 A Y H < S+ 0 0 18 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.919 120.4 32.3 -71.7 -43.9 11.0 35.1 -15.6 86 90 A I H >< S+ 0 0 0 -4,-2.3 3,-2.4 -5,-0.2 -2,-0.2 0.722 83.7 125.9 -89.5 -21.7 11.0 36.6 -12.1 87 91 A R T 3< S- 0 0 127 -4,-2.6 34,-0.2 1,-0.3 3,-0.1 -0.047 85.1 -1.2 -46.9 129.2 14.4 38.2 -11.9 88 92 A G T 3 S+ 0 0 61 32,-2.8 -1,-0.3 1,-0.2 -85,-0.2 0.339 103.1 122.3 78.7 -8.2 14.3 41.9 -11.0 89 93 A A S < S- 0 0 1 -3,-2.4 33,-2.0 -87,-0.1 2,-0.8 -0.372 71.9-109.2 -82.9 163.9 10.5 42.0 -10.7 90 94 A E E -be 4 122A 33 -87,-2.3 -85,-2.7 31,-0.2 2,-0.4 -0.884 37.3-147.5 -84.1 112.8 8.3 43.0 -7.8 91 95 A L E -be 5 123A 0 31,-3.6 33,-3.7 -2,-0.8 2,-0.5 -0.743 9.5-161.4 -81.2 130.8 6.8 39.7 -6.8 92 96 A V E +be 6 124A 0 -87,-2.5 -85,-2.2 -2,-0.4 2,-0.4 -0.978 19.9 165.8-117.1 118.8 3.3 40.1 -5.4 93 97 A I E > - e 0 125A 0 31,-2.4 33,-1.6 -2,-0.5 3,-0.9 -0.997 41.0-122.1-140.4 137.2 2.3 37.1 -3.3 94 98 A H T 3 S+ 0 0 27 -87,-0.4 5,-0.1 -2,-0.4 31,-0.1 -0.711 108.5 2.9 -86.0 106.6 -0.6 36.6 -0.9 95 99 A N T >> S- 0 0 74 -2,-0.9 3,-1.9 3,-0.1 4,-0.9 0.920 87.1-168.2 75.1 57.2 1.2 35.6 2.3 96 100 A A H <> S+ 0 0 4 -3,-0.9 4,-3.0 1,-0.3 5,-0.4 0.793 75.3 65.9 -50.5 -40.0 4.5 36.1 0.5 97 101 A A H 3> S+ 0 0 67 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.827 98.6 56.8 -55.5 -31.4 6.6 34.4 3.3 98 102 A F H <> S+ 0 0 34 -3,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.988 115.2 32.1 -62.4 -60.6 4.9 31.1 2.4 99 103 A D H X S+ 0 0 2 -4,-0.9 4,-3.1 2,-0.2 -2,-0.2 0.884 118.9 52.9 -68.3 -39.4 5.8 31.0 -1.3 100 104 A I H X S+ 0 0 17 -4,-3.0 4,-3.3 2,-0.2 5,-0.3 0.913 107.7 53.1 -62.8 -42.2 9.1 32.7 -0.9 101 105 A G H X S+ 0 0 11 -4,-2.0 4,-2.1 -5,-0.4 -2,-0.2 0.935 112.6 44.4 -55.7 -48.1 10.0 30.2 1.8 102 106 A F H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.907 113.7 50.2 -64.1 -43.0 9.2 27.4 -0.6 103 107 A M H X S+ 0 0 0 -4,-3.1 4,-3.1 2,-0.2 5,-0.2 0.949 113.1 44.3 -59.6 -49.8 11.0 29.0 -3.5 104 108 A D H X S+ 0 0 33 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.877 113.5 52.7 -67.6 -34.1 14.2 29.6 -1.6 105 109 A Y H X S+ 0 0 28 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.960 112.4 43.5 -60.8 -52.3 14.0 26.1 -0.2 106 110 A E H X S+ 0 0 2 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.914 114.1 50.8 -62.7 -42.2 13.6 24.6 -3.6 107 111 A F H >< S+ 0 0 2 -4,-3.1 3,-1.1 1,-0.2 5,-0.5 0.912 108.8 52.7 -60.0 -40.8 16.3 26.8 -5.0 108 112 A S H >< S+ 0 0 71 -4,-2.5 3,-1.8 1,-0.3 -1,-0.2 0.854 99.6 62.0 -65.5 -33.8 18.6 25.8 -2.1 109 113 A L H 3< S+ 0 0 86 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.710 91.5 69.0 -64.9 -19.4 18.1 22.1 -2.8 110 114 A L T << S- 0 0 34 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.652 94.0-142.5 -73.1 -16.1 19.7 22.7 -6.2 111 115 A K < + 0 0 87 -3,-1.8 -3,-0.1 -4,-0.2 -2,-0.1 0.908 63.7 123.9 50.7 48.2 23.1 23.3 -4.6 112 116 A R S S- 0 0 112 -5,-0.5 -1,-0.1 -4,-0.1 -4,-0.1 0.173 83.3-111.6-118.4 14.0 23.8 26.0 -7.2 113 117 A D + 0 0 159 1,-0.2 -5,-0.1 -5,-0.2 -6,-0.0 0.834 52.1 176.6 56.4 36.1 24.5 28.8 -4.7 114 118 A I - 0 0 31 -7,-0.3 -1,-0.2 -10,-0.1 3,-0.1 -0.577 26.0-128.1 -70.6 128.8 21.3 30.5 -5.8 115 119 A P - 0 0 67 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.256 38.1 -73.1 -73.7 167.9 20.9 33.6 -3.6 116 120 A K > - 0 0 137 1,-0.1 3,-2.1 2,-0.1 4,-0.4 -0.285 42.8-119.0 -60.5 146.0 17.7 34.3 -1.7 117 121 A T G >> S+ 0 0 0 1,-0.3 4,-2.0 -17,-0.2 3,-1.9 0.867 111.4 62.1 -55.6 -40.4 14.8 35.5 -3.9 118 122 A N G 34 S+ 0 0 95 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.529 94.5 63.2 -72.3 -0.6 14.5 38.8 -2.1 119 123 A T G <4 S+ 0 0 95 -3,-2.1 -1,-0.3 1,-0.1 -2,-0.2 0.615 118.1 25.6 -89.4 -17.6 18.1 39.7 -3.2 120 124 A F T <4 S+ 0 0 23 -3,-1.9 -32,-2.8 -4,-0.4 2,-0.3 0.478 126.5 42.1-122.9 -6.1 17.1 39.6 -6.9 121 125 A C S < S- 0 0 8 -4,-2.0 2,-0.3 -34,-0.2 -31,-0.2 -0.963 77.4-121.6-131.0 151.2 13.3 40.4 -6.6 122 126 A K E -e 90 0A 135 -33,-2.0 -31,-3.6 -2,-0.3 2,-0.5 -0.721 32.4-146.8 -81.3 142.8 11.4 42.9 -4.6 123 127 A V E -e 91 0A 47 -2,-0.3 2,-0.5 -33,-0.2 -31,-0.2 -0.972 15.8-173.9-119.7 121.1 8.8 40.9 -2.6 124 128 A T E -e 92 0A 15 -33,-3.7 -31,-2.4 -2,-0.5 2,-1.0 -0.960 16.5-147.8-112.5 125.8 5.4 42.4 -1.8 125 129 A D E > -e 93 0A 45 -2,-0.5 4,-2.3 -33,-0.2 3,-0.5 -0.800 8.1-167.1 -92.3 103.2 3.1 40.6 0.5 126 130 A S H > S+ 0 0 0 -33,-1.6 4,-2.5 -2,-1.0 -32,-0.2 0.736 87.2 59.7 -63.8 -20.6 -0.3 41.4 -0.8 127 131 A L H > S+ 0 0 15 -34,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.892 106.0 46.2 -74.2 -37.8 -1.8 40.0 2.4 128 132 A A H > S+ 0 0 51 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.925 113.8 49.8 -66.3 -41.5 0.1 42.5 4.5 129 133 A V H X S+ 0 0 39 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.940 112.2 47.2 -61.5 -46.3 -1.0 45.2 2.1 130 134 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.906 110.6 52.0 -61.8 -42.4 -4.6 44.1 2.4 131 135 A R H < S+ 0 0 145 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.882 109.8 49.5 -63.0 -36.5 -4.4 43.9 6.1 132 136 A K H < S+ 0 0 182 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.877 116.9 41.6 -67.8 -39.2 -3.0 47.5 6.2 133 137 A M H < S+ 0 0 74 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.806 129.0 28.4 -74.9 -34.2 -5.9 48.6 3.9 134 138 A F S >< S- 0 0 45 -4,-2.9 3,-1.8 -5,-0.2 -1,-0.2 -0.501 80.8-177.1-128.9 60.1 -8.6 46.6 5.6 135 139 A P T 3 S+ 0 0 86 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.317 72.7 17.7 -64.3 143.0 -7.5 46.3 9.2 136 140 A G T 3 S+ 0 0 84 1,-0.3 2,-0.2 -5,-0.1 -5,-0.1 0.547 109.0 102.4 75.9 7.4 -9.8 44.2 11.4 137 141 A K S < S- 0 0 139 -3,-1.8 -1,-0.3 -6,-0.2 2,-0.2 -0.705 84.0 -86.0-116.3 170.0 -11.4 42.7 8.3 138 142 A R + 0 0 194 -2,-0.2 -1,-0.0 1,-0.1 0, 0.0 -0.549 40.7 178.3 -70.1 138.7 -11.1 39.3 6.4 139 143 A N + 0 0 12 -2,-0.2 -1,-0.1 4,-0.1 -9,-0.1 0.184 27.5 132.2-136.2 20.7 -8.3 39.4 4.0 140 144 A S S > S- 0 0 65 1,-0.1 4,-2.5 -10,-0.1 5,-0.2 -0.294 74.5-106.1 -56.9 157.8 -8.2 36.0 2.4 141 145 A L H > S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.908 124.4 52.9 -55.4 -39.8 -8.0 36.2 -1.4 142 146 A D H > S+ 0 0 62 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 107.6 49.8 -64.0 -43.3 -11.6 35.1 -1.5 143 147 A A H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.901 111.9 49.0 -59.5 -40.9 -12.6 37.9 0.9 144 148 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.859 105.9 57.5 -68.2 -34.7 -10.7 40.4 -1.3 145 149 A C H <>S+ 0 0 1 -4,-2.4 5,-2.5 -5,-0.2 4,-0.4 0.901 109.3 44.7 -59.6 -42.7 -12.5 39.0 -4.4 146 150 A A H ><5S+ 0 0 75 -4,-1.9 3,-1.0 3,-0.2 -2,-0.2 0.928 112.7 52.3 -66.3 -42.5 -15.8 39.8 -2.8 147 151 A R H 3<5S+ 0 0 74 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.885 120.6 32.2 -62.2 -39.2 -14.5 43.2 -1.8 148 152 A Y T 3<5S- 0 0 55 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.221 108.1-116.6-106.3 12.0 -13.3 44.0 -5.3 149 153 A E T < 5 + 0 0 177 -3,-1.0 2,-0.4 -4,-0.4 -3,-0.2 0.876 57.9 159.2 53.5 44.1 -15.9 42.1 -7.3 150 154 A I < - 0 0 24 -5,-2.5 2,-0.6 -6,-0.2 -1,-0.2 -0.829 45.8-112.5 -96.6 134.7 -13.3 39.8 -8.8 151 155 A D + 0 0 109 -2,-0.4 3,-0.1 1,-0.1 -5,-0.0 -0.552 47.5 155.6 -72.3 114.9 -14.6 36.5 -10.1 152 156 A N > + 0 0 51 -2,-0.6 3,-2.0 1,-0.1 -1,-0.1 0.013 36.5 117.7-120.0 24.0 -13.4 33.6 -8.1 153 157 A S T 3 S+ 0 0 87 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.746 74.4 54.9 -64.2 -24.6 -16.3 31.3 -9.2 154 158 A K T 3 S+ 0 0 74 1,-0.2 3,-0.4 -3,-0.1 -1,-0.3 0.390 88.3 89.1 -84.3 4.4 -13.8 28.9 -10.8 155 159 A R < + 0 0 24 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.1 -0.140 35.2 120.5-104.8 37.7 -11.9 28.7 -7.5 156 160 A T S S+ 0 0 132 -3,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.959 89.8 33.8 -58.7 -49.8 -13.6 25.7 -5.7 157 161 A L S S- 0 0 84 -3,-0.4 -95,-0.2 -95,-0.1 2,-0.2 -0.862 97.2-122.8-100.1 141.6 -10.2 24.2 -5.8 158 162 A H - 0 0 52 -97,-2.5 2,-0.3 -2,-0.4 3,-0.1 -0.567 31.1-179.4 -77.7 145.0 -7.2 26.5 -5.5 159 163 A G > - 0 0 11 -2,-0.2 4,-3.2 1,-0.1 5,-0.2 -0.979 33.2-123.3-142.3 154.0 -4.6 26.4 -8.3 160 164 A A H > S+ 0 0 0 -2,-0.3 4,-2.2 2,-0.2 -130,-0.3 0.935 111.1 38.1 -68.0 -47.4 -1.4 28.3 -8.6 161 165 A L H > S+ 0 0 40 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.933 118.6 50.5 -67.7 -44.5 -2.1 30.0 -12.0 162 166 A L H > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.947 114.2 44.4 -54.7 -48.1 -5.8 30.5 -11.1 163 167 A D H X S+ 0 0 5 -4,-3.2 4,-2.8 1,-0.2 -1,-0.2 0.847 112.2 51.6 -68.3 -35.8 -4.8 32.0 -7.8 164 168 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.898 111.2 47.8 -67.7 -39.3 -2.1 34.2 -9.3 165 169 A Q H X S+ 0 0 58 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.922 113.9 46.7 -67.6 -43.3 -4.5 35.5 -11.9 166 170 A I H X S+ 0 0 6 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.946 113.3 49.2 -62.7 -47.3 -7.2 36.2 -9.3 167 171 A L H X S+ 0 0 4 -4,-2.8 4,-3.5 1,-0.2 5,-0.3 0.880 107.0 55.5 -59.7 -38.6 -4.6 37.9 -7.0 168 172 A A H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.942 110.6 45.2 -60.7 -44.3 -3.4 40.0 -9.9 169 173 A E H X S+ 0 0 83 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.926 116.1 46.4 -63.2 -45.6 -6.9 41.3 -10.5 170 174 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.923 113.8 47.6 -61.3 -46.2 -7.4 41.9 -6.8 171 175 A Y H X S+ 0 0 20 -4,-3.5 4,-2.0 2,-0.2 -2,-0.2 0.867 108.5 53.8 -68.9 -36.1 -4.1 43.6 -6.4 172 176 A L H < S+ 0 0 26 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.930 113.0 44.9 -60.5 -43.4 -4.6 45.9 -9.4 173 177 A A H >< S+ 0 0 36 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.895 110.8 53.7 -67.2 -41.0 -7.9 46.9 -7.8 174 178 A M H 3< S+ 0 0 15 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.848 116.7 37.8 -59.1 -36.7 -6.3 47.3 -4.4 175 179 A T T 3< 0 0 60 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.242 360.0 360.0-102.7 12.1 -3.6 49.6 -5.8 176 180 A G < 0 0 88 -3,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.219 360.0 360.0-112.0 360.0 -6.1 51.3 -8.2