==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 16-FEB-13 4J9K . COMPND 2 MOLECULE: DNA POLYMERASE ETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.ZHAO,M.GREGORY,C.BIERTUMPFEL,Y.HUA,F.HANAOKA,W.YANG . 430 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21884.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 15.1 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 19 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 1 1 1 1 3 1 1 0 0 0 0 1 1 0 0 0 0 0 1 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 . 2 1 1 2 1 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 1 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 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 -2 A G > 0 0 99 0, 0.0 3,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -80.3 -44.9 10.3 -2.5 2 -1 A P T 3 + 0 0 119 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.835 360.0 41.7 -57.5 -39.0 -43.6 9.4 -5.9 3 0 A H T 3 S+ 0 0 178 2,-0.1 2,-0.5 0, 0.0 0, 0.0 0.292 86.2 112.0 -98.7 6.9 -44.8 12.6 -7.5 4 1 A M < - 0 0 121 -3,-1.0 2,-0.3 2,-0.0 0, 0.0 -0.724 63.9-131.7 -90.1 127.5 -43.7 15.1 -4.9 5 2 A A - 0 0 70 -2,-0.5 -2,-0.1 1,-0.1 299,-0.0 -0.569 14.9-166.8 -75.4 136.9 -40.9 17.5 -5.7 6 3 A T - 0 0 59 -2,-0.3 -1,-0.1 297,-0.0 -2,-0.0 0.380 37.5-118.5-107.0 0.6 -38.2 17.7 -3.0 7 4 A G S S+ 0 0 5 297,-0.1 298,-0.2 1,-0.1 3,-0.1 0.908 77.8 123.7 62.0 43.5 -36.4 20.8 -4.3 8 5 A Q + 0 0 34 1,-0.1 -1,-0.1 296,-0.1 210,-0.1 0.082 33.8 105.2-118.8 20.4 -33.2 18.9 -4.8 9 6 A D S S+ 0 0 89 208,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.762 75.4 46.4 -73.0 -28.2 -32.7 19.8 -8.5 10 7 A R - 0 0 24 207,-0.4 2,-0.6 -3,-0.1 179,-0.1 -0.774 63.4-140.8-120.1 157.5 -29.9 22.3 -8.1 11 8 A V + 0 0 0 -2,-0.3 113,-2.9 177,-0.0 114,-0.6 -0.962 32.6 176.0-114.9 114.5 -26.6 22.8 -6.3 12 9 A V E -AB 123 216A 0 204,-2.9 204,-2.7 -2,-0.6 2,-0.3 -0.948 10.1-168.6-122.5 134.6 -26.4 26.4 -5.1 13 10 A A E -AB 122 215A 0 109,-2.4 109,-2.7 -2,-0.4 2,-0.5 -0.910 10.4-154.3-118.6 151.5 -23.6 28.1 -3.1 14 11 A L E -AB 121 214A 0 200,-2.3 200,-2.0 -2,-0.3 2,-0.5 -0.986 11.3-165.7-121.7 121.2 -23.4 31.4 -1.3 15 12 A V E +AB 120 213A 1 105,-2.4 105,-1.6 -2,-0.5 2,-0.4 -0.916 9.6 178.4-109.4 121.8 -19.9 32.9 -0.8 16 13 A D E -AB 119 212A 16 196,-2.6 196,-2.5 -2,-0.5 103,-0.2 -0.981 27.5-121.9-128.7 127.1 -19.6 35.7 1.7 17 14 A M E > - B 0 211A 2 101,-2.5 3,-0.6 -2,-0.4 2,-0.3 -0.287 30.7-114.6 -63.0 141.7 -16.4 37.5 2.7 18 15 A D T 3 S- 0 0 4 192,-2.1 5,-0.4 1,-0.2 192,-0.2 -0.631 87.6 -24.0 -76.6 136.0 -15.5 37.5 6.4 19 16 A C T >> S- 0 0 16 -2,-0.3 4,-2.1 34,-0.1 3,-0.6 0.790 87.2-167.8 25.9 58.2 -15.5 41.0 7.9 20 17 A F H <> S+ 0 0 9 -3,-0.6 4,-1.9 1,-0.3 5,-0.2 0.801 72.0 43.3 -48.8 -57.7 -14.9 42.3 4.4 21 18 A F H 3> S+ 0 0 28 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.880 114.8 53.7 -61.4 -36.7 -14.0 46.0 4.8 22 19 A V H <> S+ 0 0 0 -3,-0.6 4,-2.9 1,-0.2 -1,-0.2 0.935 107.7 49.1 -59.4 -48.1 -11.8 45.1 7.7 23 20 A Q H X S+ 0 0 22 -4,-2.1 4,-2.2 -5,-0.4 -1,-0.2 0.840 108.2 54.7 -61.0 -33.4 -9.9 42.5 5.6 24 21 A V H X S+ 0 0 4 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.2 0.928 113.2 41.7 -66.3 -42.4 -9.5 45.1 2.9 25 22 A E H X S+ 0 0 12 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.848 113.9 52.7 -70.7 -36.6 -7.9 47.5 5.4 26 23 A Q H < S+ 0 0 22 -4,-2.9 7,-0.3 2,-0.2 -2,-0.2 0.839 106.6 52.6 -67.9 -35.3 -5.8 44.7 7.0 27 24 A R H < S+ 0 0 85 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.939 115.1 41.6 -64.1 -45.3 -4.4 43.6 3.6 28 25 A Q H < S+ 0 0 121 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.831 123.9 37.8 -70.0 -37.2 -3.3 47.1 2.9 29 26 A N >< - 0 0 54 -4,-2.3 3,-2.4 1,-0.1 4,-0.3 -0.834 66.4-169.6-121.9 92.5 -2.0 47.8 6.5 30 27 A P G > S+ 0 0 77 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.677 80.2 75.4 -56.9 -19.9 -0.3 44.7 8.0 31 28 A H G 3 S+ 0 0 149 1,-0.2 -5,-0.1 3,-0.0 -2,-0.0 0.757 94.8 51.1 -59.9 -26.9 -0.3 46.4 11.4 32 29 A L G X S+ 0 0 17 -3,-2.4 3,-1.1 -7,-0.2 -1,-0.2 0.564 83.6 119.1 -88.4 -11.2 -4.0 45.7 11.7 33 30 A R T < S+ 0 0 114 -3,-1.1 -10,-0.0 -4,-0.3 -6,-0.0 -0.296 81.6 3.7 -64.0 138.8 -3.8 42.0 10.9 34 31 A N T 3 S+ 0 0 138 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 0.769 108.5 109.0 62.1 32.7 -4.9 39.5 13.5 35 32 A K S < S- 0 0 98 -3,-1.1 2,-0.4 44,-0.0 22,-0.3 -0.909 84.9 -86.2-133.8 157.1 -6.1 42.3 15.9 36 33 A P + 0 0 27 0, 0.0 43,-2.4 0, 0.0 2,-0.3 -0.562 67.4 158.2 -63.1 120.8 -9.4 43.6 17.1 37 34 A C E -g 79 0B 0 -2,-0.4 17,-2.8 41,-0.2 2,-0.3 -0.976 23.4-172.4-148.5 150.2 -10.2 46.1 14.4 38 35 A A E -gH 80 53B 0 41,-2.0 43,-2.2 -2,-0.3 2,-0.5 -0.981 20.4-130.1-144.4 159.2 -13.2 47.9 12.9 39 36 A V E -gH 81 52B 0 13,-2.4 12,-3.0 -2,-0.3 13,-1.2 -0.943 29.3-175.4-111.3 131.9 -14.0 50.1 10.0 40 37 A V E -gH 82 50B 0 41,-2.3 43,-2.6 -2,-0.5 2,-0.5 -0.847 23.0-131.0-123.4 159.4 -15.9 53.4 10.6 41 38 A Q E S- H 0 49B 58 8,-1.8 8,-1.7 -2,-0.3 43,-0.1 -0.957 75.2 -10.2-110.3 127.0 -17.4 56.2 8.6 42 39 A Y - 0 0 74 -2,-0.5 41,-0.1 41,-0.3 -2,-0.0 -0.062 59.6-140.5 73.5 177.7 -16.6 59.7 9.6 43 40 A K S > S+ 0 0 89 5,-0.1 4,-1.1 39,-0.1 5,-0.1 0.548 76.5 75.5-144.3 -40.3 -14.8 60.7 12.8 44 41 A S T 4 S+ 0 0 132 3,-0.2 2,-0.8 2,-0.1 3,-0.2 0.881 86.4 65.7 -56.1 -46.9 -16.1 63.9 14.5 45 42 A W T >4 S- 0 0 175 1,-0.2 3,-2.7 2,-0.1 24,-0.1 -0.703 133.1 -35.3 -87.4 112.9 -19.3 62.5 15.9 46 43 A K T 34 S- 0 0 86 -2,-0.8 23,-2.7 1,-0.3 24,-0.4 0.717 112.8 -62.9 52.3 26.0 -18.6 59.9 18.6 47 44 A G T 3< S- 0 0 5 -4,-1.1 -1,-0.3 21,-0.2 -3,-0.2 0.437 98.4 -68.0 82.4 -0.6 -15.5 58.7 16.7 48 45 A G < - 0 0 0 -3,-2.7 20,-2.8 -5,-0.1 2,-0.5 -0.066 59.7 -72.4 101.8 158.0 -17.6 57.5 13.7 49 46 A G E -HI 41 67B 19 -8,-1.7 -8,-1.8 18,-0.2 2,-0.3 -0.765 43.9-127.7 -93.8 127.4 -20.1 54.8 13.0 50 47 A I E +H 40 0B 2 16,-2.6 15,-3.4 -2,-0.5 -10,-0.3 -0.520 33.7 164.9 -74.9 130.8 -18.8 51.2 12.8 51 48 A I E + 0 0 50 -12,-3.0 2,-0.3 1,-0.3 -11,-0.2 0.490 67.4 31.5-120.5 -9.5 -19.8 49.3 9.6 52 49 A A E -H 39 0B 13 -13,-1.2 -13,-2.4 11,-0.1 2,-0.4 -0.978 61.6-168.5-151.6 140.9 -17.4 46.3 9.9 53 50 A V E -H 38 0B 6 -2,-0.3 -15,-0.2 -15,-0.2 -34,-0.1 -0.983 20.9-127.7-137.7 124.0 -15.8 44.4 12.8 54 51 A S >> - 0 0 0 -17,-2.8 4,-2.1 -2,-0.4 3,-0.8 -0.318 30.7-115.0 -65.9 150.8 -13.0 41.8 12.9 55 52 A Y H 3> S+ 0 0 55 1,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.826 117.2 60.1 -59.8 -29.6 -13.8 38.6 14.7 56 53 A E H 34 S+ 0 0 79 -21,-0.3 -1,-0.3 1,-0.2 4,-0.2 0.889 109.4 42.9 -62.2 -39.1 -11.2 39.4 17.3 57 54 A A H X4>S+ 0 0 0 -3,-0.8 5,-1.8 -22,-0.3 3,-1.5 0.810 105.0 62.5 -77.4 -31.5 -13.2 42.6 18.1 58 55 A R H ><5S+ 0 0 102 -4,-2.1 3,-1.9 1,-0.3 -1,-0.2 0.832 92.8 66.4 -61.3 -31.4 -16.5 40.8 18.0 59 56 A A T 3<5S+ 0 0 87 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.710 98.9 51.9 -61.9 -21.1 -15.3 38.8 21.0 60 57 A F T < 5S- 0 0 112 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.418 128.8 -98.8 -92.4 -2.3 -15.3 42.0 23.0 61 58 A G T < 5 + 0 0 37 -3,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.538 70.0 155.1 95.3 9.1 -18.9 42.7 22.0 62 59 A V < + 0 0 3 -5,-1.8 2,-0.3 -8,-0.1 -1,-0.3 -0.542 18.8 177.2 -73.0 133.5 -18.1 45.2 19.2 63 60 A T > - 0 0 69 -2,-0.3 3,-1.5 -11,-0.1 -13,-0.2 -0.922 34.6 -85.7-136.5 161.1 -20.8 45.3 16.6 64 61 A R T 3 S+ 0 0 180 -2,-0.3 -13,-0.2 1,-0.2 3,-0.1 -0.302 111.9 29.3 -60.9 142.9 -21.9 47.1 13.4 65 62 A S T 3 S+ 0 0 87 -15,-3.4 2,-0.2 1,-0.3 -1,-0.2 0.362 90.4 129.2 83.2 -2.7 -23.8 50.4 14.0 66 63 A M < - 0 0 42 -3,-1.5 -16,-2.6 -16,-0.1 -1,-0.3 -0.590 66.3-112.4 -75.6 140.4 -21.9 50.9 17.2 67 64 A W B > -I 49 0B 99 -2,-0.2 4,-2.7 -18,-0.2 3,-0.3 -0.541 21.8-127.8 -69.1 140.8 -20.2 54.3 17.7 68 65 A A H > S+ 0 0 1 -20,-2.8 4,-2.2 1,-0.2 -21,-0.2 0.879 110.1 55.8 -59.7 -39.6 -16.5 54.0 17.8 69 66 A D H > S+ 0 0 84 -23,-2.7 4,-0.6 -21,-0.2 -1,-0.2 0.881 111.3 45.2 -59.0 -37.7 -16.3 55.9 21.1 70 67 A D H >> S+ 0 0 55 -24,-0.4 3,-1.1 -3,-0.3 4,-1.0 0.923 110.3 52.3 -72.4 -44.7 -18.7 53.3 22.6 71 68 A A H 3X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.3 3,-0.4 0.843 102.5 61.1 -57.8 -36.2 -16.8 50.3 21.1 72 69 A K H 3< S+ 0 0 79 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.757 98.3 57.7 -62.8 -27.1 -13.6 51.6 22.6 73 70 A K H << S+ 0 0 154 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.846 112.9 39.1 -71.3 -33.7 -15.2 51.3 26.0 74 71 A L H < S+ 0 0 82 -4,-1.0 -2,-0.2 -3,-0.4 -1,-0.2 0.840 132.4 25.9 -79.6 -35.5 -15.8 47.6 25.3 75 72 A C >< - 0 0 0 -4,-2.5 3,-2.1 -5,-0.2 -1,-0.3 -0.789 65.7-176.3-138.0 85.7 -12.5 47.1 23.6 76 73 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.758 86.8 49.7 -57.6 -31.2 -9.8 49.6 24.8 77 74 A D T 3 S+ 0 0 134 2,-0.1 2,-0.1 -40,-0.0 -5,-0.1 0.225 79.1 140.7 -94.8 13.5 -7.2 48.3 22.3 78 75 A L < - 0 0 1 -3,-2.1 2,-0.4 -6,-0.1 -41,-0.2 -0.355 43.1-145.7 -58.9 127.3 -9.6 48.4 19.3 79 76 A L E -g 37 0B 59 -43,-2.4 -41,-2.0 -47,-0.1 2,-0.4 -0.804 15.3-155.0 -95.2 139.7 -7.8 49.6 16.1 80 77 A L E -g 38 0B 51 -2,-0.4 2,-0.4 -43,-0.2 -41,-0.2 -0.898 15.5-170.6-120.6 142.5 -9.9 51.7 13.7 81 78 A A E -g 39 0B 11 -43,-2.2 -41,-2.3 -2,-0.4 2,-0.4 -0.997 19.4-144.9-124.4 136.8 -9.7 52.3 10.0 82 79 A Q E -g 40 0B 102 -2,-0.4 -41,-0.2 -43,-0.2 3,-0.1 -0.828 20.0-109.4-108.7 138.5 -11.9 55.0 8.5 83 80 A V - 0 0 6 -43,-2.6 -41,-0.3 -2,-0.4 9,-0.1 -0.296 47.7 -93.4 -56.3 144.3 -13.5 55.0 5.1 84 81 A R E -J 91 0C 107 7,-0.5 7,-2.5 6,-0.1 2,-0.5 -0.310 39.9-144.8 -57.3 144.0 -11.9 57.4 2.6 85 82 A E E +J 90 0C 104 5,-0.2 2,-0.4 -3,-0.1 5,-0.2 -0.972 21.9 174.6-117.4 126.8 -13.8 60.7 2.6 86 83 A S E > -J 89 0C 29 3,-2.8 3,-1.6 -2,-0.5 260,-0.1 -0.998 67.3 -2.3-135.0 132.9 -14.2 62.7 -0.7 87 84 A R T 3 S- 0 0 65 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.823 130.3 -57.8 58.6 32.3 -16.2 65.8 -1.3 88 85 A G T 3 S+ 0 0 27 1,-0.3 2,-0.3 254,-0.0 -1,-0.3 0.582 121.3 90.5 77.1 9.5 -17.3 65.7 2.3 89 86 A K E < S-J 86 0C 6 -3,-1.6 -3,-2.8 253,-0.1 -1,-0.3 -0.870 86.0 -79.9-131.2 169.2 -18.9 62.3 1.9 90 87 A A E -J 85 0C 10 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.399 37.0-159.2 -66.0 140.3 -18.0 58.6 2.3 91 88 A N E +J 84 0C 9 -7,-2.5 -7,-0.5 -2,-0.1 3,-0.4 -0.959 13.2 179.1-126.8 107.9 -16.1 57.2 -0.6 92 89 A L >> + 0 0 24 -2,-0.5 4,-1.8 1,-0.2 3,-0.7 0.163 43.7 118.4 -98.1 18.8 -16.4 53.4 -0.8 93 90 A T H 3> + 0 0 35 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.873 69.2 57.3 -51.9 -44.9 -14.3 53.0 -4.0 94 91 A K H 3> S+ 0 0 41 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.866 110.0 44.7 -59.5 -37.2 -11.5 50.9 -2.3 95 92 A Y H <> S+ 0 0 1 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.815 110.3 54.2 -78.4 -31.7 -14.1 48.2 -1.3 96 93 A R H X S+ 0 0 76 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.880 110.2 47.8 -65.9 -39.1 -15.8 48.2 -4.6 97 94 A E H X S+ 0 0 105 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.927 111.5 49.5 -67.2 -44.7 -12.4 47.5 -6.3 98 95 A A H X S+ 0 0 2 -4,-1.9 4,-1.5 -5,-0.2 -2,-0.2 0.871 107.9 56.2 -58.7 -37.4 -11.7 44.8 -3.8 99 96 A S H X S+ 0 0 3 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.927 103.6 52.5 -61.4 -46.7 -15.2 43.4 -4.6 100 97 A V H X S+ 0 0 72 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.908 103.6 58.4 -55.9 -44.7 -14.4 43.2 -8.3 101 98 A E H X S+ 0 0 62 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.913 112.7 39.7 -49.1 -48.6 -11.2 41.2 -7.5 102 99 A V H X S+ 0 0 3 -4,-1.5 4,-2.3 -3,-0.2 -2,-0.2 0.919 113.7 51.4 -72.4 -45.4 -13.3 38.5 -5.7 103 100 A M H X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.863 106.8 55.5 -60.9 -38.3 -16.3 38.4 -8.1 104 101 A E H < S+ 0 0 112 -4,-2.6 4,-0.4 -5,-0.2 -1,-0.2 0.892 108.6 47.3 -63.1 -40.8 -13.9 38.0 -11.1 105 102 A I H >X S+ 0 0 9 -4,-1.2 3,-1.5 -5,-0.3 4,-0.6 0.941 112.0 49.3 -64.8 -49.6 -12.3 34.9 -9.5 106 103 A M H >X S+ 0 0 1 -4,-2.3 3,-1.5 1,-0.3 4,-1.4 0.887 102.9 62.5 -57.0 -38.5 -15.7 33.4 -8.6 107 104 A S H 3< S+ 0 0 47 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.660 91.9 66.8 -66.1 -14.8 -16.9 34.0 -12.2 108 105 A R H <4 S+ 0 0 142 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.805 105.3 41.5 -71.5 -30.5 -14.2 31.6 -13.4 109 106 A F H << S- 0 0 62 -3,-1.5 2,-0.3 -4,-0.6 -2,-0.2 0.853 126.9 -29.5 -86.8 -36.4 -15.9 28.6 -11.8 110 107 A A S < S- 0 0 19 -4,-1.4 -1,-0.3 16,-0.0 2,-0.2 -0.983 76.0 -59.1-167.5 169.9 -19.5 29.4 -12.6 111 108 A V - 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0 0 1 -6,-0.6 -1,-0.3 1,-0.0 2,-0.3 -0.645 49.0-145.7 -87.6 137.0 -9.1 37.6 1.6 210 211 A Q + 0 0 66 -2,-0.3 -192,-2.1 -192,-0.2 2,-0.3 -0.714 22.9 174.6 -95.8 151.2 -10.8 34.8 3.6 211 212 A C E -B 17 0A 2 -2,-0.3 2,-0.3 -194,-0.3 -194,-0.2 -0.924 23.0-132.9-146.4 170.2 -14.5 33.9 3.2 212 213 A S E -B 16 0A 0 -196,-2.5 -196,-2.6 -2,-0.3 2,-0.3 -0.814 21.6-162.3-121.0 166.5 -17.1 31.5 4.3 213 214 A A E -Bf 15 234A 0 20,-1.4 22,-2.5 -2,-0.3 2,-0.4 -0.995 14.4-147.0-151.2 153.6 -19.7 29.7 2.2 214 215 A G E -Bf 14 235A 0 -200,-2.0 -200,-2.3 -2,-0.3 2,-0.4 -0.961 13.3-163.7-118.1 137.8 -23.0 27.8 2.3 215 216 A I E +Bf 13 236A 0 20,-2.6 22,-2.6 -2,-0.4 2,-0.2 -0.991 32.4 117.5-123.2 127.0 -23.8 24.9 -0.0 216 217 A S E S-B 12 0A 0 -204,-2.7 -204,-2.9 -2,-0.4 22,-0.1 -0.784 72.1 -77.8-159.1-159.9 -27.3 23.6 -0.5 217 218 A H S S+ 0 0 3 20,-0.3 -207,-0.4 -206,-0.2 2,-0.3 0.519 104.7 19.5 -96.4 -6.8 -30.1 23.2 -3.0 218 219 A N S > S- 0 0 1 -206,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.948 81.8-100.2-154.5 171.5 -31.3 26.8 -3.1 219 220 A K H > S+ 0 0 2 88,-0.5 4,-2.6 -2,-0.3 5,-0.2 0.886 114.4 53.3 -66.9 -43.2 -30.3 30.4 -2.3 220 221 A V H > S+ 0 0 4 1,-0.2 4,-2.2 2,-0.2 35,-0.2 0.924 114.5 41.6 -60.0 -45.5 -32.2 30.7 1.0 221 222 A L H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.876 113.6 52.8 -69.8 -38.8 -30.6 27.6 2.5 222 223 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -208,-0.3 0.923 111.5 46.6 -62.0 -44.3 -27.1 28.4 1.1 223 224 A K H X S+ 0 0 70 -4,-2.6 4,-1.2 2,-0.2 -2,-0.2 0.918 114.2 47.4 -62.8 -45.7 -27.3 31.8 2.7 224 225 A L H X S+ 0 0 23 -4,-2.2 4,-0.7 -5,-0.2 3,-0.4 0.929 112.4 50.7 -58.1 -46.7 -28.4 30.4 6.0 225 226 A A H >X S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 4,-0.6 0.881 101.8 61.2 -59.1 -42.4 -25.7 27.7 5.8 226 227 A C H >< S+ 0 0 2 -4,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.857 104.7 47.8 -57.4 -39.2 -22.9 30.2 5.1 227 228 A G H >< S+ 0 0 51 -4,-1.2 3,-0.6 -3,-0.4 -1,-0.3 0.617 92.0 81.0 -79.6 -13.5 -23.5 32.0 8.4 228 229 A L H << S+ 0 0 56 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.806 107.1 20.6 -63.3 -32.4 -23.6 28.8 10.5 229 230 A N T << S- 0 0 17 -3,-0.6 -1,-0.2 -4,-0.6 -2,-0.1 0.068 91.8-178.9-133.9 28.4 -19.8 28.4 10.8 230 231 A K < + 0 0 49 -3,-0.6 2,-0.1 2,-0.1 4,-0.1 -0.403 43.6 59.1 -64.3 149.4 -18.2 31.8 10.0 231 232 A P S S- 0 0 53 0, 0.0 3,-0.1 0, 0.0 -19,-0.1 0.568 121.7 -21.1 -96.9 168.6 -15.4 32.7 9.9 232 233 A N S S+ 0 0 33 1,-0.2 2,-0.3 -2,-0.1 -20,-0.2 0.766 108.8 98.6 53.2 36.8 -13.2 31.0 7.3 233 234 A R - 0 0 77 -7,-0.2 -20,-1.4 2,-0.0 2,-0.3 -0.958 59.3-138.8-143.9 161.0 -15.4 27.8 7.0 234 235 A Q E -ef 148 213A 0 -87,-2.4 -85,-2.8 -2,-0.3 2,-0.4 -0.957 13.0-152.0-125.6 148.4 -18.1 26.4 4.7 235 236 A T E -ef 149 214A 0 -22,-2.5 -20,-2.6 -2,-0.3 2,-0.6 -0.963 4.5-149.9-126.0 131.8 -21.3 24.5 5.7 236 237 A L E -ef 150 215A 1 -87,-3.2 -85,-2.0 -2,-0.4 2,-0.6 -0.885 11.5-169.2-100.0 119.1 -23.2 21.9 3.7 237 238 A V - 0 0 1 -22,-2.6 -20,-0.3 -2,-0.6 2,-0.1 -0.929 11.2-162.4-110.3 109.3 -27.0 21.9 4.4 238 239 A S - 0 0 10 -2,-0.6 4,-0.5 -87,-0.3 3,-0.4 -0.375 33.1-109.1 -85.1 167.3 -28.7 18.9 2.9 239 240 A H S > S+ 0 0 47 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.918 120.1 55.1 -58.6 -42.2 -32.4 18.4 2.3 240 241 A G T 3 S+ 0 0 59 1,-0.3 4,-0.4 2,-0.1 -1,-0.2 0.749 99.3 59.9 -65.4 -26.3 -32.4 15.8 5.1 241 242 A S T 3> S+ 0 0 15 -3,-0.4 4,-2.2 1,-0.2 -1,-0.3 0.621 85.5 84.6 -74.1 -13.5 -30.9 18.3 7.7 242 243 A V H <> S+ 0 0 3 -3,-1.4 4,-3.2 -4,-0.5 5,-0.3 0.893 80.1 55.0 -63.8 -47.5 -33.9 20.7 7.2 243 244 A P H > S+ 0 0 94 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.943 116.6 37.3 -53.3 -49.8 -36.5 19.3 9.7 244 245 A Q H > S+ 0 0 143 -4,-0.4 4,-0.6 2,-0.2 -2,-0.2 0.909 117.7 51.1 -70.2 -40.1 -34.1 19.4 12.6 245 246 A L H >< S+ 0 0 19 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.924 115.4 41.5 -62.0 -45.2 -32.5 22.7 11.6 246 247 A F H >< S+ 0 0 2 -4,-3.2 29,-2.2 1,-0.2 3,-1.1 0.682 94.9 82.1 -77.4 -17.6 -35.8 24.4 11.1 247 248 A S H 3< S+ 0 0 55 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.787 112.0 18.5 -60.3 -29.7 -37.4 22.9 14.3 248 249 A Q T << S+ 0 0 146 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.048 95.4 122.2-126.9 21.3 -35.7 25.6 16.5 249 250 A M < - 0 0 23 -3,-1.1 25,-2.7 -5,-0.0 26,-0.2 -0.789 63.8-126.6 -91.5 113.2 -34.8 28.2 13.8 250 251 A P B > -K 273 0D 29 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.297 17.7-124.9 -56.9 141.2 -36.4 31.5 14.7 251 252 A I G > S+ 0 0 0 21,-1.7 3,-1.6 1,-0.3 6,-0.2 0.835 107.0 65.2 -59.7 -34.0 -38.5 32.8 11.7 252 253 A R G 3 S+ 0 0 146 1,-0.3 -1,-0.3 20,-0.2 5,-0.2 0.645 88.9 71.4 -64.7 -14.6 -36.5 36.1 11.6 253 254 A K G < S+ 0 0 108 -3,-1.7 -1,-0.3 4,-0.1 2,-0.2 0.733 78.7 89.5 -71.9 -27.0 -33.4 34.1 10.6 254 255 A I S X S- 0 0 4 -3,-1.6 3,-2.2 -4,-0.3 4,-0.3 -0.544 94.0 -96.6 -80.1 140.6 -34.7 33.3 7.1 255 256 A R T 3 S+ 0 0 84 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 -0.351 110.3 16.1 -59.6 126.7 -33.9 35.7 4.3 256 257 A S T 3 S+ 0 0 76 -4,-0.1 -1,-0.3 -2,-0.1 6,-0.2 0.250 110.4 81.6 93.5 -6.2 -36.8 38.1 3.8 257 258 A L < + 0 0 1 -3,-2.2 -2,-0.2 -6,-0.2 -4,-0.1 0.335 60.2 92.9-111.6 6.3 -38.5 37.3 7.1 258 259 A G S S+ 0 0 63 -4,-0.3 -1,-0.1 4,-0.1 -6,-0.1 0.497 88.5 42.1 -77.2 -4.1 -36.4 39.6 9.3 259 260 A G S > S- 0 0 45 -3,-0.2 4,-1.8 0, 0.0 5,-0.2 0.038 117.3 -37.8-116.9-139.2 -38.9 42.5 9.0 260 261 A K H > S+ 0 0 197 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.881 128.8 53.1 -60.9 -44.1 -42.6 43.2 9.0 261 262 A L H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.947 110.9 47.3 -58.4 -48.3 -43.7 40.0 7.1 262 263 A G H > S+ 0 0 2 -6,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.855 111.0 51.7 -61.1 -38.1 -41.8 37.8 9.5 263 264 A A H X S+ 0 0 58 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.864 109.9 49.4 -66.6 -37.8 -43.3 39.6 12.5 264 265 A S H X S+ 0 0 33 -4,-2.2 4,-3.0 2,-0.2 5,-0.5 0.850 107.5 54.4 -71.2 -35.6 -46.8 39.1 11.1 265 266 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 5,-0.4 0.962 112.9 43.5 -58.1 -50.4 -46.2 35.4 10.5 266 267 A I H X>S+ 0 0 57 -4,-2.0 4,-1.3 3,-0.2 5,-0.9 0.919 119.9 41.7 -61.4 -47.3 -45.2 35.0 14.1 267 268 A E H <5S+ 0 0 151 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.933 119.4 40.9 -69.9 -49.5 -48.1 37.2 15.5 268 269 A I H <5S+ 0 0 79 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.918 124.4 35.7 -67.3 -45.4 -50.9 35.9 13.2 269 270 A L H <5S- 0 0 27 -4,-2.1 -1,-0.2 -5,-0.5 -2,-0.2 0.718 100.7-130.7 -83.7 -20.6 -50.0 32.2 13.3 270 271 A G T <5 + 0 0 62 -4,-1.3 2,-0.3 -5,-0.4 -3,-0.2 0.905 62.3 125.3 70.9 42.8 -48.8 32.2 16.9 271 272 A I < - 0 0 6 -5,-0.9 -1,-0.2 -6,-0.4 -2,-0.1 -0.811 46.3-165.5-128.7 168.1 -45.5 30.4 16.2 272 273 A E + 0 0 125 -2,-0.3 -21,-1.7 1,-0.1 2,-0.3 0.610 67.4 60.9-122.2 -28.8 -41.7 31.0 16.8 273 274 A Y B > S-K 250 0D 79 -23,-0.2 3,-0.8 -22,-0.1 4,-0.4 -0.777 73.9-125.6-117.7 152.1 -39.9 28.6 14.6 274 275 A M G > S+ 0 0 0 -25,-2.7 3,-1.3 -2,-0.3 4,-0.2 0.820 108.0 60.9 -61.4 -34.1 -39.7 28.0 10.9 275 276 A G G > S+ 0 0 17 -29,-2.2 3,-1.8 1,-0.3 -1,-0.3 0.824 90.2 68.1 -65.4 -32.6 -40.6 24.3 11.3 276 277 A E G X S+ 0 0 64 -3,-0.8 3,-1.2 -30,-0.3 -1,-0.3 0.690 83.6 75.5 -62.1 -17.8 -43.9 25.1 12.8 277 278 A L G X S+ 0 0 0 -3,-1.3 3,-1.7 -4,-0.4 -1,-0.3 0.764 77.4 75.6 -64.5 -23.9 -45.0 26.5 9.4 278 279 A T G < S+ 0 0 65 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.717 80.7 68.7 -63.4 -21.4 -45.4 23.0 8.1 279 280 A Q G < S+ 0 0 131 -3,-1.2 2,-0.3 -4,-0.2 -1,-0.3 0.435 88.0 82.2 -81.5 4.0 -48.7 22.5 10.0 280 281 A F S < S- 0 0 37 -3,-1.7 2,-0.1 -4,-0.1 3,-0.0 -0.821 80.4-119.8-108.2 148.6 -50.6 25.0 7.8 281 282 A T > - 0 0 74 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.490 27.3-114.8 -78.2 154.7 -52.1 24.4 4.3 282 283 A E H > S+ 0 0 76 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.922 118.4 54.2 -52.1 -45.4 -50.8 26.4 1.4 283 284 A S H > S+ 0 0 83 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.897 105.6 52.6 -59.2 -42.7 -54.2 28.0 1.1 284 285 A Q H > S+ 0 0 86 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.944 111.5 45.8 -56.9 -49.3 -54.1 29.1 4.8 285 286 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.901 111.9 52.4 -63.1 -39.8 -50.7 30.8 4.3 286 287 A Q H X S+ 0 0 48 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.899 106.4 53.5 -63.3 -38.8 -51.9 32.4 1.1 287 288 A S H < S+ 0 0 91 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.887 117.1 36.4 -64.8 -39.4 -55.0 33.8 2.9 288 289 A H H < S+ 0 0 97 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.877 133.7 21.5 -79.5 -39.2 -53.0 35.5 5.6 289 290 A F H < S- 0 0 17 -4,-2.6 4,-0.4 1,-0.3 -3,-0.2 0.325 112.6 -95.9-119.5 6.4 -49.9 36.6 3.7 290 291 A G X - 0 0 36 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.3 -0.046 42.7 -77.2 92.3 160.8 -51.0 36.8 0.1 291 292 A E H > S+ 0 0 149 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.869 127.0 43.1 -64.9 -43.8 -50.7 34.3 -2.8 292 293 A K H > S+ 0 0 170 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.948 119.6 41.6 -67.3 -51.2 -47.0 34.8 -3.5 293 294 A N H > S+ 0 0 54 -4,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.862 114.5 52.7 -66.4 -39.0 -45.8 34.9 0.1 294 295 A G H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.950 111.4 44.9 -60.8 -52.1 -48.1 32.0 1.1 295 296 A S H X S+ 0 0 37 -4,-2.0 4,-1.9 -5,-0.2 5,-0.2 0.900 114.5 50.4 -57.3 -43.1 -46.8 29.7 -1.7 296 297 A W H X S+ 0 0 53 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.923 111.8 46.6 -63.8 -44.9 -43.2 30.8 -0.8 297 298 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.848 108.9 55.1 -65.0 -36.9 -43.7 30.0 2.9 298 299 A Y H < S+ 0 0 61 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.929 117.0 35.9 -65.1 -44.1 -45.3 26.7 2.3 299 300 A A H ><>S+ 0 0 24 -4,-1.9 5,-2.8 -5,-0.2 3,-1.0 0.895 115.0 55.9 -74.7 -40.4 -42.4 25.5 0.2 300 301 A M H ><5S+ 0 0 0 -4,-2.8 3,-2.6 1,-0.3 -2,-0.2 0.899 99.8 56.4 -63.2 -45.3 -39.7 27.2 2.2 301 302 A C T 3<5S+ 0 0 4 -4,-2.0 -1,-0.3 1,-0.3 -23,-0.2 0.682 108.0 52.1 -62.7 -14.3 -40.5 25.7 5.6 302 303 A R T < 5S- 0 0 69 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.350 127.4-103.0 -99.4 3.9 -40.0 22.3 3.8 303 304 A G T < 5S+ 0 0 1 -3,-2.6 2,-0.5 1,-0.3 -3,-0.2 0.616 82.0 129.3 87.3 15.2 -36.6 23.5 2.6 304 305 A I < + 0 0 20 -5,-2.8 2,-0.3 -8,-0.1 -1,-0.3 -0.890 21.3 154.0-113.1 129.5 -37.9 24.2 -0.9 305 306 A E - 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