==== 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 4J9R . 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 . 423 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21036.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 69.7 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 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 16 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 2 3 0 0 1 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 2 0 1 2 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 3 A T 0 0 110 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 14.1 -38.1 17.7 -3.2 2 4 A G + 0 0 10 1,-0.1 299,-0.1 298,-0.1 211,-0.1 0.841 360.0 116.9 59.0 37.5 -36.3 21.0 -4.1 3 5 A Q + 0 0 32 1,-0.1 -1,-0.1 297,-0.1 211,-0.0 0.197 38.9 96.5-118.2 8.7 -33.1 19.0 -4.7 4 6 A D S S+ 0 0 100 209,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.907 79.9 52.4 -63.7 -45.1 -32.7 19.7 -8.4 5 7 A R - 0 0 29 208,-0.4 2,-0.5 -3,-0.0 180,-0.1 -0.505 65.1-145.6 -97.9 158.9 -30.2 22.6 -8.0 6 8 A V + 0 0 0 -2,-0.2 113,-2.1 178,-0.1 114,-0.7 -0.991 29.1 175.3-118.7 121.8 -26.9 23.2 -6.3 7 9 A V E -AB 118 212A 0 205,-3.6 205,-2.8 -2,-0.5 2,-0.3 -0.983 12.5-165.8-132.3 137.1 -26.6 26.7 -4.9 8 10 A A E -AB 117 211A 0 109,-2.7 109,-2.4 -2,-0.4 2,-0.5 -0.888 10.2-155.1-117.9 148.0 -23.9 28.4 -2.8 9 11 A L E -AB 116 210A 1 201,-2.1 201,-2.5 -2,-0.3 2,-0.4 -0.990 15.9-164.7-117.9 119.4 -23.9 31.7 -0.9 10 12 A V E -AB 115 209A 3 105,-2.8 105,-1.9 -2,-0.5 2,-0.4 -0.884 5.7-173.2-104.7 133.7 -20.4 33.1 -0.5 11 13 A D E -AB 114 208A 21 197,-3.0 197,-2.6 -2,-0.4 2,-0.7 -0.990 23.4-131.5-130.8 128.2 -19.8 35.9 2.1 12 14 A M E > - B 0 207A 6 101,-2.9 3,-1.0 -2,-0.4 2,-0.3 -0.707 34.0-119.9 -78.9 117.4 -16.6 37.8 2.7 13 15 A D T 3 S- 0 0 4 193,-0.7 5,-0.3 -2,-0.7 193,-0.2 -0.417 84.9 -24.1 -61.2 118.7 -15.9 37.8 6.4 14 16 A C T 3> S- 0 0 17 -2,-0.3 4,-2.0 3,-0.1 3,-0.4 0.913 85.1-169.4 40.5 60.8 -15.9 41.4 7.7 15 17 A F H <> S+ 0 0 3 -3,-1.0 4,-2.6 1,-0.2 5,-0.2 0.847 74.5 50.1 -56.4 -47.9 -15.0 42.5 4.2 16 18 A F H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.895 111.6 51.8 -60.5 -37.3 -14.1 46.2 4.7 17 19 A V H > S+ 0 0 0 -3,-0.4 4,-3.2 2,-0.2 -2,-0.2 0.924 108.9 50.0 -62.0 -45.9 -11.8 45.1 7.6 18 20 A Q H X S+ 0 0 20 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.919 108.3 52.6 -60.2 -43.4 -10.1 42.5 5.4 19 21 A V H X S+ 0 0 3 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.957 114.6 42.4 -57.7 -47.9 -9.5 45.1 2.7 20 22 A E H X S+ 0 0 12 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.863 113.5 52.4 -64.8 -38.7 -7.9 47.4 5.4 21 23 A Q H < S+ 0 0 26 -4,-3.2 7,-0.3 2,-0.2 -1,-0.2 0.835 107.7 51.3 -68.1 -33.5 -6.0 44.5 6.9 22 24 A R H < S+ 0 0 89 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.961 115.1 42.5 -66.8 -47.4 -4.5 43.5 3.6 23 25 A Q H < S+ 0 0 120 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.804 123.1 37.8 -68.2 -33.8 -3.3 47.0 2.9 24 26 A N >< - 0 0 60 -4,-2.2 3,-2.6 -5,-0.2 4,-0.3 -0.802 67.8-167.5-124.7 91.3 -2.1 47.7 6.5 25 27 A P G > S+ 0 0 74 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.715 82.3 71.5 -46.5 -30.8 -0.4 44.5 8.0 26 28 A H G 3 S+ 0 0 145 1,-0.3 -5,-0.1 3,-0.0 -2,-0.0 0.766 93.7 57.7 -60.3 -22.4 -0.4 46.0 11.5 27 29 A L G X S+ 0 0 14 -3,-2.6 3,-1.1 -7,-0.2 -1,-0.3 0.594 80.9 114.9 -84.2 -12.4 -4.2 45.5 11.6 28 30 A R T < S+ 0 0 116 -3,-1.6 -10,-0.0 -7,-0.3 -6,-0.0 -0.365 85.2 0.3 -66.9 136.0 -4.0 41.8 10.9 29 31 A N T 3 S+ 0 0 135 1,-0.2 -1,-0.2 -2,-0.1 -2,-0.0 0.816 107.0 111.0 57.1 35.9 -5.2 39.4 13.7 30 32 A K S < S- 0 0 94 -3,-1.1 2,-0.4 44,-0.0 22,-0.3 -0.936 85.8 -86.8-131.1 154.2 -6.1 42.3 16.0 31 33 A P + 0 0 23 0, 0.0 43,-2.8 0, 0.0 2,-0.3 -0.531 67.3 169.8 -61.6 121.8 -9.5 43.5 17.2 32 34 A C E -g 74 0B 0 -2,-0.4 17,-3.1 41,-0.2 2,-0.3 -0.928 22.2-177.9-139.9 150.4 -10.3 45.9 14.3 33 35 A A E -gH 75 48B 0 41,-2.0 43,-2.3 -2,-0.3 2,-0.5 -0.987 22.8-130.7-146.5 158.9 -13.2 47.9 13.0 34 36 A V E -gH 76 47B 0 13,-2.7 12,-3.0 -2,-0.3 13,-1.0 -0.952 30.2-173.8-110.0 128.0 -13.8 50.1 10.0 35 37 A V E -gH 77 45B 0 41,-2.8 43,-2.4 -2,-0.5 2,-0.4 -0.855 14.1-155.7-118.8 154.9 -15.5 53.5 10.8 36 38 A Q E S+ H 0 44B 56 8,-1.7 8,-1.7 -2,-0.3 43,-0.1 -0.996 73.0 15.6-127.4 138.9 -16.9 56.4 8.8 37 39 A Y > - 0 0 70 -2,-0.4 3,-0.8 41,-0.3 6,-0.2 0.975 64.2-168.0 71.5 61.8 -17.2 60.1 9.9 38 40 A K T 3> S+ 0 0 78 1,-0.2 4,-1.0 4,-0.2 5,-0.2 0.656 70.2 76.5 -55.4 -24.7 -15.0 60.2 13.0 39 41 A S T 34 S+ 0 0 119 3,-0.2 2,-1.0 1,-0.2 3,-0.5 0.943 84.5 64.2 -59.2 -49.9 -16.1 63.6 14.3 40 42 A W T X4 S- 0 0 156 -3,-0.8 3,-1.8 1,-0.2 -1,-0.2 -0.639 134.6 -33.9 -85.4 104.8 -19.4 62.4 15.8 41 43 A K T 34 S- 0 0 98 -2,-1.0 23,-2.1 1,-0.3 24,-0.4 0.820 117.6 -55.6 57.7 36.6 -18.8 60.0 18.6 42 44 A G T 3< S- 0 0 3 -4,-1.0 -1,-0.3 -3,-0.5 -3,-0.2 0.308 98.8 -79.7 82.3 -8.2 -15.7 58.5 16.9 43 45 A G < - 0 0 0 -3,-1.8 20,-2.8 -6,-0.2 2,-0.4 -0.034 58.7 -70.6 91.9 157.8 -17.7 57.7 13.8 44 46 A G E -HI 36 62B 15 -8,-1.7 -8,-1.7 18,-0.2 2,-0.3 -0.713 44.4-124.1 -92.3 135.4 -20.0 54.8 13.2 45 47 A I E +H 35 0B 1 16,-3.0 15,-3.5 -2,-0.4 16,-0.4 -0.576 30.0 171.7 -78.9 131.5 -18.6 51.3 12.7 46 48 A I E + 0 0 42 -12,-3.0 2,-0.3 1,-0.3 -11,-0.1 0.493 68.9 27.2-116.4 -8.5 -19.6 49.5 9.5 47 49 A A E -H 34 0B 3 -13,-1.0 -13,-2.7 11,-0.1 2,-0.4 -0.953 63.1-168.0-155.3 138.8 -17.3 46.4 9.8 48 50 A V E -H 33 0B 5 -2,-0.3 -15,-0.2 -15,-0.2 11,-0.1 -0.985 19.2-128.1-131.8 133.5 -15.9 44.6 12.8 49 51 A S >> - 0 0 1 -17,-3.1 4,-2.0 -2,-0.4 3,-0.6 -0.393 28.3-113.3 -77.8 159.0 -13.2 41.9 12.9 50 52 A Y H 3> S+ 0 0 57 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.859 117.0 59.0 -59.6 -36.8 -13.9 38.6 14.8 51 53 A E H 34 S+ 0 0 73 -21,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.863 111.3 42.3 -58.7 -35.7 -11.2 39.5 17.4 52 54 A A H X4>S+ 0 0 0 -3,-0.6 5,-1.6 -22,-0.3 3,-1.0 0.802 105.9 62.2 -82.3 -30.1 -13.3 42.7 18.2 53 55 A R H ><5S+ 0 0 102 -4,-2.0 3,-1.6 1,-0.3 -2,-0.2 0.788 91.8 67.0 -64.0 -30.1 -16.6 40.9 18.0 54 56 A A T 3<5S+ 0 0 91 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.835 98.7 52.5 -58.7 -32.4 -15.5 38.7 20.9 55 57 A F T < 5S- 0 0 104 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.482 127.3-101.2 -81.9 -5.0 -15.6 41.9 23.0 56 58 A G T < 5 + 0 0 36 -3,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.546 69.9 152.7 95.9 7.6 -19.2 42.6 21.9 57 59 A V < + 0 0 2 -5,-1.6 -1,-0.3 -8,-0.1 2,-0.3 -0.584 20.0 177.9 -73.0 130.2 -18.3 45.2 19.3 58 60 A T - 0 0 74 -2,-0.3 3,-0.4 -11,-0.1 -13,-0.2 -0.832 32.5 -89.2-129.5 165.5 -20.9 45.3 16.5 59 61 A R S S+ 0 0 136 -2,-0.3 -13,-0.2 1,-0.2 3,-0.1 -0.338 108.5 35.2 -70.8 152.8 -21.7 47.3 13.3 60 62 A S S S+ 0 0 109 -15,-3.5 2,-0.3 1,-0.3 -1,-0.2 0.870 92.8 124.8 64.5 37.1 -23.8 50.4 13.6 61 63 A M - 0 0 41 -3,-0.4 -16,-3.0 -16,-0.4 -1,-0.3 -0.919 69.0-105.8-121.3 147.5 -22.2 51.1 16.9 62 64 A W B > -I 44 0B 97 -2,-0.3 4,-2.3 -18,-0.2 -18,-0.2 -0.547 22.9-130.2 -74.4 143.1 -20.4 54.4 17.7 63 65 A A H > S+ 0 0 0 -20,-2.8 4,-2.4 -22,-0.3 -21,-0.2 0.889 106.6 55.5 -62.4 -39.2 -16.6 54.1 17.8 64 66 A D H > S+ 0 0 75 -23,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.913 111.1 44.3 -59.7 -43.7 -16.3 55.8 21.2 65 67 A D H > S+ 0 0 58 -24,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.875 110.2 56.3 -66.2 -38.2 -18.7 53.2 22.7 66 68 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.881 103.9 53.3 -59.5 -40.6 -16.8 50.5 20.9 67 69 A K H < S+ 0 0 85 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.850 103.7 57.1 -64.6 -34.2 -13.6 51.6 22.6 68 70 A K H < S+ 0 0 150 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.937 113.4 39.7 -57.9 -47.8 -15.4 51.3 25.9 69 71 A L H < S+ 0 0 82 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.852 131.8 25.7 -67.6 -38.3 -16.1 47.7 25.2 70 72 A C >< - 0 0 0 -4,-2.7 3,-2.0 -5,-0.2 -1,-0.3 -0.763 65.6-173.7-137.5 87.1 -12.7 47.0 23.6 71 73 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.701 85.9 50.0 -54.0 -28.2 -9.9 49.3 24.9 72 74 A D T 3 S+ 0 0 131 2,-0.1 -5,-0.1 -20,-0.0 -20,-0.0 0.311 78.9 140.6 -97.8 7.1 -7.4 47.9 22.4 73 75 A L < - 0 0 2 -3,-2.0 2,-0.4 -7,-0.1 -41,-0.2 -0.228 43.4-143.8 -58.4 128.4 -9.5 48.3 19.3 74 76 A L E -g 32 0B 62 -43,-2.8 -41,-2.0 -47,-0.1 2,-0.4 -0.787 16.1-152.4 -93.7 137.2 -7.8 49.4 16.1 75 77 A L E -g 33 0B 47 -2,-0.4 2,-0.5 -43,-0.2 -41,-0.2 -0.915 12.0-167.9-116.1 134.4 -9.8 51.7 13.8 76 78 A A E -g 34 0B 8 -43,-2.3 -41,-2.8 -2,-0.4 2,-0.4 -0.978 18.4-142.5-117.4 131.0 -9.5 52.2 10.1 77 79 A Q E -g 35 0B 114 -2,-0.5 -41,-0.2 -43,-0.2 2,-0.1 -0.756 17.1-114.8 -97.2 141.9 -11.4 55.1 8.6 78 80 A V - 0 0 11 -43,-2.4 -41,-0.3 -2,-0.4 9,-0.1 -0.445 41.6 -97.5 -66.6 136.9 -13.1 55.1 5.2 79 81 A R - 0 0 111 7,-0.4 7,-3.0 -2,-0.1 2,-0.5 -0.331 40.1-146.9 -50.0 133.2 -11.7 57.4 2.6 80 82 A E E +J 85 0C 116 5,-0.2 2,-0.4 -3,-0.1 5,-0.2 -0.948 19.9 177.4-111.4 128.5 -13.7 60.6 2.5 81 83 A S E > -J 84 0C 29 3,-2.9 3,-1.4 -2,-0.5 261,-0.1 -0.996 65.5 -5.7-133.5 134.5 -14.2 62.5 -0.8 82 84 A R T 3 S- 0 0 62 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.839 130.5 -53.4 56.3 36.7 -16.1 65.7 -1.4 83 85 A G T 3 S+ 0 0 27 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.620 122.6 85.4 75.2 13.4 -17.4 65.7 2.1 84 86 A K E < S-J 81 0C 16 -3,-1.4 -3,-2.9 254,-0.1 -1,-0.2 -0.926 86.9 -80.1-138.1 168.2 -18.8 62.1 2.0 85 87 A A E -J 80 0C 8 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.396 38.8-152.2 -64.0 141.3 -17.7 58.5 2.5 86 88 A N + 0 0 10 -7,-3.0 -7,-0.4 1,-0.1 3,-0.3 -0.967 17.1 178.4-122.9 114.9 -15.9 57.0 -0.5 87 89 A L >> + 0 0 42 -2,-0.5 4,-2.2 1,-0.2 3,-1.2 0.328 45.0 116.0-102.0 8.1 -16.2 53.3 -0.9 88 90 A T H 3> S+ 0 0 36 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.825 73.4 56.2 -45.3 -44.7 -14.2 52.9 -4.2 89 91 A K H 3> S+ 0 0 38 -3,-0.3 4,-1.7 1,-0.2 -1,-0.3 0.872 110.8 43.7 -60.1 -38.2 -11.5 50.8 -2.5 90 92 A Y H <> S+ 0 0 1 -3,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.876 112.2 52.1 -77.9 -38.7 -14.0 48.2 -1.3 91 93 A R H X S+ 0 0 64 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.875 110.5 49.7 -60.2 -39.9 -15.9 48.2 -4.6 92 94 A E H X S+ 0 0 90 -4,-2.6 4,-1.6 -5,-0.2 -2,-0.2 0.897 112.3 45.9 -68.0 -39.3 -12.5 47.6 -6.4 93 95 A A H X S+ 0 0 1 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.911 109.7 57.2 -67.7 -40.5 -11.7 44.7 -4.0 94 96 A S H X S+ 0 0 4 -4,-2.7 4,-2.0 1,-0.2 3,-0.2 0.917 104.9 50.0 -53.0 -49.2 -15.2 43.4 -4.5 95 97 A V H X S+ 0 0 75 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.872 104.1 59.7 -60.5 -38.4 -14.7 43.2 -8.3 96 98 A E H X S+ 0 0 67 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.909 109.2 43.6 -53.0 -45.8 -11.4 41.3 -7.8 97 99 A V H X S+ 0 0 3 -4,-1.6 4,-2.6 -3,-0.2 -2,-0.2 0.904 109.9 54.3 -70.5 -41.9 -13.3 38.5 -5.9 98 100 A M H X S+ 0 0 10 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.831 105.2 54.8 -64.2 -33.7 -16.2 38.3 -8.4 99 101 A E H X S+ 0 0 118 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.914 109.5 46.5 -65.0 -44.9 -13.9 37.8 -11.3 100 102 A I H >X S+ 0 0 9 -4,-1.4 3,-1.3 1,-0.2 4,-0.6 0.939 112.4 50.0 -60.5 -48.3 -12.3 34.8 -9.6 101 103 A M H >X S+ 0 0 4 -4,-2.6 4,-1.6 1,-0.3 3,-1.5 0.892 102.0 65.0 -57.4 -40.3 -15.7 33.4 -8.6 102 104 A S H 3< S+ 0 0 43 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.679 92.3 61.3 -53.1 -30.0 -16.7 33.8 -12.3 103 105 A R H << S+ 0 0 148 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.746 108.9 41.6 -71.0 -26.5 -14.2 31.3 -13.5 104 106 A F H << S- 0 0 58 -3,-1.5 2,-0.3 -4,-0.6 -2,-0.2 0.870 124.0 -27.6 -91.8 -40.7 -15.8 28.5 -11.5 105 107 A A S < S- 0 0 18 -4,-1.6 2,-0.4 16,-0.0 -1,-0.2 -0.899 77.1 -57.0-162.2-176.7 -19.5 29.1 -11.9 106 108 A V E -C 118 0A 73 12,-1.2 12,-2.7 -2,-0.3 2,-0.4 -0.641 55.6-161.3 -80.9 128.0 -22.4 31.3 -12.6 107 109 A I E -C 117 0A 6 -2,-0.4 201,-1.7 10,-0.2 2,-0.5 -0.893 22.4-162.4-123.3 144.9 -22.7 34.1 -10.1 108 110 A E E -Cd 116 308A 15 8,-2.7 8,-2.6 -2,-0.4 2,-0.4 -0.974 25.8-134.6-115.8 113.4 -25.2 36.6 -8.8 109 111 A R E +C 115 0A 53 199,-2.6 6,-0.3 -2,-0.5 3,-0.1 -0.552 25.5 178.6 -66.0 122.7 -23.8 39.6 -7.0 110 112 A A E - 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0 0 79 -4,-0.4 -20,-1.5 -7,-0.2 2,-0.3 -0.954 56.6-141.3-138.8 158.4 -15.5 27.9 6.9 230 235 A Q E -ef 143 209A 0 -88,-2.4 -86,-2.7 -2,-0.3 2,-0.4 -0.938 11.3-152.9-124.5 147.6 -18.2 26.4 4.6 231 236 A T E -ef 144 210A 0 -22,-2.4 -20,-2.7 -2,-0.3 2,-0.6 -0.970 5.3-149.7-128.6 128.1 -21.4 24.5 5.6 232 237 A L E -ef 145 211A 1 -88,-2.8 -86,-2.2 -2,-0.4 2,-0.6 -0.849 12.5-170.9 -94.1 120.7 -23.3 21.9 3.6 233 238 A V - 0 0 0 -22,-2.5 -20,-0.3 -2,-0.6 2,-0.1 -0.951 11.2-163.6-113.2 110.8 -27.1 21.9 4.4 234 239 A S > - 0 0 8 -2,-0.6 4,-0.6 -88,-0.3 3,-0.5 -0.380 34.4-107.9 -88.3 167.5 -28.8 18.9 2.8 235 240 A H T >4 S+ 0 0 46 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.927 119.4 57.9 -58.3 -39.9 -32.5 18.4 2.3 236 241 A G T 34 S+ 0 0 58 1,-0.3 4,-0.4 2,-0.1 -1,-0.2 0.780 100.8 55.8 -62.2 -29.7 -32.4 15.8 5.1 237 242 A S T 3> S+ 0 0 11 -3,-0.5 4,-2.6 1,-0.2 -1,-0.3 0.629 85.4 85.9 -78.0 -15.5 -31.1 18.2 7.7 238 243 A V H S+ 0 0 96 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.934 116.5 37.3 -53.8 -50.2 -36.4 19.2 9.6 240 245 A Q H > S+ 0 0 149 -4,-0.4 4,-0.7 2,-0.2 -2,-0.2 0.907 118.5 51.2 -66.9 -41.1 -34.0 19.2 12.6 241 246 A L H < S+ 0 0 19 -4,-2.6 3,-0.5 1,-0.2 -1,-0.2 0.898 114.9 41.1 -62.0 -42.9 -32.5 22.5 11.5 242 247 A F H >< S+ 0 0 2 -4,-3.1 29,-2.0 -5,-0.2 3,-1.3 0.722 96.1 80.7 -77.9 -22.4 -35.8 24.3 11.2 243 248 A S H 3< S+ 0 0 63 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.815 111.6 19.4 -59.5 -32.9 -37.3 22.8 14.3 244 249 A Q T 3< S+ 0 0 144 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.125 97.3 121.5-118.8 17.3 -35.6 25.3 16.6 245 250 A M < - 0 0 24 -3,-1.3 25,-3.4 -5,-0.1 26,-0.2 -0.752 63.5-126.8 -93.0 114.7 -34.8 27.9 14.0 246 251 A P B > -K 269 0D 32 0, 0.0 3,-1.5 0, 0.0 4,-0.3 -0.285 16.8-128.1 -57.4 137.0 -36.3 31.3 14.8 247 252 A I G > S+ 0 0 1 21,-2.1 3,-1.9 1,-0.3 6,-0.2 0.850 103.5 65.3 -55.8 -39.8 -38.4 32.7 11.9 248 253 A R G 3 S+ 0 0 144 1,-0.3 -1,-0.3 20,-0.2 4,-0.1 0.678 92.0 67.1 -63.1 -17.6 -36.6 36.0 11.7 249 254 A K G < S+ 0 0 114 -3,-1.5 -1,-0.3 4,-0.1 2,-0.2 0.657 78.9 92.9 -75.0 -21.5 -33.4 34.2 10.6 250 255 A I S X S- 0 0 3 -3,-1.9 3,-2.1 -4,-0.3 4,-0.2 -0.572 94.8 -92.6 -77.4 138.2 -34.8 33.0 7.3 251 256 A R T 3 S+ 0 0 67 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.331 110.5 12.9 -55.3 125.2 -34.0 35.4 4.4 252 257 A S T 3 S+ 0 0 74 -4,-0.1 3,-0.3 -2,-0.1 6,-0.3 0.237 110.8 82.8 90.7 -3.3 -36.8 37.9 3.8 253 258 A L < + 0 0 1 -3,-2.1 -2,-0.2 -6,-0.2 -3,-0.1 0.221 60.2 95.7-109.7 11.0 -38.5 37.2 7.1 254 259 A G S S+ 0 0 60 -4,-0.2 -1,-0.2 -5,-0.1 -6,-0.1 0.521 88.0 35.0 -79.5 -4.6 -36.3 39.4 9.2 255 260 A G S > S- 0 0 45 -3,-0.3 4,-2.1 0, 0.0 5,-0.2 0.041 118.7 -30.4-119.9-132.5 -38.7 42.3 9.0 256 261 A K H > S+ 0 0 190 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.867 129.0 51.1 -62.4 -42.6 -42.4 43.1 9.0 257 262 A L H > S+ 0 0 43 -5,-0.2 4,-2.8 2,-0.2 5,-0.2 0.962 111.1 47.6 -59.9 -51.9 -43.6 39.9 7.3 258 263 A G H > S+ 0 0 1 -6,-0.3 4,-2.6 1,-0.2 -2,-0.2 0.908 112.3 51.5 -56.5 -41.9 -41.6 37.6 9.7 259 264 A A H X S+ 0 0 56 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.892 112.3 44.6 -62.0 -42.1 -43.0 39.6 12.6 260 265 A S H X S+ 0 0 36 -4,-2.2 4,-3.3 2,-0.2 5,-0.5 0.808 109.8 55.0 -77.2 -29.7 -46.6 39.2 11.3 261 266 A V H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 6,-0.4 0.942 114.3 42.2 -62.5 -45.5 -46.0 35.5 10.6 262 267 A I H X>S+ 0 0 60 -4,-2.6 4,-1.6 -5,-0.2 5,-0.6 0.924 119.9 43.7 -63.9 -44.1 -45.0 35.2 14.2 263 268 A E H <5S+ 0 0 157 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.902 119.9 38.0 -73.2 -44.1 -47.8 37.4 15.5 264 269 A I H <5S+ 0 0 81 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.922 122.2 41.6 -76.0 -42.2 -50.7 36.1 13.4 265 270 A L H <5S- 0 0 24 -4,-1.9 -2,-0.2 -5,-0.5 -3,-0.2 0.779 97.1-132.3 -78.0 -26.3 -49.7 32.4 13.5 266 271 A G T <5 + 0 0 65 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.1 0.820 66.1 115.1 76.9 32.1 -48.7 32.3 17.2 267 272 A I < - 0 0 8 -5,-0.6 -1,-0.3 -6,-0.4 -2,-0.1 -0.800 48.7-165.6-125.9 168.1 -45.4 30.4 16.5 268 273 A E + 0 0 122 -2,-0.3 -21,-2.1 1,-0.1 2,-0.3 0.588 65.1 69.4-124.6 -22.0 -41.7 31.2 16.8 269 274 A Y B > S-K 246 0D 68 -23,-0.2 3,-0.9 1,-0.1 4,-0.4 -0.767 73.5-127.0-111.6 150.3 -39.8 28.6 14.7 270 275 A M G > S+ 0 0 0 -25,-3.4 3,-1.6 -2,-0.3 4,-0.2 0.857 107.2 57.5 -56.6 -40.5 -39.6 27.9 11.0 271 276 A G G > S+ 0 0 15 -29,-2.0 3,-2.2 1,-0.3 -1,-0.3 0.811 90.5 71.3 -65.4 -30.0 -40.6 24.3 11.3 272 277 A E G X S+ 0 0 60 -3,-0.9 3,-1.1 -30,-0.3 -1,-0.3 0.674 82.5 74.7 -58.8 -18.0 -43.9 25.2 13.0 273 278 A L G X S+ 0 0 0 -3,-1.6 3,-1.5 -4,-0.4 -1,-0.3 0.757 77.3 77.5 -66.9 -21.8 -45.0 26.5 9.6 274 279 A T G < S+ 0 0 67 -3,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.735 81.1 65.8 -62.6 -22.8 -45.4 23.0 8.4 275 280 A Q G < S+ 0 0 127 -3,-1.1 2,-0.4 -4,-0.2 -1,-0.3 0.663 86.8 84.6 -76.1 -13.9 -48.8 22.5 10.2 276 281 A F S < S- 0 0 41 -3,-1.5 2,-0.0 -4,-0.2 3,-0.0 -0.701 78.8-123.9 -94.5 137.8 -50.6 25.0 8.1 277 282 A T > - 0 0 72 -2,-0.4 4,-1.7 1,-0.1 5,-0.2 -0.378 28.4-112.8 -68.1 157.2 -52.2 24.3 4.7 278 283 A E H > S+ 0 0 71 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.929 118.3 53.1 -55.7 -50.0 -51.0 26.5 1.8 279 284 A S H > S+ 0 0 83 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.898 105.7 54.6 -53.5 -44.4 -54.5 28.1 1.5 280 285 A Q H > S+ 0 0 86 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.905 113.0 42.6 -54.0 -43.3 -54.4 29.0 5.2 281 286 A L H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.902 113.1 52.1 -74.5 -40.0 -51.0 30.7 4.7 282 287 A Q H X S+ 0 0 51 -4,-3.5 4,-2.2 1,-0.2 -2,-0.2 0.897 107.5 52.5 -60.8 -38.3 -52.2 32.4 1.4 283 288 A S H < S+ 0 0 95 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.903 116.1 40.3 -68.1 -36.4 -55.3 33.8 3.2 284 289 A H H < S+ 0 0 92 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.873 134.5 15.4 -74.9 -39.6 -53.2 35.3 5.9 285 290 A F H < S- 0 0 22 -4,-2.5 4,-0.4 1,-0.3 -3,-0.2 0.378 112.2 -94.8-125.7 -0.0 -50.2 36.7 3.9 286 291 A G X - 0 0 32 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 -0.114 43.7 -70.1 101.1 161.1 -51.3 36.7 0.3 287 292 A E H > S+ 0 0 166 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.898 128.0 38.1 -51.3 -55.4 -51.0 34.3 -2.7 288 293 A K H > S+ 0 0 162 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.911 120.1 43.6 -70.4 -48.6 -47.3 34.7 -3.3 289 294 A N H > S+ 0 0 55 -4,-0.4 4,-2.9 2,-0.2 5,-0.2 0.918 113.8 52.0 -64.7 -44.0 -46.1 34.9 0.3 290 295 A G H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.940 112.5 44.7 -57.3 -51.1 -48.4 32.0 1.4 291 296 A S H X S+ 0 0 41 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.879 115.0 49.4 -55.9 -42.1 -47.1 29.8 -1.4 292 297 A W H X S+ 0 0 45 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.859 112.3 47.0 -73.5 -35.0 -43.5 30.8 -0.6 293 298 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.926 109.4 54.0 -68.2 -46.9 -43.9 30.1 3.1 294 299 A Y H < S+ 0 0 74 -4,-2.8 4,-0.2 1,-0.2 -2,-0.2 0.892 116.6 37.8 -54.0 -46.5 -45.6 26.7 2.5 295 300 A A H ><>S+ 0 0 22 -4,-1.9 5,-2.6 -5,-0.2 3,-0.8 0.847 113.6 56.2 -73.8 -36.9 -42.6 25.6 0.3 296 301 A M H ><5S+ 0 0 0 -4,-1.9 3,-2.4 1,-0.2 -2,-0.2 0.883 99.1 56.9 -69.7 -39.9 -39.9 27.3 2.4 297 302 A C T 3<5S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.3 -23,-0.2 0.646 107.6 52.2 -65.2 -13.7 -40.7 25.6 5.7 298 303 A R T < 5S- 0 0 79 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.2 0.173 127.0-104.2-102.2 9.6 -40.2 22.4 3.8 299 304 A G T < 5S+ 0 0 0 -3,-2.4 2,-0.5 1,-0.2 -3,-0.2 0.722 81.0 130.7 75.6 21.8 -36.8 23.6 2.6 300 305 A I < + 0 0 35 -5,-2.6 2,-0.3 -8,-0.1 -1,-0.2 -0.932 21.5 154.3-116.5 128.3 -38.1 24.3 -0.9 301 306 A E - 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