==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 28-APR-10 3MR6 . COMPND 2 MOLECULE: DNA POLYMERASE ETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.BIERTUMPFEL,Y.ZHAO,S.RAMON-MAIQUES,M.T.GREGORY,J.Y.LEE,W.Y . 427 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21650.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 70.5 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 15.2 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 . 21 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 0 2 2 0 1 0 0 1 0 1 0 1 0 0 0 1 0 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 . 1 3 0 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 94 0, 0.0 3,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -73.9 -44.4 -10.2 1.6 2 -1 A P T 3 + 0 0 122 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.813 360.0 41.5 -61.6 -38.0 -43.1 -9.6 5.2 3 0 A H T 3 S+ 0 0 180 2,-0.1 2,-0.6 0, 0.0 0, 0.0 0.419 88.0 111.5 -96.2 2.8 -44.7 -12.8 6.7 4 1 A M < - 0 0 116 -3,-0.8 2,-0.2 1,-0.0 0, 0.0 -0.660 68.6-131.7 -79.5 118.6 -43.8 -15.0 3.7 5 2 A A - 0 0 69 -2,-0.6 -2,-0.1 1,-0.1 298,-0.0 -0.476 20.1-171.5 -68.4 139.4 -41.1 -17.5 4.7 6 3 A T - 0 0 57 -2,-0.2 -1,-0.1 296,-0.0 -2,-0.0 0.404 34.9-123.6-114.9 0.9 -38.2 -17.6 2.2 7 4 A G S S+ 0 0 7 1,-0.1 297,-0.2 296,-0.1 3,-0.1 0.912 73.9 124.4 58.2 43.4 -36.4 -20.7 3.5 8 5 A Q + 0 0 41 1,-0.1 -1,-0.1 295,-0.1 209,-0.0 0.096 34.3 107.5-116.9 22.7 -33.1 -18.8 4.0 9 6 A D S S+ 0 0 91 207,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.773 75.5 39.8 -75.3 -29.5 -32.8 -19.7 7.7 10 7 A R - 0 0 23 206,-0.4 2,-0.6 -3,-0.1 178,-0.1 -0.797 65.3-136.1-122.6 163.2 -29.9 -22.2 7.4 11 8 A V + 0 0 0 -2,-0.3 113,-2.6 176,-0.1 114,-0.6 -0.970 33.3 176.4-114.9 112.5 -26.7 -22.7 5.6 12 9 A V E -AB 123 215A 0 203,-3.1 203,-2.8 -2,-0.6 2,-0.3 -0.940 9.2-169.0-121.5 138.6 -26.4 -26.3 4.4 13 10 A A E -AB 122 214A 0 109,-2.3 109,-2.7 -2,-0.4 2,-0.5 -0.904 11.4-153.1-124.4 153.1 -23.7 -27.9 2.3 14 11 A L E -AB 121 213A 0 199,-2.2 199,-1.9 -2,-0.3 2,-0.5 -0.971 9.9-167.1-125.5 116.2 -23.3 -31.2 0.5 15 12 A V E +AB 120 212A 1 105,-2.2 105,-1.8 -2,-0.5 2,-0.4 -0.910 9.7 178.4-103.7 121.9 -19.9 -32.6 -0.0 16 13 A D E -AB 119 211A 14 195,-2.2 195,-2.3 -2,-0.5 103,-0.2 -0.990 28.0-120.8-127.5 127.2 -19.6 -35.5 -2.5 17 14 A M E > - B 0 210A 2 101,-2.6 3,-0.6 -2,-0.4 2,-0.3 -0.303 30.2-114.6 -65.0 143.2 -16.4 -37.3 -3.4 18 15 A D T 3 S- 0 0 4 191,-1.9 5,-0.4 1,-0.3 191,-0.2 -0.657 87.6 -23.5 -79.3 135.4 -15.4 -37.3 -7.1 19 16 A C T >> S- 0 0 17 -2,-0.3 4,-2.1 34,-0.1 3,-0.6 0.812 87.5-169.3 24.0 59.1 -15.5 -40.7 -8.8 20 17 A F H <> S+ 0 0 9 -3,-0.6 4,-2.1 1,-0.3 5,-0.2 0.821 71.7 44.7 -45.2 -65.8 -14.9 -42.0 -5.2 21 18 A F H 3> S+ 0 0 30 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.877 113.9 53.0 -55.4 -36.9 -14.1 -45.7 -5.7 22 19 A V H <> S+ 0 0 1 -3,-0.6 4,-2.7 1,-0.2 -1,-0.2 0.931 107.5 50.1 -61.6 -47.8 -11.7 -44.8 -8.5 23 20 A Q H X S+ 0 0 23 -4,-2.1 4,-2.6 -5,-0.4 -1,-0.2 0.870 107.5 54.8 -59.4 -39.0 -9.9 -42.3 -6.4 24 21 A V H X S+ 0 0 4 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.937 113.4 41.2 -60.0 -44.8 -9.5 -44.9 -3.7 25 22 A E H X S+ 0 0 12 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.829 114.1 53.6 -71.4 -32.8 -7.9 -47.3 -6.1 26 23 A Q H < S+ 0 0 25 -4,-2.7 7,-0.3 2,-0.2 6,-0.2 0.858 106.2 51.7 -71.3 -37.0 -5.8 -44.5 -7.7 27 24 A R H < S+ 0 0 88 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.924 115.1 43.3 -62.9 -40.2 -4.4 -43.4 -4.4 28 25 A Q H < S+ 0 0 121 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.867 123.4 35.9 -72.2 -42.2 -3.4 -47.0 -3.7 29 26 A N >< - 0 0 60 -4,-2.5 3,-2.6 1,-0.1 4,-0.4 -0.841 66.3-168.2-120.2 93.5 -2.0 -47.6 -7.2 30 27 A P G > S+ 0 0 77 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.701 81.9 75.4 -50.8 -24.0 -0.3 -44.5 -8.7 31 28 A H G 3 S+ 0 0 160 1,-0.2 -5,-0.1 -3,-0.1 -3,-0.0 0.700 94.4 51.8 -64.9 -16.8 -0.3 -46.3 -12.2 32 29 A L G X S+ 0 0 16 -3,-2.6 3,-0.9 -6,-0.2 -1,-0.2 0.602 84.0 115.2 -94.6 -13.7 -4.0 -45.5 -12.4 33 30 A R T < S+ 0 0 117 -3,-1.1 -10,-0.0 -4,-0.4 -6,-0.0 -0.257 82.5 5.4 -63.3 141.5 -3.8 -41.8 -11.7 34 31 A N T 3 S+ 0 0 136 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 0.832 108.9 107.3 56.8 39.5 -4.7 -39.3 -14.4 35 32 A K S < S- 0 0 109 -3,-0.9 2,-0.8 44,-0.0 22,-0.3 -0.915 83.9 -87.5-140.4 162.7 -5.9 -42.0 -16.7 36 33 A P + 0 0 29 0, 0.0 43,-2.9 0, 0.0 2,-0.3 -0.650 69.0 147.9 -70.9 115.2 -9.2 -43.4 -18.1 37 34 A C E -g 79 0B 4 -2,-0.8 17,-3.2 41,-0.2 2,-0.3 -0.986 27.9-169.6-150.7 161.1 -10.1 -46.0 -15.4 38 35 A A E -gH 80 53B 1 41,-2.1 43,-2.5 -2,-0.3 2,-0.5 -0.947 24.0-119.2-147.5 158.3 -13.0 -47.6 -13.8 39 36 A V E -gH 81 52B 0 13,-2.0 12,-3.0 -2,-0.3 13,-1.2 -0.928 34.6-178.1-104.3 130.1 -13.9 -49.8 -10.8 40 37 A V E -gH 82 50B 0 41,-2.5 43,-2.7 -2,-0.5 2,-0.4 -0.912 17.9-150.1-128.0 152.4 -15.6 -53.1 -11.6 41 38 A Q E S+ H 0 49B 56 8,-1.7 8,-1.6 -2,-0.3 43,-0.1 -0.984 71.8 12.1-121.9 127.4 -17.0 -56.1 -9.6 42 39 A Y - 0 0 75 -2,-0.4 3,-0.3 41,-0.3 -1,-0.2 0.991 58.4-161.9 77.3 88.7 -17.1 -59.7 -10.9 43 40 A K S > S+ 0 0 84 1,-0.2 4,-1.1 5,-0.1 5,-0.1 0.821 74.0 75.3 -72.3 -38.4 -15.0 -60.2 -14.1 44 41 A S T 4 S+ 0 0 124 3,-0.2 2,-0.8 2,-0.1 3,-0.5 0.878 85.6 65.2 -46.0 -55.0 -16.4 -63.6 -15.4 45 42 A W T >4 S- 0 0 162 -3,-0.3 3,-2.3 1,-0.3 -1,-0.1 -0.613 133.4 -36.2 -84.4 110.4 -19.7 -62.1 -16.8 46 43 A K T 34 S- 0 0 96 -2,-0.8 23,-2.3 1,-0.3 24,-0.4 0.762 114.5 -59.7 53.3 30.9 -19.1 -59.8 -19.7 47 44 A G T 3< S- 0 0 9 -4,-1.1 -1,-0.3 -3,-0.5 -3,-0.2 0.317 99.1 -71.2 85.8 -10.9 -16.0 -58.4 -18.0 48 45 A G < - 0 0 1 -3,-2.3 20,-3.3 -5,-0.1 2,-0.5 -0.060 56.7 -73.4 105.7 153.2 -17.8 -57.2 -14.9 49 46 A G E -HI 41 67B 20 -8,-1.6 -8,-1.7 18,-0.2 2,-0.4 -0.713 42.5-130.5 -89.4 128.7 -20.1 -54.4 -14.0 50 47 A I E +HI 40 66B 1 16,-2.9 15,-2.2 -2,-0.5 16,-0.5 -0.623 31.8 167.3 -78.1 129.0 -18.7 -50.9 -13.8 51 48 A I E + 0 0 56 -12,-3.0 2,-0.3 -2,-0.4 -11,-0.2 0.516 66.1 31.3-119.8 -8.8 -19.6 -49.1 -10.6 52 49 A A E -H 39 0B 12 -13,-1.2 -13,-2.0 11,-0.1 2,-0.4 -0.995 62.4-166.6-148.3 144.6 -17.2 -46.1 -10.8 53 50 A V E -H 38 0B 6 -2,-0.3 -15,-0.2 -15,-0.2 -34,-0.1 -0.984 19.2-129.4-138.7 126.6 -15.7 -44.1 -13.7 54 51 A S > - 0 0 0 -17,-3.2 4,-1.9 -2,-0.4 3,-0.4 -0.310 30.7-114.2 -65.4 154.4 -12.8 -41.6 -13.8 55 52 A Y H > S+ 0 0 61 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.835 117.8 56.6 -63.9 -29.5 -13.6 -38.3 -15.5 56 53 A E H 4 S+ 0 0 72 -21,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.883 108.6 47.2 -65.6 -37.1 -11.0 -39.2 -18.2 57 54 A A H >4>S+ 0 0 0 -3,-0.4 5,-1.5 -22,-0.3 3,-1.5 0.834 103.7 61.1 -72.8 -32.9 -13.0 -42.4 -18.9 58 55 A R H ><5S+ 0 0 103 -4,-1.9 3,-1.9 1,-0.3 -1,-0.2 0.821 91.4 68.4 -63.8 -29.2 -16.3 -40.5 -19.0 59 56 A A T 3<5S+ 0 0 87 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.734 99.7 50.3 -60.8 -23.4 -15.0 -38.5 -21.9 60 57 A F T < 5S- 0 0 110 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.448 126.7-101.8 -92.9 -5.1 -15.2 -41.7 -23.9 61 58 A G T < 5 + 0 0 34 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.489 68.6 152.1 98.7 1.9 -18.7 -42.4 -22.8 62 59 A V < + 0 0 2 -5,-1.5 -1,-0.3 -8,-0.1 2,-0.3 -0.458 22.2 173.9 -65.4 138.2 -18.0 -45.0 -20.1 63 60 A T > - 0 0 72 -2,-0.1 3,-0.6 -11,-0.1 -13,-0.2 -0.868 34.9 -77.9-140.9 174.3 -20.7 -45.0 -17.5 64 61 A R T 3 S+ 0 0 194 -2,-0.3 -13,-0.2 1,-0.2 3,-0.1 -0.340 110.9 29.6 -66.7 151.3 -22.0 -46.6 -14.4 65 62 A S T 3 S+ 0 0 112 -15,-2.2 2,-0.4 1,-0.2 -1,-0.2 0.854 93.1 130.2 63.4 34.6 -24.1 -49.8 -14.8 66 63 A M E < -I 50 0B 37 -3,-0.6 -16,-2.9 -16,-0.5 -1,-0.2 -0.941 63.6-113.1-119.9 141.3 -22.1 -50.7 -17.9 67 64 A W E > -I 49 0B 105 -2,-0.4 4,-2.5 -18,-0.2 3,-0.4 -0.546 22.2-131.0 -70.4 138.0 -20.4 -54.0 -18.7 68 65 A A H > S+ 0 0 2 -20,-3.3 4,-2.7 1,-0.2 -21,-0.2 0.887 108.0 57.6 -56.6 -39.3 -16.6 -53.8 -18.7 69 66 A D H > S+ 0 0 80 -23,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.900 110.3 43.5 -58.0 -41.2 -16.5 -55.6 -22.1 70 67 A D H >> S+ 0 0 62 -3,-0.4 4,-1.2 -24,-0.4 3,-0.6 0.890 112.0 52.7 -70.6 -40.7 -18.7 -52.9 -23.6 71 68 A A H 3X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 3,-0.2 0.875 103.2 58.6 -61.2 -38.2 -16.8 -50.1 -21.9 72 69 A K H 3< S+ 0 0 79 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.793 100.3 57.8 -62.5 -27.6 -13.6 -51.5 -23.4 73 70 A K H << S+ 0 0 148 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.899 111.8 39.5 -69.7 -39.6 -15.2 -51.0 -26.8 74 71 A L H < S+ 0 0 82 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.855 132.2 26.9 -74.4 -38.8 -15.7 -47.3 -26.2 75 72 A C >< - 0 0 1 -4,-2.7 3,-1.8 -5,-0.2 -1,-0.3 -0.817 66.4-175.6-132.0 90.4 -12.4 -46.9 -24.5 76 73 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.818 87.2 46.3 -53.6 -37.0 -9.7 -49.5 -25.6 77 74 A D T 3 S+ 0 0 133 2,-0.1 -5,-0.1 -40,-0.0 -2,-0.0 0.250 79.2 143.5 -96.6 14.2 -7.1 -48.3 -23.1 78 75 A L < - 0 0 1 -3,-1.8 2,-0.3 -6,-0.2 -41,-0.2 -0.283 43.3-141.8 -54.7 127.2 -9.5 -48.2 -20.2 79 76 A L E -g 37 0B 60 -43,-2.9 -41,-2.1 -47,-0.1 2,-0.4 -0.738 16.2-152.4 -90.8 145.6 -7.8 -49.3 -17.0 80 77 A L E -g 38 0B 44 -2,-0.3 2,-0.4 -43,-0.2 -41,-0.2 -0.971 14.1-166.4-128.6 135.1 -9.7 -51.4 -14.5 81 78 A A E -g 39 0B 10 -43,-2.5 -41,-2.5 -2,-0.4 2,-0.4 -0.967 22.6-137.5-112.7 132.1 -9.6 -51.9 -10.8 82 79 A Q E -g 40 0B 101 -2,-0.4 -41,-0.2 -43,-0.2 2,-0.1 -0.737 14.2-117.9 -97.8 138.1 -11.5 -54.8 -9.3 83 80 A V - 0 0 5 -43,-2.7 -41,-0.3 -2,-0.4 9,-0.1 -0.425 44.9 -98.9 -63.1 137.3 -13.5 -54.8 -6.1 84 81 A R - 0 0 125 7,-0.5 7,-3.2 -2,-0.1 2,-0.4 -0.275 35.7-150.0 -59.2 145.0 -12.1 -57.2 -3.6 85 82 A E E +J 90 0C 99 5,-0.3 2,-0.3 -3,-0.1 5,-0.2 -0.988 21.1 166.7-121.8 129.4 -13.8 -60.6 -3.3 86 83 A S E > +J 89 0C 33 3,-2.9 3,-1.6 -2,-0.4 259,-0.1 -0.997 65.6 4.7-141.3 142.2 -14.0 -62.6 -0.1 87 84 A R T 3 S- 0 0 83 -2,-0.3 -1,-0.1 1,-0.3 258,-0.1 0.835 133.0 -55.1 53.2 35.0 -16.0 -65.6 0.9 88 85 A G T 3 S+ 0 0 36 1,-0.2 2,-0.3 253,-0.1 -1,-0.3 0.574 121.5 80.3 80.2 13.5 -17.3 -65.8 -2.7 89 86 A K E < S-J 86 0C 9 -3,-1.6 -3,-2.9 252,-0.1 -1,-0.2 -0.954 87.5 -79.8-146.7 163.1 -18.7 -62.2 -2.8 90 87 A A E -J 85 0C 5 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.3 -0.366 39.9-155.2 -61.4 138.0 -17.7 -58.6 -3.4 91 88 A N - 0 0 10 -7,-3.2 -7,-0.5 1,-0.1 3,-0.3 -0.990 12.3-172.3-120.3 120.3 -16.2 -57.0 -0.3 92 89 A L >> + 0 0 34 -2,-0.5 4,-2.1 1,-0.2 3,-0.8 0.233 48.3 118.7 -98.3 16.8 -16.5 -53.2 0.0 93 90 A T H 3> S+ 0 0 35 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.857 71.4 55.0 -51.8 -47.2 -14.3 -52.8 3.1 94 91 A K H 3> S+ 0 0 65 -3,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.888 111.3 45.4 -55.8 -39.9 -11.6 -50.6 1.4 95 92 A Y H <> S+ 0 0 2 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.872 110.9 52.0 -74.0 -37.0 -14.3 -48.2 0.4 96 93 A R H X S+ 0 0 74 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.923 111.8 47.0 -63.9 -42.2 -16.0 -48.1 3.8 97 94 A E H X S+ 0 0 105 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.872 111.8 50.2 -67.9 -37.9 -12.7 -47.4 5.5 98 95 A A H X S+ 0 0 2 -4,-1.8 4,-1.6 -5,-0.3 -1,-0.2 0.900 108.3 53.9 -64.8 -39.9 -11.9 -44.6 3.0 99 96 A S H X S+ 0 0 4 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.908 105.0 54.1 -59.1 -43.4 -15.3 -43.2 3.6 100 97 A V H X S+ 0 0 69 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.888 102.7 57.5 -58.7 -41.7 -14.6 -43.0 7.3 101 98 A E H X S+ 0 0 65 -4,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.922 113.1 40.2 -53.2 -46.2 -11.4 -41.1 6.6 102 99 A V H X S+ 0 0 2 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.921 113.2 52.1 -71.7 -46.5 -13.5 -38.4 4.9 103 100 A M H X S+ 0 0 5 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.877 107.4 53.4 -61.1 -38.9 -16.4 -38.4 7.3 104 101 A E H X S+ 0 0 114 -4,-2.5 4,-0.5 -5,-0.2 -1,-0.2 0.902 108.3 50.2 -65.0 -38.8 -14.1 -37.9 10.3 105 102 A I H >X S+ 0 0 7 -4,-1.2 3,-1.2 -5,-0.2 4,-0.5 0.941 112.2 46.6 -63.9 -46.2 -12.5 -34.9 8.7 106 103 A M H >X S+ 0 0 1 -4,-2.1 3,-1.4 1,-0.3 4,-1.2 0.883 103.1 63.1 -64.2 -37.6 -15.8 -33.2 7.9 107 104 A S H 3< S+ 0 0 45 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.650 90.4 69.4 -65.2 -14.1 -17.2 -33.9 11.4 108 105 A R H << S+ 0 0 142 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.878 103.5 42.8 -67.0 -35.1 -14.4 -31.6 12.7 109 106 A F 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0A 0 -3,-1.0 2,-0.4 84,-0.2 86,-0.2 -0.708 40.3-164.1-101.2 135.2 -16.3 -21.5 -6.0 149 146 A Y E -e 234 0A 27 84,-2.6 86,-3.5 -2,-0.4 2,-0.7 -0.928 12.8-145.2-109.0 133.6 -19.0 -21.1 -8.7 150 147 A I E > -e 235 0A 6 -2,-0.4 3,-1.9 15,-0.3 86,-0.2 -0.902 27.7-123.5 -98.1 110.2 -21.9 -18.8 -8.2 151 148 A E T 3 S+ 0 0 53 84,-2.5 86,-0.3 -2,-0.7 93,-0.1 -0.239 91.9 18.1 -56.9 134.2 -24.9 -20.3 -10.0 152 149 A G T 3 S+ 0 0 43 1,-0.3 -1,-0.2 2,-0.1 84,-0.0 0.334 101.8 147.2 91.5 -7.5 -26.5 -18.0 -12.5 153 150 A L < + 0 0 47 -3,-1.9 -1,-0.3 2,-0.1 15,-0.3 -0.880 34.9 43.9-119.0 154.2 -23.6 -15.6 -12.8 154 151 A P S S+ 0 0 33 0, 0.0 2,-0.3 0, 0.0 14,-0.1 0.517 77.7 156.9 -76.2 157.5 -22.1 -13.9 -14.6 155 152 A Q + 0 0 114 -2,-0.1 -2,-0.1 13,-0.1 16,-0.0 -0.941 31.1 17.5-140.5 159.2 -25.1 -12.3 -16.1 156 153 A G 0 0 63 -2,-0.3 -3,-0.0 1,-0.1 0, 0.0 -0.172 360.0 360.0 83.7-170.4 -26.0 -9.0 -18.0 157 154 A P 0 0 183 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.927 360.0 360.0 -79.7 360.0 -23.9 -6.4 -19.7 158 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 159 161 A V 0 0 199 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -1.3 -14.4 -17.6 -23.5 160 162 A Q > - 0 0 126 1,-0.1 4,-2.6 0, 0.0 5,-0.2 -0.926 360.0-131.1-117.2 144.3 -12.7 -19.7 -20.9 161 163 A K H > S+ 0 0 124 -2,-0.4 4,-2.5 1,-0.2 5,-0.1 0.907 108.6 48.1 -62.8 -43.3 -14.4 -21.6 -18.1 162 164 A E H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 111.9 50.6 -63.6 -37.7 -12.1 -20.4 -15.4 163 165 A G H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.908 109.8 51.1 -63.4 -40.3 -12.5 -16.8 -16.7 164 166 A M H X S+ 0 0 100 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.908 108.3 51.9 -61.3 -43.3 -16.2 -17.3 -16.6 165 167 A R H X S+ 0 0 15 -4,-2.5 4,-2.5 1,-0.2 -15,-0.3 0.924 110.4 47.2 -61.6 -46.3 -16.0 -18.5 -13.0 166 168 A K H X S+ 0 0 97 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.922 109.5 54.0 -62.8 -45.3 -14.1 -15.5 -11.8 167 169 A Q H X S+ 0 0 109 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.951 111.6 44.6 -51.6 -54.7 -16.4 -13.1 -13.6 168 170 A G H X S+ 0 0 1 -4,-2.3 4,-2.2 -15,-0.3 -1,-0.2 0.922 113.5 50.0 -57.1 -47.3 -19.4 -14.6 -11.9 169 171 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.902 109.4 51.9 -59.8 -42.4 -17.6 -14.6 -8.5 170 172 A F H X S+ 0 0 90 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.906 108.7 50.1 -62.8 -42.3 -16.6 -11.0 -8.9 171 173 A Q H X S+ 0 0 66 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.925 112.1 49.3 -61.0 -42.1 -20.1 -9.9 -9.7 172 174 A W H X S+ 0 0 14 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.948 114.4 42.1 -61.6 -53.7 -21.4 -11.7 -6.6 173 175 A L H < S+ 0 0 28 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.852 111.0 56.4 -65.5 -38.3 -18.8 -10.3 -4.2 174 176 A D H < S+ 0 0 139 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.898 110.7 46.1 -58.6 -38.2 -19.1 -6.8 -5.6 175 177 A S H < S+ 0 0 75 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.784 89.5 111.5 -77.4 -27.4 -22.9 -6.9 -4.9 176 178 A L < - 0 0 17 -4,-1.4 2,-1.0 -5,-0.1 3,-0.1 -0.127 62.4-140.5 -57.4 141.3 -22.6 -8.3 -1.3 177 179 A Q > - 0 0 74 1,-0.1 3,-0.8 3,-0.1 6,-0.2 -0.790 20.2-177.2 -99.5 88.8 -23.5 -6.2 1.7 178 180 A I T 3 S+ 0 0 51 -2,-1.0 -41,-0.6 1,-0.2 -1,-0.1 0.615 72.8 64.6 -65.8 -11.8 -20.8 -7.2 4.1 179 181 A D T 3 S+ 0 0 128 -42,-0.1 2,-1.0 1,-0.1 -1,-0.2 0.811 82.9 75.8 -87.4 -31.0 -22.2 -5.1 6.9 180 182 A N X - 0 0 78 -3,-0.8 3,-1.7 1,-0.2 6,-0.2 -0.721 60.4-168.7 -85.5 106.3 -25.6 -6.8 7.5 181 183 A L T 3 S+ 0 0 46 -2,-1.0 -1,-0.2 1,-0.3 -49,-0.1 0.653 84.7 58.9 -67.5 -15.2 -24.7 -10.0 9.4 182 184 A T T 3 S+ 0 0 95 -3,-0.1 -1,-0.3 4,-0.0 -2,-0.1 0.472 72.9 123.8 -94.1 -2.5 -28.3 -11.3 8.8 183 185 A S <> - 0 0 11 -3,-1.7 4,-2.3 -6,-0.2 5,-0.1 -0.448 54.8-150.3 -62.8 121.9 -28.0 -11.2 5.0 184 186 A P H > S+ 0 0 34 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.857 96.5 51.4 -59.5 -42.9 -28.8 -14.7 3.7 185 187 A D H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.904 110.0 49.3 -64.0 -43.7 -26.5 -14.2 0.7 186 188 A L H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.921 109.7 52.3 -60.0 -43.3 -23.7 -13.1 2.9 187 189 A Q H X S+ 0 0 21 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.911 108.6 49.5 -61.1 -44.1 -24.2 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-25.0 3.9 198 200 A M H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.930 111.9 46.9 -57.4 -50.2 -13.2 -28.3 4.4 199 201 A R H X S+ 0 0 15 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.859 110.7 52.5 -65.5 -34.5 -12.5 -29.5 0.9 200 202 A A H X S+ 0 0 56 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.925 109.8 49.9 -65.2 -41.9 -8.8 -28.4 1.2 201 203 A A H X S+ 0 0 14 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.920 109.8 50.2 -62.2 -45.7 -8.6 -30.4 4.5 202 204 A I H X>S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 6,-0.6 0.937 114.8 43.2 -60.3 -45.7 -10.1 -33.5 2.9 203 205 A E H X5S+ 0 0 78 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.911 115.8 47.5 -68.8 -42.4 -7.7 -33.4 -0.1 204 206 A R H <5S+ 0 0 198 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.915 119.9 38.8 -63.8 -40.3 -4.6 -32.6 2.0 205 207 A E H <5S+ 0 0 67 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.649 133.8 18.3 -90.1 -17.4 -5.3 -35.3 4.5 206 208 A T H <5S- 0 0 8 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.620 89.5-124.6-124.1 -23.3 -6.6 -38.1 2.2 207 209 A G S < S- 0 0 1 -205,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.972 81.3-101.3-156.2 169.9 -31.3 -26.7 2.3 218 220 A K H > S+ 0 0 9 88,-0.4 4,-2.8 -2,-0.3 5,-0.3 0.901 113.7 51.2 -65.8 -45.5 -30.2 -30.2 1.4 219 221 A V H > S+ 0 0 6 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.946 115.3 42.5 -59.4 -47.3 -32.0 -30.6 -2.0 220 222 A L H > S+ 0 0 2 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.885 114.5 51.1 -67.4 -38.6 -30.5 -27.3 -3.3 221 223 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -207,-0.3 0.943 112.0 46.8 -62.2 -47.0 -27.1 -28.1 -1.9 222 224 A K H X S+ 0 0 64 -4,-2.8 4,-1.2 2,-0.2 -2,-0.2 0.903 114.5 47.4 -60.9 -43.7 -27.1 -31.6 -3.5 223 225 A L H X S+ 0 0 26 -4,-2.3 4,-0.7 -5,-0.3 3,-0.4 0.926 110.8 51.7 -63.0 -44.6 -28.2 -30.2 -6.8 224 226 A A H >X S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.2 4,-0.6 0.853 101.6 62.5 -60.7 -37.1 -25.6 -27.4 -6.6 225 227 A C H >< S+ 0 0 1 -4,-2.1 3,-0.7 1,-0.2 4,-0.3 0.893 102.4 48.8 -58.3 -42.0 -22.9 -30.0 -6.0 226 228 A G H >< S+ 0 0 50 -4,-1.2 3,-0.5 -3,-0.4 -1,-0.2 0.694 92.7 79.9 -75.3 -14.9 -23.4 -31.7 -9.3 227 229 A L H << S+ 0 0 55 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.828 108.2 19.0 -63.7 -35.7 -23.4 -28.4 -11.3 228 230 A N T << S+ 0 0 16 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.1 0.152 91.7 177.4-130.6 25.9 -19.6 -28.0 -11.4 229 231 A K < + 0 0 48 -3,-0.5 2,-0.1 -4,-0.3 4,-0.1 -0.368 42.2 60.9 -63.0 147.7 -18.0 -31.4 -10.7 230 232 A P S S- 0 0 52 0, 0.0 3,-0.1 0, 0.0 -19,-0.1 0.524 123.4 -21.0 -99.9 167.1 -15.2 -32.3 -10.6 231 233 A N S S+ 0 0 36 1,-0.2 2,-0.3 -2,-0.1 -20,-0.2 0.774 110.3 102.3 53.7 35.7 -13.0 -30.6 -8.0 232 234 A R - 0 0 81 -7,-0.2 -20,-1.2 2,-0.0 2,-0.4 -0.966 57.1-144.8-141.7 156.3 -15.3 -27.5 -7.8 233 235 A Q E -ef 148 212A 0 -86,-2.3 -84,-2.6 -2,-0.3 2,-0.4 -0.952 12.6-150.0-123.4 148.3 -18.0 -26.2 -5.4 234 236 A T E -ef 149 213A 0 -22,-2.8 -20,-2.6 -2,-0.4 2,-0.6 -0.959 4.7-149.8-128.1 132.7 -21.2 -24.3 -6.3 235 237 A L E -ef 150 214A 1 -86,-3.5 -84,-2.5 -2,-0.4 2,-0.6 -0.851 11.9-170.1 -98.2 117.9 -23.1 -21.7 -4.4 236 238 A V - 0 0 1 -22,-2.5 -20,-0.3 -2,-0.6 2,-0.1 -0.920 11.0-160.9-113.5 104.5 -26.9 -21.6 -5.1 237 239 A S > - 0 0 9 -2,-0.6 3,-0.6 -86,-0.3 4,-0.5 -0.333 32.0-110.8 -77.7 162.1 -28.6 -18.6 -3.7 238 240 A H G > S+ 0 0 47 1,-0.2 3,-1.3 2,-0.2 -1,-0.1 0.907 118.9 57.0 -57.2 -39.0 -32.2 -18.2 -3.0 239 241 A G G 3 S+ 0 0 57 1,-0.3 4,-0.4 2,-0.1 -1,-0.2 0.783 98.6 58.0 -65.2 -30.1 -32.3 -15.7 -5.8 240 242 A S G <> S+ 0 0 13 -3,-0.6 4,-2.4 1,-0.2 -1,-0.3 0.554 84.5 86.9 -78.5 -7.9 -30.9 -18.0 -8.4 241 243 A V H <> S+ 0 0 4 -3,-1.3 4,-3.4 -4,-0.5 5,-0.3 0.931 80.3 55.2 -64.5 -49.4 -33.8 -20.6 -7.9 242 244 A P H > S+ 0 0 91 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.930 117.1 35.4 -51.6 -51.0 -36.4 -19.1 -10.4 243 245 A Q H > S+ 0 0 148 -4,-0.4 4,-0.6 2,-0.2 3,-0.3 0.929 118.6 51.8 -70.8 -40.1 -34.0 -19.2 -13.4 244 246 A L H >< S+ 0 0 20 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.922 115.2 41.4 -59.4 -44.0 -32.3 -22.4 -12.3 245 247 A F H >< S+ 0 0 2 -4,-3.4 29,-2.4 1,-0.2 3,-0.9 0.664 94.4 82.5 -79.8 -17.0 -35.6 -24.2 -11.9 246 248 A S H 3< S+ 0 0 59 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.803 111.4 18.6 -60.8 -30.7 -37.2 -22.8 -15.0 247 249 A Q T << S+ 0 0 149 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.125 95.2 121.6-124.4 18.8 -35.4 -25.4 -17.2 248 250 A M < - 0 0 25 -3,-0.9 25,-2.8 -5,-0.1 26,-0.2 -0.741 64.7-124.8 -89.2 113.7 -34.6 -28.0 -14.6 249 251 A P B > -K 272 0D 29 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.281 17.1-126.3 -56.1 138.8 -36.1 -31.4 -15.4 250 252 A I G > S+ 0 0 0 21,-1.9 3,-1.4 1,-0.3 6,-0.1 0.832 106.4 64.3 -56.9 -33.6 -38.2 -32.6 -12.4 251 253 A R G 3 S+ 0 0 147 1,-0.3 -1,-0.3 20,-0.2 5,-0.2 0.649 88.4 71.1 -68.5 -13.3 -36.3 -35.9 -12.3 252 254 A K G < S+ 0 0 113 -3,-1.9 -1,-0.3 4,-0.1 2,-0.2 0.776 78.7 91.7 -74.6 -24.8 -33.1 -34.0 -11.4 253 255 A I S X S- 0 0 3 -3,-1.4 3,-2.7 -4,-0.4 4,-0.2 -0.485 93.7 -96.3 -74.1 138.9 -34.4 -33.2 -7.9 254 256 A R T 3 S+ 0 0 133 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 -0.279 110.7 16.0 -60.2 131.1 -33.6 -35.6 -5.1 255 257 A S T 3 S+ 0 0 74 -4,-0.1 -1,-0.3 -3,-0.1 3,-0.2 0.292 109.9 84.4 87.1 -1.1 -36.4 -38.1 -4.5 256 258 A L < + 0 0 1 -3,-2.7 -2,-0.2 -5,-0.2 -3,-0.1 0.317 59.1 92.4-112.1 12.4 -38.0 -37.2 -7.8 257 259 A G S S+ 0 0 63 -4,-0.2 -1,-0.1 4,-0.1 -6,-0.1 0.536 86.4 44.8 -84.2 -2.6 -36.0 -39.5 -10.1 258 260 A G S > S- 0 0 46 -3,-0.2 4,-2.2 0, 0.0 5,-0.1 0.030 115.8 -40.9-114.2-140.2 -38.5 -42.4 -9.8 259 261 A K H > S+ 0 0 190 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.867 129.4 53.6 -60.3 -44.2 -42.2 -43.2 -10.0 260 262 A L H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 110.2 46.8 -59.0 -49.5 -43.3 -40.1 -8.0 261 263 A G H > S+ 0 0 1 1,-0.2 4,-2.0 -6,-0.2 -1,-0.2 0.918 112.1 51.6 -57.4 -42.0 -41.4 -37.8 -10.3 262 264 A A H X S+ 0 0 56 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.867 108.2 51.7 -62.3 -38.0 -42.9 -39.5 -13.3 263 265 A S H X S+ 0 0 43 -4,-2.3 4,-3.2 2,-0.2 5,-0.4 0.868 106.4 53.9 -68.7 -37.5 -46.4 -39.1 -11.8 264 266 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 6,-0.3 0.954 110.9 46.1 -59.5 -49.0 -45.9 -35.4 -11.3 265 267 A I H X>S+ 0 0 57 -4,-2.0 4,-1.5 1,-0.2 5,-1.1 0.937 119.3 39.7 -59.0 -49.3 -44.9 -34.9 -14.9 266 268 A E H <5S+ 0 0 154 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.912 118.6 43.5 -75.0 -44.7 -47.8 -37.0 -16.3 267 269 A I H <5S+ 0 0 76 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.929 124.4 35.4 -66.5 -42.9 -50.6 -35.9 -13.9 268 270 A L H <5S- 0 0 25 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.669 101.1-130.3 -87.3 -17.9 -49.7 -32.2 -14.1 269 271 A G T <5 + 0 0 64 -4,-1.5 2,-0.3 -5,-0.3 -3,-0.2 0.901 63.7 123.7 70.5 41.1 -48.6 -32.2 -17.7 270 272 A I < - 0 0 10 -5,-1.1 -1,-0.2 -6,-0.3 -2,-0.1 -0.845 47.2-165.5-131.1 166.9 -45.3 -30.4 -17.0 271 273 A E + 0 0 122 -2,-0.3 -21,-1.9 1,-0.1 2,-0.3 0.654 66.8 61.8-121.2 -31.9 -41.5 -31.0 -17.5 272 274 A Y B > S-K 249 0D 74 -23,-0.2 3,-1.4 -26,-0.1 4,-0.3 -0.784 73.3-125.6-114.2 151.3 -39.6 -28.5 -15.3 273 275 A M G > S+ 0 0 0 -25,-2.8 3,-1.7 -2,-0.3 4,-0.2 0.844 108.9 58.9 -54.9 -41.2 -39.4 -27.9 -11.5 274 276 A G G > S+ 0 0 18 -29,-2.4 3,-1.7 1,-0.3 -1,-0.3 0.781 89.7 70.9 -63.2 -27.7 -40.3 -24.2 -11.9 275 277 A E G X S+ 0 0 75 -3,-1.4 3,-0.9 -30,-0.3 -1,-0.3 0.658 83.3 74.7 -64.1 -13.3 -43.7 -25.1 -13.5 276 278 A L G X S+ 0 0 0 -3,-1.7 3,-1.8 -4,-0.3 -1,-0.3 0.753 76.3 75.9 -70.8 -24.6 -44.8 -26.4 -10.1 277 279 A T G < S+ 0 0 45 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.737 82.1 68.8 -61.6 -21.6 -45.2 -22.8 -8.8 278 280 A Q G < S+ 0 0 151 -3,-0.9 2,-0.3 -4,-0.2 -1,-0.3 0.563 87.5 80.9 -79.1 -3.5 -48.5 -22.4 -10.7 279 281 A F S < S- 0 0 44 -3,-1.8 2,-0.0 -4,-0.1 -3,-0.0 -0.795 80.5-119.7-106.7 143.8 -50.3 -25.0 -8.5 280 282 A T > - 0 0 68 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.358 27.2-114.5 -70.9 157.3 -51.9 -24.3 -5.1 281 283 A E H > S+ 0 0 78 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.937 119.6 51.8 -57.3 -45.8 -50.6 -26.4 -2.2 282 284 A S H > S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.883 107.4 53.9 -59.4 -38.1 -54.0 -28.0 -1.9 283 285 A Q H > S+ 0 0 86 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.954 111.6 43.5 -60.5 -49.6 -53.9 -28.9 -5.6 284 286 A L H >X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 3,-0.5 0.907 113.2 52.5 -63.8 -39.3 -50.5 -30.6 -5.2 285 287 A Q H 3X S+ 0 0 52 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.896 102.8 58.7 -62.8 -39.3 -51.7 -32.3 -2.0 286 288 A S H 3< S+ 0 0 89 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.809 115.7 34.3 -62.7 -28.6 -54.7 -33.7 -3.7 287 289 A H H << S+ 0 0 96 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.841 131.7 25.3 -95.3 -35.7 -52.6 -35.5 -6.3 288 290 A F H X S- 0 0 15 -4,-2.5 4,-0.5 1,-0.3 -2,-0.2 0.285 112.0 -97.4-118.5 12.4 -49.5 -36.6 -4.3 289 291 A G H X - 0 0 35 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.3 -0.071 43.8 -73.2 92.2 161.4 -50.7 -36.8 -0.7 290 292 A E H > S+ 0 0 148 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.925 130.4 40.9 -61.0 -47.5 -50.6 -34.3 2.2 291 293 A K H > S+ 0 0 177 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.953 118.6 44.0 -69.6 -49.4 -46.8 -34.8 2.8 292 294 A N H X S+ 0 0 69 -4,-0.5 4,-2.5 1,-0.2 5,-0.2 0.885 113.6 51.6 -64.0 -41.1 -45.7 -34.9 -0.8 293 295 A G H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.921 110.4 47.2 -63.0 -45.3 -47.9 -32.0 -1.9 294 296 A S H X S+ 0 0 39 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.894 112.8 50.5 -62.3 -39.5 -46.6 -29.7 0.9 295 297 A W H X S+ 0 0 58 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.917 112.0 45.6 -66.1 -44.9 -43.0 -30.7 0.1 296 298 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.908 108.9 56.2 -65.0 -43.9 -43.4 -29.9 -3.7 297 299 A Y H < S+ 0 0 58 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.905 117.2 35.1 -55.1 -43.8 -45.2 -26.6 -3.0 298 300 A A H ><>S+ 0 0 23 -4,-1.7 5,-2.7 -5,-0.2 3,-1.1 0.899 115.7 55.3 -78.4 -40.2 -42.3 -25.4 -0.9 299 301 A M H ><5S+ 0 0 0 -4,-3.0 3,-2.7 1,-0.3 -2,-0.2 0.884 99.7 57.7 -64.6 -42.8 -39.5 -27.1 -3.0 300 302 A C T 3<5S+ 0 0 3 -4,-2.7 -1,-0.3 1,-0.3 -23,-0.2 0.666 108.1 51.2 -63.5 -12.0 -40.4 -25.6 -6.3 301 303 A R T < 5S- 0 0 68 -3,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.296 126.8-103.8-104.0 6.8 -39.9 -22.3 -4.6 302 304 A G T < 5S+ 0 0 1 -3,-2.7 2,-0.5 1,-0.2 -3,-0.2 0.645 81.8 128.4 80.7 18.5 -36.5 -23.4 -3.3 303 305 A I < + 0 0 21 -5,-2.7 2,-0.3 -8,-0.1 -1,-0.2 -0.909 22.2 153.6-114.6 129.8 -37.8 -24.0 0.2 304 306 A E - 0 0 10 -2,-0.5 -86,-0.1 -297,-0.2 -9,-0.0 -0.985 25.8-164.3-149.8 143.4 -37.2 -27.2 2.2 305 307 A H + 0 0 119 -2,-0.3 -1,-0.0 -88,-0.1 -88,-0.0 0.345 40.8 134.5-114.8 7.7 -37.1 -27.9 6.0 306 308 A D - 0 0 62 1,-0.1 -88,-0.4 3,-0.0 -87,-0.1 -0.402 53.2-133.1 -59.4 117.1 -35.5 -31.4 6.1 307 309 A P - 0 0 76 0, 0.0 2,-1.0 0, 0.0 -1,-0.1 -0.328 15.7-107.3 -72.3 152.4 -32.9 -31.0 8.9 308 310 A V - 0 0 11 -2,-0.0 -185,-0.1 -197,-0.0 -197,-0.0 -0.741 42.9-136.3 -76.0 104.3 -29.4 -32.2 8.6 309 311 A K - 0 0 79 -2,-1.0 2,-2.0 1,-0.1 -188,-0.1 -0.424 9.7-123.1 -68.1 137.3 -29.6 -35.2 10.9 310 312 A P + 0 0 116 0, 0.0 2,-0.4 0, 0.0 -197,-0.2 -0.563 66.9 126.9 -81.1 78.6 -26.7 -35.7 13.3 311 313 A R B +d 113 0A 62 -2,-2.0 -197,-3.0 -199,-1.1 -2,-0.1 -0.909 26.0 166.5-141.3 111.7 -25.7 -39.2 12.1 312 314 A Q + 0 0 65 -2,-0.4 -1,-0.1 -199,-0.2 -199,-0.1 0.655 65.0 65.7 -95.2 -19.4 -22.2 -40.1 11.1 313 315 A L S S- 0 0 57 1,-0.1 -199,-0.1 44,-0.0 2,-0.0 -0.793 89.2-102.0-111.9 148.8 -22.7 -43.8 11.1 314 316 A P - 0 0 42 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.337 23.1-138.3 -63.1 145.2 -24.8 -46.2 9.0 315 317 A K S S+ 0 0 139 -4,-0.1 111,-0.4 110,-0.0 2,-0.3 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