==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 26-MAR-12 4ED1 . COMPND 2 MOLECULE: DNA POLYMERASE ETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.NAKAMURA,Y.ZHAO,W.YANG . 430 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21943.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 68.6 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 . 64 14.9 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 . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 31.9 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 2 1 2 1 1 0 1 1 0 0 0 0 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 . 2 2 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 83 0, 0.0 3,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-128.2 67.1 -34.3 -3.9 2 -1 A P T 3 + 0 0 125 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.630 360.0 48.5 -69.4 -16.8 68.7 -32.9 -7.1 3 0 A H T 3 S+ 0 0 181 2,-0.1 2,-1.0 1,-0.0 0, 0.0 0.409 80.5 112.7-104.0 -1.0 65.3 -32.3 -8.7 4 1 A M < - 0 0 139 -3,-0.9 -1,-0.0 2,-0.0 0, 0.0 -0.629 65.5-137.9 -80.6 100.5 63.7 -30.5 -5.7 5 2 A A - 0 0 81 -2,-1.0 -2,-0.1 1,-0.1 -1,-0.0 -0.280 13.9-164.2 -61.4 139.9 63.2 -26.9 -6.9 6 3 A T - 0 0 57 297,-0.0 -1,-0.1 298,-0.0 -2,-0.0 0.349 35.2-117.4-112.9 3.1 64.2 -24.3 -4.2 7 4 A G S S+ 0 0 7 297,-0.1 298,-0.2 1,-0.1 3,-0.1 0.938 77.1 124.0 59.2 50.1 62.5 -21.2 -5.6 8 5 A Q + 0 0 42 1,-0.1 -1,-0.1 296,-0.1 210,-0.1 0.122 34.0 102.5-125.3 16.7 65.8 -19.4 -6.0 9 6 A D S S+ 0 0 97 208,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.634 77.3 47.3 -76.3 -21.0 65.4 -18.5 -9.7 10 7 A R - 0 0 25 207,-0.3 2,-0.5 -3,-0.1 179,-0.1 -0.839 64.8-140.4-123.3 157.8 64.5 -14.8 -9.3 11 8 A V + 0 0 0 -2,-0.3 113,-2.5 177,-0.1 114,-0.7 -0.986 30.9 178.4-114.4 120.4 65.6 -11.7 -7.5 12 9 A V E -AB 123 216A 0 204,-2.8 204,-2.5 -2,-0.5 2,-0.3 -0.957 9.3-168.1-124.6 139.6 62.6 -9.7 -6.2 13 10 A A E -AB 122 215A 0 109,-2.3 109,-2.2 -2,-0.4 2,-0.4 -0.904 10.4-155.7-122.1 152.9 62.5 -6.5 -4.2 14 11 A L E -AB 121 214A 0 200,-2.0 200,-2.0 -2,-0.3 2,-0.5 -0.986 12.6-165.0-124.7 118.5 59.7 -4.7 -2.5 15 12 A V E +AB 120 213A 1 105,-2.6 105,-2.0 -2,-0.4 2,-0.4 -0.913 9.4 179.1-106.9 130.1 60.3 -1.0 -1.9 16 13 A D E -AB 119 212A 14 196,-2.4 196,-2.6 -2,-0.5 103,-0.2 -0.989 26.5-124.1-136.0 124.3 58.0 0.8 0.5 17 14 A M E > - B 0 211A 3 101,-2.1 3,-0.6 -2,-0.4 194,-0.3 -0.380 32.5-112.1 -68.0 140.3 58.1 4.5 1.5 18 15 A D T 3 S- 0 0 4 192,-2.0 5,-0.3 1,-0.2 192,-0.2 -0.557 87.0 -23.6 -74.0 136.6 58.5 5.3 5.2 19 16 A C T 3> S- 0 0 18 -2,-0.2 4,-2.0 3,-0.1 3,-0.4 0.802 86.0-165.4 24.9 68.5 55.3 6.9 6.8 20 17 A F H <> S+ 0 0 8 -3,-0.6 4,-2.0 1,-0.3 5,-0.2 0.851 72.5 43.7 -60.4 -54.4 54.4 8.1 3.3 21 18 A F H > S+ 0 0 30 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.857 114.0 55.0 -63.3 -33.1 51.7 10.7 3.7 22 19 A V H > S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.927 106.7 49.0 -60.0 -47.3 53.7 12.2 6.6 23 20 A Q H X S+ 0 0 21 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.866 107.8 55.5 -61.8 -37.1 56.8 12.6 4.5 24 21 A V H X S+ 0 0 5 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.939 112.6 42.0 -58.2 -46.5 54.8 14.3 1.7 25 22 A E H X S+ 0 0 12 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.838 113.9 52.3 -71.1 -34.3 53.5 16.9 4.3 26 23 A Q H < S+ 0 0 24 -4,-2.7 7,-0.3 2,-0.2 6,-0.2 0.843 106.1 53.1 -70.6 -35.1 57.0 17.3 5.9 27 24 A R H < S+ 0 0 88 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.939 114.2 43.8 -61.4 -43.7 58.7 17.9 2.5 28 25 A Q H < S+ 0 0 120 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.856 122.9 35.8 -69.5 -38.4 56.1 20.7 1.9 29 26 A N >< - 0 0 60 -4,-2.1 3,-2.5 1,-0.1 4,-0.3 -0.849 65.6-166.6-125.3 93.7 56.3 22.2 5.4 30 27 A P G > S+ 0 0 79 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.708 83.3 74.0 -51.1 -27.6 59.8 22.1 6.9 31 28 A H G 3 S+ 0 0 156 1,-0.3 -5,-0.1 3,-0.0 -2,-0.0 0.710 94.8 52.3 -60.3 -21.9 58.4 22.9 10.4 32 29 A L G X S+ 0 0 15 -3,-2.5 3,-1.1 -6,-0.2 -1,-0.3 0.560 83.2 117.1 -90.9 -9.4 57.1 19.3 10.6 33 30 A R T < S+ 0 0 117 -3,-1.4 -10,-0.0 -4,-0.3 -6,-0.0 -0.351 84.5 2.3 -68.2 137.7 60.4 17.7 9.8 34 31 A N T 3 S+ 0 0 138 1,-0.2 -1,-0.3 -2,-0.1 -2,-0.0 0.829 108.1 114.2 55.8 37.9 62.0 15.5 12.5 35 32 A K S < S- 0 0 101 -3,-1.1 2,-0.6 44,-0.0 22,-0.3 -0.917 80.8 -94.6-128.7 156.3 59.0 16.0 14.8 36 33 A P + 0 0 26 0, 0.0 43,-2.6 0, 0.0 2,-0.3 -0.635 68.1 149.0 -64.9 114.9 56.2 13.8 16.2 37 34 A C E -g 79 0B 5 -2,-0.6 17,-3.0 41,-0.2 2,-0.3 -0.976 29.5-165.9-150.9 164.6 53.5 14.4 13.6 38 35 A A E -gH 80 53B 2 41,-2.0 43,-2.0 -2,-0.3 2,-0.4 -0.959 22.7-121.3-147.0 158.2 50.5 12.7 12.0 39 36 A V E -gH 81 52B 1 13,-2.4 12,-3.1 -2,-0.3 13,-1.1 -0.922 34.3-173.8-106.3 135.2 48.3 13.1 9.0 40 37 A V E -gH 82 50B 0 41,-2.5 43,-2.4 -2,-0.4 2,-0.4 -0.892 17.6-142.5-127.9 151.7 44.5 13.4 9.8 41 38 A Q E S- H 0 49B 60 8,-2.2 8,-2.3 -2,-0.3 43,-0.1 -0.971 70.5 -2.1-119.2 138.8 41.3 13.5 7.8 42 39 A Y - 0 0 73 -2,-0.4 41,-0.1 41,-0.3 7,-0.1 0.147 59.4-151.0 64.6 165.7 38.4 15.7 8.8 43 40 A K S > S+ 0 0 84 5,-0.2 4,-1.1 39,-0.1 5,-0.1 0.533 75.2 76.4-142.2 -27.2 38.6 17.6 12.1 44 41 A S T 4 S+ 0 0 128 3,-0.2 2,-1.0 1,-0.2 -2,-0.1 0.839 85.0 67.2 -68.1 -38.2 35.1 18.0 13.5 45 42 A W T >4 S- 0 0 167 1,-0.2 3,-1.9 2,-0.0 -1,-0.2 -0.779 133.2 -38.1 -94.2 101.6 34.8 14.5 14.8 46 43 A K T 34 S- 0 0 93 -2,-1.0 23,-2.7 1,-0.3 24,-0.4 0.738 114.2 -55.9 58.8 31.5 37.3 14.0 17.7 47 44 A G T 3< S- 0 0 6 -4,-1.1 -1,-0.3 21,-0.2 -3,-0.2 0.391 102.4 -68.2 88.6 -2.3 40.0 16.1 16.0 48 45 A G < - 0 0 1 -3,-1.9 20,-3.1 -5,-0.1 2,-0.4 -0.114 59.9 -75.0 101.9 159.8 40.0 14.0 12.9 49 46 A G E -HI 41 67B 13 -8,-2.3 -8,-2.2 18,-0.2 2,-0.3 -0.779 44.2-125.0 -96.6 132.4 41.0 10.4 12.1 50 47 A I E +H 40 0B 2 16,-2.6 15,-2.5 -2,-0.4 -10,-0.3 -0.584 33.1 167.8 -78.1 129.8 44.7 9.6 11.9 51 48 A I E + 0 0 36 -12,-3.1 2,-0.3 -2,-0.3 -11,-0.2 0.593 66.7 22.8-115.4 -12.9 45.9 7.9 8.6 52 49 A A E -H 39 0B 2 -13,-1.1 -13,-2.4 11,-0.1 2,-0.4 -0.982 62.2-162.9-154.6 146.9 49.7 8.2 8.9 53 50 A V E -H 38 0B 5 -2,-0.3 -15,-0.2 -15,-0.2 -34,-0.1 -0.990 18.7-126.8-139.1 128.5 52.2 8.6 11.8 54 51 A S > - 0 0 1 -17,-3.0 4,-2.0 -2,-0.4 3,-0.3 -0.368 30.2-114.4 -72.2 155.5 55.8 9.7 11.9 55 52 A Y H > S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.842 117.1 58.4 -59.5 -33.5 58.3 7.4 13.7 56 53 A E H 4 S+ 0 0 78 -21,-0.3 4,-0.3 1,-0.2 3,-0.2 0.912 108.9 44.7 -60.0 -43.5 58.9 10.1 16.4 57 54 A A H >4>S+ 0 0 0 -3,-0.3 5,-1.6 -22,-0.3 3,-1.4 0.820 104.1 62.9 -71.7 -31.9 55.1 10.0 17.2 58 55 A R H ><5S+ 0 0 94 -4,-2.0 3,-2.0 1,-0.3 -1,-0.2 0.848 91.3 67.4 -59.8 -32.5 55.0 6.2 17.2 59 56 A A T 3<5S+ 0 0 91 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.726 99.8 50.4 -59.7 -22.6 57.4 6.2 20.1 60 57 A F T < 5S- 0 0 109 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.448 127.7 -99.6 -92.1 -5.7 54.6 7.8 22.1 61 58 A G T < 5 + 0 0 35 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.524 68.4 154.7 99.8 8.3 52.1 5.1 21.1 62 59 A V < + 0 0 3 -5,-1.6 -1,-0.3 -8,-0.1 2,-0.3 -0.530 18.7 176.2 -72.9 132.8 50.3 7.1 18.3 63 60 A T > - 0 0 68 -2,-0.2 3,-1.2 -11,-0.1 -13,-0.2 -0.909 35.2 -87.2-133.1 160.8 48.8 4.8 15.7 64 61 A R T 3 S+ 0 0 156 -2,-0.3 -13,-0.2 1,-0.2 3,-0.1 -0.324 111.2 31.9 -57.2 148.8 46.7 4.8 12.6 65 62 A S T 3 S+ 0 0 100 -15,-2.5 -1,-0.2 1,-0.3 2,-0.2 0.261 89.9 125.5 80.9 -11.2 42.9 4.7 13.2 66 63 A M < - 0 0 43 -3,-1.2 -16,-2.6 -16,-0.1 -1,-0.3 -0.538 67.8-115.5 -72.5 140.6 43.3 6.7 16.4 67 64 A W B >> -I 49 0B 91 -18,-0.2 4,-2.4 -2,-0.2 3,-0.8 -0.604 22.4-123.1 -73.0 142.6 41.3 9.9 16.7 68 65 A A H 3> S+ 0 0 2 -20,-3.1 4,-2.1 1,-0.3 -21,-0.2 0.844 111.2 57.9 -57.6 -35.0 43.5 13.0 16.9 69 66 A D H 34 S+ 0 0 86 -23,-2.7 4,-0.5 -21,-0.3 -1,-0.3 0.868 110.7 43.6 -63.4 -34.5 42.0 14.0 20.3 70 67 A D H X> S+ 0 0 57 -3,-0.8 4,-0.9 -24,-0.4 3,-0.9 0.890 109.7 55.0 -77.8 -41.1 43.1 10.6 21.7 71 68 A A H >X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 3,-0.7 0.867 102.1 58.8 -54.9 -40.2 46.5 10.7 20.1 72 69 A K H 3< S+ 0 0 81 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.748 97.9 60.6 -63.8 -23.9 47.1 14.1 21.8 73 70 A K H <4 S+ 0 0 152 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.828 111.8 38.0 -72.8 -30.8 46.5 12.4 25.1 74 71 A L H << S+ 0 0 81 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.2 0.785 135.1 22.4 -83.1 -31.1 49.5 10.2 24.4 75 72 A C >< - 0 0 1 -4,-2.1 3,-2.0 -5,-0.2 -1,-0.3 -0.762 64.3-177.5-143.1 85.4 51.6 12.9 22.7 76 73 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.775 86.7 51.5 -62.1 -27.3 50.5 16.5 23.7 77 74 A D T 3 S+ 0 0 134 2,-0.1 -5,-0.1 -40,-0.0 -2,-0.0 0.286 78.4 139.2 -92.2 9.8 53.1 18.0 21.4 78 75 A L < - 0 0 1 -3,-2.0 2,-0.3 -6,-0.1 -41,-0.2 -0.280 44.5-143.6 -53.8 131.4 51.9 16.0 18.3 79 76 A L E -g 37 0B 61 -43,-2.6 -41,-2.0 -47,-0.1 2,-0.4 -0.770 15.9-155.1 -96.2 149.1 51.9 18.1 15.2 80 77 A L E -g 38 0B 47 -2,-0.3 2,-0.4 -43,-0.2 -41,-0.2 -0.954 15.9-167.2-128.1 143.7 49.1 17.5 12.6 81 78 A A E -g 39 0B 12 -43,-2.0 -41,-2.5 -2,-0.4 2,-0.4 -0.985 23.3-136.8-120.3 139.0 48.6 18.0 8.9 82 79 A Q E -g 40 0B 99 -2,-0.4 -41,-0.2 -43,-0.2 2,-0.1 -0.775 15.7-116.2 -99.2 141.7 45.1 17.8 7.4 83 80 A V - 0 0 4 -43,-2.4 -41,-0.3 -2,-0.4 9,-0.1 -0.465 45.4-100.4 -65.8 138.9 44.2 16.0 4.1 84 81 A R - 0 0 141 7,-0.5 7,-2.6 -2,-0.1 2,-0.4 -0.293 33.5-144.3 -60.9 145.4 42.8 18.5 1.7 85 82 A E E +J 90 0C 98 5,-0.2 2,-0.3 -3,-0.1 5,-0.2 -0.966 22.4 171.1-115.7 134.1 39.0 18.7 1.3 86 83 A S E > +J 89 0C 20 3,-2.8 3,-1.8 -2,-0.4 260,-0.1 -0.997 66.9 0.4-141.0 140.1 37.3 19.4 -2.0 87 84 A R T 3 S- 0 0 83 -2,-0.3 259,-0.1 1,-0.3 3,-0.1 0.838 132.6 -54.0 50.2 37.9 33.6 19.2 -2.9 88 85 A G T 3 S+ 0 0 38 1,-0.2 2,-0.3 254,-0.0 -1,-0.3 0.496 121.1 84.8 81.3 5.0 32.8 18.3 0.6 89 86 A K E < S-J 86 0C 13 -3,-1.8 -3,-2.8 253,-0.1 -1,-0.2 -0.911 85.5 -84.5-139.2 163.5 35.2 15.3 0.8 90 87 A A E -J 85 0C 12 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.400 40.8-157.6 -63.6 139.4 38.7 14.2 1.5 91 88 A N - 0 0 2 -7,-2.6 -7,-0.5 -2,-0.1 3,-0.4 -0.970 14.0-172.5-129.8 115.6 40.9 14.5 -1.6 92 89 A L >> + 0 0 46 -2,-0.5 4,-2.0 1,-0.2 3,-0.9 0.197 48.1 118.3 -95.6 16.9 44.1 12.4 -1.9 93 90 A T H 3> + 0 0 29 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.868 69.9 56.9 -53.3 -44.7 45.5 14.0 -5.1 94 91 A K H 3> S+ 0 0 70 -3,-0.4 4,-1.7 1,-0.2 -1,-0.3 0.856 110.3 44.4 -57.4 -36.4 48.7 15.3 -3.5 95 92 A Y H <> S+ 0 0 2 -3,-0.9 4,-2.0 2,-0.2 -1,-0.2 0.849 110.6 54.1 -81.5 -34.5 49.7 11.9 -2.3 96 93 A R H X S+ 0 0 70 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.878 110.5 47.3 -61.3 -38.9 48.8 10.3 -5.6 97 94 A E H X S+ 0 0 110 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.889 110.0 51.4 -72.4 -37.0 51.0 12.8 -7.4 98 95 A A H X S+ 0 0 2 -4,-1.7 4,-1.5 -5,-0.2 -2,-0.2 0.881 108.0 55.0 -63.3 -36.7 53.9 12.2 -5.0 99 96 A S H X S+ 0 0 3 -4,-2.0 4,-2.9 1,-0.2 3,-0.3 0.932 103.6 52.7 -60.8 -50.6 53.4 8.4 -5.7 100 97 A V H X S+ 0 0 71 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.908 104.4 58.6 -51.6 -42.1 53.8 8.9 -9.4 101 98 A E H X S+ 0 0 66 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.907 111.6 39.9 -54.3 -46.3 57.1 10.7 -8.6 102 99 A V H X S+ 0 0 4 -4,-1.5 4,-2.3 -3,-0.3 -2,-0.2 0.918 112.8 53.6 -72.1 -43.0 58.5 7.7 -6.9 103 100 A M H X S+ 0 0 5 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.864 106.2 54.3 -62.2 -35.7 57.1 5.1 -9.3 104 101 A E H < S+ 0 0 121 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.882 108.4 48.6 -67.7 -36.8 58.7 6.9 -12.3 105 102 A I H >< S+ 0 0 9 -4,-1.1 3,-1.7 -5,-0.2 4,-0.5 0.954 111.1 49.4 -65.1 -50.0 62.2 6.8 -10.6 106 103 A M H >X S+ 0 0 2 -4,-2.3 3,-1.6 1,-0.3 4,-1.3 0.874 101.7 64.7 -56.7 -37.7 61.9 3.1 -9.8 107 104 A S T 3< S+ 0 0 40 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.672 89.1 67.5 -62.9 -17.7 60.9 2.4 -13.4 108 105 A R T <4 S+ 0 0 145 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.768 106.0 41.4 -71.2 -25.7 64.3 3.5 -14.6 109 106 A F T <4 S- 0 0 62 -3,-1.6 2,-0.3 -4,-0.5 -2,-0.2 0.814 127.0 -28.4 -91.0 -34.0 65.9 0.5 -12.9 110 107 A A S < S- 0 0 17 -4,-1.3 -1,-0.3 16,-0.0 2,-0.1 -0.987 75.9 -62.5-172.8 163.4 63.4 -2.3 -13.7 111 108 A V - 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0 0 66 -4,-0.4 -20,-1.3 -7,-0.2 2,-0.3 -0.917 57.7-141.0-141.0 164.5 66.9 0.5 6.0 234 235 A Q E -ef 148 213A 0 -87,-2.4 -85,-2.4 -2,-0.3 2,-0.4 -0.975 12.4-150.8-131.7 150.5 66.8 -2.5 3.6 235 236 A T E -ef 149 214A 0 -22,-2.5 -20,-2.6 -2,-0.3 2,-0.6 -0.971 5.0-150.2-129.0 132.3 66.9 -6.2 4.5 236 237 A L E -ef 150 215A 1 -87,-2.9 -85,-2.3 -2,-0.4 2,-0.6 -0.880 11.3-169.7 -99.6 120.3 68.1 -9.3 2.6 237 238 A V - 0 0 0 -22,-2.4 -20,-0.3 -2,-0.6 2,-0.1 -0.932 12.1-161.1-110.9 107.1 66.3 -12.5 3.3 238 239 A S > - 0 0 9 -2,-0.6 3,-0.6 -87,-0.3 4,-0.5 -0.375 31.7-110.7 -84.4 165.7 68.1 -15.5 1.8 239 240 A H G > S+ 0 0 44 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.916 119.3 56.1 -57.6 -41.4 66.7 -18.9 1.1 240 241 A G G 3 S+ 0 0 59 1,-0.3 4,-0.4 2,-0.1 -1,-0.2 0.765 99.1 59.7 -62.7 -30.0 68.9 -20.3 3.9 241 242 A S G <> S+ 0 0 14 -3,-0.6 4,-2.4 1,-0.2 -1,-0.3 0.616 84.4 86.6 -74.6 -11.8 67.5 -17.9 6.5 242 243 A V H <> S+ 0 0 3 -3,-1.4 4,-3.2 -4,-0.5 5,-0.3 0.918 79.7 53.6 -63.7 -49.3 63.9 -19.2 6.0 243 244 A P H > S+ 0 0 94 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.921 116.5 38.9 -53.2 -46.6 63.8 -22.1 8.5 244 245 A Q H > S+ 0 0 148 -4,-0.4 4,-0.6 2,-0.2 3,-0.2 0.925 117.0 50.4 -69.8 -43.0 65.0 -20.0 11.4 245 246 A L H >< S+ 0 0 18 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.928 115.5 42.6 -57.8 -45.8 62.9 -16.9 10.4 246 247 A F H >< S+ 0 0 2 -4,-3.2 29,-2.3 -5,-0.2 3,-1.3 0.704 93.9 81.2 -76.8 -19.9 59.8 -19.0 10.0 247 248 A S H 3< S+ 0 0 59 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.772 111.7 20.3 -63.0 -25.6 60.3 -21.1 13.2 248 249 A Q T << S+ 0 0 149 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.092 95.0 119.6-126.4 26.3 58.9 -18.2 15.3 249 250 A M < - 0 0 23 -3,-1.3 25,-2.9 -5,-0.1 26,-0.2 -0.814 63.9-127.0 -96.1 115.6 57.0 -16.2 12.7 250 251 A P B > -K 273 0D 32 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.323 19.2-123.2 -59.9 142.2 53.2 -16.0 13.5 251 252 A I G > S+ 0 0 0 21,-1.7 3,-1.6 1,-0.3 6,-0.2 0.846 106.2 65.2 -57.4 -35.6 51.1 -17.1 10.5 252 253 A R G 3 S+ 0 0 148 1,-0.3 -1,-0.3 20,-0.2 4,-0.1 0.623 87.4 70.3 -66.1 -14.3 49.3 -13.8 10.4 253 254 A K G < S+ 0 0 114 -3,-1.8 2,-0.3 4,-0.1 -1,-0.3 0.699 79.1 90.9 -76.9 -17.8 52.5 -11.8 9.5 254 255 A I S X S- 0 0 2 -3,-1.6 3,-2.5 -4,-0.3 4,-0.2 -0.630 94.3 -98.2 -82.7 133.2 52.6 -13.4 6.0 255 256 A R T 3 S+ 0 0 155 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 -0.261 109.2 17.7 -55.7 127.2 50.8 -11.4 3.3 256 257 A S T 3 S+ 0 0 74 -4,-0.1 3,-0.3 -3,-0.0 -1,-0.3 0.164 110.3 79.6 95.3 -11.7 47.3 -12.9 2.6 257 258 A L < + 0 0 1 -3,-2.5 -2,-0.2 -6,-0.2 -3,-0.1 0.192 62.1 95.9-105.5 16.3 47.2 -14.8 5.9 258 259 A G S S+ 0 0 61 -4,-0.2 -1,-0.1 -5,-0.1 -6,-0.1 0.512 86.1 39.4 -84.9 -3.7 46.3 -11.8 8.0 259 260 A G S > S- 0 0 46 -3,-0.3 4,-1.9 0, 0.0 5,-0.2 0.008 116.6 -36.0-120.3-140.1 42.5 -12.5 8.0 260 261 A K H > S+ 0 0 193 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.838 127.8 53.4 -63.6 -40.2 40.1 -15.4 8.1 261 262 A L H > S+ 0 0 43 2,-0.2 4,-2.3 -5,-0.2 -1,-0.2 0.927 110.4 48.6 -59.7 -45.6 42.2 -18.0 6.2 262 263 A G H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.877 110.6 50.4 -63.2 -38.3 45.1 -17.4 8.5 263 264 A A H X S+ 0 0 57 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.884 110.2 50.5 -68.0 -36.2 42.9 -17.8 11.5 264 265 A S H X S+ 0 0 40 -4,-2.2 4,-2.8 2,-0.2 5,-0.4 0.860 106.7 54.3 -70.7 -34.2 41.5 -21.1 10.1 265 266 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 6,-0.4 0.959 112.9 44.1 -59.6 -48.1 45.1 -22.4 9.5 266 267 A I H X>S+ 0 0 61 -4,-2.1 4,-1.4 2,-0.2 5,-0.8 0.934 119.4 41.4 -61.6 -48.1 45.8 -21.7 13.1 267 268 A E H <5S+ 0 0 168 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.943 118.0 42.8 -70.1 -49.9 42.5 -23.2 14.4 268 269 A I H <5S+ 0 0 84 -4,-2.8 -1,-0.2 1,-0.2 -3,-0.2 0.884 123.9 34.7 -66.8 -40.1 42.2 -26.2 12.2 269 270 A L H <5S- 0 0 26 -4,-2.0 -1,-0.2 -5,-0.4 -2,-0.2 0.650 99.4-130.0 -93.0 -14.6 45.9 -27.4 12.4 270 271 A G T <5 + 0 0 65 -4,-1.4 2,-0.2 -5,-0.3 -3,-0.2 0.863 64.1 123.6 69.3 37.8 46.5 -26.3 16.0 271 272 A I < - 0 0 12 -5,-0.8 -1,-0.2 -6,-0.4 -2,-0.1 -0.730 46.7-164.6-123.3 171.6 49.7 -24.4 15.2 272 273 A E + 0 0 123 -2,-0.2 -21,-1.7 1,-0.2 2,-0.3 0.616 65.5 59.8-124.0 -31.4 51.1 -20.8 15.6 273 274 A Y B > S-K 250 0D 73 -23,-0.2 3,-1.3 -22,-0.1 4,-0.4 -0.805 73.9-123.4-115.7 148.9 54.1 -20.3 13.4 274 275 A M G > S+ 0 0 0 -25,-2.9 3,-1.8 -2,-0.3 4,-0.3 0.861 109.1 60.9 -51.4 -41.9 54.8 -20.5 9.6 275 276 A G G > S+ 0 0 18 -29,-2.3 3,-1.6 1,-0.3 -1,-0.3 0.801 90.4 68.6 -61.5 -28.9 57.5 -23.1 10.1 276 277 A E G X S+ 0 0 74 -3,-1.3 3,-1.2 -30,-0.3 -1,-0.3 0.709 83.7 74.5 -64.2 -18.4 55.1 -25.6 11.6 277 278 A L G X S+ 0 0 0 -3,-1.8 3,-1.7 -4,-0.4 -1,-0.3 0.752 76.1 77.4 -64.5 -22.4 53.3 -25.9 8.3 278 279 A T G < S+ 0 0 41 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.686 81.4 68.5 -65.3 -17.3 56.2 -28.0 6.9 279 280 A Q G < S+ 0 0 155 -3,-1.2 2,-0.3 -4,-0.2 -1,-0.3 0.416 87.0 79.7 -85.3 3.8 55.0 -31.1 8.7 280 281 A F S < S- 0 0 45 -3,-1.7 2,-0.1 -4,-0.1 3,-0.0 -0.793 81.6-117.7-108.2 151.1 51.8 -31.5 6.6 281 282 A T > - 0 0 73 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.470 27.3-112.8 -79.9 162.1 51.6 -33.0 3.1 282 283 A E H > S+ 0 0 78 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.937 120.2 51.3 -57.8 -45.1 50.5 -30.9 0.2 283 284 A S H > S+ 0 0 85 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.888 106.7 53.7 -60.0 -40.1 47.3 -33.0 -0.0 284 285 A Q H > S+ 0 0 90 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.953 110.9 45.9 -60.2 -47.2 46.6 -32.5 3.7 285 286 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-0.4 0.925 111.8 51.3 -62.5 -43.5 46.8 -28.7 3.2 286 287 A Q H X S+ 0 0 51 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.867 103.6 59.8 -59.6 -36.9 44.6 -28.8 0.1 287 288 A S H < S+ 0 0 92 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.878 116.1 32.2 -60.3 -37.6 42.0 -30.9 1.9 288 289 A H H < S+ 0 0 94 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.846 133.5 24.2 -86.4 -38.9 41.5 -28.1 4.5 289 290 A F H < S- 0 0 15 -4,-2.5 4,-0.4 1,-0.3 -3,-0.2 0.361 111.1 -99.4-117.9 2.1 42.1 -24.9 2.6 290 291 A G X - 0 0 34 -4,-1.9 4,-2.6 -5,-0.3 -1,-0.3 -0.070 42.3 -71.1 96.0 161.9 41.4 -25.8 -1.0 291 292 A E H > S+ 0 0 157 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.907 128.3 39.3 -58.8 -50.1 43.5 -26.8 -4.0 292 293 A K H > S+ 0 0 180 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.963 119.4 44.2 -68.4 -52.9 45.1 -23.3 -4.7 293 294 A N H > S+ 0 0 65 -4,-0.4 4,-2.8 1,-0.2 5,-0.2 0.886 113.2 53.5 -60.1 -39.8 45.6 -22.3 -1.1 294 295 A G H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.925 110.6 44.0 -62.9 -47.6 47.0 -25.7 -0.1 295 296 A S H X S+ 0 0 42 -4,-1.8 4,-1.9 -5,-0.2 5,-0.2 0.899 114.6 51.4 -61.2 -41.2 49.6 -25.8 -2.9 296 297 A W H X S+ 0 0 55 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.938 112.1 45.6 -64.0 -45.8 50.5 -22.2 -2.1 297 298 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.890 108.5 56.0 -62.4 -42.0 50.9 -22.9 1.7 298 299 A Y H < S+ 0 0 74 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.919 117.5 34.6 -59.8 -45.1 53.0 -26.1 1.0 299 300 A A H ><>S+ 0 0 24 -4,-1.9 5,-2.5 2,-0.2 3,-1.2 0.885 114.6 57.2 -74.0 -42.6 55.5 -24.1 -1.0 300 301 A M H ><5S+ 0 0 0 -4,-3.0 3,-2.0 1,-0.3 -2,-0.2 0.880 99.3 57.4 -63.4 -39.6 55.3 -20.9 1.0 301 302 A C T 3<5S+ 0 0 4 -4,-2.4 -1,-0.3 1,-0.3 -23,-0.2 0.684 106.9 51.6 -65.5 -14.9 56.3 -22.5 4.3 302 303 A R T < 5S- 0 0 79 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.311 127.7-101.4 -97.3 4.7 59.5 -23.7 2.6 303 304 A G T < 5S+ 0 0 1 -3,-2.0 2,-0.5 1,-0.3 -3,-0.2 0.645 83.5 127.1 89.3 16.6 60.2 -20.1 1.4 304 305 A I < + 0 0 21 -5,-2.5 2,-0.3 -8,-0.1 -1,-0.3 -0.915 22.3 152.7-118.1 129.7 58.9 -20.8 -2.1 305 306 A E - 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