==== 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 4ECS . 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) . 21782.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 298 69.3 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 . 50 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 138 32.1 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 2 1 2 1 1 0 2 0 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 87 0, 0.0 3,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-118.5 67.2 -34.4 -4.2 2 -1 A P T 3 + 0 0 123 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.569 360.0 52.5 -76.6 -11.0 68.7 -32.8 -7.4 3 0 A H T 3 S+ 0 0 180 2,-0.1 2,-0.9 0, 0.0 0, 0.0 0.385 78.5 112.7-105.5 0.5 65.1 -32.3 -8.7 4 1 A M < - 0 0 141 -3,-0.7 0, 0.0 1,-0.0 0, 0.0 -0.658 66.4-133.1 -83.1 106.3 63.7 -30.5 -5.7 5 2 A A - 0 0 72 -2,-0.9 -2,-0.1 1,-0.1 299,-0.0 -0.204 18.6-169.6 -56.8 144.1 62.9 -26.8 -6.7 6 3 A T - 0 0 59 297,-0.0 -1,-0.1 298,-0.0 -2,-0.0 0.386 35.4-120.0-121.6 1.6 64.2 -24.3 -4.2 7 4 A G S S+ 0 0 5 1,-0.1 3,-0.1 297,-0.1 298,-0.1 0.880 76.3 122.2 59.8 43.1 62.5 -21.0 -5.4 8 5 A Q + 0 0 41 1,-0.1 -1,-0.1 296,-0.1 210,-0.1 0.067 35.0 104.5-119.4 20.1 65.8 -19.3 -6.0 9 6 A D S S+ 0 0 93 208,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.650 78.0 43.4 -76.7 -19.1 65.2 -18.5 -9.7 10 7 A R - 0 0 23 207,-0.3 2,-0.5 -3,-0.1 179,-0.1 -0.854 64.1-140.0-126.9 158.0 64.4 -14.8 -9.2 11 8 A V + 0 0 1 -2,-0.3 113,-2.3 177,-0.1 114,-0.6 -0.988 32.6 177.7-114.7 121.4 65.6 -11.7 -7.4 12 9 A V E -AB 123 216A 0 204,-3.1 204,-2.6 -2,-0.5 2,-0.3 -0.964 10.5-166.7-125.8 138.4 62.6 -9.7 -6.2 13 10 A A E -AB 122 215A 0 109,-2.7 109,-2.6 -2,-0.4 2,-0.5 -0.904 10.3-155.8-120.1 153.0 62.4 -6.5 -4.2 14 11 A L E -AB 121 214A 0 200,-2.1 200,-1.8 -2,-0.3 2,-0.5 -0.988 12.9-161.5-121.7 119.7 59.6 -4.7 -2.4 15 12 A V E -AB 120 213A 1 105,-2.8 105,-1.8 -2,-0.5 2,-0.4 -0.902 9.0-175.9-105.8 128.4 60.2 -0.9 -1.9 16 13 A D E -AB 119 212A 22 196,-2.9 196,-3.0 -2,-0.5 103,-0.2 -0.969 23.0-130.4-129.4 117.1 58.0 0.8 0.8 17 14 A M E > - B 0 211A 4 101,-2.3 3,-0.6 -2,-0.4 194,-0.3 -0.325 32.4-114.1 -63.9 137.9 58.0 4.5 1.5 18 15 A D T 3 S- 0 0 4 192,-2.1 5,-0.3 1,-0.3 192,-0.2 -0.576 84.8 -23.6 -76.0 141.4 58.4 5.3 5.2 19 16 A C T 3> S- 0 0 17 -2,-0.2 4,-2.0 34,-0.1 3,-0.5 0.747 86.5-167.3 19.1 66.7 55.4 6.9 6.8 20 17 A F H <> S+ 0 0 8 -3,-0.6 4,-2.1 1,-0.3 5,-0.2 0.833 71.7 44.3 -57.9 -55.4 54.5 8.1 3.3 21 18 A F H > S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.861 114.4 53.9 -60.5 -34.0 51.7 10.8 3.7 22 19 A V H > S+ 0 0 1 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.920 107.6 48.7 -62.5 -45.2 53.7 12.3 6.6 23 20 A Q H X S+ 0 0 20 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.867 108.4 55.1 -63.4 -37.3 56.9 12.6 4.5 24 21 A V H X S+ 0 0 4 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.953 112.9 41.7 -58.8 -49.7 54.8 14.2 1.7 25 22 A E H X S+ 0 0 14 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.847 113.5 53.1 -66.9 -34.8 53.6 16.9 4.2 26 23 A Q H < S+ 0 0 24 -4,-2.6 7,-0.3 2,-0.2 6,-0.2 0.816 105.5 53.9 -72.6 -31.9 57.0 17.3 5.8 27 24 A R H < S+ 0 0 86 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.932 114.5 41.6 -62.0 -44.9 58.6 17.9 2.4 28 25 A Q H < S+ 0 0 125 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.851 123.6 38.2 -72.2 -36.4 56.1 20.7 1.8 29 26 A N >< - 0 0 60 -4,-2.3 3,-2.7 -5,-0.1 4,-0.3 -0.812 64.4-170.0-123.2 93.2 56.3 22.1 5.3 30 27 A P G > S+ 0 0 78 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.711 82.2 73.5 -54.6 -25.8 59.8 22.1 6.8 31 28 A H G 3 S+ 0 0 157 1,-0.3 -5,-0.1 3,-0.0 -2,-0.0 0.669 95.8 52.1 -59.5 -20.2 58.3 23.0 10.3 32 29 A L G X S+ 0 0 14 -3,-2.7 3,-1.0 -6,-0.2 -1,-0.3 0.552 83.8 115.1 -93.0 -11.5 57.0 19.4 10.5 33 30 A R T < S+ 0 0 115 -3,-1.4 -10,-0.0 -4,-0.3 -6,-0.0 -0.368 84.8 4.3 -66.2 138.2 60.4 17.8 9.7 34 31 A N T 3 S+ 0 0 139 1,-0.2 -1,-0.2 -2,-0.1 -2,-0.0 0.849 107.2 114.3 56.7 39.7 61.9 15.7 12.5 35 32 A K S < S- 0 0 101 -3,-1.0 2,-0.6 44,-0.0 22,-0.4 -0.919 80.9 -96.9-129.4 156.6 58.9 16.1 14.8 36 33 A P + 0 0 25 0, 0.0 43,-2.4 0, 0.0 2,-0.3 -0.678 67.8 151.7 -67.3 117.6 56.2 13.7 16.1 37 34 A C E -g 79 0B 4 -2,-0.6 17,-2.9 41,-0.2 2,-0.3 -0.974 29.9-164.1-150.2 164.2 53.5 14.4 13.6 38 35 A A E -gH 80 53B 1 41,-1.9 43,-1.9 -2,-0.3 2,-0.5 -0.969 22.2-123.1-145.1 156.3 50.6 12.7 11.9 39 36 A V E -gH 81 52B 1 13,-2.1 12,-3.0 -2,-0.3 13,-1.2 -0.915 34.5-172.8-103.9 132.7 48.3 13.2 8.9 40 37 A V E -gH 82 50B 0 41,-2.6 43,-2.6 -2,-0.5 2,-0.4 -0.887 17.0-143.1-126.2 149.6 44.6 13.4 9.7 41 38 A Q E S- H 0 49B 61 8,-2.2 8,-2.1 -2,-0.3 43,-0.1 -0.968 70.2 -8.0-118.5 138.4 41.4 13.6 7.7 42 39 A Y - 0 0 73 -2,-0.4 41,-0.1 41,-0.3 47,-0.0 -0.099 61.5-151.4 63.2-175.8 38.5 15.7 8.7 43 40 A K S > S+ 0 0 85 5,-0.1 4,-1.2 39,-0.1 5,-0.1 0.452 70.3 81.0-160.6 -29.9 38.6 17.4 12.1 44 41 A S T 4 S+ 0 0 130 3,-0.2 2,-1.1 2,-0.2 3,-0.2 0.903 83.4 66.4 -62.4 -47.7 35.2 18.0 13.6 45 42 A W T >4 S- 0 0 168 1,-0.2 3,-1.6 2,-0.1 -1,-0.2 -0.693 134.9 -34.8 -84.2 99.1 34.7 14.5 15.0 46 43 A K T 34 S- 0 0 91 -2,-1.1 23,-2.7 1,-0.3 24,-0.4 0.765 114.0 -59.0 60.7 31.9 37.3 14.1 17.8 47 44 A G T 3< S- 0 0 4 -4,-1.2 -1,-0.3 21,-0.2 -3,-0.2 0.406 100.9 -66.2 84.9 -0.1 40.0 16.1 16.0 48 45 A G < - 0 0 1 -3,-1.6 20,-3.2 -5,-0.1 2,-0.5 -0.091 59.0 -75.0 104.2 157.7 40.1 13.9 12.9 49 46 A G E -HI 41 67B 14 -8,-2.1 -8,-2.2 18,-0.2 2,-0.3 -0.783 43.8-128.3 -93.3 128.9 41.1 10.4 12.1 50 47 A I E +H 40 0B 2 16,-2.9 15,-2.9 -2,-0.5 -10,-0.2 -0.589 31.6 169.4 -77.5 130.7 44.8 9.7 11.9 51 48 A I E + 0 0 36 -12,-3.0 2,-0.3 1,-0.3 -11,-0.2 0.556 66.0 23.2-114.8 -15.2 45.9 8.0 8.6 52 49 A A E -H 39 0B 2 -13,-1.2 -13,-2.1 11,-0.1 2,-0.4 -0.989 63.0-161.9-151.1 147.2 49.8 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 -0.989 18.4-127.0-137.8 130.3 52.2 8.6 11.7 54 51 A S > - 0 0 1 -17,-2.9 4,-2.1 -2,-0.4 3,-0.2 -0.323 31.4-114.0 -70.0 156.8 55.9 9.8 11.9 55 52 A Y H > S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.832 117.4 58.5 -64.1 -28.8 58.3 7.4 13.6 56 53 A E H 4 S+ 0 0 78 -21,-0.3 4,-0.3 1,-0.2 3,-0.3 0.922 108.6 44.7 -63.5 -44.4 58.8 10.1 16.3 57 54 A A H >4>S+ 0 0 0 -22,-0.4 3,-1.7 -20,-0.3 5,-1.5 0.864 104.8 62.2 -67.0 -35.6 55.1 10.1 17.1 58 55 A R H ><5S+ 0 0 92 -4,-2.1 3,-1.7 1,-0.3 -1,-0.2 0.824 91.7 67.3 -61.4 -29.9 54.9 6.2 17.1 59 56 A A T 3<5S+ 0 0 92 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.736 99.6 50.4 -61.6 -24.3 57.4 6.2 20.0 60 57 A F T < 5S- 0 0 113 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.493 127.9-101.4 -88.1 -7.0 54.6 7.8 22.1 61 58 A G T < 5 + 0 0 33 -3,-1.7 2,-0.2 -4,-0.4 -3,-0.2 0.585 67.6 155.1 96.7 12.5 52.1 5.1 20.9 62 59 A V < - 0 0 3 -5,-1.5 -1,-0.3 -8,-0.1 2,-0.3 -0.559 20.5-178.8 -70.2 136.2 50.3 7.1 18.3 63 60 A T > - 0 0 67 -2,-0.2 3,-1.2 -11,-0.1 -13,-0.2 -0.908 33.2 -87.6-134.5 160.4 48.8 4.9 15.6 64 61 A R T 3 S+ 0 0 157 -2,-0.3 -13,-0.2 1,-0.2 3,-0.1 -0.358 112.1 29.5 -53.7 145.0 46.8 4.9 12.4 65 62 A S T 3 S+ 0 0 98 -15,-2.9 -1,-0.2 1,-0.3 2,-0.2 0.248 90.1 126.1 83.9 -10.9 43.0 4.8 13.0 66 63 A M < - 0 0 40 -3,-1.2 -16,-2.9 -16,-0.1 -1,-0.3 -0.533 67.4-114.1 -74.9 141.9 43.4 6.7 16.3 67 64 A W B >> -I 49 0B 91 -18,-0.2 4,-2.4 -2,-0.2 3,-0.5 -0.590 22.9-124.7 -70.6 141.6 41.3 9.9 16.6 68 65 A A H 3> S+ 0 0 2 -20,-3.2 4,-2.3 1,-0.2 -21,-0.2 0.845 110.3 58.4 -59.5 -35.2 43.6 13.0 16.9 69 66 A D H 3> S+ 0 0 81 -23,-2.7 4,-0.5 -21,-0.3 -1,-0.2 0.912 110.6 43.4 -60.0 -38.8 42.0 14.0 20.2 70 67 A D H X> S+ 0 0 57 -3,-0.5 4,-1.0 -24,-0.4 3,-0.8 0.883 109.8 55.5 -74.7 -39.5 43.1 10.7 21.6 71 68 A A H >X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 3,-0.8 0.895 101.9 58.1 -56.0 -43.0 46.5 10.8 20.0 72 69 A K H 3< S+ 0 0 82 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.728 98.2 61.3 -62.1 -21.4 47.1 14.2 21.8 73 70 A K H << S+ 0 0 155 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.852 113.5 34.7 -73.0 -33.4 46.5 12.4 25.1 74 71 A L H << S+ 0 0 81 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.795 136.0 23.9 -83.8 -33.3 49.5 10.2 24.3 75 72 A C >< - 0 0 1 -4,-2.6 3,-2.0 -5,-0.2 -1,-0.2 -0.765 65.2-179.0-140.5 84.9 51.5 12.9 22.6 76 73 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.774 84.8 50.6 -65.1 -27.5 50.6 16.4 23.6 77 74 A D T 3 S+ 0 0 131 2,-0.1 -5,-0.1 -40,-0.0 -2,-0.0 0.265 79.5 141.7 -91.8 11.9 53.1 18.1 21.3 78 75 A L < - 0 0 2 -3,-2.0 2,-0.3 -7,-0.1 -41,-0.2 -0.278 42.6-145.6 -52.4 130.7 51.9 16.0 18.3 79 76 A L E -g 37 0B 58 -43,-2.4 -41,-1.9 -47,-0.1 2,-0.4 -0.760 14.9-154.6 -98.5 150.8 51.9 18.1 15.1 80 77 A L E -g 38 0B 48 -2,-0.3 2,-0.4 -43,-0.2 -41,-0.2 -0.954 16.9-165.5-129.6 147.1 49.2 17.5 12.5 81 78 A A E -g 39 0B 11 -43,-1.9 -41,-2.6 -2,-0.4 2,-0.4 -0.993 24.3-137.8-123.2 134.3 48.7 18.0 8.7 82 79 A Q E -g 40 0B 98 -2,-0.4 -41,-0.2 -43,-0.2 2,-0.1 -0.754 16.5-115.3 -96.9 140.5 45.2 17.8 7.3 83 80 A V - 0 0 4 -43,-2.6 -41,-0.3 -2,-0.4 9,-0.1 -0.466 45.8 -97.6 -65.7 140.0 44.2 16.0 4.1 84 81 A R - 0 0 130 7,-0.4 7,-2.4 -2,-0.1 2,-0.5 -0.236 34.5-144.5 -58.9 145.1 42.9 18.5 1.6 85 82 A E E +J 90 0C 103 5,-0.2 2,-0.3 -3,-0.1 5,-0.2 -0.970 23.9 167.6-116.8 127.2 39.1 18.8 1.3 86 83 A S E > +J 89 0C 17 3,-2.6 3,-1.9 -2,-0.5 260,-0.1 -0.999 67.0 0.6-136.6 140.6 37.4 19.4 -2.0 87 84 A R T 3 S- 0 0 82 -2,-0.3 259,-0.1 1,-0.3 -1,-0.1 0.830 131.8 -55.0 53.2 35.9 33.7 19.2 -2.9 88 85 A G T 3 S+ 0 0 35 1,-0.2 2,-0.3 254,-0.0 -1,-0.3 0.465 120.5 82.6 83.5 3.8 32.9 18.2 0.6 89 86 A K E < S-J 86 0C 13 -3,-1.9 -3,-2.6 253,-0.1 -1,-0.2 -0.898 86.1 -82.0-138.5 165.4 35.3 15.3 0.9 90 87 A A E -J 85 0C 11 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.387 40.9-157.1 -63.0 141.3 38.9 14.2 1.5 91 88 A N - 0 0 1 -7,-2.4 -7,-0.4 1,-0.1 3,-0.4 -0.962 13.6-172.3-130.3 115.3 41.0 14.5 -1.6 92 89 A L >> + 0 0 46 -2,-0.5 4,-2.0 1,-0.2 3,-1.1 0.255 48.7 117.2 -92.8 13.9 44.1 12.4 -1.9 93 90 A T H 3> S+ 0 0 26 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.865 70.4 56.5 -52.4 -48.7 45.5 14.0 -5.1 94 91 A K H 3> S+ 0 0 67 -3,-0.4 4,-2.0 1,-0.2 -1,-0.3 0.854 111.2 44.7 -51.8 -38.0 48.7 15.3 -3.5 95 92 A Y H <> S+ 0 0 2 -3,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.864 110.8 52.4 -79.7 -36.3 49.7 11.8 -2.3 96 93 A R H X S+ 0 0 69 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.917 111.7 48.2 -61.9 -42.7 48.8 10.1 -5.6 97 94 A E H X S+ 0 0 110 -4,-3.0 4,-1.7 -5,-0.2 -2,-0.2 0.912 109.8 50.3 -66.4 -41.6 51.0 12.7 -7.4 98 95 A A H X S+ 0 0 2 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.903 108.2 55.9 -59.4 -38.9 53.9 12.1 -5.0 99 96 A S H X S+ 0 0 3 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.927 103.0 53.0 -59.2 -47.9 53.5 8.4 -5.6 100 97 A V H X S+ 0 0 70 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.884 104.5 58.1 -52.9 -40.8 53.9 8.9 -9.4 101 98 A E H X S+ 0 0 66 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.919 111.5 39.9 -55.0 -49.4 57.2 10.7 -8.6 102 99 A V H X S+ 0 0 4 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.913 114.0 51.9 -69.1 -43.7 58.6 7.7 -6.8 103 100 A M H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.856 106.3 54.7 -64.6 -35.5 57.3 5.1 -9.2 104 101 A E H < S+ 0 0 119 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 0.870 109.7 48.0 -68.3 -34.6 58.7 6.9 -12.2 105 102 A I H >< S+ 0 0 10 -4,-1.2 3,-1.8 -5,-0.2 4,-0.5 0.948 111.1 49.1 -66.4 -49.4 62.1 6.8 -10.6 106 103 A M H >X S+ 0 0 3 -4,-2.5 3,-1.8 1,-0.3 4,-1.5 0.886 102.3 64.1 -58.4 -38.3 61.9 3.1 -9.7 107 104 A S T 3< S+ 0 0 40 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.659 89.7 67.8 -59.9 -16.8 60.9 2.4 -13.3 108 105 A R T <4 S+ 0 0 143 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.758 106.6 39.8 -73.6 -23.7 64.3 3.6 -14.5 109 106 A F T <4 S- 0 0 61 -3,-1.8 2,-0.3 -4,-0.5 -2,-0.2 0.824 128.5 -24.9 -93.6 -35.6 65.9 0.6 -12.8 110 107 A A S < S- 0 0 17 -4,-1.5 -1,-0.3 16,-0.0 2,-0.1 -0.986 76.1 -67.0-168.7 163.7 63.5 -2.2 -13.6 111 108 A V - 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0 0 1 -6,-0.6 -1,-0.3 -5,-0.0 2,-0.3 -0.614 47.6-150.4 -90.1 140.0 61.5 10.8 0.5 210 211 A Q + 0 0 62 -2,-0.3 -192,-2.1 -192,-0.2 2,-0.3 -0.725 18.3 177.3-101.2 158.2 63.0 7.9 2.4 211 212 A C E -B 17 0A 2 -194,-0.3 2,-0.3 -2,-0.3 -194,-0.3 -0.950 23.8-129.4-149.0 167.5 61.9 4.3 2.2 212 213 A S E -B 16 0A 0 -196,-3.0 -196,-2.9 -2,-0.3 2,-0.3 -0.756 25.5-165.4-111.4 169.0 62.7 0.8 3.3 213 214 A A E -Bf 15 234A 0 20,-1.4 22,-2.3 -2,-0.3 2,-0.4 -0.993 15.1-146.2-153.1 154.4 63.0 -2.3 1.1 214 215 A G E -Bf 14 235A 0 -200,-1.8 -200,-2.1 -2,-0.3 2,-0.5 -0.967 12.1-162.7-119.5 138.1 63.1 -6.1 1.2 215 216 A I E +Bf 13 236A 0 20,-2.7 22,-2.6 -2,-0.4 2,-0.2 -0.981 33.4 118.5-122.3 119.9 65.3 -8.2 -1.1 216 217 A S E S-B 12 0A 0 -204,-2.6 -204,-3.1 -2,-0.5 22,-0.1 -0.724 72.0 -78.0-152.2-155.7 64.5 -11.9 -1.6 217 218 A H S S+ 0 0 2 20,-0.3 -207,-0.3 -206,-0.2 2,-0.3 0.495 104.2 16.6-100.2 -6.1 63.6 -14.5 -4.1 218 219 A N S > S- 0 0 1 -206,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.975 82.2 -97.2-158.7 169.8 59.9 -13.7 -4.3 219 220 A K H > S+ 0 0 3 88,-0.4 4,-2.8 -2,-0.3 5,-0.2 0.876 116.8 51.1 -60.6 -44.6 57.2 -11.1 -3.5 220 221 A V H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 35,-0.2 0.938 114.7 41.9 -62.1 -47.5 56.1 -12.6 -0.1 221 222 A L H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.883 114.8 52.8 -67.4 -37.7 59.6 -12.9 1.3 222 223 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -208,-0.3 0.935 110.5 46.9 -60.1 -47.6 60.5 -9.5 -0.1 223 224 A K H X S+ 0 0 71 -4,-2.8 4,-1.2 2,-0.2 -2,-0.2 0.922 114.1 47.0 -60.7 -47.7 57.5 -7.9 1.6 224 225 A L H >< S+ 0 0 23 -4,-2.4 3,-0.5 -5,-0.2 4,-0.4 0.942 112.3 50.6 -58.4 -50.2 58.2 -9.7 4.9 225 226 A A H >X S+ 0 0 0 -4,-3.0 3,-2.3 1,-0.2 4,-0.6 0.915 102.0 61.8 -52.7 -48.0 61.9 -8.6 4.7 226 227 A C H >< S+ 0 0 2 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.862 104.6 47.7 -49.9 -41.8 61.0 -5.0 4.0 227 228 A G T << S+ 0 0 51 -4,-1.2 3,-0.4 -3,-0.5 -1,-0.3 0.536 91.8 81.5 -79.5 -6.1 59.2 -4.7 7.4 228 229 A L T <4 S+ 0 0 57 -3,-2.3 2,-0.4 -4,-0.4 -1,-0.2 0.855 104.0 24.0 -73.0 -32.9 62.1 -6.3 9.4 229 230 A N S << S- 0 0 36 -4,-0.6 4,-0.4 -3,-0.6 -1,-0.3 -0.831 91.0-160.6-137.4 92.0 64.2 -3.1 9.7 230 231 A K + 0 0 64 -2,-0.4 2,-0.1 -3,-0.4 4,-0.1 -0.901 46.1 34.2-123.9 155.3 62.2 0.1 9.3 231 232 A P S S- 0 0 47 0, 0.0 3,-0.1 0, 0.0 -19,-0.1 0.675 121.9 -9.0 -93.6 175.2 62.5 3.0 8.7 232 233 A N S S+ 0 0 40 1,-0.2 2,-0.3 -2,-0.1 -20,-0.2 0.740 107.9 97.9 62.7 28.8 65.2 4.0 6.2 233 234 A R - 0 0 68 -4,-0.4 -20,-1.4 -7,-0.2 2,-0.3 -0.924 58.9-139.2-140.9 165.5 66.8 0.6 5.9 234 235 A Q E -ef 148 213A 0 -87,-2.5 -85,-2.6 -2,-0.3 2,-0.4 -0.979 11.7-152.9-134.1 148.2 66.7 -2.5 3.7 235 236 A T E -ef 149 214A 0 -22,-2.3 -20,-2.7 -2,-0.3 2,-0.6 -0.957 5.2-150.6-127.9 132.4 66.8 -6.2 4.5 236 237 A L E -ef 150 215A 0 -87,-2.9 -85,-2.0 -2,-0.4 2,-0.7 -0.899 10.6-167.6-101.1 118.6 68.0 -9.2 2.5 237 238 A V - 0 0 0 -22,-2.6 -20,-0.3 -2,-0.6 2,-0.1 -0.912 12.5-159.1-108.1 107.6 66.2 -12.5 3.3 238 239 A S >> - 0 0 9 -2,-0.7 3,-0.6 -87,-0.3 4,-0.6 -0.369 30.4-113.0 -82.1 163.3 68.1 -15.4 1.8 239 240 A H G >4 S+ 0 0 46 1,-0.2 3,-1.2 2,-0.2 -1,-0.1 0.912 119.3 56.3 -57.4 -40.8 66.6 -18.8 1.0 240 241 A G G 34 S+ 0 0 60 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 0.759 98.8 59.2 -61.5 -29.9 68.9 -20.2 3.8 241 242 A S G <> S+ 0 0 14 -3,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.631 84.0 88.5 -76.0 -13.3 67.4 -17.8 6.4 242 243 A V H S+ 0 0 93 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.914 116.7 39.3 -52.4 -47.1 63.8 -22.1 8.4 244 245 A Q H > S+ 0 0 145 -4,-0.4 4,-0.6 2,-0.2 3,-0.2 0.910 117.1 50.0 -69.0 -40.2 65.0 -20.0 11.4 245 246 A L H >< S+ 0 0 19 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.926 115.5 42.8 -62.2 -43.3 62.9 -17.0 10.4 246 247 A F H >< S+ 0 0 2 -4,-3.3 29,-2.5 -5,-0.2 3,-0.9 0.680 94.9 79.4 -78.8 -16.0 59.7 -19.0 10.0 247 248 A S H 3< S+ 0 0 61 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.779 112.8 20.8 -66.4 -25.2 60.2 -21.1 13.1 248 249 A Q T << S+ 0 0 148 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.132 94.6 119.8-124.3 19.0 58.9 -18.2 15.2 249 250 A M < - 0 0 22 -3,-0.9 25,-2.7 -4,-0.0 26,-0.2 -0.765 64.7-127.7 -92.9 110.4 57.0 -16.2 12.6 250 251 A P B > -K 273 0D 32 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.312 20.4-122.2 -57.4 139.9 53.3 -16.0 13.5 251 252 A I G > S+ 0 0 0 21,-2.2 3,-1.8 1,-0.3 6,-0.2 0.838 106.8 66.4 -52.0 -37.7 51.2 -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 0.596 87.0 70.9 -63.8 -10.7 49.4 -13.8 10.3 253 254 A K G < S+ 0 0 109 -3,-2.1 2,-0.3 4,-0.1 -1,-0.3 0.734 77.6 91.8 -78.7 -22.7 52.6 -12.0 9.3 254 255 A I S X S- 0 0 3 -3,-1.8 3,-2.4 -4,-0.3 4,-0.2 -0.553 93.0-102.9 -75.3 129.5 52.6 -13.6 5.8 255 256 A R T 3 S+ 0 0 80 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 -0.347 109.0 20.8 -58.1 127.4 50.9 -11.6 3.2 256 257 A S T 3 S+ 0 0 72 -4,-0.1 3,-0.3 -2,-0.1 6,-0.3 0.078 111.1 78.7 98.3 -17.7 47.4 -13.0 2.4 257 258 A L < + 0 0 1 -3,-2.4 -2,-0.2 -6,-0.2 -3,-0.1 0.279 62.4 94.7-101.6 11.5 47.3 -14.8 5.8 258 259 A G S S+ 0 0 60 -4,-0.2 -1,-0.2 4,-0.1 -6,-0.1 0.539 86.8 36.4 -82.5 -6.0 46.4 -11.8 7.9 259 260 A G S > S- 0 0 47 -3,-0.3 4,-1.9 0, 0.0 5,-0.2 0.084 117.4 -31.6-120.1-134.6 42.7 -12.5 7.9 260 261 A K H > S+ 0 0 193 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.840 128.8 50.7 -66.7 -39.1 40.2 -15.4 8.0 261 262 A L H > S+ 0 0 44 -5,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.944 111.0 49.8 -62.8 -48.4 42.3 -18.0 6.1 262 263 A G H > S+ 0 0 1 -6,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.890 111.1 50.0 -57.0 -40.9 45.3 -17.4 8.4 263 264 A A H X S+ 0 0 57 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.880 111.1 48.5 -65.7 -38.2 43.0 -17.8 11.4 264 265 A S H X S+ 0 0 37 -4,-2.1 4,-3.1 2,-0.2 5,-0.5 0.878 106.9 55.3 -72.5 -35.3 41.6 -21.0 10.0 265 266 A V H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 6,-0.4 0.950 112.8 44.5 -56.4 -46.9 45.1 -22.4 9.3 266 267 A I H X>S+ 0 0 58 -4,-1.9 4,-1.1 -5,-0.2 5,-0.7 0.900 118.8 41.9 -64.4 -44.0 45.9 -21.8 12.9 267 268 A E H <5S+ 0 0 168 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.937 118.3 41.9 -74.3 -48.7 42.6 -23.2 14.2 268 269 A I H <5S+ 0 0 83 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.877 124.5 35.4 -65.8 -41.6 42.3 -26.3 12.0 269 270 A L H <5S- 0 0 26 -4,-1.9 -1,-0.2 -5,-0.5 -2,-0.2 0.669 99.5-132.1 -90.9 -17.0 45.9 -27.3 12.2 270 271 A G T <5 + 0 0 64 -4,-1.1 2,-0.2 -5,-0.3 -3,-0.2 0.881 62.6 124.7 67.2 39.6 46.5 -26.2 15.8 271 272 A I < - 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