==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 15-APR-11 3RJK . COMPND 2 MOLECULE: DNA POLYMERASE BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.K.BATRA,W.A.BEARD,S.H.WILSON . 326 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 9.5 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 2 0 1 1 2 3 0 1 0 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 0 PARALLEL BRIDGES PER LADDER . 2 1 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 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 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 10 A T > 0 0 181 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 -11.2 9.9 -15.5 12.9 2 11 A L T 3 + 0 0 78 1,-0.3 3,-0.1 36,-0.2 36,-0.1 0.866 360.0 11.9 -58.1 -37.8 10.8 -17.6 9.8 3 12 A N T 3> S+ 0 0 13 35,-0.1 4,-2.4 40,-0.1 3,-0.3 -0.208 91.2 139.5-130.6 36.3 14.3 -15.9 9.8 4 13 A G H <> + 0 0 15 -3,-1.1 4,-2.7 1,-0.2 5,-0.3 0.838 65.0 57.5 -51.8 -43.2 13.9 -14.4 13.3 5 14 A G H > S+ 0 0 33 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.940 112.1 41.8 -56.0 -48.1 17.4 -15.1 14.4 6 15 A I H > S+ 0 0 4 -3,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.897 114.8 48.8 -66.6 -45.1 18.8 -13.1 11.5 7 16 A T H X S+ 0 0 23 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.882 110.5 51.9 -66.9 -35.4 16.4 -10.2 11.7 8 17 A D H X S+ 0 0 108 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.969 110.0 50.4 -61.9 -49.7 16.9 -9.8 15.4 9 18 A M H X S+ 0 0 5 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.922 110.9 47.0 -52.2 -52.4 20.7 -9.7 14.8 10 19 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.889 111.2 52.5 -59.8 -39.2 20.4 -7.1 12.1 11 20 A T H X S+ 0 0 57 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.849 108.6 49.8 -66.8 -34.3 18.1 -5.0 14.3 12 21 A E H X S+ 0 0 64 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.940 112.1 48.0 -68.4 -46.1 20.5 -5.2 17.2 13 22 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.909 110.4 52.7 -59.1 -42.9 23.3 -4.0 14.9 14 23 A A H X S+ 0 0 1 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.963 109.3 48.3 -58.1 -51.1 21.1 -1.3 13.6 15 24 A N H X S+ 0 0 64 -4,-2.5 4,-3.2 1,-0.2 5,-0.4 0.886 110.0 53.6 -57.9 -37.7 20.4 -0.0 17.1 16 25 A F H X>S+ 0 0 25 -4,-2.3 4,-2.3 1,-0.2 5,-1.9 0.951 108.7 47.3 -61.5 -51.5 24.1 -0.1 17.9 17 26 A E H <5S+ 0 0 7 -4,-2.5 6,-3.0 3,-0.2 5,-0.5 0.887 119.0 41.8 -58.0 -40.1 25.0 2.0 14.9 18 27 A K H <5S+ 0 0 73 -4,-2.3 -2,-0.2 4,-0.2 -1,-0.2 0.940 124.6 31.4 -73.8 -49.2 22.3 4.5 15.8 19 28 A N H <5S+ 0 0 18 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.889 134.9 19.9 -79.3 -42.5 22.7 4.7 19.6 20 29 A V T <5S+ 0 0 12 -4,-2.3 -3,-0.2 -5,-0.4 -4,-0.1 0.866 132.5 35.2 -96.6 -47.6 26.4 4.1 20.1 21 30 A S S > + 0 0 30 -6,-3.0 4,-1.6 1,-0.1 3,-0.8 -0.749 26.2 179.2-123.0 78.7 25.9 6.5 12.3 24 33 A I H 3> S+ 0 0 80 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.784 77.1 55.9 -54.9 -34.6 22.3 6.9 11.0 25 34 A H H 3> S+ 0 0 156 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.867 108.2 48.3 -69.9 -32.6 23.0 5.6 7.5 26 35 A K H <> S+ 0 0 118 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.837 109.2 55.4 -72.2 -31.0 24.3 2.4 8.9 27 36 A Y H X S+ 0 0 30 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.947 110.6 43.6 -63.8 -48.9 21.2 2.2 11.1 28 37 A N H X S+ 0 0 38 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.839 110.1 56.6 -66.6 -33.9 19.0 2.5 8.0 29 38 A A H X S+ 0 0 51 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.931 110.1 44.6 -63.8 -45.2 21.1 0.0 6.1 30 39 A Y H X S+ 0 0 23 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.889 112.8 51.0 -67.2 -38.7 20.6 -2.6 8.8 31 40 A R H X S+ 0 0 61 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.897 109.9 49.4 -67.2 -38.6 16.9 -1.9 9.1 32 41 A K H X S+ 0 0 97 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.938 112.8 47.0 -64.7 -45.9 16.2 -2.2 5.4 33 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 22,-0.3 5,-0.3 0.944 113.1 49.0 -59.8 -47.5 18.1 -5.5 5.2 34 43 A A H X S+ 0 0 8 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.897 113.2 49.6 -57.3 -41.8 16.2 -6.8 8.3 35 44 A S H X S+ 0 0 10 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.964 111.4 44.4 -63.9 -55.7 13.0 -5.7 6.6 36 45 A V H < S+ 0 0 19 -4,-3.0 4,-0.5 1,-0.2 3,-0.3 0.883 116.6 47.9 -60.6 -36.5 13.5 -7.3 3.2 37 46 A I H >< S+ 0 0 0 -4,-2.6 3,-1.0 -5,-0.3 -1,-0.2 0.878 103.6 62.8 -70.7 -36.3 14.7 -10.5 4.9 38 47 A A H 3< S+ 0 0 66 -4,-2.1 -1,-0.2 -5,-0.3 -36,-0.2 0.833 108.9 40.1 -58.3 -33.4 11.8 -10.4 7.2 39 48 A K T 3< S+ 0 0 126 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.489 84.0 117.4 -95.7 -2.8 9.3 -10.8 4.3 40 49 A Y < - 0 0 46 -3,-1.0 4,-0.1 -4,-0.5 -38,-0.1 -0.516 63.1-142.7 -64.2 122.9 11.5 -13.3 2.4 41 50 A P S S+ 0 0 98 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.164 72.3 73.9 -78.3 19.5 9.2 -16.4 2.3 42 51 A H S S- 0 0 105 -39,-0.0 2,-1.1 0, 0.0 -2,-0.1 -0.964 87.5-110.0-132.9 149.4 12.0 -19.0 2.7 43 52 A K - 0 0 158 -2,-0.3 -40,-0.1 1,-0.1 -41,-0.0 -0.679 49.2-120.5 -78.8 101.9 14.2 -20.0 5.7 44 53 A I - 0 0 6 -2,-1.1 3,-0.1 1,-0.1 -1,-0.1 -0.119 29.3-172.7 -49.1 132.1 17.5 -18.6 4.6 45 54 A K + 0 0 168 1,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.528 63.1 2.3-104.4 -12.4 20.4 -21.1 4.2 46 55 A S > - 0 0 36 1,-0.1 4,-1.9 22,-0.0 -1,-0.2 -0.991 65.3-109.0-168.0 163.4 23.3 -18.8 3.6 47 56 A G H > S+ 0 0 0 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.878 118.0 58.1 -66.2 -36.4 24.6 -15.3 3.3 48 57 A A H 4 S+ 0 0 68 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.926 106.3 47.9 -58.2 -46.2 25.0 -15.8 -0.5 49 58 A E H >4 S+ 0 0 39 1,-0.2 3,-1.0 2,-0.2 4,-0.3 0.904 114.7 47.0 -60.9 -41.6 21.3 -16.6 -0.7 50 59 A A H >< S+ 0 0 0 -4,-1.9 3,-2.0 1,-0.2 -2,-0.2 0.849 98.6 68.1 -69.2 -35.7 20.5 -13.5 1.3 51 60 A K T 3< S+ 0 0 98 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.611 87.5 69.9 -61.8 -10.6 22.8 -11.3 -0.7 52 61 A K T < S+ 0 0 178 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.782 83.3 86.6 -75.9 -28.3 20.3 -11.8 -3.6 53 62 A L S X S- 0 0 25 -3,-2.0 3,-1.2 -4,-0.3 2,-0.4 -0.418 93.6-105.7 -71.3 146.5 17.8 -9.7 -1.7 54 63 A P T 3 S+ 0 0 98 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.624 106.3 31.3 -77.2 126.3 18.1 -5.9 -2.2 55 64 A G T 3 S+ 0 0 36 -2,-0.4 2,-0.6 1,-0.3 -22,-0.3 0.118 95.2 101.6 114.6 -19.1 19.6 -4.2 0.8 56 65 A V < + 0 0 9 -3,-1.2 -1,-0.3 -6,-0.2 2,-0.1 -0.885 50.4 172.2-100.5 119.3 21.8 -7.1 1.8 57 66 A G > - 0 0 32 -2,-0.6 4,-1.3 -3,-0.1 5,-0.1 -0.147 49.8 -72.6-107.4-154.2 25.4 -6.6 0.7 58 67 A T H > S+ 0 0 87 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.913 125.1 52.6 -71.8 -44.2 28.7 -8.4 1.2 59 68 A K H > S+ 0 0 138 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.933 112.5 42.5 -58.9 -51.4 29.1 -7.4 4.9 60 69 A I H > S+ 0 0 13 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.861 109.7 59.5 -66.8 -32.8 25.7 -8.6 6.0 61 70 A A H X S+ 0 0 7 -4,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.933 107.1 46.5 -60.0 -44.4 26.1 -11.7 3.9 62 71 A E H X S+ 0 0 122 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.911 111.8 50.6 -63.7 -42.8 29.2 -12.6 5.9 63 72 A K H X S+ 0 0 26 -4,-2.0 4,-3.0 1,-0.2 -1,-0.2 0.880 108.1 53.2 -63.3 -37.2 27.5 -11.9 9.2 64 73 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.864 108.1 50.3 -66.6 -35.6 24.6 -14.1 8.2 65 74 A D H X S+ 0 0 76 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.887 112.0 48.1 -69.7 -36.6 27.0 -16.9 7.5 66 75 A E H X>S+ 0 0 39 -4,-2.1 4,-3.0 2,-0.2 5,-0.6 0.955 114.1 45.7 -66.9 -48.6 28.6 -16.4 10.9 67 76 A F H X5S+ 0 0 45 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.885 112.7 50.9 -61.2 -40.3 25.2 -16.4 12.6 68 77 A L H <5S+ 0 0 69 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.891 117.3 38.6 -66.0 -39.8 24.0 -19.4 10.7 69 78 A A H <5S+ 0 0 87 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.923 132.7 22.5 -78.2 -44.5 27.1 -21.5 11.6 70 79 A T H <5S- 0 0 80 -4,-3.0 -3,-0.2 2,-0.3 -2,-0.2 0.680 93.6-126.8 -97.8 -20.2 27.6 -20.4 15.2 71 80 A G S <> - 0 0 4 -2,-0.3 4,-2.5 1,-0.1 3,-1.1 -0.962 9.6-155.1-127.9 113.6 27.8 -12.9 16.1 74 83 A R H 3> S+ 0 0 165 -2,-0.5 4,-2.3 1,-0.3 5,-0.2 0.899 96.8 60.3 -50.8 -43.9 31.1 -12.2 17.8 75 84 A K H 3> S+ 0 0 82 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.839 111.1 39.7 -54.8 -35.9 30.8 -8.5 16.9 76 85 A L H <> S+ 0 0 4 -3,-1.1 4,-2.7 2,-0.2 -1,-0.2 0.842 107.6 62.9 -81.6 -35.2 27.6 -8.3 18.9 77 86 A E H X S+ 0 0 76 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.902 109.1 42.7 -53.6 -43.6 29.0 -10.5 21.7 78 87 A K H X S+ 0 0 149 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.923 109.4 55.4 -70.4 -47.6 31.6 -7.9 22.3 79 88 A I H >< S+ 0 0 18 -4,-1.4 3,-1.3 -5,-0.2 7,-0.2 0.919 108.0 51.2 -53.0 -44.4 29.2 -4.9 22.0 80 89 A R H 3< S+ 0 0 113 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.916 108.6 50.1 -59.1 -46.1 27.1 -6.5 24.7 81 90 A Q H 3< S+ 0 0 144 -4,-1.5 2,-0.7 -5,-0.2 -1,-0.3 0.473 88.8 100.4 -74.4 -0.6 30.0 -7.0 27.1 82 91 A D S+ 0 0 126 -2,-0.7 4,-2.9 2,-0.2 5,-0.2 0.921 91.6 48.4 -56.2 -51.4 29.9 -1.2 29.6 84 93 A T H > S+ 0 0 62 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.940 114.6 46.3 -56.5 -48.4 29.8 2.1 27.8 85 94 A S H > S+ 0 0 11 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.907 113.3 49.1 -60.0 -44.6 27.8 0.6 24.9 86 95 A S H X S+ 0 0 49 -4,-2.7 4,-2.2 -7,-0.2 -1,-0.2 0.892 113.0 47.8 -62.6 -41.2 25.5 -1.2 27.2 87 96 A S H X S+ 0 0 15 -4,-2.9 4,-2.7 -5,-0.2 5,-0.2 0.971 113.0 47.1 -63.9 -54.4 24.9 2.0 29.2 88 97 A I H X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.911 112.6 50.1 -54.1 -46.6 24.3 4.1 26.1 89 98 A N H < S+ 0 0 41 -4,-2.7 4,-0.3 -5,-0.2 -1,-0.2 0.913 112.1 47.8 -61.3 -43.5 21.9 1.6 24.7 90 99 A F H >< S+ 0 0 42 -4,-2.2 3,-2.5 1,-0.2 4,-0.3 0.979 109.7 50.8 -61.5 -56.4 19.9 1.4 27.9 91 100 A L H >< S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.811 100.2 64.0 -52.2 -35.2 19.6 5.1 28.4 92 101 A T T 3< S+ 0 0 26 -4,-1.8 -1,-0.3 1,-0.3 4,-0.2 0.598 87.5 73.3 -67.4 -8.9 18.3 5.7 24.8 93 102 A R T < S+ 0 0 119 -3,-2.5 2,-0.5 -4,-0.3 -1,-0.3 0.585 75.7 91.4 -80.4 -10.5 15.3 3.6 25.8 94 103 A V S X S- 0 0 1 -3,-1.8 3,-2.2 -4,-0.3 2,-0.2 -0.751 92.9-113.3 -83.7 126.9 14.0 6.5 27.8 95 104 A S T 3 S+ 0 0 35 -2,-0.5 35,-0.4 35,-0.3 36,-0.2 -0.437 104.2 28.1 -61.7 127.6 11.7 8.5 25.6 96 105 A G T 3 S+ 0 0 33 1,-0.2 2,-0.7 -2,-0.2 -1,-0.3 0.141 96.5 100.5 106.8 -21.5 13.4 11.9 25.1 97 106 A I < + 0 0 5 -3,-2.2 -1,-0.2 -6,-0.2 -3,-0.1 -0.888 52.0 176.8-101.1 112.7 17.0 10.6 25.6 98 107 A G > - 0 0 30 -2,-0.7 4,-2.3 -3,-0.1 5,-0.2 -0.345 49.2 -74.5-101.8-171.9 18.6 10.1 22.2 99 108 A P H > S+ 0 0 33 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.886 128.8 46.6 -49.8 -47.2 22.2 9.1 21.2 100 109 A S H > S+ 0 0 83 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.964 113.9 43.8 -64.3 -54.6 23.7 12.4 22.2 101 110 A A H > S+ 0 0 26 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.828 111.7 56.4 -61.7 -32.2 22.1 12.9 25.6 102 111 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.951 108.5 45.1 -65.1 -48.4 22.8 9.2 26.4 103 112 A R H X S+ 0 0 88 -4,-1.9 4,-1.5 -5,-0.2 -2,-0.2 0.880 114.4 50.9 -62.2 -37.8 26.5 9.5 25.8 104 113 A K H X S+ 0 0 134 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.909 108.5 49.7 -67.0 -44.1 26.5 12.8 27.8 105 114 A F H ><>S+ 0 0 12 -4,-2.6 5,-2.2 1,-0.2 3,-1.1 0.919 108.6 53.5 -61.0 -43.8 24.7 11.3 30.8 106 115 A V H ><5S+ 0 0 15 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.870 101.9 59.6 -58.6 -36.2 27.2 8.4 30.8 107 116 A D H 3<5S+ 0 0 129 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.793 106.3 48.4 -62.2 -27.2 30.0 11.0 30.9 108 117 A E T <<5S- 0 0 91 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.442 122.6-106.9 -91.5 -2.1 28.4 12.3 34.2 109 118 A G T < 5S+ 0 0 39 -3,-1.5 2,-1.2 -4,-0.4 -3,-0.2 0.466 79.8 132.7 90.2 -0.3 28.2 8.8 35.6 110 119 A I < + 0 0 6 -5,-2.2 -1,-0.2 -6,-0.2 -2,-0.2 -0.741 20.6 132.2 -85.9 97.1 24.4 8.7 35.2 111 120 A K + 0 0 80 -2,-1.2 2,-0.3 -3,-0.1 -1,-0.2 0.368 48.1 56.9-132.6 7.3 24.0 5.3 33.6 112 121 A T S > S- 0 0 58 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.867 84.7-104.8-133.8 170.4 21.2 3.3 35.2 113 122 A L H > S+ 0 0 44 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.867 123.0 54.8 -60.9 -35.9 17.5 3.7 36.0 114 123 A E H > S+ 0 0 147 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.902 106.2 50.5 -64.9 -41.8 18.5 4.4 39.6 115 124 A D H > S+ 0 0 33 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.914 110.1 50.0 -63.5 -42.5 20.8 7.2 38.5 116 125 A L H >< S+ 0 0 1 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.907 107.5 53.9 -62.8 -42.9 18.1 8.8 36.4 117 126 A R H >< S+ 0 0 157 -4,-2.1 3,-0.6 1,-0.3 -1,-0.2 0.816 110.9 45.6 -62.4 -32.4 15.6 8.7 39.2 118 127 A K H 3< S+ 0 0 153 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.538 116.0 46.3 -89.1 -6.7 17.9 10.5 41.5 119 128 A N T X< + 0 0 28 -3,-0.9 3,-2.9 -4,-0.7 -1,-0.2 -0.075 65.5 133.6-123.1 31.5 18.9 13.1 38.9 120 129 A E G X + 0 0 86 -3,-0.6 3,-1.9 1,-0.3 -1,-0.1 0.820 66.3 68.7 -50.2 -33.1 15.5 14.0 37.7 121 130 A D G 3 S+ 0 0 117 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.653 93.0 58.6 -63.2 -15.8 16.5 17.6 38.0 122 131 A K G < S+ 0 0 98 -3,-2.9 2,-0.3 -6,-0.2 -1,-0.3 0.302 91.6 87.0 -97.6 9.0 18.9 17.1 35.1 123 132 A L S < S- 0 0 11 -3,-1.9 2,-0.0 -4,-0.1 -26,-0.0 -0.823 74.6-126.2-109.1 147.8 16.3 16.0 32.6 124 133 A N > - 0 0 87 -2,-0.3 4,-2.1 -28,-0.1 5,-0.2 -0.267 43.6 -88.9 -78.7 177.7 14.1 18.2 30.3 125 134 A H H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.917 125.5 48.3 -55.0 -52.5 10.3 17.8 30.4 126 135 A H H > S+ 0 0 40 1,-0.2 4,-2.5 93,-0.2 3,-0.3 0.939 112.0 49.6 -54.5 -51.6 10.0 15.1 27.8 127 136 A Q H > S+ 0 0 12 -31,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.865 107.4 55.7 -57.3 -38.8 12.8 13.0 29.4 128 137 A R H X S+ 0 0 90 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.901 109.9 44.2 -63.2 -41.3 11.2 13.3 32.8 129 138 A I H X S+ 0 0 11 -4,-1.9 4,-2.1 -3,-0.3 -2,-0.2 0.895 110.7 55.3 -71.7 -37.0 7.9 11.8 31.5 130 139 A G H < S+ 0 0 1 -4,-2.5 -35,-0.3 -35,-0.4 -2,-0.2 0.875 111.5 44.3 -61.3 -36.8 9.7 9.1 29.6 131 140 A L H >< S+ 0 0 9 -4,-2.1 3,-1.7 -5,-0.2 4,-0.3 0.932 108.4 57.5 -71.1 -46.9 11.4 8.1 32.8 132 141 A K H 3< S+ 0 0 125 -4,-2.4 3,-0.2 1,-0.3 -2,-0.2 0.864 120.7 28.7 -51.0 -42.0 8.2 8.3 34.8 133 142 A Y T 3X S+ 0 0 20 -4,-2.1 4,-2.7 1,-0.2 -1,-0.3 0.122 81.3 130.3-108.9 20.3 6.5 5.8 32.4 134 143 A F T <4 S+ 0 0 24 -3,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.846 77.8 42.2 -40.5 -50.6 9.7 3.9 31.4 135 144 A G T >4 S+ 0 0 39 -4,-0.3 3,-1.3 -3,-0.2 4,-0.4 0.953 114.8 49.6 -66.2 -49.5 8.1 0.5 32.1 136 145 A D G >4 S+ 0 0 36 1,-0.2 3,-2.0 2,-0.2 -2,-0.2 0.896 102.3 60.1 -56.5 -46.5 4.7 1.3 30.6 137 146 A F G 3< S+ 0 0 43 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.571 101.7 55.1 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48.0 -62.4 -41.8 -10.3 -0.4 19.8 148 157 A Q H X S+ 0 0 75 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.885 113.2 48.1 -66.2 -39.5 -11.4 0.9 23.2 149 158 A M H X S+ 0 0 1 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.899 109.1 53.4 -68.3 -41.4 -9.0 3.9 22.8 150 159 A Q H X S+ 0 0 55 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.932 107.4 52.3 -57.4 -47.7 -10.2 4.6 19.3 151 160 A D H X S+ 0 0 98 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.933 110.6 46.1 -56.6 -50.9 -13.8 4.8 20.5 152 161 A I H X S+ 0 0 35 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.942 114.5 48.6 -58.2 -49.2 -13.0 7.3 23.3 153 162 A V H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.933 113.9 43.6 -59.1 -50.5 -11.0 9.5 20.9 154 163 A L H X S+ 0 0 59 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.890 115.7 48.9 -65.2 -38.0 -13.5 9.6 18.1 155 164 A N H X S+ 0 0 58 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.895 113.0 47.0 -69.9 -37.2 -16.4 10.2 20.5 156 165 A E H X S+ 0 0 18 -4,-2.6 4,-1.3 -5,-0.2 -2,-0.2 0.920 112.3 48.2 -71.1 -43.1 -14.6 12.9 22.4 157 166 A V H X S+ 0 0 6 -4,-2.5 4,-2.1 -5,-0.2 3,-0.3 0.894 109.0 55.9 -63.5 -36.3 -13.5 14.8 19.2 158 167 A K H < S+ 0 0 125 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.914 103.5 54.1 -60.0 -42.4 -17.0 14.5 17.9 159 168 A K H < S+ 0 0 141 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.818 107.4 51.5 -61.5 -32.2 -18.3 16.2 21.1 160 169 A V H < S- 0 0 41 -4,-1.3 2,-0.2 -3,-0.3 -1,-0.2 0.945 138.4 -19.3 -69.6 -50.5 -15.9 19.1 20.4 161 170 A D >< - 0 0 42 -4,-2.1 3,-2.5 3,-0.0 -1,-0.3 -0.787 53.9-142.8-163.0 114.4 -17.1 19.6 16.8 162 171 A S T 3 S+ 0 0 101 1,-0.3 -4,-0.1 -2,-0.2 -3,-0.1 0.511 98.2 70.2 -58.0 -3.7 -18.9 17.0 14.7 163 172 A E T 3 S+ 0 0 108 -6,-0.1 -1,-0.3 -5,-0.1 2,-0.2 0.566 75.3 98.4 -92.9 -7.9 -16.9 18.3 11.7 164 173 A Y < - 0 0 13 -3,-2.5 2,-0.5 -7,-0.3 24,-0.2 -0.504 58.7-158.2 -74.5 146.0 -13.6 16.8 13.0 165 174 A I E -B 187 0B 81 22,-2.2 22,-2.2 -2,-0.2 2,-0.5 -0.996 6.2-167.8-127.4 124.8 -12.6 13.5 11.5 166 175 A A E -B 186 0B 11 -2,-0.5 2,-0.4 20,-0.2 20,-0.2 -0.967 3.1-172.6-116.0 126.7 -10.1 11.4 13.4 167 176 A T E -B 185 0B 28 18,-2.8 18,-3.4 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-35,-0.1 2,-0.3 0.560 91.6 18.6 -79.5 -8.7 -2.8 -7.3 16.5 178 187 A S E S-A 142 0A 37 -36,-0.3 2,-0.3 -35,-0.1 -1,-0.2 -0.964 72.7-157.4-156.6 148.7 -0.8 -5.1 18.9 179 188 A S E -A 141 0A 0 -38,-2.0 -38,-2.6 -2,-0.3 3,-0.1 -0.909 23.2-135.8-129.8 156.8 0.7 -1.6 18.5 180 189 A G S S- 0 0 39 -2,-0.3 65,-0.4 -40,-0.2 2,-0.3 0.726 86.9 -23.5 -81.5 -22.6 3.5 0.3 20.3 181 190 A D S S- 0 0 30 63,-0.1 2,-0.5 -40,-0.1 -9,-0.2 -0.941 73.3 -85.9-167.0-175.1 1.3 3.4 20.5 182 191 A M E - c 0 246B 0 63,-1.9 65,-2.8 -2,-0.3 2,-0.5 -0.952 30.8-167.7-115.8 125.8 -1.7 5.2 19.1 183 192 A D E - c 0 247B 20 -2,-0.5 -14,-2.6 -14,-0.4 2,-0.5 -0.951 7.6-167.6-112.2 122.6 -1.3 7.5 16.1 184 193 A V E -Bc 168 248B 2 63,-3.3 65,-2.9 -2,-0.5 2,-0.4 -0.941 10.5-157.0-117.7 122.4 -4.3 9.8 15.3 185 194 A L E -Bc 167 249B 0 -18,-3.4 -18,-2.8 -2,-0.5 2,-0.4 -0.793 19.3-166.2 -92.0 135.5 -4.7 11.8 12.1 186 195 A L E +Bc 166 250B 1 63,-2.9 65,-2.4 -2,-0.4 2,-0.3 -0.988 11.4 175.0-129.7 133.2 -7.0 14.7 12.6 187 196 A T E -B 165 0B 4 -22,-2.2 -22,-2.2 -2,-0.4 5,-0.1 -0.920 6.3-179.4-131.3 159.1 -8.8 16.9 10.1 188 197 A H > - 0 0 1 3,-0.4 3,-2.1 63,-0.3 65,-0.5 -0.956 36.4-122.0-155.1 137.7 -11.3 19.7 10.2 189 198 A P T 3 S+ 0 0 47 0, 0.0 8,-0.1 0, 0.0 65,-0.1 0.744 107.4 67.9 -56.4 -22.2 -12.8 21.7 7.3 190 199 A S T 3 S+ 0 0 22 1,-0.2 7,-2.9 6,-0.1 2,-0.5 0.602 95.5 61.2 -74.5 -9.8 -11.6 25.0 8.9 191 200 A F B < +F 196 0C 28 -3,-2.1 62,-2.1 5,-0.2 -3,-0.4 -0.923 65.8 145.9-124.7 108.0 -8.0 24.0 8.2 192 201 A T - 0 0 35 3,-2.8 3,-0.2 -2,-0.5 -2,-0.0 -0.706 65.9 -97.0-127.6 178.0 -6.9 23.5 4.6 193 202 A S S S+ 0 0 59 -2,-0.2 3,-0.1 1,-0.2 94,-0.0 0.605 126.1 55.9 -73.3 -8.1 -3.8 24.1 2.6 194 203 A E S S- 0 0 163 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.765 120.8 -21.6 -92.6 -31.5 -5.6 27.3 1.6 195 204 A S - 0 0 43 -3,-0.2 -3,-2.8 3,-0.0 2,-0.6 -0.989 42.8-123.5-172.9 163.5 -6.2 28.7 5.1 196 205 A T B +F 191 0C 90 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.889 30.5 173.4-117.4 91.8 -6.6 28.3 8.8 197 206 A K S S+ 0 0 163 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