==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-APR-05 1ZDL . COMPND 2 MOLECULE: THIOREDOXIN REDUCTASE 2, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.I.BITEROVA,A.A.TURANOV,V.N.GLADYSHEV,J.J.BARYCKI . 484 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23053.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 42 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.3 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 2 1 0 1 1 0 0 3 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 2 2 3 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 . 3 1 3 0 1 2 2 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 . 1 0 2 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 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 38 A Q 0 0 130 0, 0.0 142,-1.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-152.9 -29.2 55.8 21.7 2 39 A S B +a 143 0A 71 140,-0.2 2,-0.3 127,-0.0 142,-0.2 -0.698 360.0 173.7 -97.1 144.1 -29.3 52.4 19.9 3 40 A F - 0 0 10 140,-3.0 142,-0.5 -2,-0.3 143,-0.2 -0.950 38.4-127.0-139.1 154.3 -30.3 51.6 16.3 4 41 A D S S+ 0 0 58 23,-0.7 2,-0.2 -2,-0.3 142,-0.2 0.384 100.6 34.2 -86.6 7.0 -30.2 48.4 14.2 5 42 A L E -d 28 0B 0 22,-0.9 24,-1.8 138,-0.2 2,-0.5 -0.784 65.5-172.1-162.9 114.9 -28.3 50.3 11.5 6 43 A L E -de 29 147B 3 140,-2.5 142,-2.6 -2,-0.2 2,-0.5 -0.924 6.7-164.6-111.6 132.0 -25.7 53.1 11.8 7 44 A V E -de 30 148B 0 22,-2.4 24,-2.9 -2,-0.5 2,-0.7 -0.962 6.7-155.1-119.4 129.6 -24.4 55.0 8.8 8 45 A I E S+de 31 149B 11 140,-2.6 142,-2.9 -2,-0.5 24,-0.2 -0.882 70.5 33.9-106.2 107.1 -21.3 57.1 8.8 9 46 A G - 0 0 6 22,-2.0 2,-2.6 -2,-0.7 6,-0.3 0.487 67.1-136.5 114.9 99.3 -21.3 59.8 6.2 10 47 A G + 0 0 0 4,-0.2 36,-1.3 5,-0.1 37,-0.6 -0.307 65.9 133.1 -77.6 56.4 -24.5 61.5 5.0 11 48 A G S >>S- 0 0 10 -2,-2.6 4,-2.3 139,-0.3 5,-0.6 -0.570 77.9 -85.7-109.8 171.5 -23.2 61.1 1.5 12 49 A S H >5S+ 0 0 22 34,-0.3 4,-0.6 1,-0.2 326,-0.1 0.807 130.6 33.5 -39.4 -41.6 -24.3 59.9 -1.9 13 50 A G H >5S+ 0 0 6 2,-0.1 4,-2.2 3,-0.1 -1,-0.2 0.944 120.1 47.4 -82.9 -55.0 -23.5 56.4 -0.9 14 51 A G H >5S+ 0 0 0 136,-0.3 4,-3.0 1,-0.2 -2,-0.2 0.955 111.6 49.1 -50.0 -63.3 -24.3 56.5 2.8 15 52 A L H X5S+ 0 0 3 -4,-2.3 4,-3.5 -6,-0.3 5,-0.4 0.831 108.9 55.5 -45.7 -42.1 -27.7 58.2 2.4 16 53 A A H XS+ 0 0 0 -4,-2.5 5,-1.3 -5,-0.3 -2,-0.2 0.799 111.5 47.3 -72.7 -29.3 -32.4 50.3 4.6 22 59 A A H ><5S+ 0 0 7 -4,-1.8 3,-2.7 1,-0.2 -2,-0.2 0.864 103.7 60.2 -77.5 -38.2 -35.2 52.2 6.4 23 60 A Q H 3<5S+ 0 0 132 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.729 96.8 62.5 -60.4 -21.4 -37.6 51.6 3.5 24 61 A L T 3<5S- 0 0 52 -4,-0.6 -1,-0.3 -5,-0.1 -2,-0.2 0.355 129.7-103.2 -84.2 5.1 -37.0 47.9 4.4 25 62 A G T < 5S+ 0 0 43 -3,-2.7 2,-0.3 1,-0.2 -3,-0.2 0.688 74.6 141.5 83.2 22.7 -38.5 48.8 7.7 26 63 A K < - 0 0 82 -5,-1.3 2,-1.9 1,-0.1 -1,-0.2 -0.719 62.9-107.3-103.3 150.0 -35.4 49.1 9.8 27 64 A K - 0 0 78 -2,-0.3 -22,-0.9 88,-0.1 -23,-0.7 -0.491 52.8-178.4 -71.1 83.1 -34.4 51.5 12.5 28 65 A V E +d 5 0B 1 -2,-1.9 88,-1.5 86,-0.5 2,-0.3 -0.569 13.6 174.0 -90.9 150.6 -31.8 53.5 10.5 29 66 A A E -df 6 116B 0 -24,-1.8 -22,-2.4 86,-0.2 2,-0.4 -0.967 9.1-163.2-155.6 136.4 -29.7 56.4 11.7 30 67 A V E -df 7 117B 0 86,-2.1 88,-2.5 -2,-0.3 2,-0.5 -0.951 6.6-159.3-128.1 143.8 -26.9 58.3 10.1 31 68 A A E +d 8 0B 2 -24,-2.9 -22,-2.0 -2,-0.4 2,-0.4 -0.978 16.6 174.5-123.6 119.4 -24.2 60.7 11.3 32 69 A D - 0 0 16 -2,-0.5 2,-0.4 -23,-0.2 89,-0.1 -0.976 8.6-172.5-126.2 136.4 -22.5 63.1 8.9 33 70 A Y - 0 0 69 -2,-0.4 2,-1.9 86,-0.2 11,-0.1 -0.906 15.5-152.6-135.5 112.2 -20.0 65.8 9.7 34 71 A V - 0 0 23 -2,-0.4 9,-0.2 9,-0.2 3,-0.1 -0.486 17.1-162.0 -80.4 72.4 -18.7 68.4 7.2 35 72 A E - 0 0 72 -2,-1.9 6,-0.1 1,-0.1 -2,-0.0 -0.399 32.5-106.4 -55.8 118.0 -15.3 69.1 8.7 36 73 A P - 0 0 49 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 0.140 30.7-100.4 -47.2 159.2 -14.4 72.5 7.0 37 74 A S > - 0 0 4 4,-2.0 3,-3.9 135,-0.1 4,-0.4 -0.508 39.2-100.9 -81.6 152.7 -11.8 72.9 4.3 38 75 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 131,-0.0 0.754 127.8 53.8 -43.9 -28.5 -8.3 74.2 5.1 39 76 A R T 3 S- 0 0 110 2,-0.1 -2,-0.1 128,-0.0 127,-0.0 0.191 128.3-100.7 -93.6 16.3 -9.5 77.6 3.8 40 77 A G < + 0 0 58 -3,-3.9 2,-0.5 1,-0.2 133,-0.0 0.932 69.1 151.3 67.7 50.8 -12.5 77.4 6.2 41 78 A T + 0 0 25 -4,-0.4 -4,-2.0 -6,-0.1 2,-0.3 -0.951 16.3 176.2-117.7 131.0 -15.3 76.3 3.8 42 79 A K - 0 0 152 -2,-0.5 2,-0.2 -6,-0.2 -7,-0.1 -0.916 4.7-178.2-132.0 157.8 -18.3 74.3 5.0 43 80 A W - 0 0 36 -2,-0.3 -9,-0.2 -9,-0.2 3,-0.1 -0.848 26.0 -88.8-144.4 178.5 -21.5 73.0 3.5 44 81 A G - 0 0 26 -2,-0.2 7,-0.2 1,-0.2 3,-0.1 -0.060 59.1 -54.9 -85.9-173.9 -24.7 71.1 4.3 45 82 A L S S+ 0 0 9 1,-0.2 61,-0.2 55,-0.1 -1,-0.2 -0.257 96.3 77.4 -60.7 146.6 -25.8 67.4 4.3 46 83 A G S > S- 0 0 0 -36,-1.3 4,-1.4 -3,-0.1 -34,-0.3 0.578 82.9-117.6 127.6 14.7 -25.3 65.5 1.1 47 84 A G H > - 0 0 15 -37,-0.6 4,-1.9 -36,-0.2 5,-0.4 0.236 58.0 -44.7 50.4-175.0 -21.6 64.5 0.8 48 85 A T H > S+ 0 0 43 3,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.918 129.8 64.0 -50.5 -52.8 -19.1 65.6 -1.9 49 86 A C H > S+ 0 0 18 1,-0.2 6,-1.6 2,-0.2 4,-0.6 0.894 110.9 30.6 -36.8 -74.1 -21.6 65.0 -4.7 50 87 A V H < S+ 0 0 6 -4,-1.4 3,-0.3 4,-0.2 -1,-0.2 0.928 132.2 31.5 -56.2 -51.5 -24.2 67.5 -3.9 51 88 A N H < S+ 0 0 0 -4,-1.9 -2,-0.2 -5,-0.3 -3,-0.2 0.847 130.8 14.8 -85.2 -39.2 -22.0 70.1 -2.3 52 89 A V H < S- 0 0 4 -4,-3.1 2,-0.2 -5,-0.4 -1,-0.2 -0.277 123.7 -1.3-136.4 56.5 -18.5 70.1 -3.9 53 90 A G S X S+ 0 0 14 -4,-0.6 4,-2.2 -3,-0.3 5,-0.4 -0.642 105.5 47.4 175.0-117.6 -18.7 68.2 -7.1 54 91 A C H > S+ 0 0 45 1,-0.2 4,-1.1 -2,-0.2 5,-0.2 0.755 122.6 31.8 -22.8 -63.3 -21.1 66.2 -9.2 55 92 A I H > S+ 0 0 48 -6,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.975 122.9 41.3 -71.9 -58.5 -23.8 68.9 -9.0 56 93 A P H > S+ 0 0 1 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.948 114.7 51.2 -56.5 -53.5 -22.0 72.2 -8.8 57 94 A K H >X S+ 0 0 28 -4,-2.2 4,-4.0 1,-0.2 3,-1.1 0.958 111.3 46.3 -44.2 -71.2 -19.3 71.3 -11.4 58 95 A K H 3X S+ 0 0 66 -4,-1.1 4,-2.7 -5,-0.4 -1,-0.2 0.875 113.5 51.9 -38.5 -50.0 -21.8 70.2 -14.0 59 96 A L H 3X S+ 0 0 60 -4,-2.3 4,-2.0 2,-0.2 -1,-0.3 0.860 115.0 39.6 -60.0 -39.9 -23.8 73.4 -13.2 60 97 A M H X S+ 0 0 13 -4,-2.2 3,-1.7 2,-0.2 4,-1.0 0.997 109.2 48.1 -60.1 -59.8 -19.6 77.8 -19.4 65 102 A L H >X S+ 0 0 49 -4,-2.5 4,-1.8 1,-0.3 3,-0.8 0.873 103.6 60.9 -45.5 -49.4 -21.3 76.0 -22.3 66 103 A L H 3X S+ 0 0 76 -4,-2.8 4,-1.7 1,-0.3 -1,-0.3 0.852 97.8 61.9 -47.7 -38.4 -24.1 78.6 -22.3 67 104 A G H X S+ 0 0 174 -4,-1.6 3,-2.1 1,-0.2 4,-0.6 0.992 116.0 42.6 -54.1 -71.4 -21.5 83.1 -29.6 72 109 A D H >X S+ 0 0 28 -4,-2.3 3,-1.9 1,-0.3 4,-0.9 0.859 103.4 71.6 -37.6 -50.9 -23.0 80.4 -31.8 73 110 A A H ><>S+ 0 0 21 -4,-2.7 5,-2.0 1,-0.3 3,-0.7 0.774 86.8 63.0 -37.1 -45.2 -26.4 82.0 -31.3 74 111 A H H X<5S+ 0 0 99 -3,-2.1 3,-1.6 -4,-1.3 -1,-0.3 0.894 99.6 53.6 -51.8 -45.2 -25.4 85.0 -33.5 75 112 A H H <<5S+ 0 0 95 -3,-1.9 -1,-0.2 -4,-0.6 -2,-0.2 0.810 101.9 58.6 -63.0 -31.7 -25.0 82.6 -36.6 76 113 A Y T <<5S- 0 0 105 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.245 130.7 -89.4 -84.1 15.2 -28.5 81.2 -36.1 77 114 A G T < 5S+ 0 0 58 -3,-1.6 2,-1.0 1,-0.2 -3,-0.2 0.524 82.8 137.9 94.4 4.7 -30.0 84.6 -36.5 78 115 A W < - 0 0 179 -5,-2.0 2,-2.8 -6,-0.2 -1,-0.2 -0.758 43.6-153.5 -90.4 103.9 -30.0 85.7 -32.8 79 116 A E + 0 0 192 -2,-1.0 -1,-0.1 -3,-0.1 -5,-0.1 -0.194 30.7 165.8 -72.2 50.4 -28.9 89.3 -32.8 80 117 A V - 0 0 44 -2,-2.8 2,-0.7 -10,-0.2 -3,-0.0 -0.421 40.6-118.2 -65.5 143.0 -27.5 89.1 -29.3 81 118 A A - 0 0 85 -2,-0.1 -1,-0.1 2,-0.1 -2,-0.0 -0.786 47.3-115.8 -90.1 117.7 -25.3 92.0 -28.5 82 119 A Q S S+ 0 0 93 -2,-0.7 3,-0.0 1,-0.2 2,-0.0 -0.637 82.5 41.7-108.2 166.5 -21.8 90.9 -27.7 83 120 A P S S- 0 0 128 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.335 74.5-160.3 -85.2 124.7 -19.5 90.5 -26.0 84 121 A V - 0 0 78 -17,-0.1 -2,-0.1 1,-0.1 -13,-0.0 -0.482 10.3-138.8 -69.2 131.3 -21.8 89.5 -23.3 85 122 A Q - 0 0 179 -2,-0.2 2,-0.2 -3,-0.0 -1,-0.1 -0.127 12.3-158.4 -79.3-177.0 -20.4 89.7 -19.8 86 123 A H - 0 0 70 118,-0.0 2,-0.5 117,-0.0 3,-0.0 -0.802 5.5-147.3-165.9 119.1 -20.8 87.2 -17.0 87 124 A N > - 0 0 76 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.819 11.7-144.8-104.8 132.8 -20.4 87.7 -13.3 88 125 A W H > S+ 0 0 8 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 0.746 98.7 62.0 -55.4 -28.8 -19.1 85.1 -10.9 89 126 A K H > S+ 0 0 115 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.973 103.7 44.3 -66.0 -54.9 -21.5 86.4 -8.2 90 127 A T H > S+ 0 0 96 -3,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.907 117.2 46.4 -56.8 -45.8 -24.7 85.7 -10.1 91 128 A M H X S+ 0 0 15 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.994 112.1 48.2 -60.5 -63.8 -23.6 82.3 -11.2 92 129 A A H X S+ 0 0 1 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.885 111.4 51.0 -43.7 -52.5 -22.3 81.1 -7.8 93 130 A E H X S+ 0 0 100 -4,-2.5 4,-3.4 -5,-0.2 5,-0.3 0.971 111.4 47.5 -48.7 -64.4 -25.4 82.3 -6.0 94 131 A A H X S+ 0 0 59 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.888 115.2 45.6 -40.6 -58.9 -27.7 80.4 -8.4 95 132 A V H >X S+ 0 0 8 -4,-2.6 4,-2.0 1,-0.2 3,-1.9 0.968 115.7 45.1 -51.3 -62.3 -25.6 77.3 -8.1 96 133 A Q H 3X S+ 0 0 18 -4,-3.0 4,-2.8 1,-0.3 5,-0.2 0.865 105.2 59.8 -52.6 -45.0 -25.3 77.4 -4.3 97 134 A N H 3< S+ 0 0 96 -4,-3.4 4,-0.5 -5,-0.3 -1,-0.3 0.738 110.8 45.6 -58.6 -19.9 -29.0 78.2 -3.8 98 135 A H H < S+ 0 0 1 -4,-2.0 3,-1.7 1,-0.3 4,-0.5 0.947 109.2 50.1 -51.8 -46.2 -27.0 72.9 -3.7 100 137 A K G >X S+ 0 0 83 -4,-2.8 4,-2.7 1,-0.3 3,-0.6 0.814 99.0 63.5 -61.7 -32.9 -28.9 74.0 -0.7 101 138 A S G 34 S+ 0 0 73 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.680 110.1 40.9 -65.9 -15.9 -32.1 72.8 -2.3 102 139 A L G S+ 0 0 8 -3,-0.6 4,-1.6 -4,-0.5 3,-0.8 0.949 114.2 33.0 -78.5 -68.3 -29.2 70.2 1.4 104 141 A W H 3< S+ 0 0 184 -4,-2.7 -1,-0.2 1,-0.2 -3,-0.1 0.008 117.5 65.4 -77.7 31.8 -32.7 70.8 2.9 105 142 A G H 3> S+ 0 0 18 -2,-0.4 4,-1.6 -3,-0.2 -1,-0.2 0.636 100.8 40.4-120.3 -40.8 -33.8 68.1 0.5 106 143 A H H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 3,-0.9 0.936 109.4 51.9 -62.1 -49.1 -36.5 66.1 4.3 109 146 A Q H 3< S+ 0 0 75 -4,-1.6 4,-0.3 1,-0.3 -1,-0.2 0.723 106.1 56.7 -61.8 -22.9 -36.2 62.6 2.8 110 147 A L H 3<>S+ 0 0 0 -4,-1.5 5,-1.5 -3,-0.3 -1,-0.3 0.747 108.1 46.5 -80.6 -25.8 -34.6 61.5 6.1 111 148 A Q H X<5S+ 0 0 130 -4,-1.0 3,-1.7 -3,-0.9 4,-0.3 0.954 109.0 50.7 -78.7 -55.9 -37.5 62.6 8.2 112 149 A D T 3<5S+ 0 0 126 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.650 107.8 61.4 -57.4 -13.6 -40.3 61.2 6.2 113 150 A R T 3 5S- 0 0 86 -4,-0.3 -1,-0.3 -5,-0.2 -85,-0.2 0.144 112.9-107.8-104.2 21.3 -38.4 57.9 6.3 114 151 A K T < 5S+ 0 0 149 -3,-1.7 -86,-0.5 1,-0.2 2,-0.4 0.895 75.5 136.6 59.8 38.3 -38.2 57.0 10.0 115 152 A V < - 0 0 12 -5,-1.5 2,-0.3 -4,-0.3 -86,-0.2 -0.977 45.4-145.1-125.3 132.2 -34.5 57.9 10.0 116 153 A K E -f 29 0B 132 -88,-1.5 -86,-2.1 -2,-0.4 2,-0.4 -0.732 10.4-150.4 -96.0 143.1 -32.6 59.9 12.7 117 154 A Y E -f 30 0B 41 -2,-0.3 2,-0.5 -88,-0.2 -86,-0.2 -0.935 10.2-173.0-115.8 130.5 -29.7 62.3 11.8 118 155 A F - 0 0 47 -88,-2.5 2,-1.6 -2,-0.4 22,-0.0 -0.805 15.9-150.8-130.4 92.3 -26.9 63.0 14.2 119 156 A N + 0 0 44 -2,-0.5 2,-0.3 -88,-0.2 16,-0.3 -0.398 48.4 136.1 -59.2 85.5 -24.5 65.7 12.9 120 157 A I - 0 0 5 -2,-1.6 2,-2.7 14,-0.1 14,-0.2 -0.929 66.0-119.9-148.1 122.8 -21.4 64.4 14.7 121 158 A K - 0 0 68 -2,-0.3 12,-0.9 12,-0.3 10,-0.1 -0.256 51.0-150.2 -55.1 76.9 -17.7 63.9 13.7 122 159 A A E +B 132 0A 9 -2,-2.7 2,-0.3 10,-0.2 10,-0.2 0.015 23.3 176.9 -53.7 159.1 -18.1 60.2 14.4 123 160 A S E -B 131 0A 21 8,-0.9 8,-2.9 166,-0.1 2,-0.2 -0.930 33.2 -98.0-164.9 141.5 -15.2 58.0 15.5 124 161 A F E +B 130 0A 10 164,-3.4 6,-0.2 -2,-0.3 168,-0.1 -0.440 34.2 167.3 -71.7 133.3 -14.8 54.3 16.5 125 162 A V - 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0 0 16 -3,-1.3 29,-2.8 28,-0.2 2,-0.2 0.947 9.1-135.8 83.9 72.1 -16.6 40.9 -32.6 422 459 A L B -X 449 0H 63 -4,-0.4 -6,-1.7 27,-0.3 2,-0.3 -0.385 16.8-128.3 -60.3 123.8 -17.8 41.6 -29.1 423 460 A V E + W 0 415G 8 25,-2.2 -8,-0.3 -8,-0.2 3,-0.1 -0.598 33.7 171.6 -73.6 131.9 -17.5 45.4 -28.4 424 461 A L E + 0 0 19 -10,-2.6 -51,-3.6 1,-0.3 -9,-0.2 0.139 59.9 23.8-133.3 24.1 -15.6 45.9 -25.2 425 462 A G E -SW 372 414G 0 -11,-0.7 -11,-2.1 -53,-0.3 2,-0.4 -0.635 57.6-165.7 175.7 123.4 -14.9 49.6 -25.0 426 463 A L E -SW 371 413G 3 -55,-2.4 -55,-1.6 -13,-0.2 2,-0.4 -0.954 3.7-167.5-121.3 143.0 -16.6 52.7 -26.5 427 464 A H E +SW 370 412G 3 -15,-1.7 -15,-2.9 -2,-0.4 2,-0.4 -0.974 6.9 177.8-134.8 118.5 -15.1 56.2 -26.6 428 465 A F E -SW 369 411G 0 -59,-2.8 -59,-3.0 -2,-0.4 2,-0.4 -0.979 4.5-179.5-122.8 129.8 -17.1 59.3 -27.5 429 466 A L E +SW 368 410G 0 -19,-2.1 -19,-0.7 -2,-0.4 -61,-0.2 -0.884 48.1 66.4-133.1 100.4 -15.7 62.8 -27.5 430 467 A G E > S-S 367 0G 0 -63,-1.7 -63,-0.6 -2,-0.4 3,-0.5 -0.857 88.1 -13.6-176.4-151.9 -18.1 65.5 -28.5 431 468 A P T 3 S- 0 0 26 0, 0.0 5,-0.1 0, 0.0 32,-0.1 -0.486 121.6 -1.0 -74.4 134.8 -21.3 67.2 -27.1 432 469 A N T 3> S+ 0 0 89 -2,-0.2 4,-1.5 3,-0.1 5,-0.2 0.955 72.8 178.1 51.2 58.2 -23.2 65.6 -24.2 433 470 A A H <> S+ 0 0 0 -3,-0.5 4,-3.8 2,-0.2 3,-0.4 0.931 76.6 47.9 -56.2 -51.8 -20.9 62.6 -23.9 434 471 A G H > S+ 0 0 19 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.924 106.7 56.8 -57.0 -47.2 -22.8 61.0 -21.0 435 472 A E H > S+ 0 0 144 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.863 118.2 35.4 -52.4 -35.8 -26.1 61.5 -22.7 436 473 A V H X S+ 0 0 19 -4,-1.5 4,-1.0 -3,-0.4 -2,-0.2 0.902 117.0 50.0 -84.9 -46.4 -24.6 59.5 -25.6 437 474 A T H X S+ 0 0 1 -4,-3.8 4,-2.0 1,-0.2 -3,-0.2 0.871 96.7 70.7 -61.3 -40.8 -22.5 57.0 -23.7 438 475 A Q H >X S+ 0 0 121 -4,-2.8 4,-0.6 -5,-0.2 3,-0.6 0.901 97.4 47.6 -46.0 -59.1 -25.2 55.9 -21.3 439 476 A G H >X S+ 0 0 52 -4,-0.5 3,-2.2 1,-0.3 4,-0.6 0.945 112.6 50.4 -48.2 -55.5 -27.3 54.0 -23.8 440 477 A F H >X S+ 0 0 55 -4,-1.0 4,-1.4 1,-0.3 3,-1.0 0.786 94.0 70.0 -55.9 -32.5 -24.3 52.2 -25.1 441 478 A A H S+ 0 0 23 -3,-1.0 5,-3.8 -4,-0.6 4,-0.7 0.851 108.0 49.2 -65.3 -30.6 -24.8 47.3 -25.0 444 481 A I H ><5S+ 0 0 16 -4,-1.4 3,-1.1 2,-0.2 -2,-0.2 0.950 104.9 53.5 -73.2 -49.9 -21.7 46.3 -23.0 445 482 A K H 3<5S+ 0 0 103 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.817 117.5 43.1 -53.5 -26.9 -23.6 44.9 -20.1 446 483 A C H 3<5S- 0 0 101 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.625 113.2-120.8 -93.4 -17.8 -25.2 42.8 -22.8 447 484 A G T <<5 - 0 0 29 -3,-1.1 -3,-0.2 -4,-0.7 -2,-0.1 0.810 36.6-163.6 80.4 31.0 -22.1 42.1 -24.8 448 485 A A < - 0 0 22 -5,-3.8 -25,-2.2 -8,-0.1 2,-0.3 -0.096 10.6-133.0 -48.1 143.1 -23.3 43.7 -28.0 449 486 A S B > -X 422 0H 6 -27,-0.2 4,-0.7 1,-0.1 -27,-0.3 -0.713 20.2-112.5-102.6 154.6 -21.4 42.7 -31.0 450 487 A Y H > S+ 0 0 11 -29,-2.8 4,-1.6 -2,-0.3 3,-0.3 0.747 121.0 60.2 -54.1 -22.6 -19.9 44.9 -33.8 451 488 A A H >> S+ 0 0 32 -31,-0.6 4,-2.0 1,-0.2 3,-0.6 0.979 98.2 53.0 -66.8 -58.2 -22.5 43.2 -35.9 452 489 A Q H 34 S+ 0 0 87 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.573 108.9 54.1 -55.2 -8.2 -25.4 44.4 -33.8 453 490 A V H 3< S+ 0 0 11 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.2 0.828 108.3 44.4 -93.0 -41.3 -24.0 47.8 -34.4 454 491 A M H << S+ 0 0 133 -4,-1.6 -2,-0.2 -3,-0.6 -3,-0.1 0.673 117.2 50.5 -72.7 -15.6 -23.9 47.5 -38.2 455 492 A Q S < S+ 0 0 146 -4,-2.0 2,-0.5 -5,-0.1 -1,-0.2 0.637 92.4 89.8 -92.9 -20.4 -27.4 46.0 -37.6 456 493 A T S S- 0 0 74 -5,-0.3 2,-0.1 -3,-0.2 -3,-0.0 -0.677 74.4-140.6 -81.5 127.1 -28.5 49.0 -35.4 457 494 A V - 0 0 128 -2,-0.5 2,-0.2 1,-0.1 11,-0.1 -0.325 20.7-108.7 -81.8 168.7 -30.0 51.7 -37.5 458 495 A G - 0 0 38 -2,-0.1 2,-0.8 10,-0.0 -1,-0.1 -0.643 3.3-133.6-106.3 160.4 -29.3 55.4 -36.8 459 496 A I - 0 0 126 -2,-0.2 6,-0.4 0, 0.0 3,-0.2 -0.901 47.1-127.4-106.2 98.9 -31.2 58.4 -35.5 460 497 A H S S+ 0 0 149 -2,-0.8 3,-0.1 1,-0.3 -2,-0.0 -0.780 81.8 26.7 -98.8 140.5 -30.4 61.0 -38.0 461 498 A P S S+ 0 0 69 0, 0.0 -1,-0.3 0, 0.0 2,-0.3 0.300 96.0 109.6-101.2 120.8 -29.4 63.7 -37.5 462 499 A T - 0 0 47 -3,-0.2 4,-0.3 1,-0.1 -65,-0.0 -0.830 64.5-126.5-139.1 177.3 -27.5 63.1 -34.3 463 500 A C S > S+ 0 0 18 -2,-0.3 3,-0.8 2,-0.1 4,-0.4 0.792 108.9 55.0 -95.0 -37.8 -24.1 62.9 -32.8 464 501 A S G >> S+ 0 0 37 1,-0.2 3,-1.8 2,-0.2 4,-0.9 0.839 93.6 70.6 -65.1 -32.2 -24.6 59.5 -31.2 465 502 A E G 34 S+ 0 0 25 -6,-0.4 4,-0.3 1,-0.3 -1,-0.2 0.880 85.2 70.0 -53.9 -35.0 -25.6 58.1 -34.6 466 503 A E G X> S+ 0 0 22 -3,-0.8 3,-1.6 -4,-0.3 4,-1.5 0.847 91.9 58.7 -50.7 -37.1 -22.0 58.4 -35.6 467 504 A V G X4 S+ 0 0 0 -3,-1.8 3,-1.3 -4,-0.4 -1,-0.2 0.988 103.6 50.0 -55.8 -57.6 -21.2 55.6 -33.2 468 505 A V G 3< S+ 0 0 22 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.373 109.1 55.1 -64.9 9.1 -23.5 53.2 -35.1 469 506 A K G <4 S+ 0 0 84 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.683 75.2 129.8-109.8 -29.6 -21.9 54.2 -38.4 470 507 A L << + 0 0 5 -4,-1.5 -78,-0.1 -3,-1.3 3,-0.1 0.123 12.7 134.9 -31.0 126.0 -18.3 53.4 -37.4 471 508 A H + 0 0 122 -80,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.437 31.4 104.4-146.5 -36.8 -16.6 51.2 -40.0 472 509 A I - 0 0 25 -81,-0.3 -81,-2.0 8,-0.1 2,-0.2 -0.377 58.6-152.4 -61.1 120.0 -13.1 52.5 -40.7 473 510 A S B > -U 390 0G 10 -2,-0.3 5,-1.1 -83,-0.2 4,-0.3 -0.486 21.5-137.5 -91.6 160.3 -10.7 50.2 -39.0 474 511 A K T 5S+ 0 0 56 -85,-1.6 -1,-0.1 2,-0.2 3,-0.1 0.790 106.7 62.9 -83.7 -31.5 -7.2 51.0 -37.7 475 512 A R T 5S+ 0 0 109 -86,-0.3 -1,-0.1 1,-0.3 -85,-0.1 0.981 107.9 42.9 -52.4 -55.7 -6.0 47.6 -39.1 476 513 A S T 5S- 0 0 64 1,-0.1 -1,-0.3 2,-0.0 -2,-0.2 0.703 99.9-149.3 -62.2 -22.2 -7.0 49.0 -42.5 477 514 A G T 5 + 0 0 59 -4,-0.3 -3,-0.2 1,-0.2 2,-0.2 0.836 35.4 161.7 53.9 37.2 -5.4 52.3 -41.5 478 515 A L < - 0 0 105 -5,-1.1 -1,-0.2 1,-0.1 -2,-0.0 -0.509 53.1 -78.7 -85.2 158.6 -7.8 54.3 -43.7 479 516 A E - 0 0 125 -2,-0.2 -1,-0.1 1,-0.1 -7,-0.1 -0.367 40.3-150.5 -57.9 120.8 -8.4 58.0 -43.2 480 517 A P + 0 0 22 0, 0.0 -87,-0.7 0, 0.0 -8,-0.1 0.907 61.6 105.1 -63.4 -46.4 -10.8 58.4 -40.2 481 518 A T B S-v 393 0G 76 -89,-0.2 2,-0.3 1,-0.1 -87,-0.1 -0.050 73.1-121.8 -40.9 131.3 -12.6 61.7 -41.2 482 519 A V - 0 0 59 -89,-1.9 2,-0.1 1,-0.1 -1,-0.1 -0.587 26.1-165.5 -86.6 140.3 -16.2 60.8 -42.3 483 520 A T 0 0 131 -2,-0.3 -1,-0.1 -89,-0.0 0, 0.0 -0.254 360.0 360.0-105.6-166.5 -17.7 61.7 -45.7 484 521 A G 0 0 127 -2,-0.1 -2,-0.0 0, 0.0 -1,-0.0 -0.419 360.0 360.0 61.9 360.0 -21.3 61.7 -47.1