==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/IMMUNE SYSTEM 30-AUG-99 1QLE . COMPND 2 MOLECULE: CYTOCHROME C OXIDASE POLYPEPTIDE I-BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: PARACOCCUS DENITRIFICANS; . AUTHOR A.HARRENGA,H.MICHEL . 1333 6 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51010.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 969 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 84 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 153 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 537 40.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 25 1.9 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 6 2 0 1 0 1 0 0 1 0 2 0 0 1 0 0 1 0 2 2 0 1 1 1 0 1 9 RESIDUES PER ALPHA HELIX . 4 2 0 2 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 . 9 3 5 0 3 6 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 1 4 0 0 2 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 17 A G 0 0 98 0, 0.0 2,-0.7 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -40.4 88.7 50.5 7.9 2 18 A F >>> - 0 0 148 1,-0.2 2,-2.6 2,-0.1 4,-2.2 -0.266 360.0-146.5 -47.5 91.6 89.5 46.8 8.7 3 19 A F T 345S+ 0 0 107 -2,-0.7 -1,-0.2 1,-0.3 0, 0.0 0.087 95.4 45.7 -59.6 29.5 87.5 45.2 5.8 4 20 A T T 345S+ 0 0 59 -2,-2.6 -1,-0.3 3,-0.1 4,-0.2 0.432 113.6 43.4-138.4 -35.3 86.8 42.2 8.1 5 21 A R T <45S+ 0 0 106 -3,-1.6 -2,-0.2 2,-0.1 6,-0.2 0.737 128.4 26.2 -87.1 -27.8 85.7 43.9 11.3 6 22 A W T <5S+ 0 0 51 -4,-2.2 -3,-0.2 2,-0.1 3,-0.1 0.583 130.2 36.5-113.6 -12.2 83.5 46.6 9.8 7 23 A F S > - 0 0 15 -6,-0.2 4,-0.6 1,-0.1 3,-0.5 -0.880 64.7-147.5 -97.8 119.3 79.3 40.8 16.5 12 28 A H H >> S+ 0 0 1 -2,-0.6 4,-1.7 1,-0.2 3,-0.6 0.826 99.7 53.2 -53.6 -34.8 76.0 42.2 17.7 13 29 A K H 3> S+ 0 0 4 1,-0.2 4,-1.4 511,-0.2 -1,-0.2 0.853 105.6 50.9 -70.8 -36.4 77.9 45.1 19.4 14 30 A D H <> S+ 0 0 13 -3,-0.5 4,-0.9 1,-0.2 -1,-0.2 0.488 109.7 54.0 -80.7 0.8 79.8 46.1 16.3 15 31 A I H X S+ 0 0 7 -4,-1.2 4,-2.8 74,-0.3 3,-1.5 0.938 107.2 51.1 -80.9 -63.9 73.7 51.6 12.8 20 36 A L H 3X S+ 0 0 22 -4,-2.4 4,-1.7 1,-0.3 5,-0.2 0.904 112.7 46.9 -38.1 -58.7 73.9 54.5 15.2 21 37 A F H 3X S+ 0 0 97 -4,-2.0 4,-1.5 1,-0.2 -1,-0.3 0.749 115.1 47.5 -61.4 -24.8 76.6 56.3 13.1 22 38 A T H <> S+ 0 0 27 -3,-1.5 4,-2.5 -5,-0.3 5,-0.4 0.918 108.3 50.9 -81.8 -44.5 74.6 55.6 9.9 23 39 A A H X S+ 0 0 5 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.768 113.6 50.3 -62.2 -22.6 71.2 56.8 11.2 24 40 A G H X S+ 0 0 30 -4,-1.7 4,-2.2 -5,-0.4 -1,-0.2 0.924 110.5 45.9 -79.5 -45.5 73.1 59.9 12.3 25 41 A I H X S+ 0 0 105 -4,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.778 121.6 38.5 -68.4 -30.4 74.8 60.5 8.9 26 42 A V H X S+ 0 0 7 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.829 114.2 54.6 -86.5 -36.8 71.5 60.0 7.1 27 43 A G H X S+ 0 0 6 -4,-1.5 4,-3.3 -5,-0.4 -2,-0.2 0.824 106.2 55.0 -61.9 -32.8 69.5 61.7 9.8 28 44 A L H X S+ 0 0 52 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.972 104.5 50.3 -64.2 -57.6 71.9 64.7 9.2 29 45 A I H >X S+ 0 0 66 -4,-1.2 4,-2.3 1,-0.2 3,-0.8 0.905 116.3 44.5 -49.0 -43.1 71.2 64.9 5.5 30 46 A S H 3X S+ 0 0 0 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.977 109.2 52.6 -68.0 -52.1 67.4 64.9 6.4 31 47 A V H 3< S+ 0 0 38 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.459 111.1 52.6 -64.2 3.3 67.7 67.4 9.2 32 48 A C H XX S+ 0 0 40 -3,-0.8 3,-2.6 -4,-0.6 4,-1.3 0.817 99.5 57.5 -99.1 -49.4 69.5 69.5 6.6 33 49 A F H 3X S+ 0 0 34 -4,-2.3 4,-1.7 1,-0.3 -2,-0.2 0.771 100.1 66.1 -47.7 -30.1 66.7 69.3 4.0 34 50 A T H 3X S+ 0 0 33 -4,-1.4 4,-2.6 2,-0.2 -1,-0.3 0.699 99.4 46.4 -66.9 -30.6 64.6 70.8 6.8 35 51 A V H <> S+ 0 0 22 -3,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.901 110.7 48.8 -82.2 -45.6 66.4 74.1 6.9 36 52 A Y H X S+ 0 0 36 -4,-1.3 4,-1.2 2,-0.2 -2,-0.2 0.925 118.4 46.2 -57.2 -36.4 66.4 74.8 3.2 37 53 A M H >X S+ 0 0 22 -4,-1.7 4,-1.2 -5,-0.3 3,-0.5 0.981 111.8 47.1 -65.0 -59.1 62.7 73.9 3.5 38 54 A R H 3X S+ 0 0 19 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.592 103.8 68.5 -61.4 -10.4 62.0 76.0 6.6 39 55 A M H >X S+ 0 0 40 -4,-1.4 3,-1.1 2,-0.2 4,-0.7 0.969 99.7 43.3 -73.7 -52.8 63.9 78.8 4.8 40 56 A E H << S+ 0 0 2 -4,-1.2 3,-0.4 -3,-0.5 -2,-0.2 0.831 112.1 57.5 -60.4 -31.4 61.2 79.3 2.0 41 57 A L H 3< S+ 0 0 6 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.661 89.9 71.9 -74.3 -23.4 58.5 79.1 4.7 42 58 A Q H << S+ 0 0 28 -3,-1.1 429,-0.3 -4,-0.7 -1,-0.2 0.871 109.4 23.0 -61.8 -44.5 59.9 81.9 6.9 43 59 A H S < S- 0 0 93 -4,-0.7 4,-0.2 -3,-0.4 -1,-0.1 -0.964 92.8-104.3-127.3 143.4 58.8 84.7 4.4 44 60 A P S S+ 0 0 42 0, 0.0 -1,-0.1 0, 0.0 417,-0.1 0.057 77.3 38.1 -55.8 168.8 56.0 84.5 1.7 45 61 A G S S- 0 0 23 417,-0.4 2,-0.9 1,-0.1 -2,-0.1 0.195 97.2 -66.4 71.3 164.7 56.6 84.1 -2.0 46 62 A V + 0 0 20 18,-0.3 18,-0.1 1,-0.2 -1,-0.1 -0.811 64.7 146.0 -91.8 102.3 59.2 82.0 -3.9 47 63 A Q S S+ 0 0 49 -2,-0.9 12,-0.3 -4,-0.2 -1,-0.2 0.830 77.3 18.2 -96.5 -64.7 62.6 83.5 -3.1 48 64 A Y S S+ 0 0 31 1,-0.1 2,-0.7 -12,-0.1 5,-0.1 0.998 114.3 65.1 -69.2 -76.7 65.0 80.5 -3.1 49 65 A M + 0 0 0 5,-0.2 2,-0.4 15,-0.1 18,-0.4 -0.357 68.8 160.0 -57.6 102.2 63.1 77.8 -4.9 50 66 A a > - 0 0 2 -2,-0.7 3,-2.7 16,-0.1 14,-0.1 -0.995 46.3-135.7-130.0 128.1 62.9 79.3 -8.4 51 67 A L T 3 S+ 0 0 107 14,-2.8 3,-0.2 -2,-0.4 -1,-0.1 0.818 107.5 63.1 -51.0 -33.2 62.2 77.3 -11.6 52 68 A E T 3 S- 0 0 99 11,-0.4 -1,-0.3 1,-0.2 2,-0.1 0.788 132.3 -43.2 -62.9 -23.5 65.0 79.3 -13.3 53 69 A G < - 0 0 25 -3,-2.7 -1,-0.2 -5,-0.1 -2,-0.1 -0.458 63.8 -96.4 155.4 128.6 67.3 77.8 -10.8 54 70 A A - 0 0 62 -3,-0.2 2,-0.3 -2,-0.1 -5,-0.2 -0.097 43.0-155.7 -55.2 155.1 67.4 77.0 -7.0 55 71 A R - 0 0 55 1,-0.1 3,-0.1 4,-0.0 -1,-0.1 -0.965 31.1-158.8-139.9 158.0 69.1 79.5 -4.8 56 72 A L S S+ 0 0 121 -2,-0.3 2,-0.3 1,-0.2 -8,-0.1 0.496 88.6 42.6-106.2 -12.8 70.8 79.7 -1.4 57 73 A I S S- 0 0 127 -10,-0.1 -1,-0.2 -9,-0.1 0, 0.0 -1.000 98.2 -92.1-139.8 136.8 70.3 83.5 -1.1 58 74 A A - 0 0 71 -2,-0.3 2,-0.6 1,-0.1 -10,-0.1 -0.167 32.6-153.5 -48.6 129.9 67.2 85.7 -1.9 59 75 A D > + 0 0 26 -12,-0.3 3,-0.8 1,-0.2 5,-0.2 -0.673 22.1 168.6-113.0 78.7 67.3 87.1 -5.5 60 76 A A T 3 S+ 0 0 109 -2,-0.6 -1,-0.2 1,-0.3 4,-0.1 0.804 83.2 43.7 -58.3 -34.2 65.3 90.4 -5.6 61 77 A S T 3 S+ 0 0 134 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.638 103.8 83.1 -87.6 -15.8 66.5 91.3 -9.1 62 78 A A S < S- 0 0 47 -3,-0.8 2,-1.2 1,-0.1 -3,-0.1 -0.598 87.6-106.1 -95.6 154.3 66.0 87.7 -10.5 63 79 A E - 0 0 140 -2,-0.2 2,-1.2 1,-0.1 -11,-0.4 -0.617 34.8-173.3 -77.2 93.2 62.9 86.0 -11.9 64 80 A a - 0 0 26 -2,-1.2 -18,-0.3 -5,-0.2 -15,-0.1 -0.727 7.5-173.8 -95.1 88.1 61.9 83.6 -9.2 65 81 A T - 0 0 46 -2,-1.2 -14,-2.8 1,-0.1 -13,-0.2 -0.673 37.0 -90.1 -82.3 135.9 59.1 81.6 -10.8 66 82 A P - 0 0 44 0, 0.0 2,-0.2 0, 0.0 -16,-0.1 -0.102 41.4-175.5 -48.5 138.3 57.2 79.1 -8.5 67 83 A N > + 0 0 3 -18,-0.4 4,-1.3 1,-0.1 5,-0.1 -0.649 13.3 168.5-139.4 77.3 58.6 75.6 -8.5 68 84 A G H > S+ 0 0 0 1,-0.2 4,-3.4 -2,-0.2 5,-0.2 0.906 72.7 67.2 -57.3 -41.9 56.5 73.2 -6.5 69 85 A H H > S+ 0 0 7 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.903 100.7 44.9 -44.8 -64.0 58.4 70.1 -7.8 70 86 A L H > S+ 0 0 43 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.896 117.5 48.5 -49.0 -43.0 61.7 70.9 -6.1 71 87 A W H X S+ 0 0 2 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.894 110.4 47.9 -65.6 -47.8 59.7 71.7 -2.9 72 88 A N H >X S+ 0 0 9 -4,-3.4 4,-3.7 2,-0.2 3,-1.4 0.992 113.0 51.2 -53.1 -56.0 57.6 68.5 -3.1 73 89 A V H 3X S+ 0 0 4 -4,-2.9 4,-2.7 1,-0.3 5,-0.4 0.902 105.7 53.9 -45.3 -55.4 60.9 66.6 -3.6 74 90 A M H 3< S+ 0 0 18 -4,-2.9 -1,-0.3 -5,-0.2 4,-0.3 0.818 118.3 36.3 -55.6 -31.2 62.5 68.3 -0.6 75 91 A I H S+ 0 0 26 -5,-0.4 4,-1.4 -3,-0.3 -2,-0.2 0.961 114.3 34.4 -68.8 -44.5 62.7 64.6 3.9 79 95 A G H X S+ 0 0 10 -4,-2.4 4,-2.2 2,-0.2 5,-0.4 0.891 107.3 61.9 -75.1 -51.9 60.1 62.1 5.2 80 96 A V H X S+ 0 0 15 -4,-2.3 4,-2.7 -5,-0.3 5,-0.5 0.911 113.1 42.5 -44.5 -40.6 60.9 58.9 3.4 81 97 A L H X S+ 0 0 8 -4,-0.9 4,-1.3 2,-0.2 6,-0.3 0.883 110.2 52.6 -76.4 -43.0 64.3 59.1 5.2 82 98 A M H <>S+ 0 0 34 -4,-1.4 5,-0.8 1,-0.2 -1,-0.2 0.785 125.3 28.8 -62.8 -22.8 63.1 60.1 8.6 83 99 A M H <5S+ 0 0 21 -4,-2.2 -2,-0.2 3,-0.1 -1,-0.2 0.691 131.5 30.0-111.9 -27.0 60.7 57.2 8.5 84 100 A F H <5S+ 0 0 17 -4,-2.7 -3,-0.2 -5,-0.4 -2,-0.1 0.651 133.0 21.2-108.5 -21.5 62.3 54.4 6.3 85 101 A F T <5S+ 0 0 0 -4,-1.3 -3,-0.1 -5,-0.5 -2,-0.1 -0.159 120.5 31.4-144.0 49.8 66.0 55.1 6.9 86 102 A V T >5S+ 0 0 14 -4,-0.2 4,-0.7 -60,-0.1 -4,-0.2 0.362 100.8 49.5-161.0 -57.4 66.8 57.1 10.2 87 103 A V H >>S+ 0 0 18 2,-0.2 4,-5.3 3,-0.2 5,-0.8 0.942 110.0 61.7 -77.0 -51.9 64.5 53.0 13.8 89 105 A P H 45S+ 0 0 13 0, 0.0 5,-0.5 0, 0.0 -2,-0.2 0.876 112.1 44.0 -43.5 -30.8 67.9 52.2 12.5 90 106 A A H <>S+ 0 0 6 -4,-0.7 5,-2.0 3,-0.2 -2,-0.2 0.917 125.3 28.8 -80.1 -45.8 69.0 54.3 15.4 91 107 A L H <5S+ 0 0 0 -4,-1.6 -3,-0.2 3,-0.2 -1,-0.1 0.762 136.7 27.4 -86.7 -25.4 66.7 52.9 18.1 92 108 A F T <5S+ 0 0 10 -4,-5.3 5,-0.3 -5,-0.1 -2,-0.1 0.876 129.1 35.7-100.7 -62.9 66.3 49.5 16.7 93 109 A G T >5S+ 0 0 0 -6,-0.6 2,-2.8 -5,-0.5 4,-1.9 0.798 127.4 31.3 -97.0 -85.1 71.4 50.7 17.3 95 111 A F T 34 S+ 0 0 0 -5,-0.4 4,-1.9 2,-0.1 5,-0.2 0.801 103.9 71.9-123.3 -34.9 72.0 46.3 24.3 100 116 A M H >> S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 3,-0.8 0.955 103.2 48.3 -49.9 -55.8 69.1 43.8 24.2 101 117 A P H >4>S+ 0 0 0 0, 0.0 5,-2.1 0, 0.0 3,-0.7 0.945 113.0 48.4 -52.3 -45.8 71.5 40.8 24.1 102 118 A L H >45S+ 0 0 1 1,-0.2 3,-0.6 3,-0.2 -2,-0.2 0.767 105.4 61.0 -63.5 -26.2 73.5 42.2 27.0 103 119 A H H <<5S+ 0 0 2 -4,-1.9 411,-0.3 -3,-0.8 -1,-0.2 0.843 112.6 34.5 -69.6 -35.0 70.2 42.9 28.9 104 120 A I T <<5S- 0 0 0 -4,-1.5 89,-2.1 -3,-0.7 -1,-0.2 0.129 117.9-106.7-104.5 17.0 69.3 39.2 29.0 105 121 A G T < 5 + 0 0 1 -3,-0.6 -3,-0.2 1,-0.2 3,-0.1 0.981 59.5 168.2 56.8 57.4 72.8 37.9 29.3 106 122 A A < - 0 0 0 -5,-2.1 -1,-0.2 1,-0.2 86,-0.1 -0.914 40.3-146.0-107.8 129.3 73.1 36.6 25.8 107 123 A P S S- 0 0 3 0, 0.0 419,-0.5 0, 0.0 420,-0.4 0.928 79.6 -49.0 -53.2 -40.1 76.5 35.6 24.3 108 124 A D S S- 0 0 16 418,-0.1 2,-0.5 83,-0.1 -97,-0.1 -0.818 75.4 -58.5-167.6-157.9 75.0 36.9 21.1 109 125 A M - 0 0 2 -2,-0.2 6,-0.2 1,-0.1 75,-0.1 -0.952 44.7-114.9-116.0 129.5 72.0 36.8 18.8 110 126 A A S S+ 0 0 19 -2,-0.5 3,-0.2 1,-0.2 -1,-0.1 0.653 107.9 30.4 -21.0 -63.7 70.6 33.7 17.2 111 127 A F > + 0 0 13 1,-0.2 4,-2.1 2,-0.1 -1,-0.2 -0.797 61.2 157.6-111.3 91.5 71.3 34.7 13.6 112 128 A P H > S+ 0 0 9 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.770 78.0 65.0 -79.2 -27.4 74.5 36.9 13.4 113 129 A R H > S+ 0 0 44 1,-0.2 4,-0.5 -3,-0.2 3,-0.2 0.898 113.4 34.7 -52.7 -41.9 74.9 35.9 9.8 114 130 A L H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 3,-0.5 0.814 99.0 76.1 -83.2 -43.5 71.6 37.8 9.4 115 131 A N H < S+ 0 0 2 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.638 105.8 41.9 -48.6 -15.6 72.1 40.6 12.0 116 132 A N H >X S+ 0 0 1 -4,-0.5 4,-2.9 -3,-0.2 3,-0.9 0.744 101.9 60.8-106.5 -32.3 74.3 42.1 9.3 117 133 A L H 3X S+ 0 0 28 -4,-0.5 4,-2.1 -3,-0.5 5,-0.2 0.811 102.9 59.1 -64.1 -22.9 72.5 41.5 6.0 118 134 A S H 3X S+ 0 0 2 -4,-1.9 4,-0.9 2,-0.2 -1,-0.3 0.763 109.7 42.6 -73.2 -26.1 69.9 43.7 7.8 119 135 A Y H <> S+ 0 0 16 -3,-0.9 4,-1.7 -5,-0.3 -2,-0.2 0.871 114.5 46.7 -84.3 -47.8 72.5 46.4 8.0 120 136 A W H X S+ 0 0 20 -4,-2.9 4,-1.3 1,-0.2 -2,-0.2 0.858 115.5 48.0 -64.6 -27.6 74.0 46.0 4.6 121 137 A M H X S+ 0 0 31 -4,-2.1 4,-1.0 -5,-0.3 -1,-0.2 0.877 102.6 62.7 -76.2 -36.9 70.4 46.0 3.2 122 138 A Y H >X S+ 0 0 1 -4,-0.9 4,-1.2 1,-0.2 3,-0.5 0.909 109.0 42.2 -53.0 -40.0 69.6 49.0 5.4 123 139 A V H 3X S+ 0 0 38 -4,-1.7 4,-3.3 1,-0.2 5,-0.3 0.808 101.5 67.6 -78.8 -28.8 72.3 50.9 3.2 124 140 A C H 3X S+ 0 0 4 -4,-1.3 4,-1.5 1,-0.2 -1,-0.2 0.705 105.9 46.5 -61.3 -19.7 71.1 49.3 -0.1 125 141 A G H S- 0 0 6 -2,-0.6 5,-0.8 -74,-0.2 -1,-0.1 0.231 74.2 -83.5-158.9 16.3 54.7 62.5 -4.4 147 163 A G T > 5 - 0 0 1 3,-0.2 3,-2.3 1,-0.1 -71,-0.1 0.299 52.2 -79.2 85.1 144.5 54.7 62.7 -0.6 148 164 A W T 3 5S+ 0 0 35 1,-0.3 -1,-0.1 -73,-0.1 -72,-0.0 0.727 129.7 45.8 -53.4 -29.3 56.3 60.3 1.9 149 165 A V T 3 5S- 0 0 6 -3,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.333 103.2-130.1 -99.5 9.1 53.6 57.6 1.6 150 166 A L T < 5 - 0 0 9 -3,-2.3 -3,-0.2 1,-0.1 -2,-0.1 0.894 26.2-161.2 47.2 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T H 3X S+ 0 0 12 -4,-1.9 4,-1.4 -5,-0.3 -1,-0.3 0.815 104.7 50.0 -62.4 -30.4 54.4 46.3 -5.4 228 244 A M H X S+ 0 0 15 -4,-1.9 4,-1.8 2,-0.2 3,-0.8 0.864 110.6 51.0 -63.3 -45.5 54.8 49.3 -9.7 231 247 A M H >X>S+ 0 0 21 -4,-1.4 4,-2.8 1,-0.2 3,-1.3 0.996 112.0 42.6 -58.5 -65.9 52.6 47.0 -11.6 232 248 A D H 3<5S+ 0 0 9 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.382 121.5 48.6 -65.4 12.1 49.9 49.5 -12.6 233 249 A R H <45S+ 0 0 27 -3,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.577 123.7 23.6-122.4 -23.5 52.8 51.7 -13.3 234 250 A N H <<5S+ 0 0 11 -4,-1.8 -2,-0.2 -3,-1.3 -3,-0.2 0.385 134.3 32.3-125.3 -0.3 55.1 49.5 -15.4 235 251 A F T <5S- 0 0 108 -4,-2.8 -3,-0.2 -5,-0.2 758,-0.2 0.246 100.1-119.3-137.8 8.5 52.7 47.0 -16.8 236 252 A G < + 0 0 41 -5,-0.5 -4,-0.2 1,-0.2 -5,-0.1 0.724 53.6 166.5 57.5 24.9 49.6 49.1 -17.2 237 253 A T - 0 0 1 -6,-0.7 2,-1.1 756,-0.2 3,-0.3 -0.302 43.4-114.0 -67.4 155.0 47.6 46.9 -14.8 238 254 A Q S S+ 0 0 35 757,-0.5 761,-0.3 1,-0.2 762,-0.3 -0.780 70.1 120.9 -96.5 93.3 44.3 48.1 -13.4 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265 A V H 3> S+ 0 0 11 1,-0.2 4,-0.8 2,-0.2 5,-0.1 0.755 91.2 65.8 -73.4 -20.8 41.3 54.6 -1.2 250 266 A L H <> S+ 0 0 5 -3,-1.0 4,-2.4 1,-0.2 3,-0.3 0.822 97.6 53.0 -65.0 -38.2 42.2 50.9 -1.1 251 267 A Y H > S+ 0 0 0 -4,-0.5 4,-2.9 -3,-0.3 5,-0.3 0.869 105.3 54.6 -65.7 -36.8 45.8 51.7 -1.4 252 268 A Q H X S+ 0 0 1 -4,-0.9 4,-1.5 1,-0.2 -1,-0.2 0.731 110.9 46.5 -67.9 -23.5 45.5 54.1 1.6 253 269 A H H X S+ 0 0 34 -4,-0.8 4,-0.5 -3,-0.3 -2,-0.2 0.887 114.8 44.3 -80.6 -48.5 44.0 51.2 3.6 254 270 A I H >< S+ 0 0 0 -4,-2.4 3,-0.8 2,-0.2 4,-0.5 0.964 121.7 40.7 -58.5 -52.5 46.6 48.7 2.7 255 271 A L H >X S+ 0 0 5 -4,-2.9 4,-2.5 1,-0.3 3,-1.9 0.939 115.1 48.9 -62.3 -55.6 49.3 51.3 3.2 256 272 A W H 3X S+ 0 0 20 -4,-1.5 4,-0.9 -5,-0.3 -1,-0.3 0.506 97.6 71.7 -67.5 -3.7 47.9 52.8 6.3 257 273 A F H << S+ 0 0 27 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.726 114.1 27.1 -78.5 -23.5 47.5 49.3 7.7 258 274 A F H <> S+ 0 0 2 -3,-1.9 4,-2.1 -4,-0.5 -2,-0.2 0.652 112.2 73.9-100.7 -33.9 51.3 49.3 8.0 259 275 A G H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -3,-0.2 0.764 100.8 39.1 -55.2 -39.2 51.5 53.1 8.4 260 276 A H H X S+ 0 0 10 -4,-0.9 4,-0.7 2,-0.2 -1,-0.2 0.886 108.6 58.5 -81.1 -43.9 50.1 53.2 11.9 261 277 A P H >> S+ 0 0 1 0, 0.0 4,-1.4 0, 0.0 3,-1.4 0.933 102.6 64.7 -44.7 -39.9 52.0 50.1 13.2 262 278 A E H >X S+ 0 0 13 -4,-2.1 3,-2.4 1,-0.3 4,-1.7 0.916 93.9 50.5 -44.6 -75.9 55.0 52.2 12.1 263 279 A V H 3X S+ 0 0 51 -4,-1.0 4,-1.3 1,-0.3 -1,-0.3 0.599 114.2 49.0 -48.7 -11.4 54.8 55.2 14.5 264 280 A Y H S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.915 109.9 58.9 -62.5 -33.8 61.9 51.4 21.8 270 286 A G H X S+ 0 0 0 -4,-0.7 4,-2.0 -3,-0.3 -2,-0.2 0.854 101.5 53.8 -60.3 -36.0 62.0 55.0 23.0 271 287 A F H X S+ 0 0 1 -4,-1.9 4,-1.0 -3,-0.3 -1,-0.2 0.906 105.9 53.2 -64.8 -42.5 59.8 54.1 25.9 272 288 A G H X S+ 0 0 1 -4,-1.5 4,-1.4 2,-0.2 3,-0.4 0.899 109.2 46.9 -59.4 -46.3 62.2 51.3 27.0 273 289 A I H >X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 3,-0.7 0.994 109.5 54.7 -57.6 -56.7 65.3 53.5 27.1 274 290 A I H 3X S+ 0 0 0 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.696 102.8 60.9 -49.4 -25.4 63.3 56.2 29.1 275 291 A S H 3X S+ 0 0 2 -4,-1.0 4,-1.7 -3,-0.4 -1,-0.2 0.973 109.0 36.5 -73.6 -49.9 62.5 53.5 31.6 276 292 A H H S+ 0 0 15 -4,-1.7 5,-2.5 -3,-0.4 4,-0.4 0.904 114.8 51.0 -67.8 -36.0 65.2 54.4 37.5 280 296 A T H ><5S+ 0 0 4 -4,-2.9 3,-1.4 3,-0.2 230,-0.2 0.993 117.1 31.8 -60.9 -73.1 68.9 55.1 37.4 281 297 A F H 3<5S+ 0 0 2 -4,-1.7 71,-2.3 1,-0.3 -1,-0.2 0.808 117.8 55.1 -60.9 -35.1 69.2 58.8 37.9 282 298 A A T 3<5S- 0 0 0 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.646 106.4-133.9 -73.8 -10.7 66.2 59.0 40.1 283 299 A K T < 5S+ 0 0 22 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.938 70.6 97.9 56.2 52.3 68.0 56.4 42.2 284 300 A K S - 0 0 2 323,-3.8 4,-1.1 -2,-0.2 -1,-0.2 0.951 69.3-174.4 47.5 83.5 54.9 48.8 38.7 289 305 A Y H > S+ 0 0 54 -3,-0.3 4,-1.0 2,-0.2 -2,-0.1 0.897 77.5 51.2 -73.0 -45.7 56.9 46.5 36.4 290 306 A L H >> S+ 0 0 83 1,-0.2 4,-1.8 2,-0.2 3,-1.0 0.954 110.8 47.3 -59.7 -51.2 54.1 44.1 35.4 291 307 A P H 3> S+ 0 0 43 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.895 108.3 58.9 -57.0 -36.6 51.6 46.8 34.3 292 308 A M H 3X S+ 0 0 0 -4,-1.1 4,-0.7 1,-0.2 -2,-0.2 0.728 108.3 43.0 -65.4 -27.1 54.4 48.5 32.4 293 309 A V H < S+ 0 0 115 -4,-2.5 3,-2.5 1,-0.2 4,-0.3 0.934 116.5 54.4 -59.0 -54.5 48.0 44.9 19.6 302 318 A L H >< S+ 0 0 45 -4,-2.9 3,-1.1 1,-0.3 -1,-0.2 0.736 97.7 67.6 -52.9 -27.8 45.7 47.9 19.8 303 319 A G T 3< S+ 0 0 0 -4,-1.3 3,-0.4 -3,-0.5 -1,-0.3 0.565 92.7 59.3 -72.7 -8.5 47.9 49.6 17.2 304 320 A F T < S+ 0 0 35 -3,-2.5 -1,-0.2 1,-0.2 3,-0.2 0.524 104.3 50.0 -95.4 -8.8 46.8 47.2 14.5 305 321 A V S < S+ 0 0 60 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.1 -0.304 100.8 57.8-126.8 46.3 43.2 48.0 14.8 306 322 A V > + 0 0 0 -3,-0.4 3,-0.8 21,-0.1 -1,-0.1 0.069 62.0 121.8-159.8 29.2 43.1 51.9 14.6 307 323 A W G > + 0 0 35 1,-0.2 3,-0.5 -3,-0.2 -49,-0.1 0.527 54.5 76.0 -81.2 -6.7 44.7 52.6 11.2 308 324 A A G > + 0 0 0 1,-0.2 3,-2.9 2,-0.1 -1,-0.2 0.520 61.8 92.8 -87.3 -1.6 41.9 54.6 9.5 309 325 A H G < S+ 0 0 32 -3,-0.8 -1,-0.2 1,-0.3 3,-0.1 0.394 82.1 66.0 -66.4 5.4 42.3 57.9 11.3 310 326 A H G < S+ 0 0 47 -3,-0.5 -1,-0.3 1,-0.1 -2,-0.1 0.402 106.1 39.5-101.9 -6.2 44.6 58.6 8.3 311 327 A M X > + 0 0 2 -3,-2.9 3,-1.6 1,-0.1 5,-0.6 0.025 69.9 125.1-135.0 29.2 41.6 58.5 6.0 312 328 A Y G >>5S+ 0 0 1 1,-0.3 3,-0.6 2,-0.1 4,-0.5 0.954 89.9 32.5 -55.9 -50.5 38.7 60.2 7.8 313 329 A T G 345S+ 0 0 1 1,-0.2 419,-2.3 2,-0.1 -1,-0.3 0.131 96.1 98.4 -94.4 25.2 38.1 62.6 4.9 314 330 A A G <45S- 0 0 2 -3,-1.6 -1,-0.2 417,-0.1 -2,-0.1 0.734 114.3 -79.0 -81.4 -27.9 39.2 60.1 2.3 315 331 A G T <45S+ 0 0 25 -3,-0.6 2,-0.4 -4,-0.4 -2,-0.1 0.403 80.4 156.0 129.8 19.4 35.8 58.9 1.3 316 332 A M << - 0 0 11 -5,-0.6 -1,-0.2 -4,-0.5 5,-0.0 -0.679 41.8-119.6 -76.9 129.7 35.3 56.7 4.3 317 333 A S > - 0 0 50 -2,-0.4 4,-2.1 1,-0.1 5,-0.2 -0.032 25.3-103.7 -63.1 169.7 31.7 56.1 5.2 318 334 A L H > S+ 0 0 27 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.929 117.4 54.3 -66.9 -46.1 30.2 57.0 8.5 319 335 A T H > S+ 0 0 83 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.850 109.6 50.7 -61.2 -28.2 30.1 53.5 10.1 320 336 A Q H >> S+ 0 0 70 2,-0.2 4,-2.0 1,-0.2 3,-0.7 0.993 113.6 42.6 -68.0 -57.1 33.8 53.2 9.3 321 337 A Q H 3X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.3 5,-0.3 0.855 108.4 60.6 -55.0 -42.5 34.7 56.6 10.9 322 338 A A H 3X S+ 0 0 14 -4,-3.3 4,-1.0 -5,-0.2 -1,-0.3 0.930 114.1 37.5 -52.9 -41.7 32.4 55.8 13.8 323 339 A Y H XX S+ 0 0 103 -4,-1.4 4,-2.0 -3,-0.7 3,-1.2 0.998 115.7 45.9 -71.6 -74.4 34.6 52.8 14.5 324 340 A F H 3X S+ 0 0 23 -4,-2.0 4,-1.4 1,-0.3 -15,-0.2 0.748 110.3 57.6 -42.0 -34.1 38.2 54.0 13.8 325 341 A M H 3X S+ 0 0 0 -4,-2.1 4,-0.6 -5,-0.3 -1,-0.3 0.928 111.3 42.7 -64.6 -44.1 37.5 57.1 15.8 326 342 A L H XX S+ 0 0 72 -3,-1.2 3,-1.2 -4,-1.0 4,-0.9 0.950 110.2 52.3 -68.8 -52.9 36.5 55.0 18.8 327 343 A A H >X S+ 0 0 13 -4,-2.0 3,-2.0 1,-0.3 4,-1.0 0.944 105.2 55.5 -50.8 -53.1 39.3 52.4 18.7 328 344 A T H 3X S+ 0 0 16 -4,-1.4 4,-0.5 1,-0.3 -1,-0.3 0.749 98.7 63.8 -55.7 -22.2 42.1 55.0 18.6 329 345 A M H X< S+ 0 0 10 -3,-1.2 3,-1.0 -4,-0.6 -1,-0.3 0.893 97.3 57.1 -69.3 -35.8 40.7 56.5 21.7 330 346 A T H X< S+ 0 0 65 -3,-2.0 3,-2.8 -4,-0.9 -1,-0.2 0.869 91.7 67.8 -60.8 -44.2 41.5 53.2 23.6 331 347 A I H 3X S+ 0 0 10 -4,-1.0 4,-1.1 1,-0.3 -1,-0.2 0.760 90.8 66.1 -49.0 -29.1 45.2 53.3 22.7 332 348 A A H S+ 0 0 25 -3,-2.8 3,-0.8 -4,-0.2 4,-0.8 0.994 101.6 38.2 -64.8 -63.2 44.7 54.3 28.1 334 350 A P H >> S+ 0 0 10 0, 0.0 4,-1.9 0, 0.0 3,-1.8 0.923 111.0 60.0 -54.5 -45.8 47.8 52.2 28.4 335 351 A T H 3X S+ 0 0 25 -4,-1.1 4,-1.9 1,-0.3 -2,-0.2 0.845 102.1 55.6 -51.9 -33.6 50.1 55.0 27.3 336 352 A G H < S+ 0 0 0 -4,-1.8 3,-1.1 -5,-0.2 4,-0.3 0.924 110.7 43.4 -62.6 -48.9 57.2 56.9 35.0 343 359 A I H >X S+ 0 0 7 -4,-1.8 3,-1.4 1,-0.3 4,-1.1 0.821 106.5 63.3 -67.9 -27.3 56.4 59.9 37.3 344 360 A A T 3< S+ 0 0 13 -4,-1.6 4,-0.3 1,-0.3 -1,-0.3 0.629 97.5 58.1 -71.0 -12.8 55.5 57.3 40.0 345 361 A T T <4 S+ 0 0 0 -3,-1.1 -1,-0.3 -4,-0.4 4,-0.2 0.567 105.3 49.1 -92.0 -8.6 59.2 56.2 39.8 346 362 A M T X4 S+ 0 0 0 -3,-1.4 3,-0.7 -4,-0.3 -2,-0.2 0.686 89.0 80.0-101.3 -20.5 60.4 59.7 40.7 347 363 A W T 3< S+ 0 0 111 -4,-1.1 -1,-0.1 1,-0.2 -2,-0.1 0.787 81.1 69.8 -57.4 -31.1 58.1 60.3 43.7 348 364 A G T 3 S- 0 0 6 -4,-0.3 260,-0.9 1,-0.2 -1,-0.2 0.925 102.7-124.8 -54.1 -52.4 60.5 58.2 45.9 349 365 A G S < S+ 0 0 0 -3,-0.7 -1,-0.2 -4,-0.2 251,-0.2 -0.741 71.3 90.6 134.3 178.4 63.3 60.9 45.8 350 366 A S - 0 0 0 250,-0.3 2,-0.8 -2,-0.2 250,-0.3 0.964 44.3-176.7 56.3 71.8 66.9 61.6 45.0 351 367 A I B -b 600 0B 1 248,-1.1 2,-1.4 244,-0.2 250,-0.7 -0.840 14.4-158.1-101.3 108.4 66.9 62.8 41.4 352 368 A E - 0 0 38 -71,-2.3 2,-3.5 -2,-0.8 5,-0.2 -0.685 14.3-147.5 -85.2 92.5 70.4 63.5 40.1 353 369 A F + 0 0 52 -2,-1.4 -1,-0.1 4,-0.1 -2,-0.0 -0.219 39.7 151.6 -61.9 64.1 69.6 65.8 37.2 354 370 A K - 0 0 53 -2,-3.5 4,-0.2 1,-0.0 -3,-0.0 0.077 63.0 -84.0 -75.3-161.1 72.4 64.8 34.9 355 371 A T S >> S+ 0 0 0 2,-0.2 3,-2.1 1,-0.2 4,-2.0 0.940 126.3 50.5 -77.7 -49.2 71.9 65.0 31.1 356 372 A P H 3> S+ 0 0 0 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.777 107.9 58.5 -59.8 -20.9 70.2 61.7 30.3 357 373 A M H 3> S+ 0 0 0 -5,-0.2 4,-1.2 2,-0.2 -2,-0.2 0.621 105.8 48.9 -81.0 -14.9 67.8 62.7 33.1 358 374 A L H <> S+ 0 0 17 -3,-2.1 4,-3.8 -4,-0.2 5,-0.2 0.924 106.4 52.4 -87.3 -51.0 66.9 65.9 31.3 359 375 A W H X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 -2,-0.2 0.811 115.2 44.7 -51.6 -36.5 66.2 64.4 27.9 360 376 A A H X S+ 0 0 0 -4,-1.1 4,-4.0 -5,-0.2 -1,-0.2 0.962 113.3 47.6 -72.2 -54.2 63.8 62.0 29.6 361 377 A F H X S+ 0 0 13 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.884 117.0 47.3 -52.0 -39.2 62.2 64.6 31.7 362 378 A G H X S+ 0 0 3 -4,-3.8 4,-2.8 2,-0.2 3,-0.4 0.971 111.7 46.8 -65.7 -56.2 62.0 66.6 28.5 363 379 A F H X S+ 0 0 0 -4,-3.1 4,-2.2 43,-0.2 5,-0.3 0.919 109.0 58.7 -50.5 -46.5 60.6 63.7 26.5 364 380 A L H X S+ 0 0 3 -4,-4.0 4,-1.6 2,-0.2 -1,-0.2 0.885 115.7 32.7 -49.6 -50.9 58.1 63.1 29.3 365 381 A F H X S+ 0 0 59 -4,-1.7 4,-1.8 -3,-0.4 5,-0.2 0.990 121.2 47.6 -70.1 -64.3 56.7 66.6 29.0 366 382 A L H X S+ 0 0 1 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.578 113.4 50.8 -55.2 -18.1 57.2 67.1 25.2 367 383 A F H X S+ 0 0 19 -4,-2.2 4,-3.2 -5,-0.3 5,-0.3 0.902 104.5 54.0 -86.1 -49.0 55.6 63.6 24.6 368 384 A T H X S+ 0 0 19 -4,-1.6 4,-2.4 -5,-0.3 5,-0.2 0.914 110.7 48.7 -47.9 -50.7 52.4 64.2 26.8 369 385 A V H X S+ 0 0 17 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.942 114.3 45.8 -55.5 -48.6 51.7 67.3 24.8 370 386 A G H < S+ 0 0 0 -4,-0.8 4,-0.3 28,-0.3 -2,-0.2 0.866 113.7 47.2 -66.2 -38.7 52.2 65.5 21.5 371 387 A G H X S+ 0 0 31 -4,-3.2 4,-1.0 1,-0.2 3,-0.4 0.819 108.6 55.8 -71.7 -32.4 50.2 62.4 22.5 372 388 A V H X S+ 0 0 23 -4,-2.4 4,-1.4 -5,-0.3 -1,-0.2 0.806 103.4 53.4 -69.0 -34.2 47.4 64.6 23.8 373 389 A T H X S+ 0 0 7 -4,-1.5 4,-1.7 1,-0.2 -1,-0.3 0.594 102.3 62.4 -74.4 -12.2 47.1 66.4 20.4 374 390 A G H > S+ 0 0 23 -3,-0.4 4,-0.8 -4,-0.3 -2,-0.2 0.832 100.2 50.2 -76.4 -37.2 46.8 62.9 19.0 375 391 A V H X S+ 0 0 23 -4,-1.0 4,-1.1 2,-0.2 3,-0.4 0.904 107.9 56.8 -64.6 -40.7 43.6 62.3 21.0 376 392 A V H >< S+ 0 0 0 -4,-1.4 3,-0.8 1,-0.3 7,-0.2 0.948 110.5 40.6 -54.5 -57.4 42.4 65.6 19.5 377 393 A L H 3< S+ 0 0 16 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.629 100.0 77.3 -69.8 -13.1 42.9 64.5 16.0 378 394 A S H 3< S+ 0 0 4 -4,-0.8 2,-0.6 -3,-0.4 -1,-0.2 0.939 77.8 81.6 -59.6 -45.4 41.4 61.1 17.0 379 395 A Q S XX S- 0 0 0 -4,-1.1 4,-2.7 -3,-0.8 3,-0.8 -0.495 77.3-148.0 -64.3 104.5 37.9 62.6 16.9 380 396 A A H 3> S+ 0 0 0 -2,-0.6 4,-1.7 1,-0.2 -1,-0.1 0.873 93.2 56.1 -43.3 -56.5 36.8 62.6 13.2 381 397 A P H 34 S+ 0 0 7 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.868 114.2 40.5 -46.2 -46.6 34.7 65.8 13.5 382 398 A L H X4 S+ 0 0 0 -3,-0.8 3,-1.4 1,-0.2 4,-0.4 0.907 111.2 58.6 -68.3 -40.6 37.7 67.8 14.8 383 399 A D H >X S+ 0 0 9 -4,-2.7 4,-2.8 1,-0.3 3,-0.8 0.726 88.6 74.5 -63.9 -20.5 40.0 66.0 12.4 384 400 A R T 3< S+ 0 0 14 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.793 102.5 39.5 -64.5 -28.2 37.9 67.3 9.4 385 401 A V T <4 S+ 0 0 10 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.484 118.8 49.4 -97.6 -4.0 39.4 70.8 9.8 386 402 A Y T <4 S+ 0 0 0 -3,-0.8 3,-0.5 -4,-0.4 6,-0.4 0.756 76.2 114.9-101.8 -34.6 42.8 69.5 10.6 387 403 A H S < S+ 0 0 22 -4,-2.8 3,-0.1 1,-0.2 70,-0.0 -0.115 91.1 8.3 -44.8 122.1 43.4 67.0 7.8 388 404 A D S S+ 0 0 4 1,-0.3 69,-0.7 68,-0.1 2,-0.3 0.951 107.0 116.2 68.0 48.5 46.3 68.3 5.7 389 405 A T B >> S-C 456 0C 1 -3,-0.5 3,-1.9 67,-0.3 4,-1.4 -0.977 80.2-105.5-141.3 157.8 47.2 71.2 8.0 390 406 A Y T 34 S+ 0 0 13 65,-1.5 61,-0.1 -2,-0.3 57,-0.1 0.606 111.6 75.1 -61.0 -10.5 50.3 72.1 10.2 391 407 A Y T >4 S+ 0 0 15 64,-0.3 3,-0.7 -5,-0.2 4,-0.3 0.893 103.2 40.2 -66.9 -37.8 48.4 71.1 13.3 392 408 A V G X> S+ 0 0 21 -3,-1.9 3,-2.4 -6,-0.4 4,-2.2 0.974 113.9 52.5 -67.7 -53.4 49.0 67.6 12.2 393 409 A V G 3< S+ 0 0 18 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.243 113.1 47.2 -67.9 12.5 52.6 68.5 11.1 394 410 A A G <4 S+ 0 0 0 -3,-0.7 4,-0.5 -5,-0.2 -1,-0.3 0.359 108.8 53.4-128.1 -11.2 52.9 69.9 14.6 395 411 A H T <> S+ 0 0 39 -3,-2.4 4,-1.2 -4,-0.3 -2,-0.2 0.840 108.8 45.5 -90.3 -48.1 51.5 66.9 16.4 396 412 A F H X S+ 0 0 48 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.674 110.2 55.0 -74.0 -19.2 53.7 64.3 15.0 397 413 A H H 4>S+ 0 0 24 -5,-0.3 5,-1.5 3,-0.2 6,-0.4 0.892 103.9 53.9 -79.6 -38.5 56.9 66.3 15.4 398 414 A Y H 45S+ 0 0 3 -4,-0.5 -28,-0.3 1,-0.2 -2,-0.2 0.854 118.8 36.8 -61.1 -32.4 56.2 66.7 19.1 399 415 A V H <>S+ 0 0 24 -4,-1.2 5,-2.3 -29,-0.2 -2,-0.2 0.873 133.2 24.9 -86.3 -41.4 55.9 62.9 19.3 400 416 A M T ><>S+ 0 0 33 -4,-2.5 5,-2.3 3,-0.2 3,-1.8 0.892 133.2 28.0 -82.4 -85.4 58.7 62.1 16.8 401 417 A S T 3 5S+ 0 0 31 -5,-0.3 -3,-0.2 1,-0.3 -4,-0.1 0.517 135.2 34.2 -57.3 -8.5 61.2 64.9 16.6 402 418 A L T 3 5S+ 0 0 0 -3,-1.8 4,-0.9 -6,-0.4 -3,-0.2 0.542 125.0 37.3-127.6 -68.8 59.8 62.7 21.8 404 420 A A H > S+ 0 0 0 -6,-0.5 4,-1.3 1,-0.2 -1,-0.2 0.705 106.6 52.7 -65.1 -20.5 64.4 63.0 22.7 407 423 A G H X S+ 0 0 0 -4,-0.9 4,-1.0 -3,-0.5 -2,-0.2 0.887 102.2 56.0 -79.8 -44.2 64.6 59.4 23.6 408 424 A I H >X S+ 0 0 23 -4,-1.9 4,-2.6 2,-0.2 3,-1.4 0.959 109.6 46.1 -51.1 -56.0 67.6 58.6 21.4 409 425 A F H 3X S+ 0 0 10 -4,-1.9 4,-2.5 1,-0.3 5,-0.4 0.953 103.0 61.8 -54.1 -55.5 69.7 61.3 23.2 410 426 A A H 3< S+ 0 0 0 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.770 114.2 39.9 -43.3 -25.4 68.6 60.2 26.7 411 427 A G H XX S+ 0 0 0 -3,-1.4 4,-3.0 -4,-1.0 3,-1.8 0.913 107.2 57.0 -89.9 -51.4 70.3 57.0 25.6 412 428 A V H 3< S+ 0 0 24 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.799 114.5 43.5 -52.4 -27.1 73.4 58.2 23.7 413 429 A Y T 3< S+ 0 0 5 -4,-2.5 -1,-0.3 -5,-0.2 4,-0.2 0.624 114.1 50.1 -92.8 -12.8 74.3 60.1 26.9 414 430 A Y T <4 S+ 0 0 2 -3,-1.8 -2,-0.2 -5,-0.4 -3,-0.1 0.748 125.8 25.8 -92.7 -27.7 73.4 57.1 29.1 415 431 A W S X S+ 0 0 0 -4,-3.0 4,-0.9 2,-0.1 -2,-0.2 -0.131 92.1 94.8-128.0 31.7 75.5 54.7 27.0 416 432 A I H > S+ 0 0 18 2,-0.2 4,-1.3 -5,-0.1 6,-0.3 0.819 89.5 49.7 -87.4 -34.4 78.2 56.9 25.4 417 433 A G H > S+ 0 0 0 -4,-0.2 4,-0.7 1,-0.2 84,-0.1 0.851 116.5 40.7 -70.3 -35.0 80.6 56.1 28.2 418 434 A K H 4 S+ 0 0 0 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.857 107.7 60.1 -84.8 -32.0 80.0 52.4 27.9 419 435 A M H < S+ 0 0 23 -4,-0.9 -2,-0.2 1,-0.2 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