==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ENDOCYTOSIS/EXOCYTOSIS 17-SEP-02 1MQS . COMPND 2 MOLECULE: SLY1 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR A.BRACHER,W.WEISSENHORN . 614 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27574.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 2.4 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 36 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 244 39.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.6 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 4 3 1 0 2 1 2 2 3 0 0 0 2 0 1 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 1 2 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 PARALLEL BRIDGES PER LADDER . 2 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 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 10 A K 0 0 160 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 70.8 37.5 66.1 61.8 2 11 A D - 0 0 141 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.948 360.0-125.8-113.6 131.8 36.2 68.7 59.3 3 12 A I - 0 0 72 -2,-0.5 2,-0.1 1,-0.1 0, 0.0 -0.552 17.3-144.8 -80.3 132.6 36.6 68.3 55.6 4 13 A S > - 0 0 12 -2,-0.3 4,-1.8 1,-0.1 156,-0.2 -0.397 30.3-105.4 -87.2 168.0 38.2 71.0 53.4 5 14 A L H > S+ 0 0 0 154,-0.9 4,-1.7 1,-0.2 155,-0.2 0.893 123.9 52.3 -61.4 -39.0 37.2 71.9 49.9 6 15 A R H > S+ 0 0 15 153,-1.9 4,-2.9 1,-0.2 5,-0.2 0.893 104.9 54.7 -64.8 -38.1 40.3 70.1 48.7 7 16 A D H > S+ 0 0 64 152,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.894 107.5 51.7 -63.2 -35.8 39.4 67.0 50.6 8 17 A X H X S+ 0 0 23 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.864 111.6 44.9 -69.2 -36.9 36.1 66.9 48.9 9 18 A Q H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.898 112.4 51.6 -72.3 -41.7 37.6 67.2 45.5 10 19 A I H X S+ 0 0 22 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.888 110.4 50.3 -61.6 -36.3 40.2 64.6 46.3 11 20 A S H X S+ 0 0 46 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.919 111.4 46.8 -68.1 -43.1 37.5 62.3 47.5 12 21 A A H X S+ 0 0 13 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.921 114.3 48.5 -62.9 -45.7 35.5 62.8 44.3 13 22 A I H X S+ 0 0 2 -4,-3.1 4,-1.5 1,-0.2 -2,-0.2 0.888 112.7 47.9 -61.5 -41.6 38.6 62.2 42.2 14 23 A L H X S+ 0 0 28 -4,-2.4 4,-0.6 -5,-0.2 -2,-0.2 0.895 106.2 56.9 -67.1 -39.3 39.4 59.1 44.2 15 24 A K H ><>S+ 0 0 75 -4,-2.5 5,-1.1 1,-0.2 6,-0.6 0.857 107.1 50.7 -62.4 -32.2 35.9 57.7 43.9 16 25 A X H ><5S+ 0 0 2 -4,-1.4 3,-1.5 1,-0.2 -1,-0.2 0.860 101.5 58.8 -73.5 -36.1 36.3 58.0 40.2 17 26 A L H 3<5S+ 0 0 0 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.591 100.3 61.3 -69.3 -7.2 39.6 56.1 40.2 18 27 A F T X<5S- 0 0 27 -4,-0.6 3,-1.4 -3,-0.5 -1,-0.3 -0.021 132.1 -93.8-107.3 31.6 37.6 53.3 41.8 19 28 A L T < 5S- 0 0 39 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.2 0.832 74.0 -66.6 60.1 36.1 35.4 53.1 38.7 20 29 A N T > S+ 0 0 74 1,-0.2 3,-1.0 2,-0.1 -1,-0.2 0.318 89.7 126.4 48.9 -4.7 30.7 52.7 46.1 23 32 A L T < + 0 0 29 -3,-0.7 -1,-0.2 1,-0.3 3,-0.1 -0.576 65.1 28.6 -79.2 139.0 28.2 54.7 43.9 24 33 A N T 3 S+ 0 0 114 1,-0.3 -1,-0.3 -2,-0.2 2,-0.2 0.581 121.5 57.8 82.9 15.4 24.6 53.5 44.1 25 34 A N S < S- 0 0 123 -3,-1.0 -1,-0.3 -4,-0.1 2,-0.2 -0.874 85.3 -61.4-156.7-170.7 25.2 52.2 47.6 26 35 A N + 0 0 137 -2,-0.2 2,-0.1 -3,-0.1 -4,-0.1 -0.561 57.2 104.8 -92.5 150.7 26.2 52.8 51.3 27 36 A D - 0 0 92 -2,-0.2 2,-0.3 2,-0.0 -2,-0.1 -0.235 29.9-167.3 146.3 124.7 29.4 54.0 53.0 28 37 A N + 0 0 159 -2,-0.1 2,-0.3 2,-0.0 -2,-0.0 -0.738 44.4 120.0-130.8 82.7 30.6 57.2 54.7 29 38 A I - 0 0 57 -2,-0.3 2,-0.2 4,-0.0 3,-0.1 -0.676 51.4-140.8-127.5 176.5 34.3 57.0 55.2 30 39 A T S S+ 0 0 82 1,-0.3 -19,-0.0 -2,-0.3 -2,-0.0 -0.723 78.9 11.9-153.6 94.7 36.7 59.5 53.7 31 40 A T S S- 0 0 107 -2,-0.2 -1,-0.3 -20,-0.1 -20,-0.0 0.818 97.3-104.4 94.8 86.0 40.0 58.1 52.3 32 41 A I - 0 0 71 -3,-0.1 2,-0.0 1,-0.1 5,-0.0 -0.012 25.8-127.2 -39.1 121.5 39.7 54.3 52.3 33 42 A T >> - 0 0 71 1,-0.1 4,-1.5 2,-0.0 3,-0.8 -0.391 23.5-119.8 -68.7 151.8 41.5 52.2 54.9 34 43 A D H 3> S+ 0 0 90 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.819 109.1 63.3 -64.7 -34.8 43.8 49.5 53.4 35 44 A D H 34 S+ 0 0 103 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.779 108.5 43.7 -60.5 -27.6 42.0 46.6 55.1 36 45 A I H X> S+ 0 0 51 -3,-0.8 3,-2.5 2,-0.2 4,-1.2 0.807 103.9 61.0 -84.6 -38.4 38.9 47.6 53.1 37 46 A F H 3X S+ 0 0 35 -4,-1.5 4,-1.6 1,-0.3 5,-0.4 0.887 105.2 52.2 -55.0 -35.2 40.8 48.1 49.9 38 47 A N H 3< S+ 0 0 117 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.499 97.2 69.6 -77.3 -5.9 41.6 44.4 50.4 39 48 A Q H <4 S+ 0 0 141 -3,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.865 113.0 25.3 -80.2 -39.3 37.8 43.8 50.8 40 49 A Q H < S- 0 0 137 -4,-1.2 -2,-0.2 -3,-0.4 -3,-0.1 0.669 102.9-140.3 -93.8 -21.0 37.1 44.5 47.1 41 50 A E < - 0 0 69 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.2 0.938 22.3-136.1 58.1 96.5 40.7 43.5 46.0 42 51 A I - 0 0 55 -5,-0.4 2,-0.3 1,-0.0 -1,-0.1 -0.616 11.9-145.2 -96.7 149.4 41.6 46.0 43.4 43 52 A I - 0 0 91 -2,-0.3 -1,-0.0 1,-0.1 44,-0.0 -0.766 29.4 -93.8-106.7 147.7 43.3 45.7 40.0 44 53 A W - 0 0 143 -2,-0.3 2,-0.3 27,-0.1 27,-0.2 -0.279 43.0-173.7 -61.2 139.0 45.6 47.9 38.1 45 54 A K E -a 71 0A 2 25,-2.5 27,-2.1 42,-0.1 28,-0.8 -0.934 26.0-117.9-135.5 156.8 44.2 50.4 35.6 46 55 A V E -ab 73 89A 7 42,-3.1 44,-2.2 -2,-0.3 2,-0.5 -0.667 27.0-151.9 -87.2 146.5 45.5 52.8 33.0 47 56 A L E -ab 74 90A 0 26,-2.2 28,-1.6 -2,-0.3 2,-0.6 -0.966 5.9-162.2-125.5 116.0 44.6 56.4 33.6 48 57 A I E +ab 75 91A 0 42,-2.6 44,-3.1 -2,-0.5 28,-0.2 -0.872 16.7 169.5-101.6 121.8 44.2 58.7 30.6 49 58 A L E -a 76 0A 3 26,-2.0 28,-1.8 -2,-0.6 2,-0.3 -0.591 20.9-141.3-116.2 178.0 44.3 62.5 31.4 50 59 A D > - 0 0 7 42,-0.4 4,-3.0 26,-0.3 5,-0.3 -0.873 40.1 -86.2-133.7 167.1 44.6 65.5 29.1 51 60 A I H > S+ 0 0 126 -2,-0.3 4,-1.6 1,-0.2 3,-0.1 0.898 126.5 40.5 -40.3 -60.9 46.4 68.7 29.6 52 61 A K H > S+ 0 0 114 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.898 117.1 47.8 -60.2 -43.0 43.7 70.5 31.5 53 62 A S H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 3,-0.5 0.843 105.7 57.6 -70.9 -31.0 42.7 67.5 33.6 54 63 A T H X S+ 0 0 38 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.915 102.5 56.5 -63.0 -39.1 46.3 66.6 34.6 55 64 A A H < S+ 0 0 38 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.792 107.0 50.4 -60.7 -28.0 46.5 70.1 36.0 56 65 A T H < S+ 0 0 5 -4,-0.8 4,-0.4 -3,-0.5 100,-0.3 0.865 115.9 39.0 -78.5 -38.5 43.5 69.3 38.2 57 66 A I H >X S+ 0 0 8 -4,-1.8 4,-2.8 1,-0.2 3,-1.9 0.951 108.3 57.8 -75.7 -53.1 44.9 66.0 39.5 58 67 A S T 3< S+ 0 0 60 -4,-2.7 -1,-0.2 1,-0.3 -3,-0.1 0.538 101.3 63.3 -57.4 -5.8 48.6 66.9 40.0 59 68 A S T 34 S+ 0 0 3 -3,-0.3 -1,-0.3 -5,-0.2 -2,-0.2 0.755 119.4 17.5 -90.3 -27.7 47.3 69.7 42.3 60 69 A V T <4 S+ 0 0 5 -3,-1.9 2,-0.4 -4,-0.4 -2,-0.2 0.552 120.0 57.7-120.1 -13.6 45.7 67.4 44.9 61 70 A L < - 0 0 11 -4,-2.8 2,-0.2 -5,-0.1 -1,-0.1 -0.956 61.5-148.4-126.9 142.1 47.3 64.0 44.3 62 71 A R >> - 0 0 28 -2,-0.4 4,-1.6 1,-0.1 3,-0.9 -0.641 35.7-106.6 -99.3 160.5 50.9 62.7 44.3 63 72 A V H 3> S+ 0 0 95 1,-0.3 4,-1.9 -2,-0.2 5,-0.2 0.845 121.5 57.5 -54.9 -35.5 52.0 59.8 42.1 64 73 A N H 3> S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.844 102.6 54.5 -64.6 -33.5 52.2 57.6 45.2 65 74 A D H <> S+ 0 0 74 -3,-0.9 4,-0.6 2,-0.2 -1,-0.2 0.907 105.6 53.4 -66.6 -40.4 48.5 58.3 45.8 66 75 A L H ><>S+ 0 0 10 -4,-1.6 5,-2.4 2,-0.2 3,-1.1 0.933 110.4 44.8 -58.7 -52.9 47.6 57.1 42.3 67 76 A L H ><5S+ 0 0 78 -4,-1.9 3,-3.0 1,-0.3 -2,-0.2 0.953 108.2 58.0 -54.4 -52.6 49.4 53.7 42.6 68 77 A K H 3<5S+ 0 0 108 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.703 107.4 50.0 -50.6 -21.8 47.8 53.3 46.1 69 78 A A T <<5S- 0 0 3 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.414 128.8 -96.9 -98.3 -3.3 44.4 53.7 44.1 70 79 A G T < 5S+ 0 0 3 -3,-3.0 -25,-2.5 -4,-0.3 2,-0.8 0.621 76.0 142.4 97.7 15.1 45.3 51.1 41.5 71 80 A I E < +a 45 0A 2 -5,-2.4 -1,-0.3 -27,-0.2 -25,-0.2 -0.810 21.1 176.2 -94.3 112.9 46.6 53.4 38.8 72 81 A T E + 0 0 72 -27,-2.1 2,-0.3 -2,-0.8 -1,-0.2 0.940 66.9 4.3 -76.5 -52.7 49.6 51.8 37.0 73 82 A V E -a 46 0A 69 -28,-0.8 -26,-2.2 -7,-0.1 2,-0.4 -0.926 57.7-164.3-134.3 156.1 50.2 54.3 34.4 74 83 A H E +a 47 0A 88 -2,-0.3 2,-0.3 -28,-0.2 -26,-0.2 -0.990 18.4 161.3-141.5 137.4 48.8 57.6 33.4 75 84 A S E -a 48 0A 20 -28,-1.6 -26,-2.0 -2,-0.4 2,-0.1 -0.974 40.5 -92.4-150.8 159.3 49.3 59.4 30.0 76 85 A L E > -a 49 0A 46 -2,-0.3 3,-0.9 -28,-0.2 -26,-0.3 -0.429 30.7-122.5 -76.3 149.1 47.8 62.1 28.0 77 86 A I T 3 S+ 0 0 9 -28,-1.8 4,-0.2 1,-0.2 -27,-0.1 0.892 111.3 52.9 -56.1 -40.3 45.0 61.4 25.4 78 87 A K T 3 S+ 0 0 134 2,-0.1 -1,-0.2 0, 0.0 -28,-0.1 0.659 89.1 93.8 -73.7 -17.1 47.2 63.0 22.7 79 88 A Q S < S- 0 0 103 -3,-0.9 2,-1.0 1,-0.1 -4,-0.0 -0.193 90.5 -98.6 -69.8 167.4 50.4 61.0 23.2 80 89 A D - 0 0 174 2,-0.0 2,-0.6 1,-0.0 -1,-0.1 -0.790 49.3-163.4 -85.9 108.1 51.3 57.8 21.3 81 90 A R - 0 0 16 -2,-1.0 3,-0.1 -4,-0.2 -6,-0.0 -0.864 15.3-128.5-106.4 121.2 50.2 55.3 23.9 82 91 A S - 0 0 93 -2,-0.6 -2,-0.0 1,-0.1 -1,-0.0 -0.367 40.0 -96.9 -61.6 133.2 51.4 51.7 23.6 83 92 A P - 0 0 79 0, 0.0 29,-0.2 0, 0.0 28,-0.1 -0.028 34.0-179.2 -53.2 151.1 48.5 49.1 23.8 84 93 A L E > + c 0 112A 68 27,-3.0 3,-2.7 3,-0.1 29,-0.7 -0.456 10.3 174.4-149.0 59.8 47.4 47.3 27.0 85 94 A P E 3 S+ 0 0 60 0, 0.0 27,-0.2 0, 0.0 26,-0.0 0.666 77.8 46.1 -46.0 -25.3 44.6 45.2 25.6 86 95 A D E 3 S+ 0 0 146 25,-0.1 26,-0.1 26,-0.1 25,-0.1 0.296 97.5 85.4-107.7 12.2 44.1 43.3 28.8 87 96 A V E < S- 0 0 32 -3,-2.7 26,-2.0 24,-0.2 27,-0.7 -0.878 77.6-116.1-113.5 144.1 44.2 46.3 31.2 88 97 A P E - c 0 114A 17 0, 0.0 -42,-3.1 0, 0.0 2,-0.4 -0.326 26.8-147.9 -72.5 157.9 41.2 48.6 32.2 89 98 A A E -bc 46 115A 0 25,-0.6 27,-1.7 -44,-0.2 2,-0.6 -0.992 12.2-166.9-134.6 133.6 41.2 52.2 31.2 90 99 A I E -bc 47 116A 0 -44,-2.2 -42,-2.6 -2,-0.4 2,-0.5 -0.975 12.7-160.4-116.7 114.1 39.8 55.3 33.1 91 100 A Y E +bc 48 117A 1 25,-2.4 27,-2.1 -2,-0.6 2,-0.5 -0.818 12.7 180.0 -96.5 132.8 39.7 58.4 30.9 92 101 A F E + c 0 118A 1 -44,-3.1 -42,-0.4 -2,-0.5 2,-0.3 -0.834 33.8 142.5-131.2 92.0 39.3 61.6 32.8 93 102 A V E - c 0 119A 1 25,-1.9 27,-2.5 -2,-0.5 28,-0.2 -0.878 54.3 -85.3-135.7 163.3 39.3 64.1 30.0 94 103 A S - 0 0 15 -2,-0.3 2,-2.3 25,-0.2 5,-0.2 -0.384 47.5-107.0 -68.5 143.8 37.8 67.4 28.8 95 104 A P S S+ 0 0 28 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.442 70.6 140.8 -71.1 74.1 34.4 67.2 26.9 96 105 A T > - 0 0 61 -2,-2.3 4,-2.8 1,-0.1 5,-0.2 -0.918 65.4-127.9-126.6 150.3 35.8 68.0 23.5 97 106 A K H > S+ 0 0 86 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.935 113.0 55.4 -52.1 -48.9 35.3 66.8 19.9 98 107 A E H > S+ 0 0 92 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.923 111.7 40.6 -49.8 -55.2 39.0 66.1 19.8 99 108 A N H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.925 112.2 54.1 -63.4 -48.8 39.1 63.9 22.8 100 109 A I H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.925 106.7 53.6 -51.5 -48.1 35.9 62.0 22.0 101 110 A D H X S+ 0 0 45 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.926 109.6 47.8 -52.3 -50.4 37.3 61.2 18.6 102 111 A I H X S+ 0 0 33 -4,-1.8 4,-3.0 2,-0.2 -1,-0.2 0.809 107.7 54.1 -62.8 -33.3 40.4 59.7 20.2 103 112 A I H X S+ 0 0 1 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.953 111.1 47.9 -65.2 -44.8 38.3 57.7 22.7 104 113 A V H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.878 112.6 48.4 -61.5 -39.3 36.5 56.3 19.6 105 114 A N H X S+ 0 0 84 -4,-2.4 4,-2.8 -5,-0.2 -1,-0.2 0.907 114.6 44.1 -67.6 -40.5 39.9 55.6 18.0 106 115 A D H X>S+ 0 0 7 -4,-3.0 5,-1.9 2,-0.2 4,-1.2 0.865 110.4 56.8 -71.2 -34.8 41.3 53.9 21.1 107 116 A L H <5S+ 0 0 0 -4,-3.1 3,-0.2 -5,-0.2 -2,-0.2 0.931 114.7 37.3 -59.5 -47.0 38.0 52.0 21.4 108 117 A K H <5S+ 0 0 90 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.981 111.6 57.9 -65.6 -61.9 38.3 50.6 17.9 109 118 A S H <5S- 0 0 70 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.680 105.9-130.8 -39.3 -27.3 42.1 50.2 18.1 110 119 A D T <5 + 0 0 56 -4,-1.2 -3,-0.2 -3,-0.2 -1,-0.1 0.851 50.0 158.0 70.2 37.6 41.4 47.9 21.2 111 120 A K < + 0 0 31 -5,-1.9 -27,-3.0 -28,-0.1 2,-0.3 0.794 63.0 22.9 -62.6 -29.9 44.0 49.8 23.2 112 121 A Y E S-c 84 0A 5 -6,-0.4 -26,-0.1 -27,-0.2 -23,-0.1 -0.945 74.4-121.1-138.5 157.3 42.5 48.7 26.5 113 122 A S E S+ 0 0 27 -26,-2.0 2,-0.3 -29,-0.7 -27,-0.1 0.752 95.4 3.7 -66.7 -27.2 40.2 45.9 27.8 114 123 A E E -c 88 0A 54 -27,-0.7 -25,-0.6 30,-0.0 2,-0.4 -0.967 65.8-133.4-153.4 166.7 37.6 48.4 29.0 115 124 A F E -cd 89 144A 0 28,-2.0 30,-1.9 -2,-0.3 31,-1.1 -0.995 11.3-176.0-133.9 133.3 36.7 52.0 29.0 116 125 A Y E -cd 90 146A 23 -27,-1.7 -25,-2.4 -2,-0.4 2,-0.6 -0.874 21.6-158.9-124.8 90.1 35.5 54.2 31.9 117 126 A I E +cd 91 147A 1 29,-2.2 31,-2.7 -2,-0.5 2,-0.5 -0.617 14.2 177.4 -80.3 120.0 34.9 57.5 30.3 118 127 A N E -cd 92 148A 0 -27,-2.1 -25,-1.9 -2,-0.6 2,-0.4 -0.960 17.1-146.6-126.5 115.9 34.9 60.3 32.8 119 128 A F E -cd 93 149A 0 29,-3.8 31,-2.7 -2,-0.5 32,-0.5 -0.684 11.3-137.9 -90.2 134.5 34.5 63.9 31.7 120 129 A T S S- 0 0 4 -27,-2.5 32,-2.7 -2,-0.4 -26,-0.2 0.904 92.0 -3.2 -49.8 -54.2 36.2 66.7 33.4 121 130 A S S S- 0 0 24 30,-0.2 30,-1.8 -28,-0.2 2,-0.3 0.634 118.8 -48.1-106.7 -94.9 33.2 69.1 33.4 122 131 A S - 0 0 38 27,-0.1 -2,-0.1 28,-0.1 27,-0.1 -0.959 44.3-127.1-152.1 131.0 30.1 67.9 31.6 123 132 A L - 0 0 1 -2,-0.3 2,-0.1 -4,-0.1 26,-0.1 -0.623 28.8-129.6 -78.4 127.4 29.6 66.3 28.2 124 133 A P >> - 0 0 53 0, 0.0 4,-2.2 0, 0.0 3,-0.9 -0.490 17.6-119.8 -75.1 146.7 26.9 68.1 26.0 125 134 A R H 3> S+ 0 0 105 1,-0.3 4,-2.9 2,-0.2 5,-0.4 0.907 115.5 68.6 -49.6 -41.0 24.1 66.0 24.4 126 135 A N H 3> S+ 0 0 116 1,-0.3 4,-1.1 2,-0.2 -1,-0.3 0.896 110.2 29.5 -40.3 -54.9 25.6 67.4 21.3 127 136 A L H <> S+ 0 0 14 -3,-0.9 4,-2.7 2,-0.2 -1,-0.3 0.707 112.2 64.0 -84.2 -23.1 28.8 65.4 21.8 128 137 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.945 108.0 43.9 -63.5 -47.1 27.1 62.4 23.7 129 138 A E H X S+ 0 0 64 -4,-2.9 4,-3.3 2,-0.2 5,-0.2 0.894 112.9 53.9 -62.4 -41.9 25.2 61.7 20.5 130 139 A D H X S+ 0 0 38 -4,-1.1 4,-2.3 -5,-0.4 5,-0.3 0.991 112.1 41.2 -54.3 -70.2 28.3 62.2 18.5 131 140 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.841 116.0 53.5 -46.3 -41.4 30.4 59.7 20.5 132 141 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.969 107.2 48.6 -61.4 -55.5 27.4 57.4 20.5 133 142 A Q H X S+ 0 0 89 -4,-3.3 4,-1.1 1,-0.2 -2,-0.2 0.918 114.1 46.9 -50.9 -51.7 26.9 57.4 16.7 134 143 A Q H >< S+ 0 0 33 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.943 114.1 46.7 -56.7 -50.8 30.6 56.7 16.1 135 144 A V H >< S+ 0 0 0 -4,-2.4 3,-2.0 -5,-0.3 6,-0.3 0.849 101.9 67.8 -61.9 -33.0 30.6 53.9 18.7 136 145 A S H 3< S+ 0 0 8 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.859 97.0 51.4 -54.6 -42.8 27.4 52.4 17.3 137 146 A I T << S+ 0 0 115 -4,-1.1 2,-0.3 -3,-0.6 -1,-0.3 0.267 97.1 84.9 -81.2 9.1 29.1 51.4 14.0 138 147 A T S X S- 0 0 16 -3,-2.0 3,-0.6 1,-0.1 -30,-0.0 -0.786 80.9-136.4-103.4 151.2 31.8 49.6 16.0 139 148 A G T 3 S+ 0 0 77 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 0.303 96.7 72.7 -91.0 15.0 31.0 46.1 17.1 140 149 A K T > + 0 0 66 -5,-0.3 3,-2.3 1,-0.1 4,-0.3 0.151 45.0 116.5-116.1 19.8 32.5 47.2 20.5 141 150 A S G X S+ 0 0 27 -3,-0.6 3,-1.2 -6,-0.3 -1,-0.1 0.804 74.3 71.3 -56.2 -26.0 30.0 49.6 22.1 142 151 A D G 3 S+ 0 0 116 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.729 85.0 65.2 -62.0 -23.5 29.9 46.8 24.8 143 152 A K G < S+ 0 0 41 -3,-2.3 -28,-2.0 -29,-0.1 2,-1.1 0.643 77.2 89.8 -78.6 -14.2 33.5 47.7 26.0 144 153 A I E < -d 115 0A 1 -3,-1.2 -28,-0.2 -4,-0.3 3,-0.1 -0.749 55.1-179.2 -86.6 99.8 32.5 51.2 27.3 145 154 A K E - 0 0 78 -30,-1.9 2,-0.3 -2,-1.1 -29,-0.2 0.767 60.6 -6.4 -73.3 -29.6 31.5 50.3 30.9 146 155 A Q E -d 116 0A 27 -31,-1.1 -29,-2.2 -3,-0.1 2,-0.4 -0.932 46.4-158.1-169.4 146.0 30.5 53.9 31.9 147 156 A V E +d 117 0A 0 -2,-0.3 457,-2.1 -31,-0.2 458,-0.4 -0.995 25.3 179.5-127.4 123.1 30.5 57.5 30.9 148 157 A Y E -dE 118 603A 12 -31,-2.7 -29,-3.8 -2,-0.4 2,-0.8 -0.976 31.5-142.4-129.6 140.4 30.3 60.1 33.6 149 158 A D E -d 119 0A 2 453,-2.4 -29,-0.1 -2,-0.4 -27,-0.1 -0.893 25.4-173.5 -94.3 115.0 30.2 63.9 33.9 150 159 A Q - 0 0 2 -31,-2.7 -30,-0.2 -2,-0.8 -29,-0.1 0.681 19.4-143.2 -89.6 -16.8 32.3 64.4 37.0 151 160 A Y + 0 0 28 -30,-1.8 -30,-0.2 -32,-0.5 -31,-0.1 0.950 56.9 129.3 50.2 59.2 31.9 68.2 37.5 152 161 A L + 0 0 0 -32,-2.7 2,-1.7 -33,-0.2 -31,-0.2 -0.212 18.2 143.9-130.0 40.4 35.5 68.7 38.7 153 162 A D + 0 0 45 39,-0.1 2,-0.3 40,-0.1 43,-0.1 -0.439 49.9 65.3 -84.8 66.4 36.3 71.6 36.5 154 163 A F S S- 0 0 4 -2,-1.7 2,-0.4 42,-0.1 10,-0.2 -0.963 74.3-114.6-171.9 162.0 38.5 73.7 38.8 155 164 A I E -F 163 0B 14 8,-2.3 8,-2.3 -2,-0.3 2,-0.8 -0.918 14.6-152.1-111.4 133.7 41.8 73.5 40.7 156 165 A V E +F 162 0B 0 -2,-0.4 6,-0.2 -100,-0.3 413,-0.0 -0.871 19.2 173.9-107.3 100.2 42.1 73.5 44.4 157 166 A T + 0 0 17 4,-0.9 -1,-0.2 -2,-0.8 5,-0.1 0.980 66.8 10.6 -66.4 -66.1 45.4 75.1 45.4 158 167 A E S > S- 0 0 6 3,-0.5 3,-1.1 131,-0.1 -152,-0.1 -0.589 104.0 -78.4-107.3 175.1 45.3 75.3 49.2 159 168 A P T 3 S+ 0 0 39 0, 0.0 -153,-1.9 0, 0.0 -154,-0.9 0.739 129.5 13.4 -46.6 -31.7 42.7 73.6 51.4 160 169 A E T 3 S+ 0 0 16 -155,-0.2 408,-2.3 -156,-0.2 2,-0.5 0.184 105.0 99.3-134.9 18.1 40.1 76.3 50.7 161 170 A L E < + g 0 568B 0 -3,-1.1 -4,-0.9 406,-0.2 -3,-0.5 -0.924 46.0 173.2-108.9 127.4 41.5 78.2 47.7 162 171 A F E -Fg 156 569B 0 406,-1.7 408,-1.2 -2,-0.5 2,-0.3 -0.939 13.4-161.5-134.9 157.3 40.2 77.3 44.3 163 172 A S E -Fg 155 570B 1 -8,-2.3 -8,-2.3 -2,-0.3 408,-0.2 -0.991 23.1-149.6-138.7 145.9 40.6 78.7 40.8 164 173 A L - 0 0 13 406,-1.5 408,-0.2 -2,-0.3 407,-0.2 0.419 42.7-129.9 -90.7 2.3 38.7 78.4 37.5 165 174 A E + 0 0 109 405,-0.3 2,-0.9 1,-0.2 407,-0.2 0.836 60.6 143.2 53.9 33.7 42.0 78.9 35.7 166 175 A I - 0 0 41 405,-3.5 -1,-0.2 404,-0.1 -2,-0.1 -0.731 37.8-159.2-106.0 80.3 40.4 81.6 33.6 167 176 A S + 0 0 83 -2,-0.9 405,-0.0 1,-0.2 376,-0.0 -0.135 61.9 20.5 -61.1 153.2 43.3 84.0 33.3 168 177 A N S > S+ 0 0 50 3,-0.1 4,-0.8 1,-0.1 -1,-0.2 0.976 72.6 144.3 50.6 68.6 43.0 87.7 32.4 169 178 A A H > + 0 0 1 2,-0.2 4,-2.8 373,-0.1 5,-0.2 0.807 63.7 57.1-101.5 -39.8 39.3 88.1 33.4 170 179 A Y H > S+ 0 0 3 372,-0.4 4,-1.2 2,-0.2 5,-0.1 0.895 113.2 44.6 -58.2 -38.9 39.3 91.6 34.8 171 180 A L H >> S+ 0 0 17 2,-0.2 4,-2.6 1,-0.2 3,-1.2 0.988 111.9 49.0 -66.1 -64.3 40.8 92.7 31.4 172 181 A T H 3< S+ 0 0 42 -4,-0.8 -2,-0.2 1,-0.3 -1,-0.2 0.841 115.0 47.6 -44.5 -40.7 38.4 90.7 29.2 173 182 A L H 3< S+ 0 0 16 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.731 121.8 31.2 -78.0 -25.6 35.5 92.0 31.2 174 183 A N H << S+ 0 0 54 -4,-1.2 -2,-0.2 -3,-1.2 -1,-0.2 0.488 85.3 113.8-111.8 -5.9 36.3 95.7 31.2 175 184 A D < - 0 0 30 -4,-2.6 3,-0.2 1,-0.2 411,-0.1 -0.553 61.4-145.3 -67.2 123.5 38.2 96.1 27.9 176 185 A P S S+ 0 0 85 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.811 98.1 62.1 -59.6 -30.0 35.9 98.3 25.8 177 186 A K S S+ 0 0 77 -3,-0.0 -5,-0.1 2,-0.0 -2,-0.0 0.956 78.9 104.1 -60.6 -54.4 37.1 96.3 22.8 178 187 A T S S- 0 0 21 -3,-0.2 -5,-0.0 -7,-0.1 -6,-0.0 0.111 78.0-111.2 -33.6 132.5 35.6 93.0 24.1 179 188 A T > - 0 0 71 1,-0.1 4,-1.0 4,-0.0 -1,-0.1 -0.053 14.2-121.7 -62.4 167.6 32.3 92.0 22.4 180 189 A E T 4 S+ 0 0 88 2,-0.2 4,-0.5 1,-0.1 -1,-0.1 0.391 119.9 49.6 -89.2 1.2 29.0 92.0 24.1 181 190 A E T > S+ 0 0 63 2,-0.2 4,-2.6 3,-0.1 5,-0.2 0.779 102.8 54.4-103.6 -44.5 29.1 88.3 23.1 182 191 A E H > S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.896 110.2 51.6 -57.0 -40.6 32.6 87.5 24.4 183 192 A I H X S+ 0 0 44 -4,-1.0 4,-2.8 2,-0.2 5,-0.3 0.953 108.4 47.9 -62.2 -52.7 31.4 88.8 27.7 184 193 A T H > S+ 0 0 69 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.906 113.0 50.2 -56.8 -40.8 28.3 86.7 27.9 185 194 A G H X S+ 0 0 36 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.893 110.5 49.2 -63.7 -41.7 30.3 83.7 27.0 186 195 A L H >X S+ 0 0 17 -4,-2.3 4,-2.5 2,-0.2 3,-0.6 0.967 111.0 48.9 -61.1 -56.4 32.9 84.4 29.7 187 196 A C H 3X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.3 5,-0.2 0.910 107.6 56.4 -49.9 -45.6 30.2 84.8 32.3 188 197 A A H 3X S+ 0 0 27 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.3 0.870 108.7 46.7 -55.8 -40.0 28.6 81.6 31.2 189 198 A N H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.3 3,-1.0 0.958 111.6 51.6 -51.5 -56.7 31.0 77.8 40.2 195 204 A F H 3X S+ 0 0 18 -4,-2.3 4,-2.3 1,-0.3 -1,-0.3 0.877 107.5 54.1 -47.6 -43.7 28.3 75.3 39.4 196 205 A N H 3X S+ 0 0 6 -4,-3.1 4,-0.9 2,-0.2 -1,-0.3 0.860 112.5 43.8 -58.4 -39.5 31.1 72.7 39.2 197 206 A T H XX S+ 0 0 0 -4,-2.0 4,-1.8 -3,-1.0 3,-1.2 0.974 110.3 53.8 -68.1 -60.6 32.3 73.8 42.7 198 207 A V H 3X>S+ 0 0 0 -4,-2.9 4,-1.2 1,-0.3 5,-1.0 0.854 107.2 51.2 -42.0 -47.5 28.8 73.9 44.2 199 208 A L H 3<5S+ 0 0 4 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.841 106.7 55.0 -63.6 -32.8 28.0 70.4 43.1 200 209 A T H <<5S+ 0 0 12 -3,-1.2 -1,-0.2 -4,-0.9 -2,-0.2 0.887 106.2 51.3 -65.9 -38.6 31.2 69.2 44.7 201 210 A I H <5S- 0 0 15 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.745 100.9-141.4 -66.9 -27.1 30.1 70.8 48.0 202 211 A N T <5 + 0 0 73 -4,-1.2 2,-0.3 -5,-0.3 -3,-0.2 0.925 64.7 110.0 59.3 48.5 26.8 68.9 47.7 203 212 A S < - 0 0 24 -5,-1.0 -1,-0.2 392,-0.1 392,-0.2 -0.963 65.9-139.6-150.9 128.3 24.9 71.9 49.1 204 213 A I - 0 0 13 390,-0.5 35,-0.2 -2,-0.3 314,-0.1 -0.791 36.4-161.8 -94.4 97.2 22.6 74.2 47.2 205 214 A P - 0 0 5 0, 0.0 2,-0.5 0, 0.0 35,-0.3 -0.055 23.5-103.4 -73.6 169.6 23.6 77.7 48.6 206 215 A I E -h 240 0B 0 33,-1.8 35,-3.4 310,-0.1 2,-0.5 -0.823 39.0-132.8 -91.2 132.7 21.9 81.0 48.6 207 216 A I E +hI 241 515B 0 308,-3.0 308,-2.3 -2,-0.5 2,-0.4 -0.765 27.5 178.4 -90.7 131.7 23.5 83.2 46.0 208 217 A R E +hI 242 514B 10 33,-2.8 35,-3.0 -2,-0.5 2,-0.3 -1.000 10.2 164.5-131.8 130.4 24.4 86.7 47.2 209 218 A A E -hI 243 513B 0 304,-1.7 304,-1.6 -2,-0.4 2,-0.2 -0.999 42.1-102.7-151.6 148.6 26.2 89.1 44.8 210 219 A A - 0 0 19 33,-1.3 3,-0.3 -2,-0.3 6,-0.3 -0.486 46.9-126.7 -67.7 131.8 27.0 92.8 44.3 211 220 A K S S+ 0 0 124 300,-0.3 2,-0.4 -2,-0.2 4,-0.1 -0.288 76.7 42.3 -78.3 164.6 24.7 94.3 41.8 212 221 A G S S+ 0 0 72 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 -0.291 101.7 49.6 100.2 -50.2 25.6 96.3 38.6 213 222 A G S >> S- 0 0 21 -2,-0.4 3,-1.3 -3,-0.3 4,-1.2 -0.209 104.4 -56.8-110.1-158.9 28.5 94.3 37.1 214 223 A P H 3> S+ 0 0 20 0, 0.0 4,-2.8 0, 0.0 5,-0.4 0.875 121.4 64.9 -44.1 -54.7 29.7 90.8 36.1 215 224 A A H 3> S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -4,-0.1 0.819 103.5 48.7 -43.8 -39.7 29.2 89.3 39.5 216 225 A E H <> S+ 0 0 51 -3,-1.3 4,-3.6 -6,-0.3 5,-0.3 0.966 110.2 48.7 -67.5 -52.8 25.5 89.9 39.1 217 226 A I H X S+ 0 0 67 -4,-1.2 4,-2.7 1,-0.3 -2,-0.2 0.940 115.5 45.3 -48.9 -54.6 25.2 88.3 35.6 218 227 A I H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 -1,-0.3 0.860 112.7 52.6 -58.9 -38.3 27.2 85.3 36.8 219 228 A A H X S+ 0 0 0 -4,-1.8 4,-1.9 -5,-0.4 -2,-0.2 0.953 112.7 41.9 -65.8 -48.7 25.0 85.2 39.9 220 229 A E H X S+ 0 0 62 -4,-3.6 4,-2.1 2,-0.2 -2,-0.2 0.856 115.3 52.3 -67.6 -32.3 21.8 85.2 38.0 221 230 A K H X S+ 0 0 60 -4,-2.7 4,-2.1 -5,-0.3 -2,-0.2 0.970 113.5 42.1 -65.0 -55.0 23.3 82.8 35.5 222 231 A L H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.783 110.6 60.1 -60.8 -27.5 24.3 80.4 38.3 223 232 A G H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.943 107.3 44.0 -65.5 -47.7 20.9 81.1 39.9 224 233 A T H X S+ 0 0 72 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.865 113.2 51.4 -64.0 -40.1 19.1 79.7 36.9 225 234 A K H X S+ 0 0 57 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.951 114.3 42.5 -62.8 -51.2 21.4 76.7 36.6 226 235 A L H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.775 110.3 58.7 -66.2 -30.4 21.0 75.7 40.2 227 236 A R H X S+ 0 0 34 -4,-1.9 4,-1.7 -5,-0.2 3,-0.5 0.978 108.5 43.2 -65.2 -53.6 17.2 76.4 40.0 228 237 A D H X S+ 0 0 79 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.900 109.5 58.5 -57.4 -43.1 16.8 73.8 37.1 229 238 A F H < S+ 0 0 15 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.882 107.3 46.8 -53.9 -40.1 19.0 71.4 38.9 230 239 A V H X S+ 0 0 36 -4,-1.6 4,-0.9 -3,-0.5 3,-0.4 0.841 115.8 46.4 -71.4 -33.7 16.6 71.5 42.0 231 240 A I H >< S+ 0 0 86 -4,-1.7 2,-4.3 1,-0.2 3,-0.8 0.987 102.2 60.8 -70.1 -61.7 13.6 71.1 39.7 232 241 A N T 3< S+ 0 0 125 -4,-3.1 -1,-0.2 1,-0.2 3,-0.1 -0.105 103.0 58.8 -63.9 46.1 14.9 68.2 37.5 233 242 A T T 34 S+ 0 0 62 -2,-4.3 2,-0.4 -3,-0.4 -1,-0.2 0.404 114.0 16.3-135.1 -59.7 15.1 66.2 40.8 234 243 A N << 0 0 136 -4,-0.9 -1,-0.3 -3,-0.8 0, 0.0 -0.988 360.0 360.0-131.1 134.6 11.6 66.2 42.1 235 244 A S 0 0 169 -2,-0.4 -3,-0.1 -3,-0.1 -4,-0.0 -0.613 360.0 360.0 162.1 360.0 8.2 67.0 40.4 236 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 237 257 A E 0 0 154 0, 0.0 2,-0.3 0, 0.0 296,-0.1 0.000 360.0 360.0 360.0-125.1 22.1 74.8 58.5 238 258 A R - 0 0 53 294,-0.3 296,-0.9 -35,-0.0 297,-0.4 -0.764 360.0-119.6-120.6 167.9 22.4 76.0 54.9 239 259 A G - 0 0 2 -2,-0.3 -33,-1.8 -35,-0.2 2,-0.4 -0.713 13.5-146.3-111.2 161.4 25.2 77.5 52.9 240 260 A V E -hj 206 536B 1 295,-1.4 297,-2.4 -35,-0.3 2,-0.5 -0.958 1.4-156.0-126.7 143.8 25.8 80.8 51.1 241 261 A L E -hj 207 537B 0 -35,-3.4 -33,-2.8 -2,-0.4 2,-0.6 -0.966 12.8-162.4-119.6 112.9 27.7 81.6 47.9 242 262 A I E -hj 208 538B 0 295,-2.7 297,-2.7 -2,-0.5 2,-0.6 -0.879 1.9-164.5-102.2 115.6 28.8 85.2 47.8 243 263 A I E -hj 209 539B 0 -35,-3.0 -33,-1.3 -2,-0.6 2,-0.3 -0.870 14.7-180.0-103.0 112.7 29.8 86.5 44.3 244 264 A L E - j 0 540B 0 295,-3.0 297,-3.9 -2,-0.6 2,-0.4 -0.781 28.4-120.7-114.3 157.8 31.8 89.7 44.2 245 265 A D E > - j 0 541B 15 -2,-0.3 3,-2.5 295,-0.2 297,-0.2 -0.730 25.7-125.8 -90.9 137.9 33.3 92.0 41.6 246 266 A R G > S+ 0 0 0 295,-1.7 3,-1.7 -2,-0.4 -1,-0.1 0.714 104.6 81.2 -56.1 -17.1 37.1 92.5 41.9 247 267 A N G 3 S+ 0 0 27 1,-0.3 3,-0.4 294,-0.2 -1,-0.3 0.703 70.4 82.3 -61.1 -20.9 36.2 96.2 41.9 248 268 A I G < S- 0 0 20 -3,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.674 112.0 -0.7 -60.5 -19.7 35.4 95.8 45.6 249 269 A D < + 0 0 3 -3,-1.7 -1,-0.2 -4,-0.1 3,-0.2 -0.349 56.7 163.4-175.4 84.9 39.0 96.2 46.6 250 270 A F S >> S+ 0 0 0 -3,-0.4 3,-2.8 190,-0.2 4,-0.8 0.847 73.4 75.8 -75.8 -34.7 42.0 96.7 44.2 251 271 A A H >> S+ 0 0 6 1,-0.3 4,-2.3 2,-0.2 3,-1.5 0.887 93.5 55.6 -42.0 -44.1 44.4 97.9 47.0 252 272 A S H 34 S+ 0 0 4 1,-0.3 -1,-0.3 -3,-0.2 295,-0.2 0.650 94.5 65.7 -65.9 -18.9 44.7 94.2 48.1 253 273 A X H <4 S+ 0 0 0 -3,-2.8 -1,-0.3 -4,-0.2 326,-0.2 0.709 116.6 27.4 -75.8 -19.3 45.8 93.1 44.6 254 274 A F H << S+ 0 0 0 -3,-1.5 -2,-0.2 -4,-0.8 -1,-0.1 0.712 94.1 115.7-111.4 -29.5 49.0 95.1 45.0 255 275 A S < - 0 0 26 -4,-2.3 2,-0.3 -5,-0.2 292,-0.1 0.286 59.6-123.2 -38.4 164.4 49.6 95.2 48.8 256 276 A H - 0 0 13 110,-0.1 2,-0.3 111,-0.1 -1,-0.1 -0.838 26.9-161.9-112.3 151.8 52.5 93.7 50.6 257 277 A S - 0 0 16 -2,-0.3 110,-0.1 2,-0.1 9,-0.1 -0.963 26.5-151.5-139.3 157.3 52.2 91.1 53.4 258 278 A W + 0 0 20 -2,-0.3 44,-3.7 109,-0.1 2,-0.4 0.449 64.8 107.2-101.5 -6.1 54.2 89.6 56.3 259 279 A I B > S-L 301 0C 5 42,-0.3 4,-1.7 1,-0.1 5,-0.2 -0.630 77.9-118.2 -82.7 134.2 52.5 86.2 56.4 260 280 A Y H > S+ 0 0 0 40,-2.7 4,-2.2 -2,-0.4 5,-0.2 0.770 107.0 48.4 -33.0 -57.1 54.5 83.3 55.1 261 281 A Q H > S+ 0 0 7 37,-1.9 4,-3.2 1,-0.2 5,-0.3 0.972 109.7 50.1 -50.8 -71.7 52.2 82.2 52.2 262 282 A C H > S+ 0 0 7 1,-0.3 4,-3.3 2,-0.2 -1,-0.2 0.765 110.9 49.6 -35.9 -47.6 51.7 85.7 50.7 263 283 A X H X>S+ 0 0 12 -4,-1.7 4,-2.3 2,-0.2 5,-0.8 0.976 114.0 44.6 -61.8 -54.8 55.4 86.3 50.6 264 284 A V H X5S+ 0 0 0 -4,-2.2 4,-1.4 -3,-0.2 -2,-0.2 0.917 117.6 45.5 -54.2 -47.4 56.1 83.0 49.0 265 285 A F H <>S+ 0 0 11 -4,-3.2 5,-0.6 -5,-0.2 -1,-0.2 0.902 122.6 38.8 -61.4 -41.9 53.2 83.6 46.6 266 286 A D H <5S+ 0 0 28 -4,-3.3 3,-0.4 -5,-0.3 -2,-0.2 0.997 126.7 27.4 -70.3 -75.7 54.4 87.2 46.0 267 287 A I H <5S+ 0 0 30 -4,-2.3 2,-0.4 1,-0.2 -3,-0.2 0.698 128.0 41.7 -65.3 -25.5 58.2 87.1 45.9 268 288 A F T <> - 0 0 12 -3,-0.2 4,-1.0 1,-0.2 3,-0.8 -0.549 34.3-140.1 -80.0 76.9 53.1 69.3 54.1 292 326 A F T 34 S+ 0 0 87 -2,-2.0 -1,-0.2 1,-0.2 -2,-0.0 0.479 96.8 36.5 -1.4 -53.0 53.4 68.8 57.8 293 327 A F T >> S+ 0 0 6 2,-0.1 3,-2.6 1,-0.1 4,-1.5 0.968 114.0 53.0 -76.8 -60.7 55.0 72.3 58.3 294 328 A W H <> S+ 0 0 13 -3,-0.8 4,-0.8 1,-0.3 3,-0.3 0.845 104.0 55.3 -43.9 -47.6 53.2 74.3 55.6 295 329 A X H 3< S+ 0 0 125 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.362 116.5 42.5 -73.2 12.6 49.7 73.4 56.9 296 330 A E H <4 S+ 0 0 107 -3,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.598 123.2 29.1-127.1 -24.8 50.9 74.7 60.2 297 331 A N H < S+ 0 0 4 -4,-1.5 -37,-0.2 -3,-0.3 -2,-0.2 0.014 88.1 96.6-130.6 28.2 52.8 77.9 59.3 298 332 A S S < S+ 0 0 10 -4,-0.8 -37,-1.9 -5,-0.2 -36,-0.2 0.907 92.0 40.6 -81.2 -46.8 51.1 79.2 56.2 299 333 A H S S+ 0 0 81 -5,-0.2 -1,-0.2 -39,-0.1 -2,-0.1 0.438 100.4 102.2 -81.0 -0.6 48.8 81.6 58.0 300 334 A L S S- 0 0 24 1,-0.1 -40,-2.7 -41,-0.1 -39,-0.2 -0.597 80.3-105.7 -89.0 147.6 51.7 82.6 60.3 301 335 A P B > -L 259 0C 48 0, 0.0 4,-1.9 0, 0.0 3,-0.4 -0.376 41.2-100.1 -66.5 145.9 53.7 85.8 60.0 302 336 A F H > S+ 0 0 4 -44,-3.7 4,-3.2 1,-0.2 5,-0.2 0.766 119.0 52.7 -32.8 -51.2 57.3 85.4 58.7 303 337 A P H > S+ 0 0 13 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.957 110.4 43.4 -56.2 -60.2 58.9 85.5 62.2 304 338 A E H > S+ 0 0 95 -3,-0.4 4,-4.0 2,-0.2 5,-0.3 0.949 117.8 48.4 -51.1 -53.0 56.8 82.8 64.0 305 339 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.952 109.8 49.3 -52.2 -58.2 57.1 80.6 60.9 306 340 A A H X S+ 0 0 10 -4,-3.2 4,-1.5 -5,-0.2 -1,-0.2 0.911 117.5 45.1 -48.5 -43.8 60.9 81.1 60.7 307 341 A E H X S+ 0 0 70 -4,-2.8 4,-1.0 1,-0.2 3,-0.3 0.978 108.0 53.0 -64.3 -60.0 60.9 80.2 64.4 308 342 A N H X S+ 0 0 61 -4,-4.0 4,-1.5 1,-0.2 -1,-0.2 0.745 105.0 59.5 -49.6 -27.8 58.6 77.2 64.2 309 343 A V H >X S+ 0 0 1 -4,-2.1 4,-2.7 -5,-0.3 3,-0.8 0.984 106.6 44.1 -65.4 -56.5 60.9 75.8 61.5 310 344 A E H 3< S+ 0 0 16 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.567 109.8 57.6 -65.0 -8.4 63.9 75.8 63.8 311 345 A A H 3X S+ 0 0 50 -4,-1.0 4,-1.9 2,-0.1 -1,-0.3 0.810 111.3 42.4 -86.1 -34.2 61.7 74.3 66.6 312 346 A A H S+ 0 0 95 -5,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.853 111.9 43.6 -88.0 -44.0 65.2 70.8 66.6 315 349 A T H X S+ 0 0 76 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.570 113.7 55.8 -78.5 -8.0 62.5 68.3 67.6 316 350 A Y H X S+ 0 0 42 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.855 103.0 51.8 -85.7 -43.7 63.6 66.4 64.5 317 351 A K H < S+ 0 0 48 -4,-1.0 4,-0.3 -5,-0.2 -2,-0.2 0.793 117.9 41.6 -61.2 -28.4 67.2 66.1 65.6 318 352 A E H >X S+ 0 0 123 -4,-1.0 3,-2.0 2,-0.2 4,-1.2 0.953 112.2 50.5 -81.0 -59.4 65.7 64.8 68.9 319 353 A E H 3X S+ 0 0 91 -4,-1.9 4,-1.0 1,-0.3 3,-0.5 0.871 112.6 49.7 -45.2 -45.4 63.0 62.5 67.5 320 354 A A H 3X S+ 0 0 9 -4,-2.7 4,-0.7 1,-0.2 -1,-0.3 0.659 102.7 61.6 -72.4 -17.1 65.7 61.0 65.2 321 355 A A H <4 S+ 0 0 58 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.2 0.774 101.0 51.1 -80.3 -28.7 68.1 60.4 68.1 322 356 A E H >X S+ 0 0 153 -4,-1.2 4,-1.0 -3,-0.5 3,-0.7 0.834 114.1 44.4 -75.8 -33.7 65.8 58.1 70.0 323 357 A I H 3X S+ 0 0 77 -4,-1.0 4,-1.8 1,-0.2 -2,-0.2 0.680 102.5 66.9 -81.1 -20.5 65.3 56.0 66.8 324 358 A T H 3< S+ 0 0 98 -4,-0.7 -1,-0.2 3,-0.2 -2,-0.2 0.457 98.0 56.9 -78.1 -1.1 69.0 56.2 66.2 325 359 A R H <4 S+ 0 0 71 -3,-0.7 -2,-0.2 2,-0.1 -1,-0.2 0.891 106.7 42.4 -91.2 -59.3 69.4 54.0 69.3 326 360 A K H < 0 0 97 -4,-1.0 -2,-0.2 1,-0.1 -3,-0.1 0.936 360.0 360.0 -51.5 -52.7 67.3 51.0 68.3 327 361 A T < 0 0 134 -4,-1.8 -3,-0.2 0, 0.0 -2,-0.1 0.940 360.0 360.0 -85.5 360.0 68.7 51.0 64.8 328 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 329 382 A E 0 0 158 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 4.0 62.4 56.4 45.0 330 383 A V - 0 0 128 1,-0.0 2,-0.8 0, 0.0 0, 0.0 -0.846 360.0-115.4 -99.6 127.0 65.0 54.4 47.0 331 384 A V - 0 0 149 -2,-0.5 2,-0.2 2,-0.0 -1,-0.0 -0.450 44.9-162.1 -61.3 103.1 63.8 52.1 49.7 332 385 A K - 0 0 114 -2,-0.8 -1,-0.0 1,-0.1 6,-0.0 -0.611 28.8-113.6 -92.4 151.5 65.4 54.0 52.6 333 386 A K S S+ 0 0 81 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.884 110.1 15.0 -47.3 -48.4 66.1 52.6 56.1 334 387 A L > + 0 0 47 1,-0.1 4,-2.1 2,-0.0 -1,-0.3 -0.848 66.1 175.5-134.8 98.3 63.6 55.0 57.7 335 388 A P H > S+ 0 0 77 0, 0.0 4,-3.5 0, 0.0 5,-0.4 0.940 80.3 57.3 -64.8 -51.2 61.2 56.7 55.2 336 389 A E H > S+ 0 0 168 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.884 113.3 40.6 -46.4 -49.7 59.1 58.6 57.8 337 390 A L H > S+ 0 0 22 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.955 116.3 47.1 -68.6 -53.3 62.2 60.3 59.2 338 391 A T H X S+ 0 0 56 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.920 114.4 48.2 -55.8 -44.9 63.9 61.1 55.9 339 392 A A H X S+ 0 0 56 -4,-3.5 4,-1.7 1,-0.2 -1,-0.2 0.909 112.5 49.4 -61.3 -43.9 60.6 62.4 54.4 340 393 A K H X S+ 0 0 49 -4,-1.8 4,-1.7 -5,-0.4 -2,-0.2 0.882 111.5 47.2 -64.2 -42.4 60.0 64.5 57.5 341 394 A K H X S+ 0 0 69 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.925 109.9 55.1 -67.3 -40.9 63.5 66.0 57.5 342 395 A N H X S+ 0 0 93 -4,-2.5 4,-1.3 -5,-0.3 -2,-0.2 0.821 103.1 52.5 -62.3 -35.2 63.2 66.8 53.8 343 396 A T H >X S+ 0 0 31 -4,-1.7 4,-1.6 2,-0.2 3,-0.7 0.965 113.6 47.1 -63.4 -45.7 60.0 68.8 54.2 344 397 A I H 3X S+ 0 0 2 -4,-1.7 4,-3.3 1,-0.3 -2,-0.2 0.919 105.5 57.7 -58.5 -45.7 61.9 70.8 56.8 345 398 A D H 3X S+ 0 0 52 -4,-3.0 4,-0.9 2,-0.2 -1,-0.3 0.822 106.4 54.3 -55.1 -29.7 64.9 71.1 54.5 346 399 A T H XX S+ 0 0 10 -4,-1.3 3,-1.1 -3,-0.7 4,-0.9 0.999 115.7 31.2 -67.4 -69.1 62.5 72.7 52.1 347 400 A H H >X S+ 0 0 0 -4,-1.6 4,-2.8 1,-0.3 3,-1.0 0.868 106.7 78.6 -56.8 -37.4 61.1 75.5 54.2 348 401 A X H 3X S+ 0 0 22 -4,-3.3 4,-0.8 -5,-0.3 -1,-0.3 0.835 110.5 22.6 -39.3 -47.4 64.4 75.6 56.0 349 402 A N H <>S+ 0 0 23 -4,-2.8 5,-1.4 1,-0.2 3,-1.0 0.985 116.6 33.8 -58.2 -60.3 64.2 90.7 51.8 359 412 A E H ><5S+ 0 0 62 -4,-2.7 3,-2.0 1,-0.2 -2,-0.2 0.914 106.2 67.5 -63.9 -47.5 67.6 92.3 52.3 360 413 A S T 3<5S+ 0 0 53 -4,-2.5 -1,-0.2 -5,-0.4 32,-0.2 0.479 123.7 17.6 -56.7 1.1 68.7 92.4 48.6 361 414 A K T < 5S- 0 0 18 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.2 0.142 103.3-119.6-158.6 23.6 66.0 94.9 48.0 362 415 A S T < 5 + 0 0 40 -3,-2.0 3,-0.4 1,-0.1 4,-0.4 0.834 43.0 172.9 27.1 79.7 65.0 96.2 51.5 363 416 A L >< + 0 0 12 -5,-1.4 4,-1.2 1,-0.2 3,-0.4 0.801 59.9 79.1 -82.7 -33.8 61.4 95.0 51.4 364 417 A D H > S+ 0 0 55 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.591 88.7 66.5 -52.7 -8.7 60.4 95.8 54.9 365 418 A T H >> S+ 0 0 15 -3,-0.4 4,-2.0 2,-0.2 3,-1.7 0.977 94.6 48.9 -77.1 -62.6 60.1 99.4 53.7 366 419 A F H 3> S+ 0 0 2 -3,-0.4 4,-0.9 -4,-0.4 -2,-0.2 0.841 105.2 62.6 -47.1 -38.4 57.2 99.1 51.3 367 420 A F H 3< S+ 0 0 15 -4,-1.2 -1,-0.3 1,-0.2 3,-0.3 0.868 107.9 40.6 -58.1 -38.1 55.3 97.3 53.9 368 421 A E H X< S+ 0 0 87 -3,-1.7 3,-2.0 -4,-0.7 4,-0.4 0.900 104.6 64.4 -77.3 -41.9 55.3 100.3 56.2 369 422 A V H 3< S+ 0 0 1 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.697 109.2 44.3 -54.1 -19.5 54.7 102.9 53.5 370 423 A E T 3< S+ 0 0 14 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.480 95.2 74.0-105.9 -6.3 51.3 101.2 53.1 371 424 A Q S < S+ 0 0 95 -3,-2.0 -2,-0.2 -4,-0.2 -1,-0.1 0.443 104.7 36.1 -88.5 3.1 50.3 100.8 56.8 372 425 A D - 0 0 78 -4,-0.4 3,-0.2 -3,-0.2 -2,-0.1 0.677 66.0-176.8-126.0 -25.1 49.5 104.5 57.2 373 426 A P + 0 0 23 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 0.774 60.0 71.5 18.0 78.4 47.9 106.0 54.1 374 427 A G S S+ 0 0 26 1,-0.4 5,-0.1 35,-0.0 -2,-0.1 -0.465 76.6 21.1-165.6-119.4 47.7 109.6 55.4 375 428 A S S >> S- 0 0 79 -3,-0.2 3,-2.4 -2,-0.1 4,-1.5 -0.154 84.8 -85.4 -73.6 168.3 50.0 112.5 56.3 376 429 A T H 3> S+ 0 0 79 1,-0.3 4,-3.3 2,-0.2 5,-0.5 0.654 114.8 87.5 -45.9 -19.8 53.5 113.3 55.1 377 430 A K H 3> S+ 0 0 74 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.950 110.5 19.4 -44.5 -51.4 54.6 111.0 57.9 378 431 A T H <> S+ 0 0 12 -3,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.847 118.1 68.5 -85.2 -42.0 54.1 108.3 55.2 379 432 A R H >X S+ 0 0 40 -4,-1.5 4,-1.2 1,-0.2 3,-0.6 0.900 106.9 41.0 -43.8 -50.4 54.2 110.6 52.2 380 433 A S H 3X S+ 0 0 55 -4,-3.3 4,-3.4 1,-0.2 5,-0.3 0.969 103.3 64.1 -63.9 -58.0 57.9 111.3 52.9 381 434 A R H 3X S+ 0 0 21 -4,-1.0 4,-1.0 -5,-0.5 -1,-0.2 0.669 103.9 54.6 -41.9 -22.4 59.0 107.7 53.8 382 435 A F H XX S+ 0 0 1 -4,-1.2 4,-2.5 -3,-0.6 3,-0.6 0.974 111.8 35.1 -80.2 -64.7 58.0 106.9 50.2 383 436 A L H 3< S+ 0 0 43 -4,-1.2 4,-0.3 1,-0.3 -2,-0.2 0.903 116.9 61.1 -54.6 -36.3 60.1 109.3 48.1 384 437 A D H >X S+ 0 0 101 -4,-3.4 3,-0.7 1,-0.2 4,-0.5 0.904 107.2 42.7 -53.4 -45.2 62.6 108.7 50.8 385 438 A I H X< S+ 0 0 14 -4,-1.0 3,-1.0 -3,-0.6 -2,-0.2 0.881 111.8 51.6 -72.5 -39.6 62.6 105.0 49.9 386 439 A L T 3< S+ 0 0 19 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.386 100.1 69.1 -78.9 6.9 62.7 105.7 46.1 387 440 A K T <4 S+ 0 0 74 -3,-0.7 2,-0.4 -4,-0.3 -1,-0.2 0.726 87.0 62.8 -91.0 -29.1 65.7 108.0 46.9 388 441 A D S << S- 0 0 99 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.1 -0.187 95.9-159.6 -89.0 40.3 67.9 105.0 47.8 389 442 A G + 0 0 47 -2,-0.4 2,-0.1 -3,-0.3 -2,-0.1 0.396 31.0 141.9 -22.6 147.7 67.5 103.8 44.3 390 443 A K - 0 0 86 -4,-0.1 -1,-0.1 -29,-0.0 -29,-0.1 -0.359 49.1-119.1-154.1-124.0 68.1 100.2 43.1 391 444 A T S > S+ 0 0 112 -2,-0.1 3,-0.5 0, 0.0 4,-0.4 0.164 98.5 73.2-167.0 -38.2 66.3 98.1 40.5 392 445 A N T 3 S+ 0 0 72 1,-0.2 4,-0.1 -32,-0.2 0, 0.0 0.061 101.0 52.9 -78.7 27.6 65.0 95.2 42.5 393 446 A N T 3> S+ 0 0 7 2,-0.1 4,-3.1 3,-0.1 3,-0.4 0.524 76.8 97.2-126.6 -33.6 62.5 97.7 43.9 394 447 A L H <> S+ 0 0 38 -3,-0.5 4,-1.8 1,-0.2 5,-0.2 0.742 90.0 41.5 -25.9 -56.2 61.1 99.1 40.7 395 448 A E H > S+ 0 0 62 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.952 116.6 46.8 -64.6 -51.7 58.1 96.8 40.7 396 449 A D H > S+ 0 0 4 -3,-0.4 4,-3.2 2,-0.2 5,-0.3 0.843 107.9 60.1 -59.2 -35.5 57.3 97.1 44.4 397 450 A K H X S+ 0 0 3 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.992 106.3 43.7 -53.9 -68.0 57.8 100.8 44.0 398 451 A L H X S+ 0 0 4 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.840 116.4 51.2 -45.5 -41.2 54.9 101.1 41.5 399 452 A R H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.986 108.6 45.3 -64.7 -61.4 52.9 98.8 43.7 400 453 A S H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.820 114.4 54.2 -53.1 -29.8 53.2 100.6 47.1 401 454 A F H X S+ 0 0 2 -4,-2.3 4,-3.2 -5,-0.3 5,-0.3 0.992 108.1 46.3 -65.9 -61.0 52.5 103.8 45.1 402 455 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.890 110.3 54.6 -47.0 -48.8 49.3 102.5 43.6 403 456 A V H X S+ 0 0 5 -4,-2.9 4,-3.2 2,-0.2 3,-0.4 0.967 113.0 43.2 -49.8 -56.7 48.3 101.2 47.1 404 457 A L H X S+ 0 0 13 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.948 111.3 52.2 -54.2 -55.4 48.8 104.7 48.4 405 458 A Y H < S+ 0 0 33 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.828 118.5 39.8 -51.9 -33.8 47.1 106.5 45.5 406 459 A L H < S+ 0 0 0 -4,-2.4 3,-0.4 -3,-0.4 -2,-0.2 0.868 121.1 37.6 -85.2 -43.2 44.1 104.2 46.1 407 460 A T H < S+ 0 0 32 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.653 81.6 117.7 -82.8 -16.8 43.8 104.0 49.9 408 461 A S < - 0 0 4 -4,-2.6 -1,-0.2 -5,-0.3 4,-0.1 0.535 55.7-158.3 -19.2 -41.4 44.8 107.7 50.4 409 462 A T S S+ 0 0 97 -3,-0.4 -1,-0.2 -4,-0.1 2,-0.2 0.724 76.7 53.8 55.3 21.3 41.5 108.7 52.0 410 463 A T S S- 0 0 73 1,-0.1 2,-0.2 -36,-0.0 -2,-0.0 -0.556 110.2 -84.1 175.3 114.2 42.5 112.1 50.8 411 464 A G - 0 0 56 -2,-0.2 -2,-0.1 1,-0.1 -3,-0.1 0.206 49.6-131.9 19.6 -71.5 43.5 113.5 47.5 412 465 A L - 0 0 23 -2,-0.2 5,-0.2 -4,-0.1 -1,-0.1 0.808 40.6 -86.9 87.7 92.7 47.2 112.7 47.4 413 466 A P > - 0 0 44 0, 0.0 4,-1.2 0, 0.0 3,-0.5 0.172 25.3-122.0 -29.8 131.3 49.0 115.9 46.3 414 467 A K H > S+ 0 0 87 1,-0.2 4,-0.8 2,-0.2 5,-0.1 0.656 109.6 73.1 -53.4 -13.7 49.5 116.6 42.6 415 468 A D H >> S+ 0 0 121 2,-0.2 4,-3.4 3,-0.2 3,-1.4 0.991 95.1 42.4 -64.4 -66.8 53.1 116.7 43.7 416 469 A F H 3>>S+ 0 0 22 -3,-0.5 4,-3.0 1,-0.3 5,-1.1 0.946 110.2 56.4 -45.2 -62.1 53.6 112.9 44.3 417 470 A V H 3<5S+ 0 0 24 -4,-1.2 -1,-0.3 1,-0.2 4,-0.2 0.780 119.5 34.9 -42.6 -31.0 51.7 112.0 41.2 418 471 A Q H >S+ 0 0 0 -4,-0.8 5,-1.1 -3,-0.8 4,-0.4 0.869 111.8 50.4 -95.1 -50.7 59.6 106.0 36.7 425 478 A K H <5S+ 0 0 113 -4,-1.9 -2,-0.2 3,-0.2 -3,-0.1 0.710 117.8 44.4 -62.7 -20.0 59.5 107.7 33.3 426 479 A E T <5S+ 0 0 147 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.802 115.0 44.2 -91.0 -37.5 63.1 108.6 33.9 427 480 A N T 5S- 0 0 76 -4,-0.5 -2,-0.2 -5,-0.4 -1,-0.1 0.403 116.7-129.9 -82.6 0.8 64.1 105.2 35.2 428 481 A D T 5 + 0 0 133 -4,-0.4 2,-0.3 1,-0.1 -3,-0.2 0.939 55.4 147.3 45.3 77.2 62.0 104.1 32.2 429 482 A Y < - 0 0 57 -5,-1.1 -1,-0.1 -35,-0.0 -2,-0.1 -0.802 58.9-108.4-136.6 86.1 59.6 101.5 33.6 430 483 A D - 0 0 102 -2,-0.3 3,-0.2 1,-0.2 154,-0.1 0.288 29.2-167.7 -20.9 126.5 56.4 101.9 31.5 431 484 A I > + 0 0 28 1,-0.1 3,-0.6 2,-0.1 4,-0.4 -0.007 43.6 131.8-111.8 23.9 53.7 103.5 33.7 432 485 A N T >> S+ 0 0 39 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.740 71.6 60.5 -48.5 -22.9 50.9 102.7 31.2 433 486 A A H >> S+ 0 0 3 1,-0.2 4,-2.4 -3,-0.2 3,-0.8 0.947 86.1 66.3 -72.9 -53.0 49.2 101.4 34.3 434 487 A L H <> S+ 0 0 4 -3,-0.6 4,-0.7 1,-0.2 -1,-0.2 0.538 94.1 67.4 -50.5 -4.0 49.0 104.6 36.4 435 488 A K H <4 S+ 0 0 64 -3,-0.5 4,-0.3 -4,-0.4 -1,-0.2 0.955 111.7 27.9 -78.3 -58.8 46.6 105.8 33.6 436 489 A Y H XX S+ 0 0 24 -3,-0.8 3,-2.0 -4,-0.6 4,-1.1 0.876 112.2 68.4 -69.8 -40.6 43.9 103.3 34.5 437 490 A V H >X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.3 3,-0.5 0.892 90.3 61.9 -46.6 -50.1 44.8 103.0 38.1 438 491 A Y H 3< S+ 0 0 50 -4,-0.7 4,-0.4 1,-0.2 3,-0.3 0.734 101.0 55.0 -52.6 -23.9 43.7 106.5 39.0 439 492 A K H X4 S+ 0 0 116 -3,-2.0 3,-1.3 -4,-0.3 4,-0.4 0.931 99.0 59.4 -74.5 -46.5 40.2 105.6 37.9 440 493 A L H XX S+ 0 0 1 -4,-1.1 4,-2.2 -3,-0.5 3,-0.6 0.605 87.5 80.3 -56.6 -15.0 39.9 102.6 40.2 441 494 A R H 3X S+ 0 0 38 -4,-0.7 4,-2.4 -3,-0.3 -1,-0.3 0.935 83.5 58.0 -60.7 -46.4 40.5 105.0 43.1 442 495 A E H <> S+ 0 0 146 -3,-1.3 4,-1.1 -4,-0.4 -1,-0.2 0.762 109.9 47.1 -56.9 -24.9 36.8 106.2 43.1 443 496 A F H <> S+ 0 0 100 -3,-0.6 4,-2.6 -4,-0.4 5,-0.4 0.939 109.1 49.5 -79.5 -54.7 35.9 102.5 43.7 444 497 A X H X S+ 0 0 1 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.813 115.0 49.6 -52.9 -30.7 38.4 101.8 46.5 445 498 A Q H X S+ 0 0 30 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.860 108.4 50.0 -78.2 -37.7 37.1 105.0 48.1 446 499 A L H X S+ 0 0 103 -4,-1.1 4,-1.2 -5,-0.2 -2,-0.2 0.900 116.2 40.2 -71.7 -39.8 33.4 104.1 47.8 447 500 A S H X S+ 0 0 22 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.749 112.3 54.2 -84.0 -18.2 33.6 100.7 49.3 448 501 A N H < S+ 0 0 48 -4,-1.0 -1,-0.2 -5,-0.4 5,-0.2 0.771 115.0 43.3 -79.4 -21.6 36.1 101.7 52.0 449 502 A X H < S+ 0 0 126 -4,-1.1 -2,-0.2 1,-0.1 -1,-0.2 0.711 112.8 52.0 -88.2 -27.3 33.6 104.3 52.9 450 503 A S H < S+ 0 0 45 -4,-1.2 58,-0.3 -5,-0.1 2,-0.2 0.648 109.8 58.5 -84.2 -17.3 30.6 102.0 52.6 451 504 A L S < S- 0 0 8 -4,-0.9 2,-0.4 -5,-0.1 52,-0.0 -0.622 70.5-139.6-111.2 171.3 32.3 99.4 54.9 452 505 A Q - 0 0 102 -2,-0.2 2,-0.4 35,-0.1 50,-0.2 -0.966 18.2-140.1-133.8 112.1 33.5 99.3 58.4 453 506 A N - 0 0 78 -2,-0.4 2,-0.2 -5,-0.2 33,-0.1 -0.609 16.8-165.3 -76.9 124.3 36.8 97.4 59.2 454 507 A K - 0 0 51 -2,-0.4 31,-3.3 32,-0.1 2,-0.2 -0.534 16.7-143.3 -96.3 170.7 36.7 95.4 62.5 455 508 A S 0 0 85 29,-0.3 29,-0.2 -2,-0.2 -1,-0.1 -0.582 360.0 360.0-131.0-167.5 40.0 94.1 63.9 456 509 A L 0 0 119 -2,-0.2 28,-0.2 29,-0.0 -1,-0.2 0.914 360.0 360.0 59.1 360.0 42.0 91.4 65.7 457 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 458 528 A Y >> 0 0 94 0, 0.0 4,-1.7 0, 0.0 3,-1.1 0.000 360.0 360.0 360.0 -57.2 71.7 79.0 55.4 459 529 A G H 3> + 0 0 60 1,-0.3 4,-1.3 2,-0.2 0, 0.0 0.863 360.0 62.7 -52.8 -31.9 73.8 77.9 58.3 460 530 A L H 3> S+ 0 0 86 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.882 102.9 47.9 -59.2 -41.8 72.8 81.4 59.4 461 531 A T H <4 S+ 0 0 15 -3,-1.1 -2,-0.2 2,-0.3 -1,-0.2 0.971 106.4 51.2 -65.1 -54.4 69.2 80.3 59.4 462 532 A E H >< S+ 0 0 52 -4,-1.7 3,-0.5 1,-0.2 -1,-0.2 0.800 107.7 70.6 -48.6 -25.4 69.9 77.0 61.4 463 533 A G H 3< S+ 0 0 47 -4,-1.3 2,-4.8 -5,-0.4 -2,-0.3 0.980 75.9 68.9 -53.0 -74.3 71.5 79.9 63.3 464 534 A K T >< + 0 0 24 -4,-1.3 2,-1.8 1,-0.2 3,-0.9 0.148 59.2 130.4 -41.4 26.0 68.3 81.9 64.7 465 535 A L T < + 0 0 63 -2,-4.8 -1,-0.2 -3,-0.5 -3,-0.0 -0.464 40.7 93.1 -86.3 68.1 67.4 79.1 67.1 466 536 A Q T 3 S- 0 0 88 -2,-1.8 -1,-0.2 3,-0.1 -2,-0.1 0.517 95.7-114.6-127.0 -24.7 67.0 81.4 70.1 467 537 A G S < S+ 0 0 56 -3,-0.9 -2,-0.1 2,-0.1 -160,-0.1 0.493 100.0 66.0 94.4 6.7 63.4 82.2 70.1 468 538 A G S S- 0 0 34 1,-0.2 2,-0.2 -4,-0.2 -161,-0.1 0.535 92.1 -68.0-120.3 -93.2 64.3 85.8 69.4 469 539 A V - 0 0 43 4,-0.1 -1,-0.2 3,-0.0 -3,-0.1 -0.809 10.9-128.1-154.4-168.2 66.1 87.1 66.2 470 540 A G S S- 0 0 52 -2,-0.2 -6,-0.0 -4,-0.0 -7,-0.0 -0.049 78.1 -84.2-142.6 21.8 69.0 87.4 63.9 471 541 A S S S+ 0 0 103 1,-0.0 -2,-0.0 0, 0.0 4,-0.0 0.490 129.8 59.3 81.6 9.5 68.9 91.2 63.8 472 542 A L S > S+ 0 0 96 2,-0.1 4,-1.3 3,-0.1 5,-0.1 0.502 92.6 59.1-133.5 -26.8 66.3 91.2 61.1 473 543 A I H > S+ 0 0 16 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.675 99.0 65.9 -77.7 -20.1 63.4 89.2 62.7 474 544 A S H > S+ 0 0 61 2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.933 101.9 44.3 -66.2 -50.1 63.5 91.9 65.4 475 545 A G H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.898 115.3 47.1 -64.0 -42.8 62.4 94.7 63.0 476 546 A I H < S+ 0 0 7 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.866 110.1 53.3 -68.7 -35.9 59.7 92.6 61.4 477 547 A K H >< S+ 0 0 53 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.817 112.5 44.0 -68.6 -31.6 58.3 91.4 64.7 478 548 A K H 3< S+ 0 0 88 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.840 105.1 63.5 -79.9 -35.0 57.9 94.9 66.0 479 549 A L T 3< S+ 0 0 59 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.108 71.2 129.1 -76.4 22.4 56.4 96.1 62.7 480 550 A L < - 0 0 68 -3,-0.6 3,-0.1 1,-0.1 -3,-0.1 -0.702 40.8-177.4 -83.3 98.3 53.5 93.7 63.3 481 551 A P - 0 0 71 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 0.376 37.8 -49.8 -76.5-152.8 50.4 96.0 62.8 482 552 A E - 0 0 79 -111,-0.1 2,-3.3 1,-0.1 -2,-0.0 -0.770 40.0-154.1 -89.3 100.4 46.7 95.7 63.0 483 553 A K + 0 0 100 -2,-0.9 2,-0.1 -3,-0.1 3,-0.1 -0.479 36.0 173.5 -75.2 74.5 45.6 92.7 61.1 484 554 A K - 0 0 33 -2,-3.3 -29,-0.3 -29,-0.2 -31,-0.0 -0.418 39.2 -85.2 -79.4 158.8 42.3 94.5 60.7 485 555 A T - 0 0 13 -31,-3.3 -1,-0.2 -2,-0.1 -29,-0.0 -0.289 42.7-131.8 -66.0 156.1 39.6 92.9 58.5 486 556 A I > - 0 0 20 62,-0.1 4,-2.0 -3,-0.1 5,-0.2 -0.532 31.7 -93.5-100.4 169.2 39.8 93.7 54.7 487 557 A P H > S+ 0 0 5 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.889 126.0 48.0 -51.9 -43.6 36.9 94.9 52.5 488 558 A I H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.956 107.9 53.2 -65.6 -47.9 36.0 91.3 51.5 489 559 A T H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.854 108.2 53.6 -54.1 -37.3 36.1 89.9 55.0 490 560 A N H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.971 109.5 45.6 -62.5 -54.4 33.6 92.6 56.0 491 561 A V H X S+ 0 0 1 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.896 117.1 44.8 -56.1 -44.0 31.2 91.7 53.3 492 562 A V H X S+ 0 0 0 -4,-2.8 4,-3.3 2,-0.2 5,-0.3 0.958 112.4 53.1 -65.9 -48.4 31.5 88.0 54.2 493 563 A D H X S+ 0 0 20 -4,-3.2 4,-3.2 1,-0.2 -2,-0.2 0.942 109.4 46.9 -47.9 -62.1 31.3 88.7 57.9 494 564 A A H < S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.803 116.8 45.8 -53.2 -33.5 28.0 90.7 57.6 495 565 A I H < S+ 0 0 6 -4,-1.4 36,-0.5 -3,-0.3 -2,-0.2 0.907 119.5 36.9 -79.2 -42.7 26.5 88.0 55.4 496 566 A X H < S+ 0 0 0 -4,-3.3 37,-1.8 1,-0.2 -2,-0.2 0.826 131.6 26.7 -79.2 -32.2 27.6 85.0 57.5 497 567 A D < + 0 0 13 -4,-3.2 3,-0.3 -5,-0.3 -1,-0.2 -0.655 67.1 162.7-135.0 77.3 27.1 86.5 60.9 498 568 A P S > S+ 0 0 13 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.908 72.4 58.0 -59.3 -51.2 24.4 89.3 60.7 499 569 A L T 3 S+ 0 0 154 1,-0.3 2,-0.1 0, 0.0 -5,-0.1 0.817 110.8 42.2 -54.7 -37.4 23.6 89.6 64.4 500 570 A N T 3 S+ 0 0 121 -3,-0.3 2,-0.3 -7,-0.1 -1,-0.3 -0.232 95.9 105.0-106.6 47.3 27.2 90.4 65.3 501 571 A S S < S- 0 0 22 -3,-1.3 -11,-0.0 -7,-0.1 5,-0.0 -0.921 74.3 -96.2-129.6 153.9 28.2 92.8 62.6 502 572 A S > - 0 0 35 -2,-0.3 4,-1.8 -50,-0.2 5,-0.2 -0.239 33.5-121.8 -60.3 148.7 28.7 96.5 62.2 503 573 A Q H > S+ 0 0 109 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.890 111.5 55.5 -60.5 -41.9 25.7 98.5 60.9 504 574 A K H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.947 109.2 44.3 -55.4 -55.6 27.7 99.7 57.9 505 575 A N H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.834 114.8 50.8 -60.1 -34.6 28.7 96.3 56.7 506 576 A L H X S+ 0 0 7 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.931 112.7 45.0 -69.7 -43.1 25.2 95.0 57.2 507 577 A E H < S+ 0 0 107 -4,-2.7 4,-0.5 2,-0.2 -2,-0.2 0.880 113.0 50.6 -69.0 -39.1 23.7 97.9 55.2 508 578 A T H >< S+ 0 0 20 -4,-2.7 3,-1.5 -58,-0.3 -2,-0.2 0.963 115.0 41.1 -65.7 -50.4 26.2 97.7 52.4 509 579 A T H >< S+ 0 0 5 -4,-2.0 3,-1.7 1,-0.3 -1,-0.2 0.656 100.3 77.8 -70.2 -13.2 25.7 93.9 51.9 510 580 A D T 3< S+ 0 0 58 -4,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.754 87.3 58.0 -66.7 -21.5 22.0 94.6 52.4 511 581 A S T < S+ 0 0 72 -3,-1.5 2,-0.4 -4,-0.5 -300,-0.3 0.425 83.2 119.5 -88.4 0.5 22.1 95.9 48.8 512 582 A Y S < S- 0 0 17 -3,-1.7 -302,-0.2 -302,-0.1 -3,-0.0 -0.553 76.2-106.0 -77.5 124.2 23.3 92.5 47.5 513 583 A L E -I 209 0B 9 -304,-1.6 -304,-1.7 -2,-0.4 2,-0.5 -0.157 39.0-155.2 -43.0 122.4 21.2 90.6 45.1 514 584 A Y E +I 208 0B 25 12,-0.5 2,-0.4 -306,-0.2 -306,-0.2 -0.934 17.8 172.0-112.4 128.7 19.7 87.7 47.0 515 585 A I E -I 207 0B 0 -308,-2.3 -308,-3.0 -2,-0.5 7,-0.1 -0.983 19.2-165.0-145.6 131.5 18.6 84.5 45.3 516 586 A D > - 0 0 22 -2,-0.4 3,-1.2 -310,-0.2 -310,-0.1 -0.943 7.1-161.5-114.5 111.2 17.4 81.1 46.4 517 587 A P T 3 S+ 0 0 2 0, 0.0 -287,-0.2 0, 0.0 -1,-0.1 0.673 87.3 66.9 -63.9 -19.7 17.5 78.2 43.8 518 588 A K T 3 S+ 0 0 125 -314,-0.1 2,-0.1 -288,-0.1 -312,-0.0 0.712 97.7 58.1 -75.2 -22.9 15.0 76.1 45.9 519 589 A I S < S- 0 0 90 -3,-1.2 -4,-0.0 1,-0.2 0, 0.0 -0.409 83.4-128.5 -96.0 177.6 12.2 78.6 45.4 520 590 A T S S- 0 0 113 -2,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.842 80.9 -15.2 -94.6 -88.4 10.8 79.6 42.0 521 591 A R S S- 0 0 72 1,-0.1 2,-0.5 5,-0.0 -2,-0.0 0.817 84.1-134.1 -88.5 -33.5 10.4 83.3 41.2 522 592 A G - 0 0 43 4,-0.1 2,-0.2 -7,-0.1 4,-0.2 -0.679 47.2 -62.4 121.2 -79.6 10.8 84.6 44.8 523 593 A S S S- 0 0 77 2,-0.7 3,-0.1 -2,-0.5 0, 0.0 -0.654 89.3 -46.4-170.2-134.2 8.1 87.2 45.5 524 594 A H S S+ 0 0 114 -2,-0.2 2,-0.1 3,-0.0 0, 0.0 0.850 137.4 2.2 -78.7 -37.1 7.8 90.5 43.7 525 595 A T S S- 0 0 88 -3,-0.1 -2,-0.7 3,-0.0 0, 0.0 -0.349 82.7-104.1-121.3-160.9 11.5 90.5 44.4 526 596 A R - 0 0 62 -4,-0.2 -12,-0.5 -2,-0.1 3,-0.1 -0.638 51.9-154.7-128.5 57.7 14.0 88.2 46.0 527 597 A K - 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0 0 0 -3,-1.2 2,-0.3 -374,-0.1 30,-0.2 -0.382 49.4-152.6 148.1 133.0 41.0 88.1 40.4 544 614 A G B -n 573 0E 0 28,-2.0 30,-0.5 -2,-0.1 2,-0.3 -0.860 13.9-169.1-122.5 157.6 42.0 86.2 43.5 545 615 A N > - 0 0 7 -2,-0.3 4,-1.6 28,-0.2 30,-0.1 -0.954 34.4-130.6-144.2 158.7 44.9 86.6 46.0 546 616 A Y H > S+ 0 0 3 -2,-0.3 4,-4.5 28,-0.2 5,-0.3 0.799 110.0 64.6 -76.4 -28.1 46.5 84.8 48.9 547 617 A L H > S+ 0 0 18 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 108.6 36.2 -58.3 -50.5 46.2 88.1 50.7 548 618 A E H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.887 118.6 51.8 -70.6 -38.9 42.4 88.0 50.7 549 619 A Y H X S+ 0 0 10 -4,-1.6 4,-2.1 2,-0.2 5,-0.2 0.984 109.9 49.3 -60.4 -54.2 42.5 84.2 51.1 550 620 A Q H X S+ 0 0 4 -4,-4.5 4,-2.4 2,-0.2 5,-0.2 0.913 113.3 47.1 -48.9 -49.8 44.8 84.6 54.1 551 621 A N H X S+ 0 0 15 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 0.986 110.1 51.5 -56.1 -63.8 42.5 87.2 55.6 552 622 A L H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.763 112.6 46.4 -44.5 -37.8 39.3 85.2 55.1 553 623 A Q H X S+ 0 0 11 -4,-2.1 4,-4.3 2,-0.2 -1,-0.2 0.936 110.1 50.4 -75.2 -46.9 40.7 82.2 56.8 554 624 A E H < S+ 0 0 41 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.929 113.4 49.5 -55.8 -43.6 42.2 84.0 59.8 555 625 A W H >< S+ 0 0 18 -4,-2.8 3,-0.8 -5,-0.2 -1,-0.2 0.903 116.0 40.9 -59.7 -45.9 38.7 85.6 60.2 556 626 A A H >< S+ 0 0 4 -4,-1.7 3,-1.4 -5,-0.3 8,-0.8 0.884 111.5 56.2 -71.3 -40.0 37.0 82.2 59.9 557 627 A H T 3< S+ 0 0 136 -4,-4.3 -1,-0.2 1,-0.3 -2,-0.2 0.112 106.4 52.2 -80.3 22.8 39.6 80.4 62.1 558 628 A S T < S+ 0 0 66 -3,-0.8 2,-1.0 -5,-0.1 -1,-0.3 0.124 76.5 115.3-139.5 14.9 39.0 82.9 64.9 559 629 A Q < + 0 0 31 -3,-1.4 2,-0.3 5,-0.2 5,-0.1 -0.783 39.3 177.0 -94.2 96.9 35.2 82.6 65.1 560 630 A L + 0 0 140 -2,-1.0 -2,-0.0 1,-0.2 -3,-0.0 -0.721 63.2 44.1 -94.1 151.0 34.4 81.1 68.5 561 631 A H S S+ 0 0 169 -2,-0.3 -1,-0.2 2,-0.0 0, 0.0 0.966 133.2 8.4 73.8 79.2 30.7 80.7 69.2 562 632 A N S S- 0 0 114 -3,-0.1 -2,-0.0 2,-0.0 2,-0.0 0.941 90.8-140.6 81.5 79.3 29.5 79.3 65.8 563 633 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -6,-0.1 -0.300 15.6-143.0 -68.4 157.5 32.7 78.5 63.8 564 634 A K - 0 0 16 -8,-0.8 2,-0.5 -5,-0.1 -29,-0.2 -0.946 11.1-150.9-129.1 146.5 32.8 79.2 60.1 565 635 A K E - k 0 535B 34 -31,-2.1 -29,-1.6 -2,-0.4 2,-0.5 -0.962 18.1-168.9-112.5 125.2 34.2 77.5 57.0 566 636 A V E - k 0 536B 0 -2,-0.5 2,-0.6 -31,-0.2 -29,-0.2 -0.967 7.3-165.5-121.0 120.9 35.1 79.9 54.2 567 637 A X E - k 0 537B 2 -31,-2.4 -29,-3.8 -2,-0.5 2,-0.3 -0.914 14.4-164.4-105.5 118.4 36.0 78.7 50.7 568 638 A Y E +gk 161 538B 0 -408,-2.3 -406,-1.7 -2,-0.6 2,-0.3 -0.731 18.0 147.1-103.6 153.0 37.6 81.4 48.6 569 639 A G E -gk 162 539B 0 -31,-1.5 -29,-2.3 -2,-0.3 2,-0.3 -0.954 18.9-170.5-176.4 157.2 38.1 81.5 44.9 570 640 A S E -gk 163 540B 0 -408,-1.2 -406,-1.5 -2,-0.3 -405,-0.3 -0.831 50.3 -87.9-143.6-179.8 38.3 83.6 41.7 571 641 A T S S- 0 0 2 -31,-0.9 -405,-3.5 1,-0.3 2,-0.3 0.851 115.4 -7.8 -61.4 -33.2 38.5 83.2 38.0 572 642 A A S S- 0 0 11 -407,-0.2 -28,-2.0 -408,-0.2 2,-1.4 -0.968 70.3-116.8-161.5 145.0 42.3 83.0 38.5 573 643 A I B -n 544 0E 26 -2,-0.3 -28,-0.2 -30,-0.2 2,-0.1 -0.701 46.7-163.2 -88.3 89.5 44.6 83.5 41.5 574 644 A T - 0 0 5 -2,-1.4 -28,-0.2 -30,-0.5 -2,-0.0 -0.415 12.8-126.5 -78.3 148.7 46.5 86.5 40.1 575 645 A T >> - 0 0 14 -2,-0.1 4,-3.4 1,-0.1 5,-0.5 -0.717 24.9-115.0 -93.5 141.4 49.9 87.7 41.3 576 646 A P H >5S+ 0 0 4 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.867 123.2 47.1 -37.8 -43.5 50.4 91.4 42.3 577 647 A A H >5S+ 0 0 25 2,-0.2 4,-1.0 1,-0.2 3,-0.1 0.958 113.3 44.4 -64.5 -55.5 52.8 91.4 39.3 578 648 A E H >5S+ 0 0 93 1,-0.2 4,-1.8 2,-0.2 3,-0.4 0.851 114.7 48.7 -61.1 -38.8 50.4 89.6 36.9 579 649 A F H X5S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.2 -1,-0.2 0.816 102.7 63.0 -70.2 -31.7 47.4 91.8 37.9 580 650 A L H XX S+ 0 0 0 -4,-2.3 3,-2.2 1,-0.2 4,-1.3 0.983 110.2 46.5 -55.1 -65.0 45.6 96.8 34.5 584 654 A S H 3X S+ 0 0 20 -4,-1.6 4,-2.1 1,-0.3 -1,-0.2 0.766 104.9 62.6 -50.6 -29.7 48.2 98.5 32.3 585 655 A R H 3X S+ 0 0 119 -4,-2.4 4,-2.4 1,-0.2 -1,-0.3 0.824 104.2 49.2 -65.8 -30.3 46.9 96.6 29.3 586 656 A L H + 0 0 16 1,-0.1 4,-1.2 2,-0.1 3,-0.5 0.458 61.1 79.6 -97.5 -7.1 21.2 63.8 43.9 598 0 B G H > S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.864 78.7 65.7 -67.8 -37.4 24.4 64.7 42.2 599 1 B M H > S+ 0 0 40 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.845 102.1 53.3 -52.7 -31.8 25.3 61.1 41.8 600 2 B N H 4 S+ 0 0 120 -3,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.926 110.4 42.1 -68.3 -49.4 22.2 61.1 39.5 601 3 B I H < S+ 0 0 54 -4,-1.2 -452,-0.2 1,-0.2 -2,-0.2 0.786 112.2 58.0 -69.6 -27.8 23.3 63.9 37.3 602 4 B K H < S+ 0 0 33 -4,-2.7 -453,-2.4 -5,-0.1 2,-0.6 0.872 89.7 75.0 -73.3 -40.3 26.9 62.6 37.2 603 5 B D B < +E 148 0A 66 -4,-1.5 -455,-0.2 -455,-0.2 4,-0.2 -0.645 44.8 159.2 -80.4 117.4 26.2 59.1 35.7 604 6 B R > + 0 0 30 -457,-2.1 4,-3.0 -2,-0.6 -456,-0.2 0.320 38.9 109.5-117.8 8.3 25.4 59.2 32.1 605 7 B T H > S+ 0 0 13 -458,-0.4 4,-2.9 2,-0.2 5,-0.2 0.932 82.8 41.9 -48.5 -60.5 26.1 55.6 31.1 606 8 B S H > S+ 0 0 82 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.949 113.6 52.1 -55.8 -53.0 22.5 54.5 30.5 607 9 B E H > S+ 0 0 70 -4,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.943 114.0 46.8 -46.3 -50.9 21.6 57.7 28.7 608 10 B F H >X S+ 0 0 1 -4,-3.0 3,-3.4 2,-0.2 4,-2.3 0.983 112.2 46.4 -53.5 -68.1 24.6 57.1 26.5 609 11 B Q H 3X S+ 0 0 78 -4,-2.9 4,-2.9 1,-0.3 -1,-0.2 0.863 107.8 57.7 -45.5 -45.1 23.9 53.4 25.8 610 12 B Q H 3X S+ 0 0 125 -4,-3.3 4,-1.2 1,-0.2 -1,-0.3 0.678 109.9 46.1 -64.1 -14.2 20.3 54.2 25.0 611 13 B S H X S+ 0 0 69 -4,-2.9 4,-2.2 -5,-0.3 3,-0.7 0.933 107.7 46.5 -61.4 -50.7 21.0 51.9 20.7 614 16 B S H 3X S+ 0 0 32 -4,-1.2 4,-1.8 1,-0.3 -1,-0.2 0.919 110.9 54.3 -61.3 -39.9 18.9 54.3 18.8 615 17 B Y H 3X S+ 0 0 48 -4,-3.1 4,-1.6 1,-0.2 -1,-0.3 0.765 107.8 51.4 -65.2 -21.9 21.9 55.0 16.5 616 18 B K H << S+ 0 0 104 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.931 105.9 52.4 -77.9 -46.2 22.1 51.3 15.8 617 19 B K H < S+ 0 0 170 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.852 114.9 43.6 -57.9 -35.8 18.5 50.9 14.9 618 20 B R H < 0 0 165 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.984 360.0 360.0 -73.6 -61.1 18.7 53.7 12.3 619 21 B N < 0 0 104 -4,-1.6 -3,-0.0 -5,-0.2 -486,-0.0 0.302 360.0 360.0 -68.4 360.0 22.1 52.8 10.7