==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSMEMBRANE PROTEIN 08-JAN-97 1CII . COMPND 2 MOLECULE: COLICIN IA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.WIENER,D.FREYMANN,P.GHOSH,R.STROUD . 602 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34255.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 527 87.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 25 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 408 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 3 2 0 1 2 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 4 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 23 A E 0 0 95 0, 0.0 426,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -55.6 49.9 70.6 174.9 2 24 A I + 0 0 20 1,-0.2 2,-0.2 2,-0.0 422,-0.0 0.164 360.0 81.8 76.0 -23.5 47.3 73.0 176.3 3 25 A M - 0 0 20 1,-0.1 -1,-0.2 113,-0.0 110,-0.0 -0.651 66.0-148.5-106.9 171.5 46.8 74.8 172.9 4 26 A A + 0 0 17 -2,-0.2 2,-1.0 -3,-0.1 -1,-0.1 0.798 17.7 179.8-101.9 -43.8 44.6 73.8 170.0 5 27 A V + 0 0 9 1,-0.2 4,-0.3 513,-0.0 -1,-0.0 0.128 66.6 86.7 61.9 -21.6 46.6 75.1 167.1 6 28 A D S > S+ 0 0 23 -2,-1.0 3,-0.6 2,-0.1 -1,-0.2 0.905 86.8 61.4 -71.3 -35.7 44.0 73.8 164.6 7 29 A I T 3 S+ 0 0 4 1,-0.2 2,-0.9 4,-0.0 3,-0.1 -0.215 95.6 43.2 -74.8 178.2 42.4 77.1 165.3 8 30 A Y T 3 S+ 0 0 28 -4,-0.0 2,-0.4 427,-0.0 -1,-0.2 0.041 110.6 68.6 72.0 -32.6 44.4 80.2 164.3 9 31 A V S < S+ 0 0 2 -2,-0.9 426,-0.0 -3,-0.6 422,-0.0 -0.919 116.9 0.6-110.6 138.5 45.2 78.3 161.1 10 32 A N S S- 0 0 52 -2,-0.4 -1,-0.2 1,-0.1 3,-0.1 0.911 79.9-174.2 48.1 62.5 42.2 77.8 158.9 11 33 A P - 0 0 28 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.554 47.5 -66.2 -79.0 160.5 39.4 79.6 160.9 12 34 A P - 0 0 15 0, 0.0 112,-0.1 0, 0.0 111,-0.0 0.004 53.7-173.5 -47.1 147.4 35.9 79.3 159.4 13 35 A R - 0 0 112 -3,-0.1 169,-0.0 2,-0.0 -3,-0.0 0.774 5.6-165.0-110.6 -63.4 35.6 81.0 156.1 14 36 A V - 0 0 35 1,-0.1 2,-0.5 113,-0.0 113,-0.0 0.982 9.3-158.5 70.0 82.7 32.0 81.1 154.7 15 37 A D - 0 0 82 1,-0.0 -1,-0.1 3,-0.0 2,-0.1 -0.830 16.6-125.1 -96.5 130.5 32.1 82.0 151.0 16 38 A V - 0 0 93 -2,-0.5 2,-0.2 1,-0.1 115,-0.0 -0.399 34.9 -82.8 -76.0 151.7 28.9 83.5 149.5 17 39 A F - 0 0 39 -2,-0.1 2,-0.7 1,-0.1 -1,-0.1 -0.294 33.7-145.5 -57.3 115.5 27.0 82.1 146.4 18 40 A H + 0 0 166 -2,-0.2 -1,-0.1 1,-0.2 -3,-0.0 -0.733 34.5 164.8 -82.6 117.0 28.4 83.3 143.0 19 41 A G - 0 0 39 -2,-0.7 -1,-0.2 122,-0.0 119,-0.0 0.811 28.2-168.7 -97.4 -98.2 25.3 83.6 140.9 20 42 A T - 0 0 118 2,-0.1 3,-0.1 0, 0.0 -2,-0.0 0.841 32.6-125.5 92.2 86.6 24.7 85.3 137.5 21 43 A P - 0 0 85 0, 0.0 2,-0.2 0, 0.0 120,-0.0 -0.184 34.5-102.1 -52.3 149.7 21.0 85.4 136.8 22 44 A P - 0 0 37 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.600 23.0-155.6 -80.2 143.5 20.3 83.9 133.4 23 45 A A - 0 0 76 -2,-0.2 6,-0.1 -3,-0.1 5,-0.1 -0.753 28.9-135.8-117.5 80.0 19.6 86.3 130.4 24 46 A W - 0 0 17 -2,-0.5 27,-0.1 1,-0.1 0, 0.0 0.059 14.9-158.0 -41.5 133.8 17.6 83.9 128.2 25 47 A S S > S+ 0 0 106 3,-0.1 3,-0.6 25,-0.1 -1,-0.1 0.699 70.6 85.9 -87.0 -24.5 18.4 83.9 124.6 26 48 A S G > S- 0 0 16 1,-0.2 3,-3.0 2,-0.1 4,-0.3 -0.417 103.8 -3.0 -73.4 156.6 15.0 82.5 123.6 27 49 A F G > S- 0 0 27 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.744 123.6 -66.7 28.0 51.1 12.1 84.9 123.0 28 50 A G G < S- 0 0 59 -3,-0.6 -1,-0.3 1,-0.3 -3,-0.1 0.657 79.3 -77.6 51.1 28.3 14.1 88.0 124.0 29 51 A N G < S+ 0 0 67 -3,-3.0 -1,-0.3 -6,-0.1 -2,-0.2 0.954 93.0 142.4 48.9 52.8 14.6 86.9 127.6 30 52 A K < - 0 0 85 -3,-1.3 4,-0.3 -4,-0.3 -2,-0.1 0.829 37.3-156.7 -96.7 -34.7 11.0 88.1 128.2 31 53 A T > - 0 0 14 -4,-0.2 3,-1.5 1,-0.1 117,-0.1 0.699 29.6-110.8 60.1 135.8 9.0 85.9 130.6 32 54 A I T 3 S+ 0 0 37 116,-0.8 -1,-0.1 1,-0.3 116,-0.1 0.671 117.5 62.3 -70.9 -16.7 5.3 85.7 130.6 33 55 A W T 3 S+ 0 0 113 114,-0.3 -1,-0.3 124,-0.1 3,-0.1 0.628 85.2 101.8 -81.4 -12.3 5.2 87.5 134.0 34 56 A G S < S- 0 0 21 -3,-1.5 -4,-0.1 -4,-0.3 -3,-0.0 -0.288 98.8 -65.1 -65.4 154.6 6.8 90.4 132.3 35 57 A G S S+ 0 0 89 1,-0.2 -1,-0.2 2,-0.0 -2,-0.1 -0.143 78.3 132.2 -44.1 128.6 4.5 93.3 131.3 36 58 A N > + 0 0 55 -3,-0.1 3,-3.1 3,-0.1 -1,-0.2 0.359 24.7 119.5-154.3 -18.8 1.9 92.1 128.7 37 59 A E T 3 S+ 0 0 148 1,-0.3 -2,-0.0 3,-0.1 0, 0.0 0.655 88.9 24.8 -23.5 -53.3 -1.5 93.3 130.0 38 60 A W T 3 S+ 0 0 222 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 0.098 118.3 59.7-112.1 22.9 -2.3 95.5 127.0 39 61 A V S < S- 0 0 101 -3,-3.1 -3,-0.1 2,-0.1 0, 0.0 -0.472 70.3-131.7-126.8-158.6 -0.3 93.9 124.3 40 62 A D + 0 0 130 -2,-0.2 2,-0.3 2,-0.0 -3,-0.1 0.442 36.0 157.4-140.5 -9.0 -0.1 90.5 122.6 41 63 A D - 0 0 77 1,-0.1 -2,-0.1 -5,-0.1 0, 0.0 0.116 30.4-170.4 -23.5 75.5 3.6 89.6 122.5 42 64 A S - 0 0 83 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 -0.653 22.6-123.6 -90.7 139.3 3.0 85.9 122.2 43 65 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.584 28.1-136.5 -77.8 123.0 5.6 83.1 122.5 44 66 A T > - 0 0 69 -2,-0.4 4,-2.2 1,-0.1 5,-0.1 -0.253 27.8-100.0 -71.9 173.3 5.6 80.9 119.4 45 67 A R H > S+ 0 0 225 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.945 126.4 43.4 -60.9 -49.2 5.9 77.1 119.7 46 68 A S H > S+ 0 0 64 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.901 107.5 61.1 -64.0 -39.4 9.6 77.1 119.0 47 69 A D H > S+ 0 0 39 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.932 111.0 41.4 -50.9 -47.0 10.1 80.1 121.3 48 70 A I H X S+ 0 0 31 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.992 110.3 51.7 -66.8 -63.5 8.8 78.0 124.1 49 71 A E H X S+ 0 0 116 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.834 114.3 48.0 -41.8 -41.1 10.5 74.6 123.4 50 72 A K H X S+ 0 0 103 -4,-2.3 4,-2.2 2,-0.2 3,-0.3 0.983 108.6 50.7 -64.3 -60.0 13.8 76.5 123.2 51 73 A R H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 5,-0.3 0.867 109.1 54.6 -47.1 -39.6 13.2 78.5 126.4 52 74 A D H X S+ 0 0 31 -4,-2.9 4,-2.9 2,-0.2 -1,-0.3 0.950 106.4 50.8 -61.6 -44.9 12.5 75.1 128.0 53 75 A K H X S+ 0 0 132 -4,-2.1 4,-3.0 -3,-0.3 5,-0.3 0.946 111.9 46.6 -56.9 -50.3 15.9 73.8 126.8 54 76 A E H X S+ 0 0 48 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.942 115.0 45.1 -56.3 -55.6 17.7 76.8 128.3 55 77 A I H X S+ 0 0 8 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.887 114.9 50.9 -57.1 -40.0 15.9 76.6 131.6 56 78 A T H X S+ 0 0 73 -4,-2.9 4,-2.1 -5,-0.3 -2,-0.2 0.940 112.1 42.8 -63.8 -54.6 16.4 72.8 131.6 57 79 A A H X S+ 0 0 60 -4,-3.0 4,-1.4 1,-0.2 -1,-0.2 0.887 117.2 50.5 -60.6 -38.1 20.2 72.8 131.0 58 80 A Y H X S+ 0 0 39 -4,-2.6 4,-1.9 -5,-0.3 3,-0.3 0.931 105.9 51.0 -65.5 -55.8 20.6 75.7 133.4 59 81 A K H X S+ 0 0 67 -4,-2.8 4,-3.1 1,-0.3 3,-0.2 0.953 107.3 57.5 -46.7 -49.9 18.7 74.2 136.3 60 82 A N H X S+ 0 0 101 -4,-2.1 4,-3.0 1,-0.2 -1,-0.3 0.881 102.4 54.9 -47.4 -45.2 20.9 71.2 135.8 61 83 A T H X S+ 0 0 70 -4,-1.4 4,-2.5 -3,-0.3 -1,-0.2 0.937 110.1 43.8 -56.6 -50.6 23.9 73.4 136.3 62 84 A L H X S+ 0 0 12 -4,-1.9 4,-2.8 1,-0.2 -1,-0.3 0.899 112.1 57.7 -62.5 -34.4 22.6 74.6 139.6 63 85 A S H X S+ 0 0 34 -4,-3.1 4,-2.6 -5,-0.3 -2,-0.2 0.933 107.1 44.0 -61.0 -50.9 21.8 71.0 140.3 64 86 A A H X S+ 0 0 42 -4,-3.0 4,-2.3 2,-0.2 5,-0.3 0.959 113.1 52.5 -58.9 -49.4 25.3 69.8 139.9 65 87 A Q H X S+ 0 0 99 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.935 110.9 48.9 -50.7 -48.1 26.7 72.6 141.9 66 88 A Q H X S+ 0 0 22 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.911 106.5 52.7 -61.2 -49.7 24.2 71.7 144.7 67 89 A K H X S+ 0 0 146 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.941 116.2 41.2 -53.6 -47.2 25.0 68.0 144.8 68 90 A E H X S+ 0 0 130 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.860 111.2 57.7 -69.3 -31.5 28.7 68.9 145.2 69 91 A N H X S+ 0 0 34 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.2 0.849 105.3 51.5 -66.2 -34.7 27.9 71.7 147.6 70 92 A E H X S+ 0 0 41 -4,-2.5 4,-2.5 2,-0.2 3,-0.3 0.992 102.0 58.9 -63.9 -59.0 26.1 69.3 149.9 71 93 A N H X S+ 0 0 106 -4,-1.8 4,-2.3 1,-0.3 5,-0.2 0.813 105.5 50.1 -38.0 -47.7 29.1 66.9 150.0 72 94 A K H X S+ 0 0 105 -4,-1.5 4,-2.5 2,-0.2 -1,-0.3 0.976 109.2 50.6 -59.6 -51.3 31.2 69.6 151.4 73 95 A R H X S+ 0 0 78 -4,-1.7 4,-3.3 -3,-0.3 -2,-0.2 0.930 109.1 55.3 -50.1 -47.1 28.6 70.4 154.0 74 96 A T H X S+ 0 0 66 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.895 106.8 45.3 -53.0 -55.1 28.6 66.7 154.8 75 97 A E H X S+ 0 0 68 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.942 113.7 52.8 -56.7 -43.9 32.3 66.3 155.6 76 98 A A H X S+ 0 0 7 -4,-2.5 4,-2.7 1,-0.3 5,-0.2 0.977 105.9 52.4 -52.5 -57.9 32.0 69.5 157.6 77 99 A G H X S+ 0 0 22 -4,-3.3 4,-2.3 1,-0.3 -1,-0.3 0.854 107.9 52.9 -45.5 -41.4 29.2 67.9 159.5 78 100 A K H X S+ 0 0 117 -4,-2.3 4,-2.0 1,-0.2 -1,-0.3 0.969 109.5 47.2 -60.5 -50.4 31.5 64.9 160.1 79 101 A R H X S+ 0 0 69 -4,-2.8 4,-3.4 1,-0.3 -1,-0.2 0.839 107.1 57.9 -60.8 -31.3 34.1 67.3 161.5 80 102 A L H X S+ 0 0 27 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.3 0.954 104.3 53.6 -62.4 -44.4 31.4 68.9 163.6 81 103 A S H >X S+ 0 0 77 -4,-2.3 4,-2.4 -5,-0.2 3,-0.5 0.955 112.0 41.5 -54.2 -57.2 30.9 65.5 165.1 82 104 A A H 3X S+ 0 0 61 -4,-2.0 4,-2.0 1,-0.3 -1,-0.2 0.955 109.6 59.3 -56.5 -49.3 34.5 65.0 166.0 83 105 A A H 3X S+ 0 0 4 -4,-3.4 4,-2.0 1,-0.3 38,-0.3 0.849 109.3 45.7 -47.2 -38.4 34.7 68.6 167.2 84 106 A I H X S+ 0 0 129 -4,-2.3 4,-2.1 1,-0.2 3,-1.2 0.934 112.3 40.9 -53.3 -53.9 33.9 68.3 185.9 96 118 A T H 3X S+ 0 0 81 -4,-1.6 4,-1.5 1,-0.3 5,-0.3 0.937 108.5 62.0 -61.9 -41.6 35.9 65.5 187.7 97 119 A L H 3<>S+ 0 0 46 -4,-2.7 5,-2.3 -5,-0.3 -1,-0.3 0.798 111.5 40.0 -52.4 -27.0 38.8 67.9 187.9 98 120 A R H X<5S+ 0 0 118 -4,-1.3 3,-0.6 -3,-1.2 -1,-0.3 0.761 105.5 64.5 -90.9 -29.3 36.4 70.0 190.0 99 121 A A H 3<5S+ 0 0 87 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.645 109.7 40.9 -66.4 -18.6 35.0 67.0 191.8 100 122 A G T 3<5S- 0 0 61 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.490 112.2-121.2-104.7 -7.0 38.4 66.5 193.4 101 123 A N T < 5 - 0 0 144 -3,-0.6 -3,-0.2 -5,-0.3 3,-0.1 0.981 40.9-170.4 63.6 55.0 39.0 70.2 193.9 102 124 A A < - 0 0 34 -5,-2.3 -1,-0.1 1,-0.2 5,-0.0 -0.265 39.8 -63.7 -68.2 168.9 42.1 70.3 191.8 103 125 A D > - 0 0 108 1,-0.1 4,-2.5 4,-0.1 3,-0.4 -0.292 43.0-119.5 -62.0 138.5 44.2 73.4 191.9 104 126 A A H > S+ 0 0 68 1,-0.3 4,-3.0 2,-0.2 5,-0.1 0.852 117.3 50.7 -41.0 -44.1 42.6 76.6 190.6 105 127 A A H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.928 105.3 52.2 -64.6 -48.7 45.4 76.7 188.1 106 128 A D H > S+ 0 0 76 -3,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.957 116.7 42.8 -51.8 -48.3 45.0 73.1 186.9 107 129 A I H X S+ 0 0 19 -4,-2.5 4,-3.7 2,-0.2 -2,-0.2 0.897 106.6 59.2 -65.9 -42.0 41.4 73.9 186.4 108 130 A T H X S+ 0 0 40 -4,-3.0 4,-2.6 -5,-0.3 -1,-0.2 0.897 110.6 44.6 -54.3 -42.0 42.0 77.3 184.8 109 131 A R H X S+ 0 0 41 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.943 112.0 52.1 -68.0 -46.9 44.0 75.5 182.1 110 132 A Q H X S+ 0 0 10 -4,-2.4 4,-2.3 -5,-0.3 5,-0.2 0.952 110.0 48.6 -55.1 -49.7 41.4 72.9 181.8 111 133 A E H >X S+ 0 0 76 -4,-3.7 4,-2.8 1,-0.3 3,-0.7 0.970 111.0 49.1 -54.1 -56.4 38.7 75.5 181.3 112 134 A F H 3X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.3 -1,-0.3 0.841 110.0 55.5 -51.7 -31.2 40.8 77.3 178.7 113 135 A R H 3X S+ 0 0 73 -4,-2.4 4,-1.6 1,-0.2 -1,-0.3 0.903 108.7 43.9 -70.6 -40.4 41.2 73.8 177.2 114 136 A L H X S+ 0 0 6 -4,-2.6 4,-1.8 -5,-0.3 3,-0.6 0.969 107.8 38.5 -49.4 -64.2 33.7 77.0 164.1 124 146 A F H 3X S+ 0 0 38 -4,-1.9 4,-2.6 1,-0.3 -1,-0.2 0.847 108.6 62.1 -59.0 -34.7 32.1 74.2 162.2 125 147 A R H 3X S+ 0 0 111 -4,-2.6 4,-2.2 1,-0.2 -1,-0.3 0.957 106.3 48.5 -56.2 -43.4 28.6 75.1 163.2 126 148 A T H < S+ 0 0 37 -4,-2.9 3,-1.0 2,-0.2 -2,-0.2 0.891 110.3 50.2 -41.4 -47.6 13.4 81.9 139.3 145 167 A A H >X S+ 0 0 2 -4,-3.1 3,-1.7 1,-0.3 4,-0.7 0.976 110.8 46.7 -55.2 -62.0 14.4 79.7 136.4 146 168 A D H 3< S+ 0 0 51 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.664 99.6 75.8 -56.4 -11.4 11.2 77.8 136.5 147 169 A A T << S+ 0 0 0 -4,-1.7 -114,-0.3 -3,-1.0 -1,-0.3 0.301 93.6 47.4 -87.1 11.3 9.4 81.1 136.7 148 170 A D T <4 + 0 0 15 -3,-1.7 2,-1.9 -117,-0.1 -116,-0.8 0.705 67.4 131.7-117.6 -31.2 9.8 82.0 133.1 149 171 A S < - 0 0 20 -4,-0.7 -97,-0.1 1,-0.2 -2,-0.1 0.210 51.8-148.2 9.1 -46.2 8.8 78.8 131.4 150 172 A L S S+ 0 0 5 -2,-1.9 -1,-0.2 1,-0.1 -102,-0.1 0.343 86.5 82.9 75.1 -12.6 6.4 80.4 128.8 151 173 A R S S+ 0 0 156 -103,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.483 81.8 84.0 -92.7 -12.7 4.3 77.2 129.0 152 174 A I S S- 0 0 35 -4,-0.2 -5,-0.0 1,-0.1 -120,-0.0 -0.378 85.8-101.4 -93.1 171.0 2.6 78.5 132.1 153 175 A S > - 0 0 62 1,-0.1 4,-2.7 -2,-0.1 -1,-0.1 -0.693 35.6-114.7 -86.8 142.5 -0.3 80.8 132.8 154 176 A P H > S+ 0 0 86 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.804 119.4 59.2 -48.2 -26.4 0.6 84.3 133.9 155 177 A R H > S+ 0 0 153 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.998 105.0 43.2 -63.0 -70.2 -0.9 83.2 137.1 156 178 A E H > S+ 0 0 72 2,-0.2 4,-3.4 1,-0.2 -1,-0.2 0.825 114.5 57.0 -42.6 -38.4 1.5 80.4 137.8 157 179 A A H >X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 3,-0.7 0.975 105.1 44.6 -56.3 -76.5 4.1 82.8 136.6 158 180 A R H 3X S+ 0 0 122 -4,-2.3 4,-1.6 1,-0.3 -1,-0.2 0.669 117.9 49.4 -44.4 -23.0 3.5 85.6 139.1 159 181 A S H 3X S+ 0 0 29 -4,-2.0 4,-2.7 2,-0.2 -1,-0.3 0.926 106.8 51.4 -83.3 -49.2 3.3 82.8 141.8 160 182 A L H X S+ 0 0 15 -4,-3.4 4,-2.4 1,-0.3 3,-0.6 0.911 105.4 54.1 -48.1 -49.1 21.0 82.8 155.8 175 197 A D H 3X S+ 0 0 38 -4,-3.0 4,-2.3 1,-0.3 -1,-0.3 0.951 109.1 47.3 -51.3 -52.8 23.7 85.0 154.6 176 198 A K H 3X S+ 0 0 135 -4,-2.4 4,-1.9 1,-0.2 5,-0.3 0.796 108.5 56.5 -62.9 -26.7 23.3 87.3 157.5 177 199 A K H X S+ 0 0 87 -4,-1.9 4,-2.7 2,-0.2 3,-1.9 0.993 116.7 50.7 -56.7 -54.8 27.1 87.5 162.2 181 203 A M H 3X S+ 0 0 41 -4,-3.1 4,-2.1 1,-0.3 -2,-0.3 0.846 109.3 50.5 -46.3 -44.9 28.0 83.9 163.2 182 204 A L H 3X S+ 0 0 42 -4,-3.8 4,-1.1 2,-0.2 -1,-0.3 0.739 111.0 48.7 -69.2 -27.9 31.4 84.4 161.6 183 205 A A H X S+ 0 0 5 -4,-2.1 4,-2.6 1,-0.2 3,-1.5 0.919 110.0 37.7 -43.5 -62.4 33.6 83.5 166.3 186 208 A E H 3X S+ 0 0 85 -4,-1.1 4,-2.9 -3,-0.3 5,-0.2 0.928 110.4 61.5 -59.2 -41.4 36.3 86.2 166.2 187 209 A R H 3X S+ 0 0 163 -4,-2.9 4,-0.6 1,-0.2 -1,-0.3 0.765 112.1 40.9 -55.4 -25.1 34.4 88.0 169.0 188 210 A R H X S+ 0 0 155 -4,-3.2 4,-2.2 1,-0.2 3,-1.1 0.972 114.6 39.4 -55.7 -61.1 50.3 86.4 183.7 202 224 A N H 3X S+ 0 0 75 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.831 109.1 65.5 -61.5 -26.9 49.4 84.1 186.6 203 225 A G H 3X S+ 0 0 7 -4,-2.2 4,-1.5 -5,-0.4 -1,-0.3 0.863 107.2 39.2 -62.2 -38.4 51.8 81.5 185.3 204 226 A G H X S+ 0 0 18 -4,-1.5 4,-2.6 1,-0.2 3,-1.7 0.927 105.3 50.6 -43.0 -57.3 56.9 80.9 189.2 208 230 A A H 3X S+ 0 0 54 -4,-2.6 4,-2.9 1,-0.3 5,-0.5 0.922 102.7 58.4 -48.4 -57.8 58.1 83.8 191.3 209 231 A V H 3X S+ 0 0 75 -4,-1.8 4,-1.0 1,-0.3 -1,-0.3 0.767 112.6 42.4 -45.4 -30.1 56.5 82.5 194.5 210 232 A L H X S+ 0 0 63 -4,-2.9 4,-1.8 -5,-0.2 3,-0.7 0.814 113.1 55.1 -79.1 -32.0 61.6 83.4 196.2 213 235 A Q H 3X S+ 0 0 68 -4,-1.0 4,-2.0 -5,-0.5 -2,-0.2 0.957 107.7 48.4 -66.6 -44.6 60.5 80.4 198.3 214 236 A Q H 3X S+ 0 0 45 -4,-3.2 4,-0.6 1,-0.2 -1,-0.3 0.490 105.4 65.3 -72.6 -1.8 63.5 78.4 197.3 215 237 A A H X> S+ 0 0 48 -3,-0.7 4,-2.4 -5,-0.2 3,-1.1 0.940 102.0 42.1 -82.0 -59.6 65.4 81.6 198.1 216 238 A R H 3X S+ 0 0 166 -4,-1.8 4,-2.7 1,-0.3 5,-0.3 0.945 112.9 58.0 -49.6 -49.4 64.7 81.6 201.9 217 239 A L H 3X S+ 0 0 11 -4,-2.0 4,-2.5 1,-0.2 -1,-0.3 0.820 108.4 44.7 -49.5 -37.1 65.4 77.8 201.7 218 240 A L H X S+ 0 0 190 -4,-2.2 4,-1.3 -3,-0.4 3,-1.0 0.982 108.3 47.8 -71.3 -57.7 77.2 77.3 209.3 227 249 A A H 3X S+ 0 0 31 -4,-3.0 4,-2.2 1,-0.3 5,-0.3 0.875 104.5 63.2 -47.3 -43.8 75.6 76.2 212.6 228 250 A I H 3X S+ 0 0 17 -4,-2.8 4,-3.1 -5,-0.2 -1,-0.3 0.907 100.3 52.1 -49.1 -48.6 76.8 72.7 211.8 229 251 A S H X S+ 0 0 133 -4,-1.3 4,-2.4 1,-0.2 3,-1.0 0.920 116.4 41.9 -42.9 -67.8 80.1 75.5 215.3 231 253 A A H 3X S+ 0 0 19 -4,-2.2 4,-2.8 1,-0.3 5,-0.3 0.883 108.7 58.9 -50.2 -47.2 78.3 72.5 216.9 232 254 A R H 3X S+ 0 0 179 -4,-3.1 4,-0.9 -5,-0.3 -1,-0.3 0.883 112.4 43.6 -53.1 -34.6 80.6 70.0 215.3 233 255 A N H XX S+ 0 0 100 -4,-2.2 4,-2.4 -3,-1.0 3,-0.5 0.927 108.4 54.3 -76.3 -47.8 83.4 71.9 217.1 234 256 A K H 3X S+ 0 0 134 -4,-2.4 4,-1.3 1,-0.3 -2,-0.2 0.847 103.9 57.7 -58.1 -32.8 81.6 72.3 220.4 235 257 A L H 3X S+ 0 0 37 -4,-2.8 4,-2.9 -5,-0.2 -1,-0.3 0.901 108.7 47.8 -62.0 -39.8 81.2 68.5 220.4 236 258 A S H X S+ 0 0 121 -4,-3.7 4,-1.4 -5,-0.3 3,-0.9 0.987 108.9 38.0 -56.3 -59.3 88.1 66.7 224.4 241 263 A S H 3X S+ 0 0 36 -4,-1.0 4,-2.5 -3,-0.5 -2,-0.2 0.879 105.5 70.3 -59.7 -39.4 87.5 67.4 228.1 242 264 A L H 3X S+ 0 0 20 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.850 101.7 45.7 -46.8 -41.6 85.6 64.1 228.4 243 265 A N H < S+ 0 0 120 -4,-2.0 3,-1.8 1,-0.3 4,-0.5 0.938 111.0 41.9 -49.5 -57.4 97.6 51.4 245.5 259 281 A Q H 3< S+ 0 0 50 -4,-2.2 3,-0.5 1,-0.3 -1,-0.3 0.736 110.8 59.4 -64.6 -22.4 96.4 52.5 249.0 260 282 A K H 3< S+ 0 0 72 -4,-1.9 -1,-0.3 -3,-0.5 -2,-0.2 0.590 104.5 50.4 -82.4 -8.7 94.1 49.5 249.1 261 283 A N S << S+ 0 0 90 -3,-1.8 -1,-0.2 -4,-0.9 -2,-0.2 0.437 73.7 120.3-110.0 3.1 96.9 47.1 248.7 262 284 A T S > S- 0 0 49 -4,-0.5 4,-2.9 -3,-0.5 5,-0.3 -0.354 79.4-113.0 -60.5 143.4 99.3 48.3 251.4 263 285 A P H > S+ 0 0 99 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.952 124.3 37.7 -46.0 -50.3 99.9 45.4 253.8 264 286 A D H >> S+ 0 0 32 1,-0.2 4,-1.5 2,-0.2 3,-0.6 0.913 110.4 63.9 -65.5 -42.2 98.0 47.5 256.4 265 287 A G H >> S+ 0 0 1 1,-0.3 4,-2.2 2,-0.2 3,-1.1 0.919 96.2 55.9 -46.0 -55.3 95.7 48.8 253.7 266 288 A K H 3X S+ 0 0 74 -4,-2.9 4,-2.6 1,-0.3 -1,-0.3 0.864 103.0 56.8 -48.5 -41.3 94.3 45.3 253.1 267 289 A T H << S+ 0 0 4 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.886 104.2 50.5 -61.7 -39.0 93.4 45.1 256.8 268 290 A I H << S+ 0 0 25 -4,-1.5 -1,-0.2 -3,-1.1 -2,-0.2 0.964 114.1 46.3 -61.6 -44.8 91.3 48.3 256.5 269 291 A V H < S+ 0 0 62 -4,-2.2 -2,-0.3 1,-0.3 -1,-0.2 0.830 137.9 2.3 -63.8 -31.2 89.6 46.6 253.5 270 292 A S X - 0 0 20 -4,-2.6 4,-1.4 -5,-0.3 -1,-0.3 -0.713 53.9-175.9-164.4 104.2 89.3 43.4 255.5 271 293 A P T 4 S+ 0 0 0 0, 0.0 35,-0.2 0, 0.0 -1,-0.1 0.940 93.5 40.7 -64.2 -50.3 90.3 42.7 259.1 272 294 A E T 4 S+ 0 0 128 1,-0.2 34,-0.1 2,-0.1 -5,-0.1 0.926 116.7 46.7 -66.7 -47.8 89.4 39.0 259.0 273 295 A K T 4 S+ 0 0 160 1,-0.3 -1,-0.2 -7,-0.1 -6,-0.1 0.787 134.5 16.6 -66.1 -28.8 90.8 38.2 255.5 274 296 A F S < S- 0 0 77 -4,-1.4 -1,-0.3 -7,-0.2 -4,-0.2 -0.721 83.8-150.8-145.8 88.4 94.0 40.1 256.5 275 297 A P - 0 0 35 0, 0.0 2,-0.7 0, 0.0 30,-0.2 -0.366 14.9-131.5 -61.2 139.0 94.4 40.7 260.2 276 298 A G E +A 304 0A 4 28,-2.8 28,-3.0 -9,-0.1 2,-0.3 -0.871 36.9 174.0 -96.1 116.3 96.4 43.8 261.1 277 299 A R E +A 303 0A 158 -2,-0.7 2,-0.3 26,-0.3 26,-0.2 -0.836 16.5 175.1-123.0 163.9 99.1 43.0 263.6 278 300 A S E +A 302 0A 21 24,-1.9 24,-1.0 -2,-0.3 2,-0.3 -0.919 5.6 178.1-165.7 137.5 102.0 44.6 265.3 279 301 A S E -A 301 0A 62 -2,-0.3 2,-0.4 22,-0.2 22,-0.2 -0.998 10.0-165.6-150.1 151.1 104.4 43.6 268.0 280 302 A T E -A 300 0A 38 20,-1.5 20,-1.8 -2,-0.3 2,-0.5 -0.999 19.9-133.1-141.7 132.7 107.4 44.9 269.9 281 303 A N E -A 299 0A 131 -2,-0.4 2,-0.4 18,-0.2 18,-0.2 -0.780 27.2-169.6 -84.9 126.2 110.0 43.1 272.1 282 304 A D E -A 298 0A 39 16,-1.0 16,-0.8 -2,-0.5 2,-0.7 -0.908 21.1-153.0-120.3 144.3 110.6 45.0 275.3 283 305 A S E -A 297 0A 85 -2,-0.4 2,-0.3 14,-0.2 14,-0.2 -0.812 27.8-171.7-113.1 80.0 113.3 44.2 277.8 284 306 A I E -A 296 0A 19 12,-1.2 12,-2.2 -2,-0.7 2,-0.4 -0.610 6.2-152.8 -78.6 139.7 111.5 45.5 280.9 285 307 A V E -A 295 0A 73 -2,-0.3 2,-0.3 10,-0.3 10,-0.3 -0.917 5.5-160.3-116.9 141.3 113.5 45.8 284.1 286 308 A V - 0 0 8 8,-1.8 2,-0.2 -2,-0.4 8,-0.1 -0.779 10.2-179.1-113.4 162.1 112.3 45.6 287.7 287 309 A S + 0 0 67 -2,-0.3 2,-0.8 6,-0.2 51,-0.1 -0.748 47.5 40.7-145.6-174.7 113.9 46.8 290.9 288 310 A G S S+ 0 0 68 -2,-0.2 5,-0.1 5,-0.1 -2,-0.0 -0.580 94.0 66.8 74.5-108.2 113.3 46.9 294.6 289 311 A D >> - 0 0 61 -2,-0.8 3,-2.3 1,-0.2 4,-1.8 -0.276 69.1-151.7 -55.7 110.4 111.8 43.6 295.6 290 312 A P T 34 S+ 0 0 113 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.616 91.9 67.8 -58.4 -16.0 114.4 40.9 295.1 291 313 A R T 34 S+ 0 0 179 1,-0.2 -2,-0.1 3,-0.0 45,-0.1 0.783 122.5 15.5 -77.8 -21.8 111.7 38.3 294.6 292 314 A F T <4 S+ 0 0 61 -3,-2.3 2,-0.4 -5,-0.1 -1,-0.2 0.385 92.5 126.9-127.1 -3.5 110.8 40.1 291.3 293 315 A A < + 0 0 49 -4,-1.8 2,-0.2 -5,-0.1 -6,-0.2 -0.444 48.7 74.7 -64.1 117.1 113.8 42.3 290.8 294 316 A G S S- 0 0 30 -2,-0.4 -8,-1.8 -8,-0.1 2,-0.3 -0.761 85.4 -63.5-175.4-138.9 115.1 41.6 287.3 295 317 A T E -A 285 0A 82 -10,-0.3 2,-0.4 -2,-0.2 -10,-0.3 -0.870 41.6-152.4-148.7 99.6 114.7 42.1 283.6 296 318 A I E -A 284 0A 45 -12,-2.2 -12,-1.2 -2,-0.3 2,-0.7 -0.702 5.5-154.4 -78.1 129.8 111.5 40.5 282.3 297 319 A K E +A 283 0A 184 -2,-0.4 2,-0.2 -14,-0.2 -14,-0.2 -0.808 33.6 147.1-111.2 91.2 111.9 39.5 278.7 298 320 A I E -A 282 0A 46 -16,-0.8 -16,-1.0 -2,-0.7 2,-0.4 -0.503 42.7-128.5-113.0-177.7 108.4 39.4 277.0 299 321 A T E -A 281 0A 92 -18,-0.2 2,-0.7 -2,-0.2 -18,-0.2 -0.902 16.2-146.0-139.2 105.5 106.9 40.1 273.6 300 322 A T E -A 280 0A 7 -20,-1.8 -20,-1.5 -2,-0.4 2,-0.3 -0.589 23.8-176.4 -76.5 111.7 103.9 42.4 273.4 301 323 A S E +A 279 0A 82 -2,-0.7 2,-0.3 -22,-0.2 -22,-0.2 -0.843 10.0 173.2-109.6 152.2 101.5 41.2 270.6 302 324 A A E -A 278 0A 2 -24,-1.0 -24,-1.9 -2,-0.3 2,-0.3 -0.975 4.3-177.6-152.8 141.9 98.4 42.9 269.4 303 325 A V E -A 277 0A 53 -2,-0.3 2,-0.5 -26,-0.2 -26,-0.3 -0.996 15.6-155.7-147.1 144.2 96.2 41.9 266.4 304 326 A I E +A 276 0A 0 -28,-3.0 -28,-2.8 -2,-0.3 3,-0.1 -0.994 27.3 152.9-120.4 125.4 93.0 43.4 264.8 305 327 A D + 0 0 81 -2,-0.5 2,-0.3 -30,-0.2 3,-0.1 0.046 50.1 64.2-144.5 30.2 90.9 40.9 262.8 306 328 A N > - 0 0 61 -35,-0.2 4,-3.5 1,-0.1 5,-0.2 -0.976 68.8-131.1-157.8 139.0 87.3 42.2 262.9 307 329 A R H > S+ 0 0 114 -2,-0.3 4,-2.9 2,-0.2 5,-0.3 0.931 108.8 56.1 -53.4 -51.8 85.4 45.2 261.6 308 330 A A H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.953 116.2 35.6 -45.3 -59.4 83.7 45.7 265.0 309 331 A N H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.917 113.0 56.7 -66.3 -44.1 87.1 45.9 266.7 310 332 A L H X S+ 0 0 4 -4,-3.5 4,-2.1 1,-0.2 5,-0.2 0.915 109.6 48.5 -53.4 -45.2 89.0 47.7 263.9 311 333 A N H X S+ 0 0 85 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.980 108.4 52.4 -59.8 -54.0 86.4 50.5 264.0 312 334 A Y H < S+ 0 0 54 -4,-2.1 3,-0.4 -5,-0.3 -2,-0.2 0.907 110.5 48.8 -46.9 -54.9 86.5 50.8 267.8 313 335 A L H >< S+ 0 0 0 -4,-2.5 3,-3.3 1,-0.3 -1,-0.2 0.969 108.3 50.6 -51.6 -65.9 90.3 51.2 267.7 314 336 A L H 3< S+ 0 0 15 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.828 117.4 45.3 -44.5 -29.1 90.4 53.9 265.0 315 337 A S T 3< S+ 0 0 75 -4,-2.1 -1,-0.3 -3,-0.4 2,-0.2 0.087 120.3 26.8-105.4 24.9 87.7 55.6 267.2 316 338 A H S < S- 0 0 64 -3,-3.3 2,-0.2 -5,-0.1 3,-0.1 -0.834 88.5 -72.6-158.8-168.2 89.4 55.3 270.6 317 339 A S > - 0 0 44 -2,-0.2 4,-2.6 1,-0.2 5,-0.1 -0.552 31.6-123.4 -96.2 169.8 92.7 54.9 272.5 318 340 A G H > S+ 0 0 0 2,-0.2 4,-3.4 -2,-0.2 5,-0.3 0.979 118.9 49.4 -72.4 -52.3 94.9 51.9 272.6 319 341 A L H > S+ 0 0 75 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.799 112.1 49.4 -48.7 -42.5 94.6 52.1 276.4 320 342 A D H > S+ 0 0 44 2,-0.2 4,-2.3 3,-0.2 5,-0.3 0.979 110.8 46.5 -62.6 -58.3 90.9 52.3 276.0 321 343 A Y H >X>S+ 0 0 10 -4,-2.6 4,-3.1 1,-0.3 5,-1.5 0.930 113.9 51.1 -49.4 -47.6 90.6 49.3 273.6 322 344 A K H 3<5S+ 0 0 9 -4,-3.4 6,-1.9 1,-0.3 -1,-0.3 0.885 118.1 39.1 -57.0 -39.0 92.8 47.5 276.1 323 345 A R H 3<5S+ 0 0 139 -4,-1.8 -2,-0.3 -5,-0.3 -1,-0.3 0.576 128.0 28.8 -91.9 -9.5 90.4 48.6 278.8 324 346 A N H <<5S+ 0 0 78 -4,-2.3 -3,-0.2 -3,-0.6 -2,-0.2 0.557 124.1 35.8-129.0 -9.6 87.1 48.2 276.9 325 347 A I T <5S+ 0 0 51 -4,-3.1 -3,-0.2 -5,-0.3 -4,-0.1 0.658 132.1 28.4-111.9 -31.7 87.4 45.4 274.3 326 348 A L S + 0 0 22 1,-0.2 4,-2.8 2,-0.1 5,-0.2 -0.556 53.7 170.3 -88.2 85.1 104.5 41.7 291.0 337 359 A V H > S+ 0 0 62 -2,-1.6 4,-2.8 2,-0.2 5,-0.2 0.914 73.0 46.7 -56.5 -58.6 103.2 45.3 290.9 338 360 A E H > S+ 0 0 57 2,-0.2 4,-2.9 1,-0.2 3,-0.3 0.977 117.9 42.7 -50.4 -59.6 106.2 47.0 289.3 339 361 A G H > S+ 0 0 0 1,-0.3 4,-3.4 2,-0.2 5,-0.2 0.925 113.9 51.7 -54.6 -50.7 106.5 44.4 286.6 340 362 A D H X S+ 0 0 22 -4,-2.8 4,-2.0 1,-0.2 -1,-0.3 0.861 112.0 45.9 -59.2 -34.7 102.8 44.2 286.0 341 363 A K H X S+ 0 0 103 -4,-2.8 4,-2.4 -3,-0.3 5,-0.2 0.953 114.9 46.6 -74.3 -43.9 102.5 47.9 285.6 342 364 A K H X S+ 0 0 73 -4,-2.9 4,-1.8 -5,-0.2 -2,-0.2 0.919 112.7 50.1 -63.0 -42.2 105.5 48.2 283.3 343 365 A I H X S+ 0 0 30 -4,-3.4 4,-2.9 -5,-0.2 3,-0.3 0.967 110.0 50.7 -59.7 -54.0 104.3 45.2 281.2 344 366 A Y H X S+ 0 0 24 -4,-2.0 4,-3.0 2,-0.3 5,-0.3 0.942 106.8 52.3 -47.0 -62.3 100.8 46.7 280.9 345 367 A N H X S+ 0 0 104 -4,-2.4 4,-2.4 1,-0.3 -1,-0.3 0.874 112.8 47.9 -44.6 -39.4 102.1 50.1 279.7 346 368 A A H X S+ 0 0 14 -4,-1.8 4,-1.6 -3,-0.3 -1,-0.3 0.971 109.3 51.5 -66.6 -50.0 104.0 48.0 277.2 347 369 A E H X S+ 0 0 69 -4,-2.9 4,-1.0 1,-0.2 -2,-0.2 0.838 114.0 45.5 -53.9 -38.6 100.9 46.0 276.2 348 370 A V H X S+ 0 0 12 -4,-3.0 4,-2.7 -5,-0.2 -1,-0.2 0.890 99.9 65.2 -75.0 -39.7 99.1 49.2 275.7 349 371 A A H X S+ 0 0 34 -4,-2.4 4,-3.5 -5,-0.3 5,-0.2 0.883 99.4 58.6 -50.3 -39.9 101.8 51.0 273.7 350 372 A E H X S+ 0 0 1 -4,-1.6 4,-3.1 2,-0.2 5,-0.4 0.975 105.2 44.6 -52.9 -66.7 101.2 48.3 271.1 351 373 A W H X S+ 0 0 17 -4,-1.0 4,-3.5 1,-0.2 3,-0.3 0.927 114.8 52.0 -44.2 -50.4 97.5 49.1 270.6 352 374 A D H X S+ 0 0 65 -4,-2.7 4,-2.5 1,-0.2 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4,-2.9 -3,-0.3 3,-0.7 0.974 107.9 52.0 -52.6 -59.9 92.5 54.5 256.7 363 385 A N H 3X S+ 0 0 69 -4,-2.0 4,-2.9 1,-0.3 5,-0.3 0.803 103.5 58.7 -45.9 -40.8 93.1 58.1 255.8 364 386 A K H 3X S+ 0 0 111 -4,-2.2 4,-1.9 1,-0.2 -1,-0.3 0.954 110.8 40.5 -58.9 -47.0 95.2 57.0 252.8 365 387 A I H X S+ 0 0 39 -4,-2.2 4,-2.6 -5,-0.3 3,-0.6 0.993 111.8 48.6 -58.4 -66.3 89.6 61.9 244.8 372 394 A V H >X S+ 0 0 15 -4,-3.1 4,-3.3 1,-0.3 3,-0.6 0.848 114.8 42.5 -37.4 -69.7 88.1 59.0 242.9 373 395 A N H 3X S+ 0 0 74 -4,-2.7 4,-1.4 1,-0.3 -1,-0.3 0.831 110.8 56.8 -54.4 -33.6 84.6 60.0 243.4 374 396 A S H X< S+ 0 0 83 -4,-2.7 3,-0.7 -3,-0.6 -1,-0.3 0.965 113.9 39.6 -62.4 -44.1 85.4 63.6 242.6 375 397 A A H XX S+ 0 0 16 -4,-2.6 3,-2.6 -3,-0.6 4,-2.3 0.972 114.5 53.8 -65.3 -47.9 86.8 62.5 239.3 376 398 A R H 3X S+ 0 0 157 -4,-3.3 4,-0.8 1,-0.3 -1,-0.3 0.646 110.0 49.3 -60.4 -16.0 84.0 60.1 238.9 377 399 A N H << S+ 0 0 121 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.199 110.2 48.2-110.3 15.9 81.6 63.0 239.5 378 400 A N H <> S+ 0 0 63 -3,-2.6 4,-3.0 2,-0.1 -2,-0.2 0.550 105.8 57.8-116.5 -33.2 83.2 65.3 236.9 379 401 A L H X S+ 0 0 33 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.995 110.4 43.7 -59.7 -60.3 83.3 62.7 234.2 380 402 A S H X S+ 0 0 63 -4,-0.8 4,-2.4 1,-0.2 5,-0.2 0.923 111.2 54.9 -49.5 -49.1 79.6 62.3 234.5 381 403 A A H > S+ 0 0 38 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.932 113.3 43.8 -49.9 -46.2 79.3 66.1 234.7 382 404 A R H >X S+ 0 0 76 -4,-3.0 4,-1.9 1,-0.2 3,-0.6 0.905 107.6 56.0 -68.9 -42.9 81.2 66.1 231.4 383 405 A T H 3X S+ 0 0 59 -4,-3.1 4,-2.3 1,-0.3 -1,-0.2 0.855 99.8 61.0 -60.6 -33.1 79.3 63.3 229.7 384 406 A N H 3X S+ 0 0 99 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.3 0.919 106.9 47.9 -56.4 -42.4 76.0 65.2 230.3 385 407 A E H << S+ 0 0 77 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.906 105.1 57.1 -64.7 -44.4 77.6 67.8 228.1 386 408 A Q H >X S+ 0 0 59 -4,-1.9 4,-3.0 1,-0.2 3,-1.7 0.927 107.9 48.1 -55.2 -47.3 78.7 65.4 225.4 387 409 A K H 3X S+ 0 0 122 -4,-2.3 4,-2.9 1,-0.3 2,-0.8 0.990 108.1 55.2 -55.9 -53.0 75.1 64.3 225.0 388 410 A H H 3< S+ 0 0 117 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.211 114.5 41.7 -68.6 20.9 74.1 67.9 224.8 389 411 A A H <> S+ 0 0 4 -3,-1.7 4,-2.9 -2,-0.8 -1,-0.2 0.519 116.5 42.5-127.6 -55.1 76.6 68.3 222.0 390 412 A N H X S+ 0 0 83 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.967 119.1 46.4 -60.4 -52.6 76.1 65.2 219.9 391 413 A D H X S+ 0 0 76 -4,-2.9 4,-3.1 -5,-0.3 5,-0.2 0.952 113.7 48.4 -52.1 -55.7 72.3 65.5 220.3 392 414 A A H > S+ 0 0 48 -5,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.872 112.0 49.5 -52.7 -44.6 72.4 69.2 219.4 393 415 A L H X S+ 0 0 21 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.941 112.5 48.4 -60.9 -48.3 74.6 68.5 216.4 394 416 A N H X S+ 0 0 73 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.911 103.5 58.4 -59.6 -48.3 72.2 65.8 215.3 395 417 A A H >X S+ 0 0 60 -4,-3.1 4,-1.7 1,-0.3 3,-0.8 0.934 109.1 47.8 -47.7 -47.1 69.1 67.9 215.7 396 418 A L H 3X S+ 0 0 44 -4,-1.7 4,-2.1 1,-0.3 -1,-0.3 0.906 104.6 58.3 -61.5 -40.8 70.7 70.2 213.2 397 419 A L H 3X S+ 0 0 63 -4,-1.9 4,-2.0 1,-0.2 -1,-0.3 0.775 103.3 56.7 -60.8 -23.4 71.5 67.2 211.0 398 420 A K H X S+ 0 0 101 -4,-3.3 4,-2.7 -5,-0.2 3,-0.6 0.998 105.0 53.7 -66.5 -64.9 58.1 76.8 177.8 423 445 A E H 3X S+ 0 0 101 -4,-2.6 4,-2.9 1,-0.3 5,-0.3 0.816 106.1 55.7 -37.8 -47.1 56.0 74.5 175.7 424 446 A L H 3X S+ 0 0 22 -4,-1.8 4,-2.7 2,-0.2 3,-0.3 0.960 111.0 43.0 -53.5 -56.3 53.2 77.1 175.6 425 447 A K H X S+ 0 0 4 -4,-1.1 4,-2.0 -5,-0.4 3,-1.2 0.970 102.7 54.1 -63.5 -51.4 55.1 77.9 166.1 431 453 A I H 3X S+ 0 0 10 -4,-2.7 4,-1.1 -3,-0.4 -1,-0.3 0.766 111.3 50.8 -54.2 -19.9 51.4 78.8 165.6 432 454 A N H 3X S+ 0 0 77 -4,-1.4 4,-2.5 -3,-0.2 -1,-0.3 0.748 101.0 58.3 -91.3 -23.4 53.0 82.1 164.5 433 455 A F H X S+ 0 0 109 -4,-2.0 4,-2.4 -5,-0.3 3,-1.0 0.955 107.1 44.9 -62.3 -58.2 50.8 85.0 154.3 440 462 A S H 3X S+ 0 0 51 -4,-1.2 4,-2.2 -3,-0.4 5,-0.3 0.785 109.5 60.4 -57.2 -25.6 54.1 85.3 152.5 441 463 A V H 3X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 5,-0.3 0.882 105.9 46.2 -66.3 -36.9 52.7 82.5 150.4 442 464 A S H < - 0 0 32 -4,-1.7 3,-2.5 -5,-0.3 4,-0.1 0.592 45.0 -36.6 63.0 147.7 48.8 85.5 145.6 447 469 A A T >> S+ 0 0 68 1,-0.3 4,-1.5 -5,-0.2 3,-0.8 0.355 126.7 53.6 8.3 -88.0 45.4 84.5 146.9 448 470 A K H 3> S+ 0 0 134 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.799 105.6 60.0 -32.4 -45.6 44.7 81.1 145.3 449 471 A A H <> S+ 0 0 0 -3,-2.5 4,-2.6 -4,-0.5 3,-0.3 0.950 107.3 40.3 -54.1 -57.9 48.0 79.9 146.7 450 472 A E H <> S+ 0 0 36 -3,-0.8 4,-2.2 1,-0.2 5,-0.3 0.979 112.0 56.3 -58.4 -56.1 47.2 80.5 150.4 451 473 A Q H X S+ 0 0 51 -4,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.814 111.1 45.9 -43.8 -38.1 43.6 79.2 150.1 452 474 A L H X S+ 0 0 7 -4,-2.1 4,-3.0 -5,-0.3 6,-0.3 0.991 109.5 53.2 -68.8 -57.3 45.1 76.0 148.7 453 475 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 3,-0.4 0.903 116.2 39.9 -40.5 -60.4 47.8 75.7 151.3 454 476 A R H X S+ 0 0 68 -4,-2.2 4,-2.4 1,-0.3 -1,-0.2 0.967 112.2 53.9 -56.4 -59.3 45.1 76.0 154.1 455 477 A E H X S+ 0 0 57 -4,-2.5 4,-1.7 1,-0.3 -1,-0.3 0.799 108.0 53.3 -49.4 -27.6 42.6 73.9 152.3 456 478 A M H >< S+ 0 0 1 -4,-3.0 3,-0.7 -3,-0.4 -1,-0.3 0.990 112.8 40.5 -70.5 -51.3 45.3 71.2 152.1 457 479 A A H 3X S+ 0 0 9 -4,-2.3 4,-0.9 1,-0.3 -2,-0.3 0.700 106.8 73.2 -64.5 -16.9 45.9 71.5 155.9 458 480 A G H 3< S+ 0 0 24 -4,-2.4 -1,-0.3 -6,-0.3 -2,-0.2 0.943 109.8 23.0 -62.8 -54.6 42.1 71.7 155.9 459 481 A Q T << S+ 0 0 30 -4,-1.7 2,-2.1 -3,-0.7 -3,-0.1 0.407 111.6 65.9 -79.6-125.5 41.6 68.0 155.1 460 482 A A T >4 S+ 0 0 0 2,-0.1 3,-2.4 4,-0.1 99,-0.5 -0.216 76.3 98.3 49.5 -82.3 44.8 66.3 156.2 461 483 A K T 3< S+ 0 0 83 -2,-2.1 3,-0.1 -4,-0.9 -1,-0.1 -0.100 103.6 2.7 -38.2 100.4 44.1 67.1 159.9 462 484 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.3 -2,-0.1 2,-0.2 -0.107 112.6 98.2 109.7 -35.0 42.6 63.9 161.1 463 485 A K < - 0 0 59 -3,-2.4 95,-1.7 1,-0.0 96,-0.6 -0.596 66.6-128.1 -92.3 148.3 42.9 61.8 157.9 464 486 A K B -B 557 0B 141 93,-0.2 93,-0.3 -2,-0.2 92,-0.1 -0.629 41.0 -82.5 -91.2 153.2 45.7 59.3 157.1 465 487 A I - 0 0 12 91,-2.9 125,-0.2 -2,-0.2 -1,-0.1 -0.183 56.0-104.2 -54.3 140.9 47.7 59.4 153.9 466 488 A R - 0 0 39 123,-3.8 -1,-0.1 1,-0.1 5,-0.1 -0.286 39.9 -84.1 -72.1 154.5 46.0 57.7 150.9 467 489 A N > - 0 0 75 1,-0.1 4,-2.0 3,-0.1 -1,-0.1 -0.260 39.4-124.5 -55.2 134.6 46.7 54.4 149.4 468 490 A V H >> S+ 0 0 14 2,-0.2 4,-2.9 1,-0.2 3,-0.8 0.914 107.0 40.1 -46.5 -69.1 49.6 54.4 146.9 469 491 A E H 3> S+ 0 0 102 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.899 117.1 50.7 -54.6 -41.2 47.9 52.9 143.9 470 492 A E H 3> S+ 0 0 115 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.827 112.1 51.1 -65.6 -24.4 44.8 54.9 144.7 471 493 A A H XX S+ 0 0 0 -4,-2.0 4,-1.9 -3,-0.8 3,-0.5 0.939 108.7 47.2 -75.0 -50.7 47.1 57.9 144.9 472 494 A L H 3X S+ 0 0 27 -4,-2.9 4,-3.4 1,-0.2 5,-0.3 0.906 104.4 62.9 -59.6 -39.8 48.8 57.3 141.5 473 495 A K H 3X S+ 0 0 132 -4,-2.4 4,-1.1 -5,-0.3 -1,-0.2 0.881 105.4 46.2 -53.5 -42.1 45.5 56.8 139.9 474 496 A T H XX S+ 0 0 2 -4,-0.9 4,-1.8 -3,-0.5 3,-0.6 0.953 114.1 46.7 -67.0 -49.7 44.5 60.4 140.8 475 497 A Y H 3< S+ 0 0 2 -4,-1.9 4,-0.3 1,-0.2 -2,-0.2 0.939 107.3 56.7 -59.7 -46.5 47.8 61.9 139.7 476 498 A E H >< S+ 0 0 109 -4,-3.4 3,-0.6 1,-0.2 4,-0.4 0.804 106.0 52.3 -55.2 -31.7 47.8 60.0 136.3 477 499 A K H << S+ 0 0 118 -4,-1.1 3,-0.3 -3,-0.6 -1,-0.2 0.954 112.3 42.9 -70.2 -46.3 44.4 61.5 135.5 478 500 A Y T >X S+ 0 0 33 -4,-1.8 4,-2.6 1,-0.2 3,-0.6 0.331 91.1 106.6 -80.5 10.3 45.6 65.0 136.2 479 501 A R H <> S+ 0 0 47 -3,-0.6 2,-3.1 -4,-0.3 4,-1.6 0.969 73.1 46.1 -50.9 -76.3 48.8 64.0 134.3 480 502 A A H 34 S+ 0 0 76 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.0 -0.271 120.7 40.6 -72.5 58.9 48.3 65.9 131.0 481 503 A D H <> S+ 0 0 52 -2,-3.1 4,-1.1 -3,-0.6 -1,-0.2 -0.012 110.4 51.2-160.9 -66.0 47.3 69.1 132.8 482 504 A I H < S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.3 4,-0.2 0.662 126.9 31.8 -58.8 -14.8 49.7 69.2 135.7 483 505 A N T < S+ 0 0 24 -4,-1.6 -1,-0.3 -5,-0.3 -3,-0.2 0.627 115.5 60.3-113.5 -22.9 52.4 68.7 133.0 484 506 A K T 4 S+ 0 0 142 -5,-0.4 3,-0.5 2,-0.1 -2,-0.2 0.992 90.3 67.2 -64.0 -74.0 50.7 70.5 130.1 485 507 A K S < S- 0 0 54 -4,-1.1 2,-0.4 1,-0.2 -3,-0.1 0.559 124.3 -26.8 -12.2 -93.1 50.4 74.0 131.6 486 508 A I S S+ 0 0 86 -4,-0.2 -1,-0.2 91,-0.1 2,-0.1 -0.914 79.1 137.7-141.2 104.6 53.9 75.1 131.8 487 509 A N + 0 0 31 -3,-0.5 -2,-0.0 -2,-0.4 -4,-0.0 -0.564 29.6 112.1-148.3 80.1 56.6 72.5 132.1 488 510 A A S > S- 0 0 71 -2,-0.1 4,-0.6 3,-0.0 -2,-0.0 0.623 98.4 -14.8-111.4 -89.0 59.6 73.2 130.0 489 511 A K H > S+ 0 0 167 2,-0.2 4,-2.0 1,-0.2 3,-0.4 0.834 127.1 78.3 -83.9 -37.2 62.9 74.2 131.6 490 512 A D H > S+ 0 0 51 1,-0.3 4,-3.4 2,-0.2 5,-0.2 0.793 89.3 54.6 -36.1 -45.7 60.8 74.7 134.7 491 513 A R H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.978 107.6 46.3 -58.8 -57.8 60.8 71.0 135.2 492 514 A A H X S+ 0 0 59 -4,-0.6 4,-1.9 -3,-0.4 -1,-0.2 0.790 115.8 49.2 -56.5 -28.5 64.6 70.6 135.1 493 515 A A H X S+ 0 0 58 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.956 108.0 51.2 -73.9 -52.4 64.7 73.6 137.5 494 516 A I H X S+ 0 0 7 -4,-3.4 4,-2.1 -5,-0.2 -2,-0.2 0.876 115.7 45.0 -50.4 -43.1 62.1 72.2 139.9 495 517 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 3,-0.4 1.000 113.1 44.3 -66.9 -68.4 64.1 69.0 140.0 496 518 A A H X S+ 0 0 38 -4,-1.9 4,-2.4 1,-0.3 -2,-0.2 0.881 116.3 51.7 -43.5 -44.7 67.7 70.2 140.4 497 519 A A H < S+ 0 0 34 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.915 107.9 49.8 -59.3 -48.7 66.3 72.6 143.0 498 520 A L H >< S+ 0 0 0 -4,-2.1 3,-1.2 -3,-0.4 -1,-0.2 0.936 109.7 52.5 -56.1 -49.0 64.6 69.9 144.9 499 521 A E H 3< S+ 0 0 70 -4,-2.7 2,-1.3 1,-0.3 -2,-0.2 0.947 96.9 67.2 -52.0 -55.1 67.8 67.9 145.0 500 522 A S T 3< S+ 0 0 91 -4,-2.4 2,-0.3 -5,-0.2 -1,-0.3 0.229 74.1 130.3 -55.6 16.9 69.8 70.7 146.4 501 523 A V < - 0 0 24 -2,-1.3 2,-0.9 -3,-1.2 3,-0.1 -0.577 52.4-146.6 -83.4 137.7 68.0 70.6 149.7 502 524 A K >> - 0 0 126 -2,-0.3 4,-2.2 69,-0.2 3,-0.8 -0.853 8.1-167.0-101.2 93.1 70.0 70.5 152.9 503 525 A L H 3> S+ 0 0 60 -2,-0.9 4,-2.4 1,-0.3 -1,-0.2 0.926 89.0 61.2 -44.2 -50.3 67.8 68.4 155.2 504 526 A S H 3> S+ 0 0 92 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.877 107.9 42.6 -43.4 -48.9 70.0 69.6 158.0 505 527 A D H <4 S+ 0 0 104 -3,-0.8 3,-0.4 1,-0.2 4,-0.4 0.931 118.5 42.2 -69.7 -45.5 68.9 73.2 157.3 506 528 A I H X S+ 0 0 5 -4,-2.2 4,-1.8 1,-0.2 3,-0.3 0.607 89.8 90.8 -78.6 -12.4 65.2 72.6 156.8 507 529 A S H X S+ 0 0 49 -4,-2.4 4,-1.9 -5,-0.3 3,-0.3 0.926 84.1 52.5 -47.7 -53.0 64.9 70.1 159.7 508 530 A S H X S+ 0 0 67 -4,-0.5 4,-2.2 -3,-0.4 -1,-0.2 0.870 105.5 53.4 -53.1 -45.0 64.0 72.9 162.2 509 531 A N H > S+ 0 0 33 -4,-0.4 4,-3.3 -3,-0.3 -1,-0.2 0.910 106.2 54.0 -57.3 -44.5 61.1 74.3 160.0 510 532 A L H X S+ 0 0 8 -4,-1.8 4,-2.7 -3,-0.3 -1,-0.2 0.928 108.0 50.4 -56.3 -44.3 59.6 70.8 159.9 511 533 A N H X S+ 0 0 97 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.891 112.7 45.9 -63.2 -39.7 59.7 70.7 163.7 512 534 A R H X S+ 0 0 137 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.958 115.4 45.7 -67.7 -49.6 58.0 74.1 163.9 513 535 A F H X S+ 0 0 0 -4,-3.3 4,-2.7 2,-0.2 5,-0.4 0.970 105.6 58.0 -58.5 -56.1 55.3 73.3 161.3 514 536 A S H X>S+ 0 0 7 -4,-2.7 5,-2.3 1,-0.2 4,-1.5 0.867 112.7 42.9 -40.3 -49.7 54.5 69.8 162.6 515 537 A R H ><5S+ 0 0 103 -4,-1.4 3,-1.1 1,-0.3 -1,-0.2 0.974 112.8 51.1 -62.2 -55.9 53.6 71.5 165.9 516 538 A G H 3<5S+ 0 0 0 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.747 119.0 39.1 -55.4 -25.1 51.8 74.4 164.3 517 539 A L H 3<5S- 0 0 12 -4,-2.7 -1,-0.3 -3,-0.3 -2,-0.2 0.527 118.7 -99.4-105.3 -10.1 49.7 71.9 162.3 518 540 A G T <<5S+ 0 0 50 -4,-1.5 2,-0.5 -3,-1.1 -3,-0.2 0.533 77.4 120.3 109.6 3.0 49.1 69.1 164.7 519 541 A Y < + 0 0 17 -5,-2.3 2,-0.3 40,-0.2 -1,-0.2 -0.905 21.0 160.6-108.7 132.2 51.6 66.3 164.0 520 542 A A + 0 0 97 -2,-0.5 2,-0.1 2,-0.1 -9,-0.0 -0.857 40.3 86.7-149.6 97.1 54.0 65.0 166.6 521 543 A G S S- 0 0 53 -2,-0.3 2,-0.3 33,-0.0 32,-0.0 -0.335 79.4 -61.9-152.9-114.9 55.5 61.6 165.9 522 544 A K - 0 0 146 -2,-0.1 32,-1.9 0, 0.0 2,-0.1 -0.861 25.8-152.9-163.4 122.5 58.5 60.8 163.8 523 545 A F B -C 553 0C 32 -2,-0.3 30,-0.2 30,-0.2 29,-0.1 -0.334 17.7-177.1 -79.5 169.3 59.7 61.1 160.2 524 546 A T + 0 0 100 28,-0.8 3,-0.2 -2,-0.1 28,-0.1 0.654 63.8 26.2-140.8 -42.7 62.2 58.5 159.0 525 547 A S > + 0 0 28 1,-0.1 4,-2.6 23,-0.1 3,-0.4 -0.084 68.0 136.5-122.0 40.2 63.7 58.6 155.4 526 548 A L H > + 0 0 12 1,-0.2 4,-1.8 2,-0.2 5,-0.3 0.807 68.5 58.7 -54.8 -37.4 63.4 62.3 154.6 527 549 A A H > S+ 0 0 52 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.963 115.2 37.9 -58.2 -45.6 66.9 62.6 153.1 528 550 A D H > S+ 0 0 80 -3,-0.4 4,-2.8 2,-0.2 5,-0.3 0.978 109.8 59.3 -65.5 -61.7 65.9 59.9 150.6 529 551 A W H X S+ 0 0 2 -4,-2.6 4,-3.4 1,-0.3 5,-0.2 0.868 108.6 46.0 -32.7 -64.8 62.2 61.0 150.0 530 552 A I H X S+ 0 0 3 -4,-1.8 4,-2.2 1,-0.2 -1,-0.3 0.902 112.4 51.4 -47.7 -53.4 63.4 64.3 148.8 531 553 A T H >X S+ 0 0 84 -4,-1.7 4,-1.8 -5,-0.3 3,-0.8 0.951 112.0 45.6 -50.6 -55.5 66.0 62.7 146.6 532 554 A E H 3X S+ 0 0 52 -4,-2.8 4,-3.4 1,-0.3 -1,-0.2 0.921 107.6 59.1 -54.1 -44.8 63.4 60.4 145.1 533 555 A F H 3X S+ 0 0 3 -4,-3.4 4,-1.5 -5,-0.3 -1,-0.3 0.867 107.2 48.9 -51.4 -40.3 61.1 63.4 144.7 534 556 A G H XX S+ 0 0 0 -4,-2.2 3,-1.9 -3,-0.8 4,-1.4 0.998 111.1 44.0 -63.8 -67.5 63.8 64.9 142.6 535 557 A K H >X S+ 0 0 125 -4,-1.8 4,-2.4 1,-0.3 3,-0.7 0.884 110.6 63.3 -44.2 -37.6 64.5 61.9 140.3 536 558 A A H 3< S+ 0 0 4 -4,-3.4 -1,-0.3 -5,-0.3 -2,-0.2 0.866 99.6 48.3 -57.3 -43.7 60.7 61.8 140.2 537 559 A V H << S+ 0 0 1 -3,-1.9 -1,-0.3 -4,-1.5 -2,-0.2 0.760 118.5 42.0 -73.0 -21.0 60.4 65.2 138.6 538 560 A R H << S+ 0 0 141 -4,-1.4 2,-0.6 -3,-0.7 -2,-0.2 0.923 122.0 35.5 -84.3 -73.0 63.0 64.2 136.0 539 561 A T S >< S- 0 0 68 -4,-2.4 2,-1.2 1,-0.1 3,-0.5 -0.716 89.6-137.3 -78.3 124.0 61.9 60.7 135.2 540 562 A E T 3 + 0 0 59 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.1 -0.046 65.6 124.4 -76.7 40.5 58.2 61.0 135.5 541 563 A N T 3 + 0 0 92 -2,-1.2 2,-1.5 -6,-0.2 -1,-0.2 0.948 30.7 171.5 -64.6 -55.5 58.0 57.7 137.4 542 564 A W <> + 0 0 5 -3,-0.5 4,-2.8 -10,-0.2 5,-0.2 -0.016 49.9 94.8 68.8 -34.9 56.2 58.8 140.5 543 565 A R H > S+ 0 0 112 -2,-1.5 4,-3.8 1,-0.2 5,-0.3 0.975 84.6 41.8 -55.1 -67.0 55.7 55.3 141.9 544 566 A P H > S+ 0 0 49 0, 0.0 4,-3.5 0, 0.0 -1,-0.2 0.874 115.5 51.8 -49.8 -40.5 58.7 54.9 144.2 545 567 A L H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.976 114.5 43.8 -61.0 -47.4 58.3 58.5 145.5 546 568 A F H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.943 114.9 48.1 -62.6 -40.6 54.6 57.7 146.2 547 569 A V H >< S+ 0 0 52 -4,-3.8 3,-0.8 1,-0.2 4,-0.5 0.934 108.3 56.2 -64.5 -42.7 55.5 54.3 147.7 548 570 A K H >< S+ 0 0 51 -4,-3.5 3,-2.1 -5,-0.3 -1,-0.2 0.866 98.1 61.5 -55.4 -42.6 58.2 55.9 149.8 549 571 A T H >X S+ 0 0 1 -4,-2.0 3,-0.7 1,-0.3 4,-0.7 0.845 93.3 61.8 -58.1 -34.5 55.8 58.4 151.4 550 572 A E T << S+ 0 0 45 -4,-1.0 -1,-0.3 -3,-0.8 2,-0.2 0.726 109.9 49.3 -61.0 -21.2 53.7 55.5 152.9 551 573 A T T <4 S+ 0 0 93 -3,-2.1 -1,-0.3 -4,-0.5 -2,-0.1 -0.528 96.2 60.5-122.3 65.4 57.0 54.9 154.7 552 574 A I T <4 S+ 0 0 5 -3,-0.7 -28,-0.8 1,-0.2 2,-0.5 0.367 86.9 69.0-149.0 -32.3 58.4 58.1 156.2 553 575 A I B >< S-C 523 0C 8 -4,-0.7 3,-1.5 -30,-0.2 -1,-0.2 -0.869 71.1-134.6-108.0 127.3 55.9 59.3 158.8 554 576 A A T 3 S+ 0 0 63 -32,-1.9 -1,-0.1 -2,-0.5 -31,-0.1 0.846 102.9 24.8 -36.1 -82.1 55.0 57.6 162.1 555 577 A G T 3 S- 0 0 38 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.477 104.0-122.7 -71.6 4.6 51.2 57.7 162.2 556 578 A N < + 0 0 36 -3,-1.5 -91,-2.9 1,-0.2 2,-0.3 0.747 55.6 165.1 57.7 28.2 51.1 57.9 158.4 557 579 A A B >> -B 464 0B 22 -93,-0.3 4,-1.2 1,-0.1 3,-0.9 -0.540 45.0-141.7 -79.0 137.7 49.2 61.1 158.9 558 580 A A H >> S+ 0 0 0 -95,-1.7 4,-2.1 -98,-0.3 3,-0.6 0.936 98.6 71.5 -62.3 -41.2 48.7 63.5 156.1 559 581 A T H 3> S+ 0 0 13 -96,-0.6 4,-1.8 -99,-0.5 -1,-0.2 0.819 97.9 48.1 -44.9 -37.4 49.1 66.3 158.5 560 582 A A H <> S+ 0 0 0 -3,-0.9 4,-2.8 2,-0.2 -1,-0.3 0.928 108.3 54.5 -71.1 -41.7 52.8 65.5 158.8 561 583 A L H X S+ 0 0 0 -4,-2.8 4,-2.0 -3,-0.4 3,-0.8 0.969 110.8 46.0 -61.1 -58.9 56.9 68.3 155.4 565 587 A V H 3X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.860 107.7 58.9 -53.5 -39.0 56.1 70.0 152.1 566 588 A F H 3X S+ 0 0 1 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.3 0.905 107.2 48.6 -58.2 -37.1 55.7 73.3 153.9 567 589 A S H X< S+ 0 0 0 -4,-1.5 3,-0.8 -3,-0.8 4,-0.5 0.946 109.3 49.3 -68.3 -49.4 59.3 72.8 155.0 568 590 A I H >< S+ 0 0 1 -4,-2.0 3,-1.4 1,-0.3 -2,-0.2 0.885 108.7 53.6 -58.1 -40.8 60.7 72.0 151.5 569 591 A L H >< S+ 0 0 28 -4,-2.6 3,-0.6 1,-0.3 -1,-0.3 0.771 107.1 55.3 -64.7 -24.2 58.9 75.0 150.1 570 592 A T T << S+ 0 0 55 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.517 106.9 48.4 -87.6 -4.3 60.7 77.0 152.8 571 593 A G T < S+ 0 0 36 -3,-1.4 -69,-0.2 -4,-0.5 -1,-0.2 -0.050 113.7 35.1-126.5 35.5 64.2 75.8 151.8 572 594 A S < - 0 0 44 -3,-0.6 -3,-0.1 1,-0.1 -74,-0.0 -0.695 68.4-124.6-156.1-156.7 64.1 76.5 148.0 573 595 A A + 0 0 79 -2,-0.2 2,-3.1 -79,-0.1 6,-0.2 0.504 43.0 147.1-130.1 -63.6 62.7 78.9 145.4 574 596 A L > - 0 0 34 -81,-0.1 4,-0.6 4,-0.1 3,-0.3 -0.181 44.4-145.7 55.7 -62.7 60.7 76.8 142.8 575 597 A G H > - 0 0 25 -2,-3.1 4,-2.8 1,-0.2 3,-0.4 -0.061 40.5 -43.8 92.1 168.3 58.1 79.5 142.0 576 598 A I H > S+ 0 0 74 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.729 139.5 48.8 -44.3 -33.5 54.4 79.5 141.1 577 599 A I H > S+ 0 0 23 -3,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.950 116.3 44.7 -72.5 -46.3 54.9 76.6 138.7 578 600 A G H X S+ 0 0 0 -4,-0.6 4,-2.5 -3,-0.4 5,-0.2 0.950 108.6 53.1 -59.6 -56.1 56.8 74.8 141.4 579 601 A Y H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.932 112.7 50.3 -45.1 -48.5 54.4 75.6 144.3 580 602 A G H X S+ 0 0 0 -4,-1.4 4,-3.2 -5,-0.3 5,-0.3 0.969 107.2 48.3 -52.0 -75.3 51.8 74.1 142.0 581 603 A L H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.755 116.5 45.7 -37.6 -42.5 53.5 70.8 141.0 582 604 A L H X S+ 0 0 4 -4,-2.5 4,-2.9 2,-0.2 5,-0.4 0.998 112.9 45.4 -68.7 -65.0 54.3 70.1 144.7 583 605 A M H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.3 -2,-0.2 0.873 116.4 52.3 -44.6 -38.6 50.9 71.0 146.3 584 606 A A H X S+ 0 0 0 -4,-3.2 4,-1.9 -5,-0.3 -1,-0.3 0.951 112.2 41.0 -64.8 -54.0 49.5 68.9 143.4 585 607 A V H < S+ 0 0 2 -4,-2.6 3,-0.3 -5,-0.3 -2,-0.2 0.974 118.1 47.3 -60.2 -52.9 51.6 65.9 143.9 586 608 A T H >X S+ 0 0 2 -4,-2.9 3,-1.8 1,-0.2 4,-0.9 0.904 108.0 57.0 -53.3 -46.9 51.3 66.0 147.7 587 609 A G H >X S+ 0 0 0 -4,-2.9 3,-1.8 -5,-0.4 4,-1.5 0.920 93.4 67.2 -52.5 -44.4 47.6 66.5 147.4 588 610 A A H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 -3,-0.3 -113,-0.2 0.351 105.0 45.2 -61.7 7.4 47.2 63.3 145.4 589 611 A L H <4 S+ 0 0 4 -3,-1.8 -123,-3.8 2,-0.1 -1,-0.3 0.511 120.4 37.3-120.4 -23.3 48.2 61.5 148.6 590 612 A I H << S- 0 0 0 -3,-1.8 2,-0.3 -4,-0.9 -2,-0.2 0.896 131.8 -27.0 -91.8 -70.0 45.9 63.5 150.9 591 613 A D >X - 0 0 46 -4,-1.5 3,-2.0 1,-0.1 4,-0.6 -0.839 44.6-130.3-157.7 128.7 42.8 64.0 148.8 592 614 A E H >> S+ 0 0 54 -2,-0.3 4,-1.4 1,-0.3 3,-1.0 0.721 103.8 68.6 -41.2 -35.6 42.0 64.3 145.1 593 615 A S H 3> S+ 0 0 41 1,-0.3 4,-1.7 2,-0.2 3,-0.4 0.924 93.0 57.7 -51.8 -49.5 40.0 67.5 145.6 594 616 A L H <> S+ 0 0 4 -3,-2.0 4,-2.0 1,-0.3 -1,-0.3 0.826 102.1 57.4 -51.2 -35.8 43.2 69.4 146.5 595 617 A V H < S+ 0 0 0 -4,-2.0 3,-1.9 -5,-0.3 -2,-0.2 0.999 110.0 42.3 -64.4 -63.9 45.9 72.8 142.4 599 621 A N H 3< S+ 0 0 16 -4,-2.9 3,-0.4 1,-0.3 -1,-0.2 0.625 108.6 66.9 -58.8 -11.6 45.8 72.3 138.6 600 622 A K T 3< S+ 0 0 188 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.359 92.0 55.6 -95.4 5.8 43.2 75.2 138.5 601 623 A F < 0 0 32 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.1 0.275 360.0 360.0-125.1 21.2 45.4 78.2 139.5 602 624 A W 0 0 56 -3,-0.4 -117,-0.1 -4,-0.1 -25,-0.1 -0.946 360.0 360.0-165.3 360.0 48.4 78.4 137.2