==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-SEP-10 3OYV . COMPND 2 MOLECULE: IMELYSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES OVATUS ATCC 8483; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 354 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14677.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 72.6 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 . 5 1.4 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 11 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 53.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 4.0 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 0 1 2 2 3 1 0 0 0 0 1 0 0 1 1 1 1 1 0 0 1 0 0 1 0 0 0 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 . 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 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 31 A T 0 0 195 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.1 -9.9 43.0 30.6 2 32 A V - 0 0 54 1,-0.0 99,-0.0 2,-0.0 98,-0.0 -0.643 360.0-151.4 -69.6 131.3 -6.2 43.0 29.3 3 33 A D - 0 0 87 -2,-0.3 299,-0.2 1,-0.1 300,-0.2 -0.876 16.0-177.9-112.2 98.1 -3.8 42.1 32.1 4 34 A P - 0 0 50 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.622 31.1-139.4 -67.0 -13.7 -0.4 43.7 31.5 5 35 A A - 0 0 7 1,-0.2 2,-0.3 300,-0.0 -2,-0.1 0.945 23.3-161.6 51.5 57.8 1.0 42.1 34.7 6 36 A N + 0 0 110 2,-0.0 2,-0.3 300,-0.0 -1,-0.2 -0.506 22.5 153.0 -68.6 130.1 3.1 45.2 35.7 7 37 A I - 0 0 16 -2,-0.3 2,-0.3 2,-0.0 299,-0.0 -0.961 25.4-154.7-154.1 145.7 5.8 44.5 38.3 8 38 A D - 0 0 80 -2,-0.3 2,-0.3 343,-0.0 5,-0.1 -0.899 32.8 -99.3-116.2 154.5 9.1 46.1 39.1 9 39 A Y + 0 0 21 343,-0.4 345,-0.1 -2,-0.3 343,-0.1 -0.533 52.0 167.2 -68.6 128.9 12.2 44.7 40.7 10 40 A T >> - 0 0 29 -2,-0.3 4,-1.3 343,-0.1 3,-0.6 -0.926 51.6-103.9-136.8 166.1 12.3 45.5 44.5 11 41 A P T 34 S+ 0 0 84 0, 0.0 4,-0.4 0, 0.0 3,-0.1 0.870 120.9 54.8 -56.6 -33.3 14.3 44.4 47.5 12 42 A E T 34 S+ 0 0 155 1,-0.2 4,-0.2 2,-0.1 3,-0.1 0.793 117.9 31.1 -76.9 -28.3 11.2 42.4 48.6 13 43 A N T <> S+ 0 0 8 -3,-0.6 4,-2.6 1,-0.1 -1,-0.2 0.451 92.5 99.6-104.8 4.1 10.8 40.4 45.3 14 44 A A H X S+ 0 0 13 -4,-1.3 4,-2.7 1,-0.2 5,-0.2 0.861 79.6 50.8 -63.1 -39.9 14.6 40.3 44.5 15 45 A S H > S+ 0 0 46 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.955 113.7 44.1 -66.2 -45.2 15.2 36.7 45.8 16 46 A S H > S+ 0 0 3 293,-0.3 4,-2.8 -4,-0.2 5,-0.3 0.905 112.9 53.5 -61.3 -41.4 12.3 35.2 43.8 17 47 A W H X S+ 0 0 0 -4,-2.6 4,-2.5 292,-0.2 5,-0.2 0.939 111.0 46.1 -60.5 -46.2 13.3 37.3 40.8 18 48 A H H X S+ 0 0 32 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.941 115.4 45.6 -59.2 -53.2 16.9 35.9 41.0 19 49 A N H X S+ 0 0 18 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.884 115.3 45.3 -61.7 -41.6 15.8 32.3 41.4 20 50 A Y H X S+ 0 0 1 -4,-2.8 4,-2.8 2,-0.2 5,-0.2 0.901 111.4 52.2 -73.6 -39.3 13.1 32.4 38.7 21 51 A X H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.3 5,-0.2 0.931 111.5 48.7 -55.6 -48.4 15.4 34.1 36.2 22 52 A R H X S+ 0 0 48 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.912 110.6 50.8 -57.2 -45.4 18.0 31.4 36.9 23 53 A N H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.939 112.8 44.5 -58.5 -48.2 15.3 28.7 36.5 24 54 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 312,-0.3 0.915 114.8 48.3 -67.1 -38.7 14.2 30.1 33.1 25 55 A A H X S+ 0 0 2 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.869 110.0 53.2 -68.8 -36.5 17.8 30.6 31.8 26 56 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.909 108.9 49.1 -62.6 -43.2 18.7 27.0 33.0 27 57 A L H X S+ 0 0 4 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.902 111.3 49.4 -62.8 -41.5 15.8 25.6 31.0 28 58 A L H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.867 111.2 49.9 -63.7 -41.0 16.8 27.6 27.9 29 59 A K H X S+ 0 0 39 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.931 113.0 45.9 -63.2 -49.0 20.4 26.3 28.3 30 60 A T H X S+ 0 0 56 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.935 114.0 48.4 -60.2 -48.8 19.3 22.7 28.6 31 61 A D H X S+ 0 0 14 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.912 112.5 46.8 -61.3 -48.4 16.9 23.0 25.6 32 62 A A H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 207,-0.2 0.871 113.2 50.4 -62.6 -38.9 19.4 24.7 23.3 33 63 A T H X S+ 0 0 26 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.935 112.7 45.5 -64.0 -43.9 22.1 22.1 24.2 34 64 A N H X S+ 0 0 90 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.890 112.2 51.8 -68.7 -37.7 19.7 19.2 23.6 35 65 A L H X S+ 0 0 1 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.937 113.2 44.3 -61.2 -50.0 18.5 20.7 20.3 36 66 A Y H X S+ 0 0 33 -4,-2.3 4,-2.9 199,-0.2 5,-0.3 0.932 114.0 49.7 -60.9 -48.2 22.1 21.2 19.0 37 67 A N H X>S+ 0 0 67 -4,-2.6 4,-2.7 1,-0.2 5,-2.3 0.867 105.1 57.6 -63.3 -30.7 23.2 17.7 20.2 38 68 A A H <5S+ 0 0 15 -4,-2.0 11,-2.8 1,-0.2 -1,-0.2 0.910 116.6 35.7 -65.7 -40.6 20.2 16.1 18.5 39 69 A W H <5S+ 0 0 0 -4,-1.6 11,-2.0 9,-0.2 12,-0.4 0.851 128.6 33.0 -74.4 -41.7 21.3 17.6 15.2 40 70 A N H <5S+ 0 0 78 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.714 132.0 12.0 -96.2 -23.3 25.1 17.3 15.6 41 71 A S T <5S- 0 0 80 -4,-2.7 7,-0.4 -5,-0.3 2,-0.3 0.737 119.8 -11.6-122.6 -57.7 25.7 14.2 17.7 42 72 A S < - 0 0 42 -5,-2.3 2,-0.6 5,-0.2 6,-0.3 -0.912 42.5-151.8-162.6 125.5 22.8 11.8 18.2 43 73 A Y S > S- 0 0 39 4,-2.0 3,-2.0 -2,-0.3 -5,-0.1 -0.912 88.5 -22.2-101.4 114.9 19.1 11.8 17.6 44 74 A K T 3 S- 0 0 153 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.861 126.8 -52.0 52.8 45.0 17.2 9.5 20.0 45 75 A G T 3 S+ 0 0 75 1,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.317 125.4 83.5 78.8 -5.2 20.4 7.5 20.6 46 76 A G S < S- 0 0 42 -3,-2.0 -1,-0.2 1,-0.3 -3,-0.2 -0.005 92.5 -31.0-106.7-152.5 21.1 6.9 16.9 47 77 A E S S- 0 0 103 -5,-0.2 -4,-2.0 1,-0.1 -1,-0.3 -0.214 79.6 -88.0 -59.6 158.4 22.8 8.8 14.2 48 78 A S > - 0 0 11 -7,-0.4 4,-2.3 -6,-0.3 -9,-0.2 -0.237 31.0-116.6 -64.3 160.0 22.6 12.6 14.4 49 79 A Y H > S+ 0 0 8 -11,-2.8 4,-3.0 1,-0.2 5,-0.2 0.874 117.5 58.7 -67.6 -31.3 19.6 14.3 12.8 50 80 A A H > S+ 0 0 6 -11,-2.0 4,-2.5 -12,-0.2 -1,-0.2 0.937 107.9 45.2 -58.4 -49.2 22.1 16.1 10.4 51 81 A S H > S+ 0 0 51 -12,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.906 113.7 50.6 -62.4 -41.9 23.3 12.6 9.2 52 82 A L H X S+ 0 0 41 -4,-2.3 4,-2.2 2,-0.2 5,-0.3 0.940 112.9 44.4 -59.6 -50.0 19.7 11.4 8.9 53 83 A F H < S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.897 114.2 48.8 -67.1 -42.6 18.5 14.4 6.9 54 84 A K H < S+ 0 0 56 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.795 114.6 45.8 -66.3 -30.7 21.5 14.4 4.6 55 85 A A H < S- 0 0 49 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.841 79.0-176.4 -78.3 -37.2 21.2 10.7 3.9 56 86 A H < + 0 0 9 -4,-2.2 -3,-0.1 -5,-0.2 10,-0.1 0.855 24.9 147.1 37.1 62.1 17.4 10.8 3.3 57 87 A S + 0 0 109 -5,-0.3 2,-0.3 1,-0.1 5,-0.2 0.308 57.4 11.1-109.7 7.3 17.2 7.1 2.9 58 88 A G B > S-A 61 0A 34 3,-1.5 3,-1.7 5,-0.1 5,-0.1 -0.973 95.3 -14.2-172.0 166.3 13.8 6.3 4.4 59 89 A S T 3 S+ 0 0 121 1,-0.3 -2,-0.1 -2,-0.3 -3,-0.0 -0.175 117.7 23.6 -50.4 143.7 10.5 7.9 5.5 60 90 A P T 3 S+ 0 0 82 0, 0.0 2,-0.5 0, 0.0 -1,-0.3 -0.990 139.1 28.8 -85.8 0.6 9.8 10.7 6.2 61 91 A Y B < +A 58 0A 20 -3,-1.7 -3,-1.5 1,-0.1 3,-0.1 -0.854 62.4 152.6-125.3 94.0 12.7 11.8 3.9 62 92 A A + 0 0 69 -2,-0.5 2,-0.3 -5,-0.2 -3,-0.1 0.409 66.6 24.0-101.8 -1.3 13.3 9.2 1.2 63 93 A S S > S- 0 0 38 -5,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.975 77.8-110.6-155.0 161.7 14.8 11.6 -1.4 64 94 A A H > S+ 0 0 0 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.867 119.1 59.4 -64.7 -35.5 16.6 14.9 -1.7 65 95 A L H > S+ 0 0 30 149,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.925 103.1 51.2 -56.1 -46.2 13.4 16.3 -3.3 66 96 A S H > S+ 0 0 31 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.917 110.7 48.7 -58.2 -44.0 11.5 15.4 -0.1 67 97 A C H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.935 112.5 48.0 -59.3 -46.0 14.1 17.2 2.0 68 98 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.883 107.8 53.9 -69.9 -34.7 13.9 20.3 -0.3 69 99 A E H X S+ 0 0 59 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.907 110.7 48.0 -62.6 -39.2 10.1 20.4 -0.2 70 100 A E H X S+ 0 0 42 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.932 111.0 51.3 -65.5 -45.2 10.3 20.4 3.6 71 101 A I H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.941 115.1 41.4 -55.1 -49.4 13.0 23.2 3.4 72 102 A V H X S+ 0 0 2 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.922 112.7 54.0 -70.2 -40.5 10.8 25.3 1.2 73 103 A D H X S+ 0 0 34 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.899 109.3 48.9 -57.3 -43.1 7.6 24.5 3.1 74 104 A K H X S+ 0 0 19 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.827 109.1 51.7 -76.1 -26.2 9.2 25.7 6.3 75 105 A C H X S+ 0 0 6 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.921 112.1 47.7 -63.6 -47.7 10.4 28.9 4.7 76 106 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.922 108.6 56.2 -59.4 -43.8 6.9 29.6 3.5 77 107 A E H X S+ 0 0 84 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.898 107.4 46.0 -59.5 -44.7 5.5 28.8 6.9 78 108 A I H X S+ 0 0 4 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.896 110.4 53.6 -68.6 -34.6 7.6 31.4 8.7 79 109 A A H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.923 112.1 46.5 -59.9 -41.3 6.7 34.0 6.1 80 110 A N H X>S+ 0 0 63 -4,-2.6 4,-2.8 2,-0.2 5,-0.6 0.930 112.8 48.8 -63.5 -48.0 3.1 33.2 6.8 81 111 A E H X>S+ 0 0 81 -4,-2.7 5,-2.9 1,-0.2 4,-1.6 0.915 112.5 47.2 -63.4 -43.2 3.6 33.3 10.6 82 112 A V H <>S+ 0 0 0 -4,-2.8 5,-2.4 3,-0.2 6,-0.4 0.950 120.3 37.2 -62.2 -50.4 5.4 36.6 10.5 83 113 A G H <>S+ 0 0 9 -4,-2.2 5,-1.0 -5,-0.2 -2,-0.2 0.935 127.9 29.0 -70.4 -48.3 2.9 38.3 8.2 84 114 A T H <5S+ 0 0 72 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.777 134.7 20.4 -91.2 -26.8 -0.4 37.0 9.3 85 115 A A T X S+ 0 0 2 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.923 115.8 52.5 -57.9 -41.7 -2.0 42.8 16.5 91 121 A Y H X S+ 0 0 44 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.951 111.1 44.5 -59.1 -48.4 -2.9 44.8 13.4 92 122 A N H X S+ 0 0 100 -4,-3.0 4,-1.6 1,-0.2 6,-0.2 0.912 113.2 51.1 -68.5 -39.7 -6.4 43.2 13.0 93 123 A L H <>S+ 0 0 39 -4,-2.5 5,-2.2 -5,-0.3 -1,-0.2 0.942 112.3 48.1 -55.2 -45.8 -7.1 43.5 16.8 94 124 A Y H ><5S+ 0 0 77 -4,-2.5 3,-2.0 1,-0.2 5,-0.2 0.936 109.8 49.8 -64.5 -48.5 -6.1 47.2 16.6 95 125 A K H 3<5S+ 0 0 121 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.776 105.7 58.3 -65.0 -26.5 -8.3 47.9 13.5 96 126 A A T 3<5S- 0 0 74 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.421 125.1-103.4 -76.8 -4.1 -11.3 46.3 15.2 97 127 A G T < 5S+ 0 0 51 -3,-2.0 2,-1.6 -4,-0.2 3,-0.3 0.351 91.5 120.5 95.5 -1.9 -10.9 48.8 18.1 98 128 A N >< + 0 0 81 -5,-2.2 4,-2.2 -6,-0.2 -3,-0.1 -0.437 31.6 151.5 -87.8 61.9 -9.3 46.3 20.5 99 129 A T H > + 0 0 45 -2,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.807 63.5 47.5 -72.6 -36.3 -6.3 48.6 20.6 100 130 A E H > S+ 0 0 107 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.915 111.8 50.8 -74.0 -39.3 -5.0 47.7 24.1 101 131 A E H > S+ 0 0 95 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.921 110.4 53.2 -56.8 -42.5 -5.3 44.0 23.4 102 132 A A H >< S+ 0 0 0 -4,-2.2 3,-1.0 1,-0.2 4,-0.4 0.926 105.8 51.3 -57.8 -49.2 -3.3 44.7 20.2 103 133 A L H >< S+ 0 0 27 -4,-1.9 3,-0.9 1,-0.3 -1,-0.2 0.892 112.5 45.6 -58.3 -41.6 -0.5 46.5 22.0 104 134 A Y H 3< S+ 0 0 55 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.535 103.4 65.7 -84.3 -3.2 0.0 43.6 24.5 105 135 A A T << S+ 0 0 31 -3,-1.0 2,-0.6 -4,-0.7 -1,-0.2 0.494 71.8 114.9 -88.6 -11.4 -0.1 41.0 21.8 106 136 A V X - 0 0 0 -3,-0.9 3,-1.8 -4,-0.4 4,-0.2 -0.549 67.2-130.3 -73.5 113.0 3.1 42.1 20.0 107 137 A E T 3 S+ 0 0 15 -2,-0.6 10,-0.1 -21,-0.3 -1,-0.1 -0.382 90.6 10.7 -62.1 127.5 5.8 39.4 20.3 108 138 A S T > >S+ 0 0 0 -2,-0.1 5,-2.5 5,-0.1 3,-0.6 0.589 86.3 128.7 76.4 19.8 9.1 40.9 21.5 109 139 A W G X 5 + 0 0 13 -3,-1.8 3,-1.8 1,-0.2 239,-0.2 0.808 56.6 73.0 -72.1 -25.8 7.6 44.2 22.6 110 140 A Y G 3 5S+ 0 0 9 1,-0.3 238,-2.7 -4,-0.2 239,-0.3 0.870 111.1 30.5 -58.2 -34.7 9.0 44.2 26.1 111 141 A S G < 5S- 0 0 11 -3,-0.6 -1,-0.3 237,-0.2 -2,-0.2 0.218 110.5-117.9-102.2 7.8 12.4 44.9 24.5 112 142 A W T < 5S+ 0 0 82 -3,-1.8 -3,-0.2 1,-0.1 4,-0.2 0.872 80.7 126.2 52.4 38.3 11.1 46.9 21.6 113 143 A H >< + 0 0 10 -5,-2.5 4,-2.9 1,-0.1 5,-0.2 0.332 23.8 106.0-106.5 1.4 12.7 44.2 19.5 114 144 A S H > S+ 0 0 1 -6,-0.5 4,-2.8 1,-0.2 5,-0.3 0.907 80.1 50.5 -56.8 -47.6 9.7 43.0 17.3 115 145 A R H > S+ 0 0 32 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.941 115.6 42.0 -54.0 -50.0 11.0 44.6 14.1 116 146 A D H > S+ 0 0 67 2,-0.2 4,-2.5 -4,-0.2 -2,-0.2 0.891 113.9 53.0 -68.3 -38.5 14.4 43.1 14.4 117 147 A D H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.967 113.3 42.0 -55.0 -56.2 13.0 39.7 15.6 118 148 A Y H X S+ 0 0 1 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.859 112.7 53.8 -69.1 -33.9 10.7 39.4 12.6 119 149 A T H X S+ 0 0 3 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.921 107.2 51.9 -63.0 -44.2 13.3 40.7 10.2 120 150 A N H X S+ 0 0 20 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.873 104.1 57.7 -59.7 -35.4 15.7 38.0 11.5 121 151 A N H X S+ 0 0 0 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.896 107.0 47.5 -60.4 -39.8 13.0 35.5 10.8 122 152 A I H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 3,-0.4 0.900 106.7 57.0 -68.9 -38.3 13.0 36.6 7.1 123 153 A Y H X S+ 0 0 55 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.804 97.1 64.0 -63.1 -25.0 16.8 36.4 7.1 124 154 A S H X S+ 0 0 0 -4,-1.6 4,-2.3 152,-0.3 -1,-0.2 0.920 103.3 47.3 -59.3 -41.7 16.3 32.7 8.1 125 155 A I H X S+ 0 0 0 -4,-1.0 4,-2.6 -3,-0.4 5,-0.2 0.930 110.3 52.4 -64.3 -46.0 14.6 32.3 4.8 126 156 A R H X S+ 0 0 44 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.941 109.7 49.1 -52.2 -50.9 17.5 34.1 3.0 127 157 A N H X>S+ 0 0 2 -4,-2.8 4,-1.5 1,-0.2 5,-1.3 0.914 111.2 49.1 -58.2 -43.9 20.0 31.8 4.7 128 158 A A H <5S+ 0 0 4 -4,-2.3 14,-0.4 1,-0.2 -1,-0.2 0.909 115.6 43.3 -60.8 -44.8 18.0 28.7 3.7 129 159 A Y H <5S+ 0 0 4 -4,-2.6 14,-2.4 1,-0.2 15,-0.3 0.832 119.4 42.4 -71.8 -34.3 17.8 29.8 0.1 130 160 A Y H <5S- 0 0 37 -4,-2.6 8,-2.6 -5,-0.2 -1,-0.2 0.561 100.7-129.0 -89.8 -12.9 21.4 31.0 -0.2 131 161 A G T <5S+ 0 0 2 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.866 77.0 77.9 63.3 35.4 23.0 28.1 1.6 132 162 A S < - 0 0 8 -5,-1.3 -1,-0.2 -6,-0.2 -2,-0.2 -0.973 69.5-137.4-159.3 175.0 24.9 30.4 3.9 133 163 A L S S+ 0 0 63 -2,-0.3 -6,-0.1 -3,-0.1 -5,-0.1 0.505 94.3 59.2-109.1 -19.4 24.7 32.7 7.0 134 164 A D S S- 0 0 126 2,-0.2 3,-0.1 -7,-0.1 -1,-0.1 0.035 115.7 -95.6-112.3 16.8 26.7 35.7 6.0 135 165 A G S S+ 0 0 36 1,-0.3 2,-0.3 -12,-0.1 -4,-0.0 0.496 80.7 134.9 79.6 6.0 24.7 36.8 2.9 136 166 A N - 0 0 107 1,-0.0 2,-0.9 -9,-0.0 -1,-0.3 -0.733 59.0-127.4 -81.1 133.7 26.9 35.0 0.4 137 167 A I - 0 0 60 -2,-0.3 -6,-0.1 -3,-0.1 2,-0.1 -0.744 34.5-141.4 -79.8 108.1 25.0 33.0 -2.4 138 168 A N - 0 0 45 -8,-2.6 6,-0.4 -2,-0.9 3,-0.4 -0.407 13.1-124.0 -70.2 148.0 26.8 29.6 -2.0 139 169 A A S S+ 0 0 74 1,-0.3 2,-0.8 -2,-0.1 -1,-0.1 0.814 110.9 52.7 -54.9 -35.0 27.6 27.5 -5.1 140 170 A N S S+ 0 0 74 -9,-0.2 2,-0.3 -10,-0.1 -1,-0.3 -0.680 90.2 110.8-105.3 73.8 25.6 24.6 -3.5 141 171 A S S > S- 0 0 1 -2,-0.8 4,-2.1 -3,-0.4 5,-0.2 -0.966 78.7-113.5-140.4 159.5 22.3 26.4 -2.8 142 172 A L H > S+ 0 0 4 -14,-0.4 4,-2.9 -2,-0.3 5,-0.3 0.891 117.5 59.0 -57.8 -42.4 18.7 26.4 -4.0 143 173 A S H > S+ 0 0 1 -14,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.928 106.0 46.3 -56.1 -44.7 19.4 29.9 -5.4 144 174 A T H > S+ 0 0 57 -6,-0.4 4,-1.8 -15,-0.3 -1,-0.2 0.911 113.5 49.2 -66.0 -40.0 22.3 28.7 -7.6 145 175 A V H X S+ 0 0 27 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.931 115.1 43.2 -62.3 -48.0 20.2 25.8 -8.9 146 176 A I H X S+ 0 0 0 -4,-2.9 4,-3.6 1,-0.2 3,-0.3 0.913 110.0 57.2 -66.7 -40.1 17.2 28.0 -9.7 147 177 A A H < S+ 0 0 37 -4,-2.9 4,-0.3 -5,-0.3 -1,-0.2 0.867 108.5 47.5 -57.5 -38.7 19.4 30.7 -11.2 148 178 A G H < S+ 0 0 74 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.803 122.1 34.2 -72.6 -29.7 20.8 28.1 -13.6 149 179 A A H < S+ 0 0 41 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.778 140.1 3.2 -93.9 -33.0 17.3 26.8 -14.6 150 180 A N X - 0 0 49 -4,-3.6 4,-2.1 -5,-0.1 3,-0.2 -0.631 59.6-177.3-162.1 80.9 15.2 29.9 -14.4 151 181 A S H > S+ 0 0 76 -4,-0.3 4,-2.4 1,-0.2 5,-0.2 0.827 84.8 57.7 -58.3 -34.3 17.1 33.1 -13.7 152 182 A S H > S+ 0 0 67 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.932 106.9 48.0 -61.4 -48.8 13.9 35.2 -13.7 153 183 A L H > S+ 0 0 11 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.908 111.3 50.6 -59.3 -45.5 12.4 33.0 -10.9 154 184 A D H X S+ 0 0 6 -4,-2.1 4,-2.7 -8,-0.3 5,-0.2 0.948 110.5 49.1 -59.1 -46.3 15.5 33.2 -8.8 155 185 A T H X S+ 0 0 65 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.890 110.1 51.3 -62.8 -39.9 15.6 37.0 -9.1 156 186 A K H X S+ 0 0 116 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.889 111.5 47.7 -65.3 -38.5 12.0 37.3 -8.1 157 187 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.955 113.0 47.4 -67.2 -48.4 12.6 35.1 -5.0 158 188 A K H X S+ 0 0 54 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.914 113.3 49.1 -58.0 -43.7 15.6 37.0 -4.0 159 189 A N H X S+ 0 0 101 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.873 109.8 51.7 -60.8 -41.2 13.8 40.3 -4.5 160 190 A A H X S+ 0 0 11 -4,-2.1 4,-2.0 2,-0.2 34,-0.2 0.870 108.9 50.2 -67.2 -37.7 10.8 39.0 -2.5 161 191 A I H X S+ 0 0 3 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.958 114.4 44.8 -62.9 -48.4 13.0 38.0 0.5 162 192 A Q H X S+ 0 0 99 -4,-2.2 4,-2.7 -5,-0.2 5,-0.3 0.905 110.2 54.0 -63.3 -38.4 14.6 41.4 0.5 163 193 A K H X S+ 0 0 103 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.902 109.0 48.3 -70.2 -33.5 11.4 43.3 0.1 164 194 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 26,-0.3 5,-0.2 0.927 112.7 48.4 -66.2 -47.4 9.8 41.6 3.2 165 195 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.943 114.9 44.3 -57.8 -47.0 12.9 42.2 5.3 166 196 A K H X S+ 0 0 110 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.884 110.1 55.6 -69.0 -36.2 13.0 45.9 4.3 167 197 A A H X S+ 0 0 8 -4,-2.3 4,-0.8 -5,-0.3 20,-0.3 0.920 108.9 47.4 -62.9 -39.3 9.2 46.3 4.7 168 198 A I H >< S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.943 112.1 50.0 -66.7 -44.0 9.5 45.1 8.3 169 199 A Q H 3< S+ 0 0 60 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.815 102.5 62.6 -62.6 -29.0 12.4 47.4 9.0 170 200 A D H 3< S+ 0 0 82 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.721 76.2 104.9 -69.3 -22.0 10.5 50.3 7.5 171 201 A I S << S- 0 0 2 -3,-1.2 4,-0.1 -4,-0.8 8,-0.1 -0.356 90.0-102.7 -56.6 132.3 7.8 50.0 10.2 172 202 A P - 0 0 42 0, 0.0 5,-0.2 0, 0.0 6,-0.2 -0.376 57.0 -73.9 -61.8 138.4 8.5 52.9 12.6 173 203 A Q S S+ 0 0 85 1,-0.1 2,-0.1 -4,-0.1 -60,-0.0 -0.599 117.1 32.2 -75.7 131.3 10.3 51.8 15.7 174 204 A P > - 0 0 4 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.596 68.8-158.1 -90.1 152.5 8.8 50.3 17.8 175 205 A F G > S+ 0 0 0 1,-0.3 3,-2.3 2,-0.2 6,-0.2 0.878 91.6 66.4 -52.9 -41.1 6.1 48.4 15.9 176 206 A R G 3 S+ 0 0 23 1,-0.3 3,-0.4 2,-0.2 -1,-0.3 0.789 104.3 44.0 -57.5 -26.6 4.0 48.2 19.1 177 207 A N G < S+ 0 0 83 -3,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.371 119.0 43.7 -95.4 2.0 3.5 52.0 18.9 178 208 A H X + 0 0 63 -3,-2.3 3,-1.5 -4,-0.4 6,-0.3 -0.091 67.1 135.0-136.5 34.7 2.8 52.0 15.2 179 209 A I T 3 S+ 0 0 1 -3,-0.4 -2,-0.1 1,-0.3 -3,-0.1 0.921 75.2 45.3 -57.8 -45.6 0.5 49.0 14.7 180 210 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.3 0, 0.0 5,-0.1 0.452 87.7 128.9 -80.6 4.5 -2.0 50.8 12.3 181 211 A S S <> S- 0 0 19 -3,-1.5 4,-1.5 -6,-0.2 3,-0.2 -0.086 71.7-120.5 -62.0 153.4 0.7 52.4 10.2 182 212 A N H > S+ 0 0 137 1,-0.2 4,-3.2 2,-0.2 5,-0.1 0.841 116.2 60.3 -55.8 -35.1 0.8 52.1 6.4 183 213 A E H > S+ 0 0 76 2,-0.3 4,-4.0 1,-0.2 5,-0.3 0.892 98.3 54.6 -64.9 -36.1 4.2 50.5 6.9 184 214 A T H > S+ 0 0 0 -6,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.943 112.2 47.4 -56.4 -36.3 2.6 47.7 8.9 185 215 A V H X S+ 0 0 40 -4,-1.5 4,-2.6 2,-0.2 -2,-0.3 0.917 111.9 46.5 -68.0 -53.7 0.5 47.4 5.9 186 216 A A H X S+ 0 0 48 -4,-3.2 4,-2.5 1,-0.2 -2,-0.2 0.875 113.5 50.4 -61.0 -37.3 3.5 47.5 3.6 187 217 A A H X S+ 0 0 0 -4,-4.0 4,-2.3 -20,-0.3 -2,-0.2 0.930 111.8 46.7 -68.0 -41.0 5.3 45.0 5.8 188 218 A X H X S+ 0 0 33 -4,-2.7 4,-2.2 -5,-0.3 -2,-0.2 0.925 112.8 50.7 -62.2 -45.4 2.3 42.6 5.7 189 219 A D H X S+ 0 0 95 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.910 111.3 47.5 -58.3 -46.7 2.0 43.1 1.9 190 220 A A H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 -26,-0.3 0.886 111.4 50.3 -65.5 -40.3 5.7 42.3 1.4 191 221 A C H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.879 109.3 52.2 -63.5 -38.2 5.5 39.2 3.6 192 222 A A H X S+ 0 0 60 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.903 109.3 49.0 -64.2 -42.2 2.4 38.0 1.7 193 223 A E H X S+ 0 0 103 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.899 114.1 46.4 -62.9 -41.0 4.3 38.3 -1.6 194 224 A L H X S+ 0 0 0 -4,-2.0 4,-1.9 -34,-0.2 5,-0.2 0.901 109.3 53.4 -69.4 -43.3 7.2 36.4 -0.3 195 225 A E H X S+ 0 0 47 -4,-2.7 4,-2.2 1,-0.2 5,-0.3 0.921 112.4 46.3 -57.1 -43.3 5.1 33.7 1.2 196 226 A S H X>S+ 0 0 51 -4,-2.1 4,-2.1 1,-0.2 5,-0.8 0.911 108.2 53.0 -68.2 -43.8 3.5 33.3 -2.1 197 227 A I H <>S+ 0 0 16 -4,-2.4 5,-1.5 3,-0.2 -1,-0.2 0.828 115.2 43.4 -64.9 -27.9 6.7 33.2 -4.2 198 228 A L H <>S+ 0 0 2 -4,-1.9 5,-1.5 3,-0.2 -2,-0.2 0.954 119.7 36.2 -77.6 -54.9 8.2 30.5 -2.0 199 229 A K H <5S+ 0 0 58 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.791 131.5 25.9 -76.8 -25.2 5.3 28.1 -1.5 200 230 A N T X5S+ 0 0 89 -4,-2.1 4,-1.9 -5,-0.3 5,-0.4 0.831 127.1 30.6 -99.1 -77.0 3.8 28.5 -5.0 201 231 A D H >< - 0 0 77 -4,-1.6 3,-2.3 1,-0.2 5,-0.4 -0.564 65.3-154.5 -71.2 108.4 8.1 19.4 -11.8 209 239 A N G > S+ 0 0 112 -2,-0.7 3,-2.1 1,-0.3 5,-0.2 0.817 89.0 68.9 -51.4 -34.2 10.3 16.5 -13.2 210 240 A S G 3 S+ 0 0 92 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.654 88.1 63.9 -66.9 -14.3 10.4 18.2 -16.5 211 241 A N G < S- 0 0 43 -3,-2.3 -1,-0.3 -6,-0.2 -2,-0.2 0.568 97.4-139.6 -87.8 -5.5 12.6 20.9 -15.1 212 242 A N S < S+ 0 0 124 -3,-2.1 -3,-0.1 -4,-0.3 -2,-0.1 0.696 72.8 103.4 62.9 26.3 15.4 18.4 -14.4 213 243 A I + 0 0 14 -5,-0.4 -1,-0.1 -7,-0.3 -4,-0.1 0.125 58.3 75.7-123.9 21.9 16.4 19.9 -11.0 214 244 A N + 0 0 16 -5,-0.2 -149,-0.4 -6,-0.1 2,-0.1 0.314 64.6 110.6-119.2 11.0 14.8 17.4 -8.6 215 245 A T S > S- 0 0 68 1,-0.1 4,-2.9 -3,-0.1 5,-0.3 -0.398 79.2-114.8 -72.3 158.6 17.1 14.4 -8.8 216 246 A D H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 -1,-0.1 0.871 117.4 62.0 -59.6 -34.3 19.4 13.4 -5.9 217 247 A A H 4 S+ 0 0 87 1,-0.2 -1,-0.2 2,-0.2 -4,-0.0 0.921 113.6 33.8 -60.2 -40.7 22.3 14.3 -8.2 218 248 A V H 4 S+ 0 0 47 -3,-0.2 4,-0.4 2,-0.1 -2,-0.2 0.922 127.9 35.7 -76.6 -44.4 21.1 17.9 -8.3 219 249 A L H X S+ 0 0 1 -4,-2.9 4,-2.5 1,-0.2 3,-0.4 0.729 94.7 79.0 -94.1 -20.7 19.7 18.3 -4.8 220 250 A N H X S+ 0 0 58 -4,-2.6 4,-2.6 -5,-0.3 5,-0.2 0.909 96.8 47.6 -51.6 -49.2 21.9 16.2 -2.6 221 251 A P H > S+ 0 0 48 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.826 110.1 53.7 -65.8 -28.8 24.6 18.9 -2.5 222 252 A V H > S+ 0 0 6 -4,-0.4 4,-2.3 -3,-0.4 -2,-0.2 0.930 111.6 45.0 -65.2 -47.2 22.0 21.5 -1.7 223 253 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.930 113.8 49.4 -62.1 -44.8 20.7 19.4 1.3 224 254 A T H X S+ 0 0 55 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.932 113.2 45.8 -63.6 -47.2 24.3 18.8 2.5 225 255 A Q H X>S+ 0 0 44 -4,-2.2 4,-2.8 -5,-0.2 5,-0.7 0.891 111.2 53.3 -61.8 -42.8 25.3 22.4 2.3 226 256 A Y H X>S+ 0 0 3 -4,-2.3 5,-2.4 3,-0.2 4,-1.4 0.938 114.9 40.2 -58.9 -46.4 22.0 23.5 4.0 227 257 A V H <>S+ 0 0 0 -4,-2.4 5,-2.6 3,-0.2 -2,-0.2 0.954 122.2 39.8 -68.4 -47.6 22.5 21.2 6.9 228 258 A D H <5S+ 0 0 74 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.786 128.4 28.0 -79.5 -29.1 26.3 21.7 7.4 229 259 A A H <5S+ 0 0 26 -4,-2.8 -3,-0.2 -5,-0.2 -1,-0.2 0.664 133.3 22.0-103.6 -27.7 26.5 25.5 6.7 230 260 A V T X S+ 0 0 42 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.852 109.7 52.5 -61.9 -35.8 26.0 26.2 12.7 234 264 A T H X S+ 0 0 7 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.937 111.9 44.9 -63.5 -43.5 22.9 28.2 13.7 235 265 A Y H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -199,-0.2 0.838 110.8 54.5 -70.7 -31.1 22.1 25.7 16.4 236 266 A K H X S+ 0 0 99 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.936 110.4 46.6 -61.3 -46.2 25.8 25.6 17.6 237 267 A S H X S+ 0 0 23 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.915 110.9 52.4 -61.9 -43.6 25.6 29.4 17.9 238 268 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.911 110.1 48.2 -59.4 -46.6 22.3 29.2 19.8 239 269 A K H X S+ 0 0 44 -4,-2.4 4,-2.0 -207,-0.2 -2,-0.2 0.943 114.1 46.0 -58.9 -47.7 23.8 26.7 22.2 240 270 A E H X S+ 0 0 99 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.915 115.8 45.3 -63.4 -39.7 26.9 28.8 22.8 241 271 A K H X S+ 0 0 63 -4,-2.8 4,-2.3 2,-0.2 30,-0.2 0.832 110.2 52.3 -79.9 -30.1 24.9 32.0 23.2 242 272 A N H X S+ 0 0 2 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.862 109.4 52.9 -69.2 -31.4 22.2 30.4 25.5 243 273 A D H X S+ 0 0 32 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.945 110.5 46.4 -63.4 -48.3 25.3 29.3 27.6 244 274 A A H X S+ 0 0 49 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.893 110.2 53.5 -59.7 -41.7 26.5 32.9 27.7 245 275 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.890 105.3 53.7 -60.1 -43.4 23.0 34.1 28.6 246 276 A Y H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.942 109.8 48.1 -57.7 -47.8 22.9 31.7 31.6 247 277 A N H X S+ 0 0 98 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.916 110.1 51.7 -61.8 -41.0 26.2 33.1 32.9 248 278 A A H X S+ 0 0 14 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.873 110.3 49.0 -62.9 -39.2 25.0 36.6 32.5 249 279 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.900 109.3 52.0 -66.7 -41.0 21.8 35.8 34.4 250 280 A I H X S+ 0 0 34 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 110.2 49.0 -61.7 -42.5 23.8 34.1 37.3 251 281 A V H X S+ 0 0 87 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.926 110.2 51.4 -65.4 -39.4 26.0 37.3 37.6 252 282 A L H < S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.903 111.8 47.0 -60.4 -43.9 22.9 39.5 37.7 253 283 A A H < S+ 0 0 18 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.888 116.5 44.4 -64.6 -38.7 21.5 37.3 40.5 254 284 A D H < S+ 0 0 127 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.773 132.4 16.7 -79.6 -28.8 24.8 37.3 42.4 255 285 A N S < S- 0 0 113 -4,-2.3 -1,-0.3 -5,-0.2 5,-0.2 -0.597 82.8-162.3-145.5 71.2 25.5 41.0 42.0 256 286 A P + 0 0 46 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.378 28.4 131.2 -69.0 137.5 22.4 42.9 41.0 257 287 A S > - 0 0 39 1,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.951 69.2 -94.3-166.9 167.9 22.7 46.4 39.5 258 288 A N H > S+ 0 0 59 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.903 126.2 52.0 -57.9 -41.4 21.6 48.5 36.5 259 289 A S H > S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.883 107.0 52.2 -64.6 -40.3 24.8 47.5 34.7 260 290 A A H > S+ 0 0 13 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 108.7 50.3 -64.6 -38.4 24.1 43.8 35.4 261 291 A F H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.921 110.6 50.0 -61.0 -49.1 20.6 44.1 33.9 262 292 A E H X S+ 0 0 97 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.915 110.4 50.1 -55.7 -44.3 22.1 45.8 30.9 263 293 A T H X S+ 0 0 81 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.896 111.3 47.6 -62.1 -43.2 24.6 43.0 30.5 264 294 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.908 111.1 51.9 -67.3 -37.3 22.0 40.3 30.7 265 295 A C H X S+ 0 0 3 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.912 107.5 52.2 -63.4 -44.0 19.8 42.2 28.2 266 296 A D H X S+ 0 0 105 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.926 110.2 49.0 -54.5 -44.9 22.8 42.3 25.8 267 297 A A H X S+ 0 0 17 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.837 107.7 54.9 -64.2 -33.8 23.2 38.6 26.2 268 298 A W H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.949 110.0 45.0 -64.8 -49.4 19.4 38.1 25.5 269 299 A I H X S+ 0 0 64 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.917 113.2 51.9 -58.5 -44.3 19.6 40.0 22.2 270 300 A T H < S+ 0 0 64 -4,-2.2 3,-0.3 -5,-0.2 -1,-0.2 0.918 113.1 43.4 -59.5 -45.9 22.8 38.0 21.3 271 301 A A H X S+ 0 0 0 -4,-2.4 4,-1.2 -30,-0.2 -1,-0.2 0.840 108.2 60.6 -70.4 -33.3 21.2 34.7 22.0 272 302 A R H X S+ 0 0 0 -4,-2.5 4,-3.3 1,-0.2 5,-0.3 0.805 91.1 70.5 -63.0 -30.7 18.0 35.7 20.2 273 303 A E H X S+ 0 0 77 -4,-1.3 4,-2.6 -3,-0.3 -1,-0.2 0.945 101.9 38.6 -60.8 -53.0 19.7 36.2 16.9 274 304 A P H 4 S+ 0 0 9 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.885 117.5 53.4 -65.6 -32.7 20.5 32.6 16.1 275 305 A W H >< S+ 0 0 0 -4,-1.2 3,-1.7 2,-0.2 4,-0.3 0.975 112.2 42.6 -59.3 -50.8 17.1 31.6 17.5 276 306 A E H >< S+ 0 0 0 -4,-3.3 3,-1.3 1,-0.3 -152,-0.3 0.882 112.2 54.7 -66.4 -36.5 15.3 34.1 15.3 277 307 A K T 3< S+ 0 0 39 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.441 103.5 58.6 -77.8 3.8 17.5 33.2 12.3 278 308 A S T X S+ 0 0 0 -3,-1.7 3,-2.1 -4,-0.3 -1,-0.2 0.450 75.0 96.6-102.1 -3.5 16.5 29.5 12.8 279 309 A E G X S+ 0 0 8 -3,-1.3 3,-0.6 -4,-0.3 -2,-0.1 0.581 71.4 66.1 -77.0 -5.3 12.7 30.0 12.4 280 310 A A G 3 S+ 0 0 0 1,-0.2 -1,-0.3 -3,-0.2 -203,-0.1 0.506 103.6 50.7 -80.0 -6.0 12.7 29.1 8.7 281 311 A F G < + 0 0 0 -3,-2.1 2,-1.9 -206,-0.1 -1,-0.2 -0.334 63.0 147.9-127.7 53.2 13.6 25.5 9.8 282 312 A L < + 0 0 26 -3,-0.6 2,-0.3 -208,-0.2 -3,-0.1 -0.496 47.0 99.3 -83.7 66.1 11.1 24.7 12.6 283 313 A F > + 0 0 1 -2,-1.9 3,-0.8 5,-0.0 5,-0.1 -0.929 64.3 20.8-143.3 167.8 11.1 21.0 11.7 284 314 A G G > S+ 0 0 5 -2,-0.3 3,-2.0 1,-0.2 4,-0.0 -0.440 124.8 2.4 69.6-144.2 12.7 17.9 13.1 285 315 A P G > S+ 0 0 8 0, 0.0 3,-1.7 0, 0.0 6,-0.3 0.819 132.2 52.2 -45.1 -45.1 14.0 18.1 16.7 286 316 A V G < S+ 0 0 0 -3,-0.8 6,-1.5 1,-0.3 -2,-0.2 0.774 109.9 51.3 -67.5 -21.9 12.8 21.6 17.4 287 317 A D G < S+ 0 0 95 -3,-2.0 2,-0.3 4,-0.2 -1,-0.3 0.086 101.9 80.5-101.0 19.5 9.3 20.7 16.2 288 318 A E S X S+ 0 0 51 -3,-1.7 3,-2.4 -5,-0.1 4,-0.2 -0.906 91.4 9.3-125.6 151.1 9.1 17.6 18.4 289 319 A X T 3 S- 0 0 176 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.738 121.3 -70.1 57.6 28.2 8.3 16.9 22.1 290 320 A G T 3> S+ 0 0 25 -3,-0.1 4,-2.0 1,-0.1 -1,-0.3 0.667 91.5 143.0 65.3 21.8 7.1 20.5 22.6 291 321 A L H <> + 0 0 23 -3,-2.4 4,-1.2 -6,-0.3 5,-0.2 0.909 67.4 50.3 -60.1 -47.0 10.7 21.9 22.3 292 322 A D H >> S+ 0 0 37 -6,-1.5 4,-2.2 1,-0.2 3,-1.1 0.968 113.5 44.1 -59.8 -52.5 9.7 25.0 20.4 293 323 A P H 3> S+ 0 0 44 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.793 110.5 57.0 -66.5 -20.9 7.0 26.0 22.8 294 324 A N H 3< S+ 0 0 29 -4,-2.0 42,-0.3 1,-0.2 -2,-0.2 0.742 118.0 33.5 -72.8 -23.4 9.4 25.2 25.7 295 325 A X H << S+ 0 0 0 -4,-1.2 42,-2.9 -3,-1.1 -1,-0.2 0.657 134.8 14.8 -99.7 -24.0 11.9 27.6 24.2 296 326 A D H < + 0 0 16 -4,-2.2 -2,-0.2 40,-0.3 40,-0.1 -0.024 68.2 163.3-155.5 38.9 9.7 30.4 22.8 297 327 A S < - 0 0 19 -4,-0.8 41,-0.3 35,-0.4 42,-0.1 -0.363 23.4-147.9 -67.0 146.7 6.1 30.5 23.7 298 328 A W S S+ 0 0 50 1,-0.1 2,-0.2 -191,-0.1 -191,-0.1 -0.887 71.3 37.8-157.9 131.0 4.1 33.7 23.1 299 329 A P S S- 0 0 94 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.561 82.8-151.0 -73.6 172.1 1.8 35.0 24.6 300 330 A L - 0 0 18 -2,-0.2 2,-1.3 38,-0.1 3,-0.2 -0.666 26.3-111.2-103.6 163.8 2.8 34.3 28.2 301 331 A D > + 0 0 70 32,-2.6 4,-1.5 -2,-0.2 3,-0.2 -0.752 46.3 175.9 -88.8 83.1 0.7 33.8 31.3 302 332 A Q H > S+ 0 0 24 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.891 72.1 54.9 -66.6 -37.9 2.0 37.1 32.6 303 333 A N H > S+ 0 0 62 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 105.4 54.7 -64.2 -34.4 -0.1 37.1 35.8 304 334 A A H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.866 106.1 52.2 -63.8 -35.9 1.4 33.7 36.6 305 335 A I H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.931 109.0 49.3 -64.5 -45.4 4.9 35.2 36.3 306 336 A V H X S+ 0 0 19 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.916 109.8 51.7 -59.3 -41.7 3.9 38.0 38.7 307 337 A Q H < S+ 0 0 122 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.918 110.0 49.9 -61.7 -42.8 2.5 35.4 41.2 308 338 A I H >< S+ 0 0 28 -4,-2.3 3,-1.2 1,-0.2 6,-0.3 0.932 109.8 50.5 -56.9 -46.5 5.8 33.5 41.0 309 339 A L H 3< S+ 0 0 1 -4,-2.5 -293,-0.3 1,-0.3 -292,-0.2 0.809 113.8 45.2 -67.1 -29.4 7.8 36.7 41.6 310 340 A N T 3< S+ 0 0 109 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.428 92.2 113.0 -88.7 -0.1 5.6 37.4 44.7 311 341 A S <> - 0 0 28 -3,-1.2 4,-1.3 -4,-0.5 5,-0.1 -0.480 61.3-147.6 -83.0 142.7 5.8 33.9 46.0 312 342 A Q H > S+ 0 0 129 -2,-0.2 4,-2.2 2,-0.2 5,-0.2 0.834 97.3 62.1 -71.8 -31.3 7.5 32.9 49.2 313 343 A S H > S+ 0 0 86 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.934 107.2 41.7 -63.7 -45.9 8.5 29.5 47.7 314 344 A W H 4 S+ 0 0 27 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.826 114.7 53.8 -71.2 -26.0 10.6 31.0 44.9 315 345 A S H < S+ 0 0 27 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.862 113.8 41.2 -68.1 -38.5 12.0 33.5 47.4 316 346 A D H < S+ 0 0 101 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.504 86.0 125.8 -91.5 -7.6 13.1 30.8 49.8 317 347 A L < - 0 0 56 -4,-0.9 2,-0.3 -5,-0.2 -298,-0.0 -0.268 40.6-162.9 -60.2 138.1 14.4 28.3 47.3 318 348 A E - 0 0 173 -299,-0.0 2,-0.3 0, 0.0 -2,-0.1 -0.887 14.7-130.6-116.2 144.4 18.0 27.0 47.7 319 349 A W - 0 0 50 -2,-0.3 3,-0.1 1,-0.1 2,-0.1 -0.747 22.6-101.7 -97.0 150.3 19.9 25.3 44.8 320 350 A S > - 0 0 81 -2,-0.3 3,-1.7 1,-0.1 -1,-0.1 -0.409 59.8 -84.0 -60.5 141.5 21.9 22.0 44.7 321 351 A E T 3 S- 0 0 193 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.263 102.9 -14.2 -61.5 129.0 25.6 22.7 44.9 322 352 A G T 3 S+ 0 0 80 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.694 96.7 144.6 55.7 29.9 27.3 23.5 41.6 323 353 A D < - 0 0 57 -3,-1.7 -1,-0.2 1,-0.1 -3,-0.1 -0.873 33.6-173.5-108.7 118.8 24.2 22.3 39.7 324 354 A D + 0 0 81 -2,-0.5 -294,-0.1 -3,-0.1 -1,-0.1 0.464 51.2 110.5 -90.6 -2.1 23.2 24.1 36.5 325 355 A E S S- 0 0 132 1,-0.1 -5,-0.1 -296,-0.1 -298,-0.1 -0.314 77.8 -96.2 -70.5 154.6 20.0 22.2 36.0 326 356 A A - 0 0 26 -300,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.343 18.8-140.0 -64.9 150.5 16.6 23.9 36.4 327 357 A A S S+ 0 0 47 1,-0.3 2,-0.4 -308,-0.2 -1,-0.1 0.808 88.2 25.2 -73.6 -37.1 14.8 23.6 39.7 328 358 A V S S- 0 0 68 -305,-0.0 2,-1.9 -3,-0.0 -1,-0.3 -0.995 70.7-132.8-140.0 130.5 11.4 23.3 38.0 329 359 A E - 0 0 136 -2,-0.4 6,-0.1 -3,-0.1 -306,-0.0 -0.580 48.1-154.0 -77.1 79.9 10.3 22.0 34.6 330 360 A S - 0 0 11 -2,-1.9 5,-0.1 1,-0.1 -4,-0.0 -0.042 16.5 -89.7 -65.9 159.2 8.1 25.1 34.2 331 361 A A > - 0 0 59 1,-0.1 3,-1.8 3,-0.1 -1,-0.1 -0.264 39.0-111.9 -60.8 149.6 4.9 25.4 32.0 332 362 A Q G > S+ 0 0 85 1,-0.3 3,-1.4 2,-0.2 -35,-0.4 0.871 114.4 55.2 -52.0 -43.4 5.4 26.6 28.4 333 363 A N G 3 S+ 0 0 67 1,-0.3 -32,-2.6 -33,-0.1 -1,-0.3 0.383 111.1 43.5 -83.3 5.8 3.7 29.9 29.0 334 364 A V G < S+ 0 0 11 -3,-1.8 -1,-0.3 -34,-0.2 2,-0.2 0.065 112.8 53.8-131.4 26.3 5.9 30.9 32.0 335 365 A R S <> S+ 0 0 1 -3,-1.4 4,-0.6 -42,-0.2 3,-0.3 -0.667 70.4 62.5-135.4-167.7 9.3 29.9 30.5 336 366 A G H >> S- 0 0 0 -42,-0.3 4,-2.1 -312,-0.3 3,-0.8 0.010 97.2 -43.7 80.5-179.4 11.3 30.5 27.3 337 367 A F H 3> S+ 0 0 0 -42,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.818 133.0 52.0 -53.8 -41.0 12.9 33.5 25.8 338 368 A H H 3> S+ 0 0 0 -41,-0.3 4,-2.1 -3,-0.3 -1,-0.2 0.794 105.8 53.7 -76.2 -25.2 10.0 35.7 26.3 339 369 A T H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 3,-0.7 0.921 106.5 50.6 -55.7 -46.7 12.6 39.0 28.3 342 372 A F H 3< S+ 0 0 7 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.874 111.4 49.3 -56.5 -40.1 9.8 39.9 30.7 343 373 A L H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.659 119.1 37.2 -75.3 -18.6 12.2 39.5 33.6 344 374 A L H << S+ 0 0 0 -4,-1.2 7,-2.7 -3,-0.7 2,-0.3 0.667 114.5 45.1-105.9 -27.4 15.0 41.6 32.0 345 375 A Y E < -B 350 0B 16 -4,-2.3 2,-0.3 5,-0.3 -234,-0.1 -0.889 48.1-172.4-124.4 152.7 13.1 44.5 30.2 346 376 A K E > S-B 349 0B 55 3,-2.7 3,-1.5 -2,-0.3 -236,-0.1 -0.940 75.9 -17.0-143.4 125.1 10.3 46.9 30.7 347 377 A N T 3 S- 0 0 93 -2,-0.3 -236,-0.2 1,-0.3 -237,-0.1 0.867 128.4 -46.9 55.9 41.5 8.9 49.2 28.0 348 378 A G T 3 S+ 0 0 12 -238,-2.7 -1,-0.3 1,-0.2 -237,-0.2 0.425 122.1 85.1 87.0 1.2 11.8 48.8 25.6 349 379 A E E < S-B 346 0B 127 -3,-1.5 -3,-2.7 -239,-0.3 -1,-0.2 -0.916 86.3 -88.8-130.8 155.8 14.7 49.3 28.1 350 380 A P E -B 345 0B 32 0, 0.0 -5,-0.3 0, 0.0 -88,-0.1 -0.344 53.3-104.6 -56.5 143.8 16.6 47.2 30.5 351 381 A R - 0 0 19 -7,-2.7 2,-0.3 -90,-0.1 -90,-0.1 -0.308 34.7-142.8 -65.0 157.4 15.0 47.0 34.0 352 382 A K - 0 0 149 -91,-0.1 -343,-0.4 -3,-0.1 2,-0.1 -0.856 12.0-115.7-120.5 154.2 16.6 49.0 36.8 353 383 A V 0 0 46 -2,-0.3 -343,-0.1 1,-0.1 -95,-0.0 -0.456 360.0 360.0 -80.7 162.0 17.0 48.3 40.5 354 384 A Q 0 0 191 -2,-0.1 -1,-0.1 -345,-0.1 -344,-0.1 -0.220 360.0 360.0 -69.6 360.0 15.2 50.5 43.0