==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-JUN-09 3HQN . COMPND 2 MOLECULE: PYRUVATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MEXICANA; . AUTHOR H.P.MORGAN,M.D.WALKINSHAW . 985 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38796.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 733 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 124 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 76 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 100 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 307 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 6 2 4 4 2 0 5 1 1 5 0 0 2 0 6 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 12 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 3 0 3 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 D S > 0 0 52 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 6.6 9.9 7.7 36.2 2 2 D Q H > + 0 0 39 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.824 360.0 70.5 -49.2 -38.3 13.1 8.8 37.4 3 3 D L H > S+ 0 0 12 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.911 100.0 41.3 -59.3 -49.5 10.8 11.5 38.9 4 4 D A H > S+ 0 0 33 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.868 114.5 53.3 -67.1 -36.3 9.2 9.1 41.5 5 5 D H H >< S+ 0 0 51 -4,-1.5 3,-1.0 1,-0.2 4,-0.4 0.881 102.5 58.4 -66.4 -35.8 12.6 7.6 42.2 6 6 D N H >< S+ 0 0 7 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.860 98.8 59.8 -55.8 -39.4 14.1 11.1 42.9 7 7 D L H 3< S+ 0 0 39 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.794 106.2 46.8 -65.3 -24.8 11.5 11.7 45.6 8 8 D T T << S+ 0 0 102 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.421 91.7 107.4 -93.4 -10.3 12.8 8.6 47.6 9 9 D L < - 0 0 36 -3,-1.1 2,-0.4 -4,-0.4 347,-0.1 -0.450 47.5-165.5 -77.9 150.0 16.5 9.4 47.4 10 10 D S > - 0 0 50 -2,-0.1 3,-1.7 4,-0.1 762,-0.0 -0.980 16.8-150.9-128.2 127.6 18.9 10.6 50.1 11 11 D I T 3 S+ 0 0 3 -2,-0.4 -1,-0.1 1,-0.3 761,-0.1 0.671 98.1 60.4 -68.1 -10.6 22.3 12.0 49.3 12 12 D F T 3 S+ 0 0 90 2,-0.1 -1,-0.3 -3,-0.0 3,-0.1 0.441 83.6 99.8 -92.5 -0.3 23.5 10.8 52.8 13 13 D D S < S- 0 0 93 -3,-1.7 -4,-0.0 1,-0.1 0, 0.0 -0.471 86.6 -89.2 -79.4 160.0 22.7 7.1 52.0 14 14 D P - 0 0 124 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.301 41.0-116.2 -67.8 154.1 25.6 4.8 50.9 15 15 D V - 0 0 62 1,-0.2 337,-0.1 -3,-0.1 336,-0.0 -0.277 45.5 -75.8 -76.5 171.9 26.5 4.5 47.2 16 16 D A - 0 0 35 335,-0.4 -1,-0.2 2,-0.1 339,-0.1 -0.108 35.1-118.5 -63.6 165.8 26.2 1.2 45.4 17 17 D N S S+ 0 0 104 -3,-0.1 2,-0.3 452,-0.1 -1,-0.1 0.290 95.0 36.9 -89.0 10.1 28.6 -1.7 45.9 18 18 D Y S S- 0 0 26 333,-0.1 2,-0.5 451,-0.0 -2,-0.1 -0.971 73.3-131.9-156.4 150.4 29.8 -1.7 42.1 19 19 D R - 0 0 57 -2,-0.3 417,-0.1 1,-0.1 332,-0.1 -0.948 17.1-171.1-109.1 126.1 30.3 1.0 39.5 20 20 D A + 0 0 11 -2,-0.5 416,-2.2 330,-0.2 417,-0.3 0.854 58.5 83.8 -85.9 -40.1 28.6 0.2 36.1 21 21 D A S S- 0 0 6 414,-0.2 2,-0.4 326,-0.1 305,-0.2 -0.255 72.8-135.4 -66.5 152.0 30.0 3.0 33.8 22 22 D R E -a 326 0A 18 303,-2.6 305,-2.2 411,-0.1 2,-0.5 -0.868 6.9-138.3-113.0 147.4 33.3 2.3 32.2 23 23 D I E -ab 327 45A 0 21,-0.6 23,-2.6 -2,-0.4 24,-1.2 -0.877 10.6-164.8-109.3 124.0 36.3 4.7 31.9 24 24 D I E -ab 328 47A 0 303,-2.8 305,-2.4 -2,-0.5 2,-0.4 -0.893 10.4-164.1-101.6 131.6 38.4 5.0 28.8 25 25 D C E -ab 329 48A 0 22,-3.0 24,-2.8 -2,-0.4 2,-0.4 -0.963 15.4-133.2-119.2 137.5 41.8 6.8 29.1 26 26 D T E - b 0 49A 5 303,-1.2 2,-0.4 -2,-0.4 24,-0.2 -0.689 24.6-132.6 -87.7 134.6 44.0 8.2 26.4 27 27 D I + 0 0 10 22,-2.7 24,-0.5 -2,-0.4 307,-0.2 -0.675 43.6 131.2 -91.2 129.3 47.7 7.3 26.7 28 28 D G S >> S- 0 0 4 305,-0.4 3,-2.4 -2,-0.4 4,-1.1 -0.852 70.6 -49.1-152.5-157.1 50.4 10.0 26.3 29 29 D P T 34 S+ 0 0 114 0, 0.0 4,-0.2 0, 0.0 3,-0.2 0.778 129.3 53.2 -60.5 -28.5 53.5 11.3 28.0 30 30 D S T 34 S+ 0 0 45 304,-2.3 305,-0.2 1,-0.2 304,-0.1 0.662 125.8 23.5 -71.0 -18.1 51.9 11.6 31.5 31 31 D T T <4 S+ 0 0 1 -3,-2.4 -1,-0.2 303,-0.5 9,-0.1 0.306 87.0 98.8-135.6 4.3 50.8 8.0 31.3 32 32 D Q < + 0 0 31 -4,-1.1 34,-0.1 -3,-0.2 -2,-0.1 0.765 60.4 95.5 -80.0 -19.6 52.8 5.8 29.0 33 33 D S S > S- 0 0 65 -4,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.319 84.3-116.4 -67.9 156.6 55.1 4.1 31.5 34 34 D V H > S+ 0 0 21 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.932 116.3 49.1 -52.5 -54.1 54.3 0.7 32.9 35 35 D E H > S+ 0 0 127 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.850 110.6 49.0 -55.2 -45.0 54.0 2.2 36.5 36 36 D A H > S+ 0 0 22 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.908 109.8 52.8 -61.3 -40.7 51.8 5.1 35.4 37 37 D L H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.833 107.0 52.6 -65.1 -34.4 49.5 2.6 33.5 38 38 D K H X S+ 0 0 43 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.886 106.7 52.0 -66.8 -40.6 49.2 0.6 36.7 39 39 D G H X S+ 0 0 12 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.885 111.5 48.7 -60.6 -40.2 48.2 3.8 38.6 40 40 D L H X>S+ 0 0 0 -4,-2.0 5,-2.5 2,-0.2 4,-1.3 0.935 110.5 48.9 -62.4 -51.5 45.5 4.3 35.9 41 41 D I H ><5S+ 0 0 20 -4,-2.5 3,-0.9 1,-0.2 -2,-0.2 0.950 113.7 46.4 -56.1 -48.5 44.2 0.7 36.1 42 42 D Q H 3<5S+ 0 0 144 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.821 109.7 56.0 -67.1 -29.6 44.0 1.0 39.9 43 43 D S H 3<5S- 0 0 10 -4,-1.8 -1,-0.3 -5,-0.2 304,-0.2 0.703 134.0 -83.9 -72.2 -23.0 42.3 4.4 39.6 44 44 D G T <<5S+ 0 0 9 -4,-1.3 -21,-0.6 -3,-0.9 -3,-0.2 0.473 72.5 151.6 134.6 12.1 39.5 2.9 37.4 45 45 D M E < +b 23 0A 5 -5,-2.5 -1,-0.2 1,-0.2 -21,-0.2 -0.492 10.1 168.6 -70.9 135.5 40.7 2.7 33.7 46 46 D S E + 0 0 18 -23,-2.6 33,-2.0 1,-0.3 2,-0.4 0.527 67.4 39.1-114.3 -20.8 39.1 -0.2 31.7 47 47 D V E -bc 24 79A 0 -24,-1.2 -22,-3.0 31,-0.2 2,-0.6 -0.986 64.9-150.1-139.0 130.3 40.3 0.8 28.2 48 48 D A E -bc 25 80A 0 31,-3.0 33,-2.8 -2,-0.4 2,-0.5 -0.859 18.6-157.3 -99.6 121.3 43.6 2.3 26.9 49 49 D R E -bc 26 81A 17 -24,-2.8 -22,-2.7 -2,-0.6 2,-0.6 -0.864 4.2-157.3-101.8 129.9 43.1 4.6 23.9 50 50 D M E - c 0 82A 1 31,-2.5 33,-2.7 -2,-0.5 2,-1.0 -0.933 11.8-145.3-103.5 120.9 45.9 5.3 21.5 51 51 D N E > - c 0 83A 45 -2,-0.6 3,-1.4 -24,-0.5 33,-0.1 -0.793 13.1-172.3 -88.8 100.8 45.4 8.5 19.5 52 52 D F T 3 S+ 0 0 0 31,-2.5 33,-0.3 -2,-1.0 -1,-0.1 0.370 70.1 89.7 -80.4 5.7 46.9 7.8 16.1 53 53 D S T 3 S+ 0 0 30 30,-0.3 2,-0.3 31,-0.2 -1,-0.3 0.836 102.7 25.4 -59.8 -33.0 46.5 11.5 15.1 54 54 D H S < S+ 0 0 137 -3,-1.4 -1,-0.1 2,-0.1 -3,-0.0 -0.922 98.2 42.7-126.3 156.9 50.0 11.7 16.6 55 55 D G S S- 0 0 43 -2,-0.3 2,-0.1 4,-0.1 0, 0.0 0.291 71.1 -89.3 94.9 147.8 53.0 9.5 17.2 56 56 D S > - 0 0 63 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.316 39.1-102.2 -82.9 167.2 54.8 6.8 15.3 57 57 D H H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.841 124.5 55.3 -51.8 -38.6 54.1 3.1 15.2 58 58 D E H > S+ 0 0 159 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.882 106.8 50.1 -63.8 -43.7 57.1 2.6 17.5 59 59 D Y H > S+ 0 0 67 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.928 113.5 44.4 -59.1 -45.2 55.5 5.0 20.0 60 60 D H H X S+ 0 0 5 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.831 106.8 59.9 -74.6 -27.1 52.2 3.1 19.9 61 61 D Q H X S+ 0 0 42 -4,-2.3 4,-2.7 -5,-0.2 -1,-0.2 0.896 102.7 53.5 -62.9 -37.7 53.9 -0.2 20.1 62 62 D T H X S+ 0 0 50 -4,-1.5 4,-3.0 2,-0.2 5,-0.3 0.929 109.4 47.5 -62.9 -44.6 55.4 1.0 23.5 63 63 D T H X S+ 0 0 2 -4,-1.5 4,-3.0 1,-0.2 5,-0.3 0.968 112.5 50.7 -58.5 -48.8 51.8 1.8 24.7 64 64 D I H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.903 114.8 41.3 -57.4 -44.1 50.7 -1.5 23.5 65 65 D N H X S+ 0 0 78 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.879 115.5 49.2 -70.9 -43.7 53.5 -3.4 25.3 66 66 D N H X S+ 0 0 31 -4,-3.0 4,-3.2 2,-0.2 5,-0.2 0.853 110.3 51.0 -65.2 -37.4 53.3 -1.4 28.5 67 67 D V H X S+ 0 0 2 -4,-3.0 4,-2.7 -5,-0.3 5,-0.2 0.945 112.0 46.8 -63.4 -49.2 49.5 -1.8 28.8 68 68 D R H X S+ 0 0 98 -4,-1.8 4,-2.0 -5,-0.3 -2,-0.2 0.852 115.6 46.0 -62.9 -35.5 49.7 -5.5 28.4 69 69 D Q H X S+ 0 0 94 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.923 113.1 49.0 -74.2 -43.6 52.6 -5.7 30.9 70 70 D A H X S+ 0 0 0 -4,-3.2 4,-1.6 1,-0.2 -2,-0.2 0.917 113.7 46.5 -60.8 -43.2 50.8 -3.4 33.4 71 71 D A H X>S+ 0 0 7 -4,-2.7 5,-2.5 -5,-0.2 4,-0.6 0.907 111.7 50.7 -68.1 -41.1 47.5 -5.5 33.1 72 72 D A H ><5S+ 0 0 78 -4,-2.0 3,-1.0 3,-0.2 -2,-0.2 0.914 109.6 51.1 -61.7 -42.3 49.4 -8.9 33.4 73 73 D E H 3<5S+ 0 0 95 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.843 114.6 43.8 -67.4 -29.6 51.2 -7.6 36.6 74 74 D L H 3<5S- 0 0 50 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.514 111.3-121.4 -90.4 -2.5 47.9 -6.6 38.1 75 75 D G T <<5S+ 0 0 70 -3,-1.0 2,-0.2 -4,-0.6 -3,-0.2 0.770 71.0 117.4 72.9 29.0 46.0 -9.8 37.0 76 76 D V < - 0 0 58 -5,-2.5 2,-0.5 -6,-0.1 -1,-0.2 -0.777 64.8-120.3-129.2 166.5 43.3 -7.9 34.9 77 77 D N - 0 0 54 -2,-0.2 2,-0.4 362,-0.1 362,-0.1 -0.966 30.5-175.4-110.3 120.1 42.1 -7.7 31.2 78 78 D I - 0 0 13 -2,-0.5 -31,-0.2 -11,-0.1 2,-0.1 -0.974 20.5-128.4-119.2 129.2 42.4 -4.2 29.7 79 79 D A E -c 47 0A 0 -33,-2.0 -31,-3.0 -2,-0.4 2,-0.5 -0.464 13.7-146.4 -73.3 152.4 41.1 -3.3 26.3 80 80 D I E -c 48 0A 2 -33,-0.2 126,-2.2 124,-0.1 127,-1.3 -0.981 14.6-167.7-123.0 124.2 43.3 -1.5 23.7 81 81 D A E -cd 49 207A 0 -33,-2.8 -31,-2.5 -2,-0.5 2,-0.6 -0.942 13.0-150.3-115.5 133.8 41.6 0.8 21.3 82 82 D L E -cd 50 208A 0 125,-2.2 127,-2.3 -2,-0.4 2,-0.7 -0.913 11.1-161.3-103.8 112.8 43.1 2.4 18.2 83 83 D D E -cd 51 209A 0 -33,-2.7 -31,-2.5 -2,-0.6 -30,-0.3 -0.855 19.6-134.6 -98.5 111.0 41.7 5.8 17.5 84 84 D T - 0 0 6 125,-2.0 -31,-0.2 -2,-0.7 109,-0.1 -0.189 9.4-134.5 -73.0 149.6 42.4 6.7 13.8 85 85 D K - 0 0 52 -33,-0.3 -32,-0.1 126,-0.1 -1,-0.1 0.951 48.3-167.4 -63.2 -43.7 43.6 10.1 12.5 86 86 D G - 0 0 3 -34,-0.1 103,-0.1 125,-0.1 126,-0.1 -0.082 32.6 -39.9 81.2 168.9 41.0 9.9 9.8 87 87 D P - 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0 0 27 -4,-1.2 3,-1.5 -3,-0.3 -1,-0.1 -0.062 36.9 -56.8 81.8-179.7 40.6 -7.4 6.2 228 228 D P G > S+ 0 0 111 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 0.821 134.9 57.8 -72.6 -22.7 39.5 -11.0 7.0 229 229 D K G 3 S+ 0 0 176 1,-0.2 3,-0.3 -3,-0.2 -2,-0.2 0.606 105.2 52.1 -79.9 -12.5 42.0 -11.2 9.9 230 230 D G G X S+ 0 0 0 -3,-1.5 3,-1.4 -4,-0.2 -1,-0.2 0.191 72.5 114.4-105.9 20.7 40.4 -8.2 11.6 231 231 D R T < S+ 0 0 153 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.705 75.2 49.1 -68.2 -21.0 36.9 -9.5 11.5 232 232 D D T 3 S+ 0 0 80 -3,-0.3 2,-0.4 -4,-0.1 -1,-0.3 0.343 84.8 105.0-101.0 2.2 36.5 -9.8 15.4 233 233 D I S < S- 0 0 9 -3,-1.4 -26,-0.2 -10,-0.1 2,-0.2 -0.723 74.4-122.9 -79.0 129.6 37.8 -6.3 16.1 234 234 D M E -e 207 0A 10 -28,-1.9 -26,-3.2 -2,-0.4 2,-0.6 -0.505 14.6-145.0 -78.4 142.9 34.9 -4.0 17.1 235 235 D I E -e 208 0A 2 -28,-0.2 21,-2.3 -2,-0.2 22,-0.6 -0.939 12.1-169.4-108.7 112.0 34.4 -0.8 15.1 236 236 D I E -ef 209 257A 1 -28,-3.4 -26,-2.3 -2,-0.6 2,-0.4 -0.911 18.8-139.0-100.9 118.1 33.2 2.1 17.2 237 237 D C E -ef 210 258A 0 20,-2.8 22,-2.9 -2,-0.6 2,-0.6 -0.672 5.6-140.7 -88.6 127.5 32.1 5.0 14.9 238 238 D K E - f 0 259A 18 -28,-3.2 -25,-2.1 -2,-0.4 2,-0.7 -0.760 11.8-150.3 -85.5 119.1 33.0 8.5 16.0 239 239 D I E + f 0 260A 0 20,-2.8 22,-1.3 -2,-0.6 26,-0.3 -0.814 33.6 151.7 -93.2 116.0 30.1 10.9 15.2 240 240 D E + 0 0 24 -2,-0.7 2,-0.3 -27,-0.4 -1,-0.1 0.488 51.4 25.9-129.3 -7.9 31.6 14.3 14.5 241 241 D N S > S- 0 0 0 -28,-0.3 4,-1.7 26,-0.1 3,-0.2 -0.901 88.0 -83.5-151.4-179.6 29.4 16.3 12.2 242 242 D H H > S+ 0 0 17 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.809 121.0 58.5 -63.0 -34.9 25.8 16.8 11.0 243 243 D Q H > S+ 0 0 21 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.937 106.1 47.9 -61.8 -46.9 26.1 13.9 8.4 244 244 D G H 4 S+ 0 0 0 -3,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.870 113.9 48.1 -56.9 -42.7 26.9 11.4 11.1 245 245 D V H >< S+ 0 0 12 -4,-1.7 3,-1.3 2,-0.2 4,-0.2 0.949 113.4 46.4 -66.5 -46.3 24.0 12.7 13.2 246 246 D Q H 3< S+ 0 0 103 -4,-3.0 3,-0.3 1,-0.3 -2,-0.2 0.872 119.6 40.1 -60.5 -42.1 21.5 12.6 10.2 247 247 D N T 3X S+ 0 0 62 -4,-2.5 4,-2.2 -5,-0.2 3,-0.5 0.217 81.0 120.9 -91.3 14.6 22.6 9.1 9.2 248 248 D I H <> + 0 0 8 -3,-1.3 4,-2.9 1,-0.2 5,-0.2 0.848 67.9 55.8 -56.1 -38.5 22.9 7.8 12.8 249 249 D D H > S+ 0 0 94 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.944 112.3 39.4 -58.1 -53.1 20.3 4.9 12.4 250 250 D S H > S+ 0 0 43 -3,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.839 116.1 53.7 -69.2 -28.3 22.0 3.2 9.5 251 251 D I H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.950 108.8 48.6 -68.8 -45.2 25.5 3.9 11.0 252 252 D I H < S+ 0 0 8 -4,-2.9 3,-0.3 -5,-0.2 -2,-0.2 0.928 108.2 54.8 -55.2 -48.0 24.4 2.2 14.3 253 253 D E H < S+ 0 0 139 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.874 115.7 37.5 -54.5 -42.5 23.0 -0.8 12.4 254 254 D E H < S+ 0 0 111 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.701 110.1 70.1 -84.5 -23.5 26.4 -1.4 10.7 255 255 D S S < S- 0 0 1 -4,-1.9 -19,-0.2 -3,-0.3 3,-0.1 -0.349 76.0-130.2 -90.0 174.2 28.8 -0.5 13.6 256 256 D D S S- 0 0 51 -21,-2.3 2,-0.3 1,-0.3 -20,-0.2 0.391 84.2 -32.1 -98.6 -3.6 29.6 -2.2 16.9 257 257 D G E -f 236 0A 0 -22,-0.6 -20,-2.8 33,-0.2 2,-0.4 -0.949 63.3-100.4 164.1-178.5 29.0 1.0 18.8 258 258 D I E -fg 237 292A 0 33,-2.1 35,-2.6 -2,-0.3 2,-0.5 -0.967 7.1-153.8-136.5 140.2 29.2 4.8 18.8 259 259 D M E -fg 238 293A 2 -22,-2.9 -20,-2.8 -2,-0.4 2,-1.0 -0.973 14.8-148.6-110.6 124.7 31.4 7.6 20.1 260 260 D V E -fg 239 294A 0 33,-3.4 35,-2.2 -2,-0.5 2,-1.3 -0.779 12.3-166.2 -92.0 104.8 29.7 11.0 20.8 261 261 D A E > + g 0 295A 1 -22,-1.3 4,-2.7 -2,-1.0 5,-0.2 -0.680 9.8 178.4 -95.9 83.9 32.5 13.4 20.0 262 262 D R H > S+ 0 0 1 33,-1.7 4,-2.4 -2,-1.3 -1,-0.2 0.845 74.5 52.3 -64.4 -36.6 30.9 16.5 21.6 263 263 D G H > S+ 0 0 21 32,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.926 112.9 43.5 -66.2 -44.8 33.9 18.9 20.9 264 264 D D H >> S+ 0 0 61 1,-0.2 3,-1.2 2,-0.2 4,-0.6 0.932 114.5 50.5 -67.2 -42.9 34.1 18.0 17.2 265 265 D L H >X S+ 0 0 0 -4,-2.7 4,-1.9 -26,-0.3 3,-1.2 0.911 104.5 59.1 -55.6 -45.1 30.3 18.2 16.9 266 266 D G H 3< S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.611 89.4 71.9 -67.4 -11.0 30.3 21.6 18.5 267 267 D V H << S+ 0 0 41 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.899 118.5 18.2 -65.7 -37.9 32.6 23.1 15.8 268 268 D E H << S+ 0 0 25 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.1 0.633 123.7 57.8-111.0 -14.8 29.7 23.0 13.4 269 269 D I S < S- 0 0 12 -4,-1.9 -1,-0.1 -5,-0.1 5,-0.1 -0.958 90.5 -98.9-121.7 141.0 26.6 22.7 15.6 270 270 D P >> - 0 0 68 0, 0.0 4,-1.8 0, 0.0 3,-0.9 -0.166 35.8-120.6 -52.6 137.3 25.4 25.1 18.5 271 271 D A H 3> S+ 0 0 20 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.843 111.7 57.2 -55.6 -34.1 26.4 23.6 21.9 272 272 D E H 3> S+ 0 0 13 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.844 108.0 47.7 -70.8 -31.2 22.8 23.4 23.1 273 273 D K H <> S+ 0 0 44 -3,-0.9 4,-2.9 2,-0.2 -1,-0.2 0.787 105.7 56.5 -74.4 -33.5 22.0 21.2 20.1 274 274 D V H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.869 103.0 57.2 -59.1 -38.0 25.0 19.0 20.7 275 275 D V H X S+ 0 0 4 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.948 112.3 40.2 -59.3 -45.9 23.5 18.4 24.2 276 276 D V H X S+ 0 0 4 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.930 111.0 56.5 -69.3 -40.2 20.3 17.2 22.7 277 277 D A H X S+ 0 0 1 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.895 106.1 55.2 -59.4 -36.5 22.3 15.2 19.9 278 278 D Q H X S+ 0 0 7 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.952 107.0 47.1 -61.3 -47.5 24.0 13.4 22.8 279 279 D K H X S+ 0 0 16 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.905 114.9 48.0 -58.7 -42.9 20.7 12.3 24.4 280 280 D I H X S+ 0 0 6 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.934 113.0 44.9 -65.6 -47.4 19.5 11.1 21.1 281 281 D L H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.910 113.1 50.1 -73.2 -37.6 22.5 9.2 20.1 282 282 D I H X S+ 0 0 0 -4,-2.9 4,-2.9 -5,-0.3 -1,-0.2 0.940 112.0 48.0 -63.1 -42.7 23.0 7.5 23.5 283 283 D S H X S+ 0 0 2 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.903 109.3 52.3 -69.5 -40.6 19.3 6.4 23.6 284 284 D K H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.892 112.4 47.0 -58.5 -35.0 19.4 4.9 20.1 285 285 D C H X>S+ 0 0 0 -4,-1.8 5,-2.3 2,-0.2 4,-0.9 0.903 108.5 53.9 -73.4 -44.5 22.5 3.0 21.1 286 286 D N H ><5S+ 0 0 9 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.929 111.5 46.4 -52.0 -45.1 20.9 1.8 24.3 287 287 D V H 3<5S+ 0 0 37 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.867 111.5 51.0 -64.7 -39.1 17.9 0.5 22.2 288 288 D A H 3<5S- 0 0 46 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.619 110.6-123.8 -72.3 -10.4 20.3 -1.2 19.7 289 289 D G T <<5 + 0 0 19 -4,-0.9 -3,-0.2 -3,-0.6 122,-0.1 0.883 67.6 130.8 70.5 34.2 22.1 -2.9 22.6 290 290 D K < - 0 0 52 -5,-2.3 -1,-0.2 -6,-0.1 -33,-0.2 -0.971 63.8 -98.7-126.7 143.7 25.5 -1.4 21.5 291 291 D P - 0 0 3 0, 0.0 -33,-2.1 0, 0.0 2,-0.4 -0.118 35.6-165.0 -60.9 138.2 28.1 0.5 23.6 292 292 D V E -g 258 0A 0 141,-0.2 33,-1.8 -35,-0.2 34,-1.7 -1.000 2.5-156.2-130.3 133.5 28.0 4.2 23.4 293 293 D I E -gh 259 326A 1 -35,-2.6 -33,-3.4 -2,-0.4 2,-0.7 -0.937 10.2-147.0-111.8 129.7 30.9 6.5 24.6 294 294 D C E +gh 260 327A 0 32,-2.8 34,-2.1 -2,-0.5 2,-0.3 -0.862 35.1 177.9 -97.2 117.6 30.6 10.0 25.7 295 295 D A E +g 261 0A 0 -35,-2.2 -33,-1.7 -2,-0.7 -32,-0.3 -0.853 24.5 33.1-129.7 155.4 33.9 11.7 24.7 296 296 D T S S+ 0 0 24 -2,-0.3 -34,-0.2 32,-0.2 32,-0.1 0.517 100.1 29.1 75.0 140.8 35.8 15.1 24.7 297 297 D Q S S+ 0 0 69 1,-0.1 32,-0.1 2,-0.1 4,-0.1 0.895 76.6 140.2 53.3 48.2 35.7 18.0 27.1 298 298 D M S S- 0 0 0 30,-0.2 18,-0.3 1,-0.1 17,-0.1 0.929 84.4 -14.5 -89.5 -64.1 34.9 15.7 30.0 299 299 D L S > S+ 0 0 0 1,-0.1 3,-2.4 16,-0.1 4,-0.2 -0.364 88.4 154.2-128.8 52.0 36.9 17.0 33.0 300 300 D E G > + 0 0 104 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.851 62.0 58.0 -62.4 -39.0 39.1 19.2 30.8 301 301 D S G >> S+ 0 0 32 1,-0.3 4,-1.8 2,-0.2 3,-0.7 0.651 93.2 71.5 -66.1 -7.6 40.1 21.8 33.4 302 302 D M G <4 S+ 0 0 6 -3,-2.4 36,-0.4 1,-0.2 -1,-0.3 0.442 72.7 87.2 -90.1 5.4 41.5 19.0 35.5 303 303 D T G <4 S+ 0 0 10 -3,-2.1 34,-2.9 -4,-0.2 35,-0.3 0.914 116.6 2.7 -61.0 -41.7 44.3 18.7 32.9 304 304 D Y T <4 S+ 0 0 133 -3,-0.7 -2,-0.2 -4,-0.3 -1,-0.1 0.487 123.1 75.6-124.3 -11.2 46.2 21.4 34.9 305 305 D N S < S- 0 0 89 -4,-1.8 33,-0.1 1,-0.1 32,-0.1 -0.783 75.4-133.1-103.0 149.1 43.9 22.1 37.9 306 306 D P S S+ 0 0 70 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.661 93.4 34.4 -74.2 -17.6 43.6 19.8 41.0 307 307 D R S S- 0 0 180 -6,-0.2 2,-0.1 38,-0.0 -3,-0.1 -0.969 80.5-128.1-130.3 155.4 39.8 20.0 40.8 308 308 D P - 0 0 20 0, 0.0 2,-0.1 0, 0.0 -9,-0.1 -0.396 37.6 -91.2 -87.6 174.1 37.3 20.4 37.9 309 309 D T > - 0 0 71 -2,-0.1 4,-1.6 1,-0.1 5,-0.2 -0.458 34.4-112.9 -82.1 158.4 34.6 23.0 37.7 310 310 D R H > S+ 0 0 26 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.872 118.1 55.1 -57.7 -36.8 31.1 22.2 39.1 311 311 D A H > S+ 0 0 8 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.913 104.8 54.3 -68.9 -34.7 29.6 22.3 35.6 312 312 D E H > S+ 0 0 21 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.901 108.1 48.8 -62.2 -37.4 32.2 19.7 34.4 313 313 D V H X S+ 0 0 2 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.912 109.9 50.8 -71.9 -38.5 31.1 17.4 37.2 314 314 D S H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.913 107.1 56.3 -67.0 -32.4 27.5 17.9 36.3 315 315 D D H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.915 108.2 45.2 -60.3 -48.8 28.4 17.1 32.7 316 316 D V H X S+ 0 0 0 -4,-2.0 4,-1.5 -18,-0.3 -1,-0.2 0.941 113.8 50.6 -62.9 -48.5 29.9 13.6 33.6 317 317 D A H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.891 110.2 50.1 -56.5 -43.7 26.9 12.8 35.9 318 318 D N H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.811 102.9 59.2 -68.7 -27.5 24.4 13.7 33.1 319 319 D A H X>S+ 0 0 0 -4,-1.8 5,-2.8 2,-0.2 4,-0.9 0.904 108.6 46.5 -61.1 -38.4 26.2 11.5 30.6 320 320 D V H ><5S+ 0 0 9 -4,-1.5 3,-0.9 1,-0.2 -2,-0.2 0.953 112.5 48.3 -72.1 -47.1 25.6 8.6 33.0 321 321 D F H 3<5S+ 0 0 26 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.814 106.4 57.8 -56.1 -35.8 21.9 9.7 33.4 322 322 D N H 3<5S- 0 0 14 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.795 128.0-101.3 -63.0 -24.6 21.5 10.0 29.6 323 323 D G T <<5 + 0 0 0 -3,-0.9 -3,-0.2 -4,-0.9 -31,-0.1 0.550 58.3 169.2 114.7 6.5 22.6 6.2 29.5 324 324 D A < - 0 0 3 -5,-2.8 -1,-0.2 -6,-0.2 -31,-0.2 -0.262 25.3-159.8 -53.9 133.9 26.3 6.3 28.5 325 325 D D S S+ 0 0 11 -33,-1.8 -303,-2.6 1,-0.2 2,-0.3 0.863 78.3 22.5 -67.4 -44.9 28.2 3.0 28.8 326 326 D C E -ah 22 293A 0 -34,-1.7 -32,-2.8 -305,-0.2 2,-0.4 -0.920 58.7-156.3-132.5 146.1 31.6 4.8 28.8 327 327 D V E -ah 23 294A 0 -305,-2.2 -303,-2.8 -2,-0.3 2,-0.4 -0.936 25.1-148.2-118.2 141.0 33.0 8.2 29.6 328 328 D M E -a 24 0A 2 -34,-2.1 2,-0.4 -2,-0.4 -32,-0.2 -0.918 7.9-153.4-118.7 144.1 36.4 9.0 27.9 329 329 D L E +a 25 0A 0 -305,-2.4 -303,-1.2 -2,-0.4 -34,-0.0 -0.937 17.0 172.2-111.8 139.2 39.4 11.2 29.1 330 330 D S S >> S- 0 0 27 -2,-0.4 4,-2.2 -305,-0.2 3,-1.7 0.468 74.0 -0.4-112.2-105.9 41.7 12.8 26.4 331 331 D G H 3>>S+ 0 0 20 1,-0.3 4,-1.6 2,-0.2 5,-0.9 0.761 117.9 78.4 -66.9 -19.2 44.4 15.3 27.5 332 332 D E H 345S+ 0 0 4 1,-0.2 6,-0.4 3,-0.2 -1,-0.3 0.843 116.1 15.8 -57.0 -33.6 43.4 14.9 31.1 333 333 D T H <45S+ 0 0 0 -3,-1.7 -305,-0.4 2,-0.1 -1,-0.2 0.662 124.1 59.9-109.1 -27.5 45.3 11.6 31.1 334 334 D A H <5S- 0 0 15 -4,-2.2 -304,-2.3 -307,-0.2 -303,-0.5 0.945 133.7 -6.0 -70.3 -47.6 47.4 11.9 28.0 335 335 D K T <5S+ 0 0 120 -4,-1.6 -3,-0.2 -306,-0.2 -1,-0.1 0.245 102.6 123.4-133.9 13.1 49.4 15.0 29.0 336 336 D G < - 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0 0 6 -4,-0.9 2,-1.0 -3,-0.7 3,-0.1 -0.592 67.9-139.3 -76.4 130.4 19.7 6.4 38.4 358 358 D N >> - 0 0 24 -2,-0.3 3,-0.7 1,-0.2 4,-0.6 -0.793 18.4-172.1 -86.6 103.7 16.5 4.4 38.3 359 359 D E H 3> S+ 0 0 31 -2,-1.0 4,-2.4 1,-0.2 3,-0.5 0.783 76.5 70.9 -67.2 -26.4 17.6 1.4 36.1 360 360 D Y H 3> S+ 0 0 93 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.842 90.1 60.1 -64.4 -27.0 14.1 -0.0 35.9 361 361 D V H <> S+ 0 0 26 -3,-0.7 4,-2.5 2,-0.2 -1,-0.2 0.885 107.5 45.9 -65.1 -42.8 13.0 2.9 33.7 362 362 D F H X S+ 0 0 20 -4,-0.6 4,-2.6 -3,-0.5 5,-0.3 0.942 114.2 48.0 -61.6 -51.2 15.6 1.8 31.1 363 363 D F H X S+ 0 0 0 -4,-2.4 4,-2.7 50,-0.3 -2,-0.2 0.950 116.3 42.2 -58.3 -46.2 14.6 -1.9 31.4 364 364 D N H X S+ 0 0 49 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.912 114.5 50.6 -75.1 -38.0 10.9 -1.1 31.1 365 365 D S H X S+ 0 0 7 -4,-2.5 4,-0.7 -5,-0.3 -1,-0.2 0.897 114.7 44.2 -62.0 -38.4 11.4 1.5 28.2 366 366 D I H >< S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.2 4,-0.2 0.908 113.5 49.3 -74.7 -43.5 13.5 -0.9 26.3 367 367 D K H >< S+ 0 0 90 -4,-2.7 3,-2.1 -5,-0.3 -2,-0.2 0.903 106.0 57.6 -60.4 -42.7 11.2 -3.9 26.9 368 368 D K H 3< S+ 0 0 144 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.764 101.6 57.9 -61.2 -20.6 8.1 -1.9 25.8 369 369 D L T << S+ 0 0 74 -4,-0.7 -1,-0.3 -3,-0.5 2,-0.2 0.538 82.4 107.9 -84.5 -6.5 9.8 -1.2 22.5 370 370 D Q < - 0 0 42 -3,-2.1 2,-0.3 -4,-0.2 4,-0.1 -0.503 68.3-129.1 -76.5 139.5 10.2 -4.9 21.7 371 371 D H - 0 0 154 -2,-0.2 -2,-0.1 2,-0.1 -1,-0.0 -0.704 33.4 -99.8 -82.8 142.5 7.8 -6.4 18.9 372 372 D I S S+ 0 0 127 -2,-0.3 2,-0.1 1,-0.1 3,-0.0 -0.868 108.2 50.0 -96.9 131.0 5.8 -9.6 19.7 373 373 D P S S- 0 0 112 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.414 86.2-163.8 -77.9 142.1 6.6 -12.3 18.9 374 374 D M - 0 0 50 -2,-0.1 -2,-0.1 -4,-0.1 2,-0.1 -0.625 25.2-106.9 -77.5 154.7 10.2 -11.7 20.2 375 375 D S > - 0 0 73 -2,-0.2 4,-2.5 1,-0.1 3,-0.2 -0.435 36.3-103.7 -73.7 160.6 12.9 -14.0 19.1 376 376 D A H > S+ 0 0 64 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.844 117.6 52.2 -50.5 -46.9 14.1 -16.5 21.7 377 377 D D H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.926 112.0 44.8 -62.4 -43.9 17.4 -14.6 22.6 378 378 D E H > S+ 0 0 25 -3,-0.2 4,-2.0 2,-0.2 5,-0.3 0.894 114.6 50.6 -68.7 -40.9 15.6 -11.3 23.3 379 379 D A H X S+ 0 0 37 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.947 112.4 46.1 -62.4 -42.9 12.9 -13.1 25.3 380 380 D V H X S+ 0 0 17 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.928 115.1 44.6 -65.5 -49.0 15.4 -15.0 27.4 381 381 D C H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.947 116.5 46.2 -64.5 -42.3 17.7 -12.0 28.2 382 382 D S H X S+ 0 0 7 -4,-2.0 4,-2.7 -5,-0.2 -2,-0.2 0.923 113.7 48.3 -66.7 -41.0 14.7 -9.7 29.0 383 383 D S H X S+ 0 0 59 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.903 107.8 54.9 -72.0 -28.6 13.0 -12.2 31.1 384 384 D A H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.925 111.8 45.0 -63.9 -46.9 16.2 -13.0 33.1 385 385 D V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.915 109.7 54.2 -63.1 -41.4 16.6 -9.2 33.9 386 386 D N H X S+ 0 0 22 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.925 105.5 54.7 -56.7 -38.2 12.9 -9.1 34.8 387 387 D S H X S+ 0 0 21 -4,-2.2 4,-2.5 1,-0.2 6,-0.3 0.845 101.9 58.4 -64.1 -33.6 13.5 -12.0 37.2 388 388 D V H X>S+ 0 0 0 -4,-1.5 5,-1.6 2,-0.2 4,-1.0 0.951 110.6 41.0 -57.6 -50.9 16.2 -10.0 38.9 389 389 D Y H <5S+ 0 0 36 -4,-1.8 3,-0.3 3,-0.2 -2,-0.2 0.916 115.2 51.6 -65.3 -38.4 13.7 -7.2 39.7 390 390 D E H <5S+ 0 0 142 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.876 123.8 27.3 -69.6 -32.1 11.0 -9.7 40.7 391 391 D T H <5S- 0 0 44 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.376 102.9-123.9-105.3 -5.1 13.1 -11.7 43.1 392 392 D K T <5 - 0 0 167 -4,-1.0 83,-0.3 -3,-0.3 -3,-0.2 0.911 42.4-171.9 54.0 49.0 15.5 -8.8 44.0 393 393 D A < - 0 0 5 -5,-1.6 83,-0.2 -6,-0.3 -1,-0.1 -0.343 20.5-143.0 -66.6 155.5 18.4 -11.0 42.9 394 394 D K S S+ 0 0 107 81,-2.3 2,-0.3 1,-0.2 82,-0.2 0.491 71.3 9.4-106.7 -3.0 21.9 -9.6 43.7 395 395 D A E -r 476 0G 0 80,-0.7 82,-2.3 21,-0.2 2,-0.4 -0.966 59.1-141.2-159.2 160.5 23.9 -10.7 40.7 396 396 D M E -rs 477 418G 0 21,-2.2 23,-2.5 -2,-0.3 2,-0.4 -0.955 8.4-154.9-115.8 151.2 23.5 -12.3 37.3 397 397 D V E -rs 478 419G 0 80,-2.3 82,-3.0 -2,-0.4 2,-0.5 -0.993 12.3-174.6-119.2 124.4 25.8 -14.8 35.7 398 398 D V E -rs 479 420G 0 21,-2.9 23,-2.8 -2,-0.4 2,-0.8 -0.982 16.3-149.7-120.3 127.0 25.9 -14.9 31.8 399 399 D L E +rs 480 421G 5 80,-2.5 82,-0.6 -2,-0.5 2,-0.3 -0.842 34.2 157.8 -92.3 114.6 27.9 -17.6 30.0 400 400 D S - 0 0 6 21,-1.6 -2,-0.1 -2,-0.8 80,-0.0 -0.888 28.9-172.4-141.3 115.9 28.9 -15.9 26.8 401 401 D N S S+ 0 0 44 -2,-0.3 23,-0.2 1,-0.2 26,-0.2 0.932 93.2 28.2 -74.3 -41.0 31.8 -16.9 24.5 402 402 D T S S- 0 0 56 25,-0.1 -1,-0.2 21,-0.1 20,-0.1 0.579 107.1-114.4 -93.9 -11.9 31.7 -13.9 22.0 403 403 D G S > S+ 0 0 0 28,-0.0 4,-2.4 27,-0.0 5,-0.2 0.277 84.4 117.1 96.5 -9.3 30.2 -11.4 24.4 404 404 D R H > S+ 0 0 142 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.955 78.3 39.6 -66.7 -48.3 26.9 -11.1 22.4 405 405 D S H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.859 112.2 57.0 -72.1 -27.0 24.6 -12.4 25.1 406 406 D A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.907 110.2 45.8 -66.6 -40.1 26.4 -10.5 27.8 407 407 D R H X S+ 0 0 47 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.868 110.8 53.4 -68.5 -33.0 25.7 -7.3 25.8 408 408 D L H X S+ 0 0 23 -4,-2.0 4,-0.7 -5,-0.2 -2,-0.2 0.879 111.2 44.9 -70.5 -40.2 22.1 -8.3 25.2 409 409 D V H >< S+ 0 0 0 -4,-2.3 3,-1.1 2,-0.2 4,-0.3 0.927 112.1 52.2 -63.8 -45.5 21.6 -8.8 29.0 410 410 D A H >< S+ 0 0 2 -4,-2.5 3,-1.8 1,-0.3 -2,-0.2 0.864 99.1 66.2 -63.1 -28.0 23.4 -5.5 29.8 411 411 D K H 3< S+ 0 0 22 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.864 96.8 54.2 -57.3 -35.9 21.1 -3.7 27.3 412 412 D Y T << S- 0 0 0 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.502 105.0-135.6 -86.1 -0.2 18.1 -4.5 29.6 413 413 D R < - 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a 0 754H 15 -28,-2.7 -25,-2.1 -2,-0.4 2,-0.6 -0.757 10.2-153.7 -86.5 124.0 16.9 29.1 49.5 734 239 A I E + a 0 755H 0 20,-2.5 22,-1.8 -2,-0.6 26,-0.2 -0.892 31.9 153.0 -99.7 115.6 18.3 25.7 50.3 735 240 A E + 0 0 20 -2,-0.6 2,-0.3 -27,-0.3 27,-0.2 0.412 53.2 28.6-132.9 -6.8 22.0 26.3 50.9 736 241 A N S > S- 0 0 1 -28,-0.3 4,-2.0 26,-0.1 3,-0.5 -0.940 89.2 -83.7-152.0-179.7 23.3 23.6 53.3 737 242 A H H > S+ 0 0 16 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.815 119.5 56.3 -61.8 -31.0 22.8 20.0 54.5 738 243 A Q H > S+ 0 0 26 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.914 106.0 51.1 -67.3 -43.3 19.9 20.9 57.0 739 244 A G H 4 S+ 0 0 0 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.954 112.5 46.6 -54.1 -47.1 17.9 22.5 54.3 740 245 A V H >< S+ 0 0 13 -4,-2.0 3,-1.5 1,-0.2 4,-0.2 0.935 113.4 48.3 -62.5 -44.5 18.3 19.3 52.2 741 246 A Q H 3< S+ 0 0 101 -4,-2.7 3,-0.4 1,-0.3 -1,-0.2 0.904 118.4 39.7 -64.8 -43.0 17.5 17.0 55.1 742 247 A N T 3X S+ 0 0 58 -4,-2.7 4,-2.1 1,-0.2 3,-0.4 0.151 80.3 122.6 -90.9 15.6 14.4 18.9 56.1 743 248 A I H <> + 0 0 7 -3,-1.5 4,-2.8 1,-0.2 5,-0.3 0.868 67.1 55.3 -47.8 -44.2 13.4 19.5 52.5 744 249 A D H > S+ 0 0 103 -3,-0.4 4,-1.9 -4,-0.2 -1,-0.2 0.922 111.3 41.8 -63.2 -43.9 9.9 17.9 52.8 745 250 A S H > S+ 0 0 43 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.888 114.8 52.6 -72.6 -32.3 8.7 20.1 55.7 746 251 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.955 108.8 49.4 -66.4 -47.8 10.2 23.3 54.2 747 252 A I H < S+ 0 0 9 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.914 107.1 55.8 -54.8 -45.4 8.5 22.7 50.9 748 253 A E H < S+ 0 0 139 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.898 115.8 36.6 -60.9 -34.9 5.2 22.2 52.6 749 254 A E H < S+ 0 0 106 -4,-1.6 -1,-0.2 -3,-0.1 -2,-0.2 0.756 109.9 69.6 -85.3 -26.6 5.4 25.6 54.4 750 255 A S S < S- 0 0 0 -4,-2.5 -19,-0.2 -5,-0.1 3,-0.1 -0.298 77.0-129.0 -88.6 176.4 7.1 27.7 51.6 751 256 A D S S- 0 0 51 -21,-2.6 2,-0.3 1,-0.3 -20,-0.2 0.432 84.1 -28.9 -98.4 -5.0 5.7 28.9 48.3 752 257 A G E -a 731 0H 0 -22,-0.7 -20,-2.3 33,-0.2 2,-0.3 -0.957 63.3-106.0 170.2-179.8 8.7 27.4 46.4 753 258 A I E -ab 732 787H 0 33,-2.3 35,-3.0 -2,-0.3 2,-0.5 -0.935 7.1-154.4-135.0 144.2 12.4 26.6 46.5 754 259 A M E -ab 733 788H 2 -22,-2.6 -20,-2.5 -2,-0.3 2,-0.8 -0.998 15.2-146.8-116.2 125.7 15.7 27.8 45.2 755 260 A V E -ab 734 789H 0 33,-3.0 35,-2.3 -2,-0.5 2,-1.3 -0.862 10.7-163.3 -88.4 107.1 18.5 25.3 44.8 756 261 A A E > - b 0 790H 0 -22,-1.8 4,-2.3 -2,-0.8 5,-0.2 -0.714 10.4-179.7 -96.5 82.5 21.7 27.3 45.6 757 262 A R H > S+ 0 0 1 33,-1.8 4,-2.2 -2,-1.3 -1,-0.2 0.862 76.2 51.4 -55.0 -41.1 24.2 24.9 44.0 758 263 A G H 4 S+ 0 0 22 32,-0.4 4,-0.5 2,-0.2 -1,-0.2 0.897 112.9 43.9 -69.2 -40.6 27.3 27.0 44.9 759 264 A D H >> S+ 0 0 65 -3,-0.2 3,-1.0 2,-0.2 4,-0.6 0.906 114.0 50.0 -67.5 -41.6 26.4 27.4 48.6 760 265 A L H >X S+ 0 0 1 -4,-2.3 4,-1.8 -26,-0.2 3,-0.8 0.880 103.6 62.1 -62.7 -40.5 25.4 23.7 48.9 761 266 A G H 3< S+ 0 0 37 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.630 85.5 75.6 -61.8 -18.5 28.8 22.9 47.3 762 267 A V H <4 S+ 0 0 33 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.950 117.7 13.3 -58.3 -44.3 30.7 24.5 50.2 763 268 A E H << S+ 0 0 24 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.646 122.0 64.0-110.1 -9.9 29.9 21.5 52.4 764 269 A I S < S- 0 0 9 -4,-1.8 5,-0.1 2,-0.0 -1,-0.1 -0.935 90.0-103.3-118.8 132.4 28.6 18.8 50.1 765 270 A P >> - 0 0 64 0, 0.0 4,-1.8 0, 0.0 3,-0.8 -0.203 34.4-116.3 -50.7 143.8 30.8 17.2 47.3 766 271 A A H 3> S+ 0 0 24 1,-0.3 4,-2.1 2,-0.2 3,-0.2 0.885 113.7 54.3 -57.8 -37.8 29.9 18.5 43.8 767 272 A E H 3> S+ 0 0 14 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.843 109.2 50.7 -68.2 -29.5 28.6 15.1 42.5 768 273 A K H <> S+ 0 0 46 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.862 105.0 54.0 -76.0 -36.2 26.2 14.9 45.5 769 274 A V H X S+ 0 0 2 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.870 103.2 59.1 -61.5 -39.2 24.8 18.5 44.9 770 275 A V H X S+ 0 0 6 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.917 110.9 42.3 -50.3 -45.9 24.0 17.3 41.2 771 276 A V H X S+ 0 0 4 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.880 110.9 53.6 -73.2 -42.1 21.8 14.6 42.8 772 277 A A H X S+ 0 0 1 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.887 105.0 56.9 -60.5 -38.2 20.3 16.9 45.5 773 278 A Q H X S+ 0 0 7 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.955 107.2 48.1 -55.3 -45.9 19.3 19.2 42.7 774 279 A K H X S+ 0 0 15 -4,-1.4 4,-2.4 1,-0.2 5,-0.2 0.932 114.4 46.3 -58.6 -41.3 17.4 16.4 41.0 775 280 A I H X S+ 0 0 6 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.951 113.0 46.6 -68.1 -48.9 15.7 15.5 44.2 776 281 A L H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.921 113.3 49.8 -65.0 -39.8 14.7 19.0 45.3 777 282 A I H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.3 -1,-0.2 0.940 111.6 47.6 -66.2 -41.7 13.4 19.8 41.8 778 283 A S H X S+ 0 0 2 -4,-2.4 4,-2.4 -5,-0.3 5,-0.2 0.912 109.4 53.7 -64.1 -41.7 11.3 16.6 41.6 779 284 A K H X S+ 0 0 28 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.930 112.1 45.3 -58.6 -43.0 9.9 17.2 45.1 780 285 A C H X>S+ 0 0 0 -4,-2.1 5,-2.0 2,-0.2 4,-1.0 0.910 108.7 54.7 -67.0 -40.7 8.8 20.7 44.1 781 286 A N H <5S+ 0 0 9 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.921 112.2 45.0 -56.5 -45.9 7.3 19.5 40.8 782 287 A V H <5S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.850 111.1 53.0 -62.1 -38.3 5.2 17.0 42.7 783 288 A A H <5S- 0 0 44 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.624 109.9-125.2 -73.2 -13.6 4.2 19.7 45.3 784 289 A G T <5 + 0 0 19 -4,-1.0 -3,-0.2 -3,-0.5 122,-0.1 0.774 68.5 127.2 73.2 30.5 3.1 22.0 42.5 785 290 A K < - 0 0 52 -5,-2.0 -1,-0.3 -6,-0.1 -33,-0.2 -0.890 65.5 -96.6-125.3 144.2 5.4 24.8 43.7 786 291 A P - 0 0 2 0, 0.0 -33,-2.3 0, 0.0 2,-0.4 -0.211 34.8-163.9 -61.8 146.1 8.0 26.8 41.7 787 292 A V E -b 753 0H 0 141,-0.2 34,-2.0 -35,-0.2 33,-1.9 -0.996 1.9-157.1-134.3 133.6 11.7 25.7 41.8 788 293 A I E -bc 754 821H 0 -35,-3.0 -33,-3.0 -2,-0.4 2,-0.6 -0.912 10.3-146.8-111.4 134.2 14.6 27.8 40.8 789 294 A C E +bc 755 822H 0 32,-2.6 34,-1.7 -2,-0.5 2,-0.3 -0.882 36.3 178.8 -94.4 118.4 18.0 26.5 39.8 790 295 A A E +b 756 0H 0 -35,-2.3 -33,-1.8 -2,-0.6 -32,-0.4 -0.896 24.2 28.5-130.0 160.7 20.5 29.2 40.9 791 296 A T S S+ 0 0 25 32,-0.4 -34,-0.2 -2,-0.3 32,-0.1 0.495 101.0 33.4 70.1 147.0 24.2 30.1 41.1 792 297 A Q S S+ 0 0 73 -35,-0.1 4,-0.1 2,-0.1 32,-0.1 0.850 76.2 139.6 48.5 46.9 27.1 29.1 38.8 793 298 A M S S- 0 0 0 30,-0.2 18,-0.3 1,-0.1 17,-0.1 0.984 84.4 -16.7 -84.7 -68.0 24.8 29.1 35.8 794 299 A L S > S+ 0 0 0 1,-0.1 3,-1.6 16,-0.1 -1,-0.1 -0.472 87.3 154.5-129.0 51.3 26.7 30.6 32.8 795 300 A E G > + 0 0 105 1,-0.3 3,-2.3 2,-0.2 4,-0.3 0.861 61.3 59.8 -59.6 -39.4 29.3 32.1 35.1 796 301 A S G >> S+ 0 0 30 1,-0.3 4,-1.8 2,-0.2 3,-0.7 0.711 93.4 71.2 -65.3 -16.3 32.2 32.4 32.6 797 302 A M G <4 S+ 0 0 5 -3,-1.6 36,-0.4 1,-0.2 -1,-0.3 0.409 73.4 84.0 -79.3 0.4 30.0 34.6 30.5 798 303 A T G <4 S+ 0 0 8 -3,-2.3 34,-3.0 33,-0.1 35,-0.4 0.941 116.7 8.5 -59.0 -45.0 30.3 37.4 33.1 799 304 A Y T <4 S+ 0 0 141 -3,-0.7 -2,-0.2 -4,-0.3 -3,-0.1 0.588 123.7 67.2-115.8 -14.7 33.6 38.4 31.3 800 305 A N S < S- 0 0 88 -4,-1.8 33,-0.1 1,-0.1 32,-0.1 -0.821 77.9-127.0-110.7 152.0 33.7 36.3 28.1 801 306 A P S S+ 0 0 78 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.556 94.8 32.5 -75.3 -7.6 31.4 36.6 25.2 802 307 A R S S- 0 0 197 -6,-0.2 -3,-0.1 38,-0.0 -2,-0.1 -0.986 79.1-127.7-143.2 149.7 30.4 32.9 25.2 803 308 A P - 0 0 20 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.192 37.8 -88.5 -85.7-179.9 30.1 30.3 28.1 804 309 A T > - 0 0 67 1,-0.1 4,-1.8 -2,-0.0 5,-0.1 -0.531 33.6-113.6 -85.9 164.5 31.8 26.9 28.2 805 310 A R H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.884 117.7 55.8 -64.2 -35.5 30.2 23.8 26.8 806 311 A A H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.890 105.1 52.3 -67.1 -32.9 29.8 22.3 30.2 807 312 A E H > S+ 0 0 23 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.881 107.1 53.1 -68.2 -37.4 27.9 25.4 31.4 808 313 A V H X S+ 0 0 2 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.926 109.1 48.1 -61.9 -49.3 25.6 25.1 28.5 809 314 A S H X S+ 0 0 2 -4,-2.4 4,-3.3 2,-0.2 5,-0.2 0.907 107.6 56.4 -59.5 -36.2 24.8 21.4 29.4 810 315 A D H X S+ 0 0 1 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.959 109.7 45.4 -60.3 -46.6 24.2 22.5 33.1 811 316 A V H X S+ 0 0 0 -4,-2.1 4,-1.5 -18,-0.3 3,-0.4 0.953 113.9 48.7 -58.7 -51.0 21.6 24.9 32.0 812 317 A A H X S+ 0 0 1 -4,-2.8 4,-2.4 1,-0.2 3,-0.2 0.930 110.9 50.7 -57.8 -44.3 20.0 22.4 29.6 813 318 A N H X S+ 0 0 8 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.771 102.4 59.9 -69.4 -25.2 19.9 19.7 32.3 814 319 A A H X>S+ 0 0 0 -4,-1.6 5,-2.5 -3,-0.4 4,-0.8 0.891 108.1 46.4 -62.1 -42.8 18.3 22.0 34.9 815 320 A V H ><5S+ 0 0 9 -4,-1.5 3,-0.8 -3,-0.2 -2,-0.2 0.942 113.1 48.8 -67.2 -44.4 15.4 22.3 32.4 816 321 A F H 3<5S+ 0 0 24 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.841 104.7 58.3 -59.9 -33.5 15.4 18.5 31.9 817 322 A N H 3<5S- 0 0 15 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.745 127.5-100.7 -66.3 -23.1 15.4 17.9 35.7 818 323 A G T <<5 + 0 0 0 -4,-0.8 -3,-0.2 -3,-0.8 -31,-0.1 0.554 60.7 167.1 117.7 14.1 12.1 19.9 35.8 819 324 A A < - 0 0 4 -5,-2.5 -1,-0.2 -6,-0.2 -31,-0.2 -0.280 27.5-156.7 -66.1 139.5 13.3 23.4 37.0 820 325 A D S S+ 0 0 11 -33,-1.9 -303,-2.3 1,-0.2 2,-0.3 0.897 77.1 21.1 -75.6 -38.9 10.7 26.2 36.5 821 326 A C E -vc 517 788H 0 -34,-2.0 -32,-2.6 -305,-0.2 2,-0.3 -0.907 57.1-154.9-132.7 154.1 13.4 28.9 36.5 822 327 A V E -vc 518 789H 0 -305,-2.1 -303,-2.6 -2,-0.3 2,-0.4 -0.929 25.4-148.4-122.3 146.5 17.0 29.4 35.9 823 328 A M E -v 519 0H 3 -34,-1.7 2,-0.4 -2,-0.3 -32,-0.4 -0.944 6.8-152.2-130.1 132.2 18.7 32.5 37.7 824 329 A L E +v 520 0H 0 -305,-3.2 -303,-1.1 -2,-0.4 -280,-0.1 -0.891 17.9 171.2-100.5 142.4 21.6 34.7 36.7 825 330 A S S >> S+ 0 0 29 -2,-0.4 4,-2.2 -305,-0.2 3,-1.5 0.473 73.7 2.5-112.5-102.2 23.7 36.4 39.4 826 331 A G H 3>>S+ 0 0 20 1,-0.3 4,-2.3 2,-0.2 5,-1.3 0.766 118.2 75.5 -65.3 -23.3 26.9 38.3 38.5 827 332 A E H 345S+ 0 0 4 1,-0.2 6,-0.3 3,-0.2 -1,-0.3 0.806 116.1 19.0 -57.7 -30.7 26.4 37.7 34.7 828 333 A T H <45S+ 0 0 0 -3,-1.5 -305,-0.4 2,-0.1 -1,-0.2 0.659 123.9 56.9-107.8 -27.1 23.7 40.3 34.7 829 334 A A H <5S- 0 0 15 -4,-2.2 -304,-2.3 -307,-0.2 -303,-0.5 0.950 135.4 -5.9 -73.5 -42.0 24.5 42.2 37.9 830 335 A K T <5S+ 0 0 122 -4,-2.3 -3,-0.2 -306,-0.2 -1,-0.1 0.337 101.1 122.7-133.5 4.5 28.1 43.1 37.0 831 336 A G < - 0 0 4 -5,-1.3 -32,-0.2 1,-0.1 -33,-0.1 -0.134 61.9-128.5 -77.3 172.9 28.9 41.3 33.7 832 337 A K S S+ 0 0 131 -34,-3.0 -33,-0.1 1,-0.2 3,-0.1 0.595 104.3 39.9 -90.6 -16.3 30.0 42.7 30.4 833 338 A Y > + 0 0 43 -36,-0.4 4,-2.7 -35,-0.4 5,-0.3 -0.268 62.9 148.9-133.2 51.9 27.3 40.9 28.3 834 339 A P H > S+ 0 0 21 0, 0.0 4,-1.6 0, 0.0 5,-0.2 0.871 78.1 44.1 -60.5 -42.2 24.1 41.0 30.3 835 340 A N H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.941 115.6 47.6 -66.7 -45.2 21.8 41.1 27.2 836 341 A E H > S+ 0 0 93 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.840 109.4 52.7 -67.1 -38.2 23.7 38.3 25.4 837 342 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.870 111.6 45.6 -63.5 -41.1 23.8 36.0 28.4 838 343 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.3 -2,-0.2 0.918 113.9 50.1 -68.5 -40.1 20.0 36.3 28.9 839 344 A Q H X S+ 0 0 78 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.897 113.1 46.7 -63.9 -39.6 19.4 35.7 25.1 840 345 A Y H X S+ 0 0 33 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.914 110.1 51.9 -70.0 -40.0 21.7 32.7 25.2 841 346 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.921 110.0 49.6 -59.5 -42.0 20.0 31.3 28.3 842 347 A A H X S+ 0 0 13 -4,-2.5 4,-2.3 -304,-0.2 -1,-0.2 0.907 110.5 50.8 -63.4 -43.0 16.6 31.7 26.7 843 348 A R H X S+ 0 0 123 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.890 111.6 47.3 -61.6 -44.9 18.0 29.9 23.5 844 349 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.938 112.1 49.7 -60.9 -51.4 19.4 27.0 25.6 845 350 A C H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.879 112.0 48.2 -52.2 -46.2 16.1 26.6 27.5 846 351 A L H X S+ 0 0 43 -4,-2.3 4,-1.5 2,-0.2 -335,-0.4 0.915 111.7 49.5 -64.0 -42.6 14.0 26.6 24.3 847 352 A E H X S+ 0 0 13 -4,-2.4 4,-0.8 1,-0.2 3,-0.2 0.954 114.3 46.4 -59.5 -47.0 16.4 23.9 22.7 848 353 A A H >X S+ 0 0 1 -4,-2.6 3,-1.2 1,-0.2 4,-1.0 0.924 110.1 51.8 -64.3 -45.9 16.1 21.8 25.9 849 354 A Q H 3< S+ 0 0 9 -4,-2.6 3,-0.5 1,-0.3 -1,-0.2 0.845 100.9 62.0 -58.8 -34.0 12.4 22.1 26.1 850 355 A S H 3< S+ 0 0 37 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.753 111.3 40.4 -74.3 -14.0 11.9 21.0 22.5 851 356 A A H << S+ 0 0 1 -3,-1.2 2,-0.3 -4,-0.8 -1,-0.3 0.601 92.3 101.6 -96.5 -19.0 13.5 17.7 23.5 852 357 A L < - 0 0 6 -4,-1.0 2,-1.0 -3,-0.5 3,-0.1 -0.572 69.1-135.9 -72.9 129.8 11.8 17.2 26.9 853 358 A N >> - 0 0 21 -2,-0.3 3,-0.9 1,-0.2 4,-0.7 -0.769 19.5-173.0 -84.5 103.8 8.8 14.7 26.9 854 359 A E H >> S+ 0 0 33 -2,-1.0 4,-2.4 1,-0.3 3,-0.5 0.808 78.0 69.7 -70.4 -29.3 6.2 16.6 29.0 855 360 A Y H 3> S+ 0 0 92 1,-0.3 4,-3.5 2,-0.2 5,-0.3 0.855 92.0 59.0 -55.2 -36.8 4.0 13.6 29.1 856 361 A V H <> S+ 0 0 24 -3,-0.9 4,-2.5 1,-0.2 -1,-0.3 0.895 108.1 45.3 -59.2 -44.0 6.4 11.7 31.4 857 362 A F H < S+ 0 0 0 -4,-2.6 3,-0.8 -5,-0.2 4,-0.4 0.886 112.0 53.5 -70.2 -39.3 2.8 13.2 38.9 862 367 A K H >< S+ 0 0 83 -4,-2.3 3,-1.6 -5,-0.3 -2,-0.2 0.922 105.6 54.5 -63.6 -39.8 -0.7 11.8 38.1 863 368 A K H 3< S+ 0 0 147 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.666 102.0 58.4 -68.8 -18.1 0.2 8.3 39.3 864 369 A L T << S+ 0 0 73 -3,-0.8 -1,-0.3 -4,-0.5 2,-0.2 0.514 81.1 111.8 -85.7 -7.2 1.4 9.7 42.6 865 370 A Q < - 0 0 40 -3,-1.6 2,-0.3 -4,-0.4 4,-0.1 -0.519 69.6-124.7 -72.1 133.8 -2.1 11.2 43.4 866 371 A H - 0 0 142 -2,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.603 37.4-101.6 -73.7 127.5 -4.0 9.6 46.2 867 372 A I S S+ 0 0 138 -2,-0.3 2,-0.1 1,-0.1 3,-0.0 -0.866 107.3 49.0 -95.0 134.6 -7.6 8.4 45.2 868 373 A P S S- 0 0 96 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.418 86.8-159.4 -78.1 147.7 -10.0 9.9 45.9 869 374 A M - 0 0 48 -2,-0.1 2,-0.1 -4,-0.1 -2,-0.1 -0.591 23.0-108.8 -84.0 156.7 -8.5 13.2 44.6 870 375 A S > - 0 0 69 -2,-0.2 4,-2.0 1,-0.1 3,-0.3 -0.442 38.7-102.4 -80.0 161.7 -10.0 16.5 45.8 871 376 A A H > S+ 0 0 53 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.838 117.4 53.1 -58.0 -41.4 -12.0 18.3 43.1 872 377 A D H > S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.911 111.6 45.5 -61.5 -44.4 -9.3 20.9 42.1 873 378 A E H > S+ 0 0 23 -3,-0.3 4,-2.6 2,-0.2 5,-0.3 0.895 113.6 50.9 -61.3 -42.2 -6.6 18.3 41.5 874 379 A A H X S+ 0 0 36 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.898 112.5 45.2 -67.0 -43.9 -9.1 16.2 39.6 875 380 A V H X S+ 0 0 17 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.907 116.0 44.4 -65.8 -48.8 -10.2 19.1 37.3 876 381 A C H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.945 115.3 46.5 -65.8 -47.0 -6.7 20.4 36.6 877 382 A S H X S+ 0 0 8 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.920 115.7 47.4 -64.3 -37.9 -5.1 16.9 35.9 878 383 A S H X S+ 0 0 56 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.913 107.5 55.3 -74.2 -34.1 -8.1 16.0 33.7 879 384 A A H X S+ 0 0 0 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.920 111.6 44.5 -56.5 -44.1 -7.9 19.3 31.8 880 385 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 3,-0.3 0.915 110.6 54.7 -65.8 -40.8 -4.2 18.5 31.0 881 386 A N H X S+ 0 0 26 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.919 104.9 54.2 -56.4 -43.1 -5.2 14.9 30.1 882 387 A S H X S+ 0 0 23 -4,-2.6 4,-2.3 1,-0.2 6,-0.3 0.813 102.2 58.6 -61.5 -33.4 -7.7 16.4 27.7 883 388 A V H X>S+ 0 0 0 -4,-1.3 5,-1.8 -3,-0.3 4,-1.1 0.947 112.1 39.6 -57.3 -50.5 -4.9 18.4 26.0 884 389 A Y H <5S+ 0 0 35 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.868 115.5 52.0 -70.7 -36.3 -3.0 15.2 25.2 885 390 A E H <5S+ 0 0 144 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.836 123.5 28.0 -68.0 -34.4 -6.2 13.2 24.3 886 391 A T H <5S- 0 0 48 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.426 102.5-123.2-103.6 -1.7 -7.4 15.9 21.8 887 392 A K T <5 - 0 0 166 -4,-1.1 83,-0.3 -5,-0.2 -3,-0.2 0.931 43.3-174.1 53.7 45.2 -4.0 17.3 20.8 888 393 A A < - 0 0 4 -5,-1.8 83,-0.2 -6,-0.3 -1,-0.1 -0.420 22.1-144.4 -67.2 154.0 -5.2 20.7 21.9 889 394 A K S S+ 0 0 97 81,-2.6 2,-0.3 1,-0.2 82,-0.2 0.504 71.0 10.2-108.2 -2.7 -2.9 23.6 21.1 890 395 A A E -m 971 0N 0 80,-0.7 82,-2.2 21,-0.2 2,-0.4 -0.983 58.1-140.4-158.7 163.3 -3.4 25.9 24.1 891 396 A M E -mn 972 913N 0 21,-2.5 23,-3.0 -2,-0.3 2,-0.5 -0.978 9.5-157.6-119.4 145.3 -5.0 26.0 27.5 892 397 A V E -mn 973 914N 0 80,-2.8 82,-2.4 -2,-0.4 2,-0.5 -0.978 12.2-174.0-119.6 126.8 -6.8 29.0 28.9 893 398 A V E -mn 974 915N 0 21,-2.7 23,-2.3 -2,-0.5 2,-0.7 -0.956 15.7-150.1-122.9 116.3 -7.0 29.1 32.7 894 399 A L E +mn 975 916N 11 80,-2.7 82,-0.6 -2,-0.5 2,-0.3 -0.812 34.6 156.7 -83.8 118.5 -9.1 31.8 34.5 895 400 A S - 0 0 6 21,-2.2 -2,-0.1 -2,-0.7 80,-0.0 -0.939 29.5-173.2-146.4 124.6 -7.3 32.3 37.8 896 401 A N S S+ 0 0 66 -2,-0.3 23,-0.2 21,-0.2 26,-0.2 0.897 95.3 29.6 -85.4 -40.3 -7.4 35.4 40.1 897 402 A T S S- 0 0 80 25,-0.1 -1,-0.1 21,-0.1 20,-0.1 0.576 107.0-120.0 -90.6 -10.3 -4.9 34.4 42.7 898 403 A G S > S+ 0 0 0 28,-0.0 4,-2.5 27,-0.0 5,-0.2 0.346 80.4 121.3 86.5 -4.1 -2.9 32.2 40.1 899 404 A R H > S+ 0 0 177 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.944 76.0 40.6 -55.9 -52.7 -3.5 29.1 42.3 900 405 A S H > S+ 0 0 11 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.834 111.5 58.0 -71.0 -27.8 -5.3 27.1 39.7 901 406 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 108.6 45.8 -64.5 -40.2 -2.8 28.3 37.0 902 407 A R H X S+ 0 0 46 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.886 111.4 54.5 -69.0 -33.1 0.0 26.8 39.1 903 408 A L H X S+ 0 0 23 -4,-1.9 4,-0.6 -5,-0.2 -2,-0.2 0.879 110.2 43.9 -67.0 -40.4 -2.1 23.7 39.5 904 409 A V H >< S+ 0 0 0 -4,-2.4 3,-1.3 1,-0.2 4,-0.4 0.906 112.3 53.9 -64.3 -43.8 -2.5 23.2 35.8 905 410 A A H >< S+ 0 0 2 -4,-2.4 3,-1.5 1,-0.3 -2,-0.2 0.847 98.0 64.1 -62.6 -33.8 1.1 24.0 35.2 906 411 A K H 3< S+ 0 0 25 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.801 97.3 56.6 -52.6 -39.4 2.1 21.3 37.7 907 412 A Y T << S- 0 0 0 -3,-1.3 -1,-0.2 -4,-0.6 -2,-0.2 0.510 103.6-136.3 -81.6 -3.8 0.6 18.7 35.3 908 413 A R < - 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0 0 102 -23,-0.2 4,-1.8 1,-0.1 3,-0.5 -0.956 61.5-157.5-120.3 122.8 -4.8 41.0 39.5 920 425 A L H 3> S+ 0 0 69 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.842 98.1 60.8 -62.9 -32.2 -1.6 42.5 38.2 921 426 A Q H 3> S+ 0 0 31 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.857 101.4 52.5 -64.7 -31.5 0.2 40.9 41.1 922 427 A T H <> S+ 0 0 3 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.933 105.9 53.4 -67.2 -48.6 -0.9 37.6 39.8 923 428 A C H < S+ 0 0 2 -4,-1.8 4,-0.3 1,-0.2 -2,-0.2 0.936 114.8 42.8 -50.0 -46.0 0.6 38.3 36.4 924 429 A R H >< S+ 0 0 55 -4,-2.3 3,-1.6 1,-0.2 -350,-0.3 0.936 112.5 50.6 -69.7 -46.4 3.9 39.2 38.1 925 430 A Q H >< S+ 0 0 13 -4,-3.1 3,-1.4 1,-0.3 -1,-0.2 0.862 101.3 62.2 -67.1 -26.5 3.9 36.3 40.5 926 431 A L G >< S+ 0 0 1 -4,-2.2 3,-1.8 1,-0.3 6,-0.3 0.555 79.0 89.6 -72.1 -8.9 3.3 33.7 37.7 927 432 A N G < S+ 0 0 21 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.1 0.556 84.5 54.3 -60.0 -11.2 6.6 34.7 36.1 928 433 A I G < S+ 0 0 0 -3,-1.4 2,-0.5 -4,-0.1 -1,-0.2 0.318 91.3 87.6-103.8 10.8 8.2 32.1 38.2 929 434 A T S X S- 0 0 4 -3,-1.8 3,-1.1 -143,-0.1 -109,-0.0 -0.930 80.0-124.9-107.5 126.3 5.9 29.3 37.0 930 435 A Q T 3 S+ 0 0 15 -2,-0.5 -414,-0.2 1,-0.2 -415,-0.1 -0.236 86.1 17.1 -66.8 144.8 7.1 27.5 33.8 931 436 A G T 3 S+ 0 0 5 -416,-2.4 -18,-2.3 1,-0.2 2,-0.4 0.457 96.6 110.7 86.2 -0.8 4.8 27.3 30.8 932 437 A V E < -o 913 0N 4 -3,-1.1 2,-0.4 -417,-0.3 -18,-0.2 -0.866 40.2-173.5-112.6 143.0 2.3 30.1 31.7 933 438 A E E -o 914 0N 42 -20,-2.3 -18,-2.9 -2,-0.4 2,-0.4 -0.985 22.3-138.5-126.9 139.2 1.8 33.5 30.2 934 439 A S E -o 915 0N 28 -2,-0.4 2,-0.5 -20,-0.2 -18,-0.2 -0.841 12.0-162.6-107.4 144.4 -0.6 35.9 31.9 935 440 A V E -o 916 0N 26 -20,-3.1 -18,-2.2 -2,-0.4 2,-0.4 -0.987 19.1-138.3-122.4 121.5 -3.2 38.2 30.5 936 441 A F E -o 917 0N 69 -2,-0.5 2,-0.6 -20,-0.2 -18,-0.2 -0.671 11.8-161.0 -81.6 126.5 -4.4 41.0 32.7 937 442 A F - 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