==== 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 HYDROLASE/TRANSPORT PROTEIN 23-JUN-09 3A3Y . COMPND 2 MOLECULE: NA, K-ATPASE ALPHA SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: SQUALUS ACANTHIAS; . AUTHOR H.OGAWA,T.SHINODA,F.CORNELIUS,C.TOYOSHIMA . 1295 5 3 1 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56689.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 868 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 127 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 75 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 148 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 415 32.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.5 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 7 1 5 3 3 1 3 3 1 1 3 0 0 2 0 3 1 0 0 2 0 0 1 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 2 2 4 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 PARALLEL BRIDGES PER LADDER . 5 4 5 5 2 2 2 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 . 4 2 1 0 0 0 1 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 32 A L 0 0 198 0, 0.0 4,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -82.6 157.6 23.4 50.4 2 33 A D > + 0 0 31 1,-0.2 4,-0.5 2,-0.1 244,-0.0 0.473 360.0 80.3 -94.5 -6.1 153.8 23.8 51.1 3 34 A E T >4 S+ 0 0 115 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.850 85.9 57.3 -70.9 -35.5 153.7 20.7 53.3 4 35 A L G >4 S+ 0 0 126 1,-0.2 3,-1.5 2,-0.2 -1,-0.2 0.881 103.1 55.3 -59.8 -39.4 155.1 22.6 56.3 5 36 A K G 34 S+ 0 0 43 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.675 94.9 67.2 -69.7 -18.4 152.2 25.1 56.1 6 37 A K G << S+ 0 0 26 -3,-0.8 -1,-0.3 -4,-0.5 2,-0.2 0.568 87.8 84.8 -77.7 -10.2 149.7 22.2 56.3 7 38 A E S < S- 0 0 116 -3,-1.5 2,-0.1 -4,-0.3 658,-0.1 -0.598 88.7-107.9 -88.0 154.0 150.9 21.7 59.9 8 39 A V - 0 0 42 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.371 42.3 -84.8 -84.7 164.8 149.3 23.7 62.7 9 40 A S - 0 0 20 -2,-0.1 2,-0.4 -4,-0.1 197,-0.1 -0.209 30.0-151.7 -77.3 159.9 151.0 26.6 64.5 10 41 A M + 0 0 130 195,-0.1 2,-0.1 194,-0.1 194,-0.1 -0.997 29.8 165.0-136.4 126.9 153.3 26.3 67.6 11 42 A D - 0 0 42 -2,-0.4 193,-0.0 0, 0.0 0, 0.0 -0.341 46.2-116.9-138.6-156.8 153.7 29.2 70.1 12 43 A D + 0 0 11 -2,-0.1 8,-0.0 2,-0.1 -2,-0.0 -0.183 60.0 117.4-157.3 38.0 154.5 31.2 73.3 13 44 A H S S+ 0 0 1 1,-0.2 187,-0.2 190,-0.1 4,-0.1 0.532 80.2 64.8 -78.0 -14.5 151.3 32.5 75.0 14 45 A K S S+ 0 0 132 189,-0.1 -1,-0.2 185,-0.1 -2,-0.1 0.731 83.9 92.8 -83.2 -27.8 152.5 30.3 77.8 15 46 A L S S- 0 0 40 1,-0.1 2,-0.1 2,-0.1 185,-0.1 -0.228 85.7-108.5 -57.2 152.4 155.6 32.5 78.3 16 47 A S > - 0 0 45 1,-0.1 4,-1.9 4,-0.0 5,-0.1 -0.464 28.6-110.0 -76.8 161.5 155.4 35.3 80.9 17 48 A L H > S+ 0 0 65 1,-0.2 4,-1.9 2,-0.2 3,-0.3 0.949 123.3 49.5 -53.4 -50.5 155.3 38.9 79.6 18 49 A D H > S+ 0 0 116 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.903 108.8 50.9 -53.5 -51.9 158.8 39.3 81.0 19 50 A E H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.818 108.3 55.3 -54.8 -36.0 160.0 36.1 79.3 20 51 A L H X S+ 0 0 0 -4,-1.9 4,-0.6 -3,-0.3 -1,-0.2 0.898 109.5 42.8 -69.3 -45.8 158.6 37.3 76.0 21 52 A H H >X>S+ 0 0 13 -4,-1.9 3,-1.4 2,-0.2 5,-1.2 0.926 111.1 57.3 -61.5 -50.2 160.5 40.6 76.1 22 53 A N H ><5S+ 0 0 130 -4,-2.7 3,-1.1 1,-0.3 -2,-0.2 0.934 108.4 47.1 -37.1 -57.4 163.5 38.7 77.2 23 54 A K H 3<5S+ 0 0 119 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.597 119.5 39.1 -69.0 -13.6 163.0 36.6 74.0 24 55 A Y H <<5S- 0 0 27 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 0.182 102.6-119.7-124.7 18.9 162.6 39.7 71.8 25 56 A G T <<5S+ 0 0 63 -3,-1.1 2,-0.3 -4,-0.6 -3,-0.2 0.910 70.4 134.1 41.0 57.7 165.1 42.2 73.2 26 57 A T < - 0 0 21 -5,-1.2 2,-0.4 6,-0.1 -1,-0.2 -0.942 57.9-123.5-139.7 155.1 162.3 44.6 74.0 27 58 A D - 0 0 67 -2,-0.3 4,-0.5 1,-0.1 132,-0.1 -0.836 12.9-149.6-100.4 135.2 160.9 46.9 76.7 28 59 A L S S+ 0 0 55 -2,-0.4 -1,-0.1 1,-0.1 4,-0.1 0.772 95.7 26.4 -71.5 -28.6 157.3 46.4 77.9 29 60 A T S S+ 0 0 86 2,-0.1 -1,-0.1 130,-0.0 -2,-0.0 0.736 133.3 30.1-111.2 -30.2 156.7 50.0 78.7 30 61 A R S S- 0 0 122 1,-0.1 114,-2.3 113,-0.1 115,-0.2 0.742 94.5-151.2 -98.7 -32.5 159.0 52.0 76.4 31 62 A G - 0 0 5 -4,-0.5 112,-0.3 111,-0.2 111,-0.2 -0.272 42.0 -23.8 82.2-176.8 159.1 49.6 73.5 32 63 A L B -a 142 0A 4 109,-0.5 111,-1.8 110,-0.1 2,-0.3 -0.074 68.3-106.7 -59.1 160.8 162.0 49.2 71.1 33 64 A T > - 0 0 66 109,-0.2 4,-3.1 1,-0.1 5,-0.2 -0.680 24.9-119.7 -82.4 145.7 164.5 51.8 70.4 34 65 A N H > S+ 0 0 87 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.869 119.4 50.4 -47.9 -38.7 164.3 53.6 67.1 35 66 A A H > S+ 0 0 65 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.937 113.3 41.4 -66.3 -50.2 167.8 52.2 66.6 36 67 A R H > S+ 0 0 140 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.757 111.3 57.9 -73.3 -25.9 166.9 48.6 67.5 37 68 A A H X S+ 0 0 2 -4,-3.1 4,-1.4 2,-0.2 -2,-0.2 0.967 109.9 43.0 -63.5 -53.8 163.7 48.8 65.5 38 69 A K H X S+ 0 0 165 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.854 114.4 51.9 -59.5 -40.2 165.5 49.7 62.3 39 70 A E H X S+ 0 0 99 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.948 109.3 48.5 -59.8 -51.2 168.1 47.0 63.1 40 71 A I H X S+ 0 0 10 -4,-2.3 4,-1.8 1,-0.2 5,-0.3 0.720 107.3 59.9 -66.5 -21.1 165.5 44.3 63.6 41 72 A L H X S+ 0 0 41 -4,-1.4 4,-3.5 2,-0.2 -1,-0.2 0.984 106.1 42.3 -66.7 -60.7 163.9 45.4 60.3 42 73 A A H < S+ 0 0 96 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.755 112.8 60.3 -61.2 -25.5 166.9 44.7 58.0 43 74 A R H < S+ 0 0 141 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.986 123.5 12.5 -57.9 -63.8 167.3 41.5 60.0 44 75 A D H < S- 0 0 66 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.709 103.6-123.0 -96.4 -26.8 163.9 39.9 59.3 45 76 A G < - 0 0 21 -4,-3.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.442 47.9 -27.6 103.1 178.6 162.4 42.0 56.4 46 77 A P - 0 0 68 0, 0.0 2,-2.1 0, 0.0 107,-0.2 -0.169 55.9-110.7 -67.3 155.9 159.2 43.9 56.1 47 78 A N S S+ 0 0 5 105,-2.4 2,-0.3 184,-0.1 107,-0.1 -0.529 85.2 116.5 -76.6 67.1 155.9 43.3 57.8 48 79 A S S S- 0 0 21 -2,-2.1 184,-0.6 104,-0.1 2,-0.3 -0.997 70.5-115.0-149.3 142.6 154.6 42.2 54.4 49 80 A L - 0 0 4 -2,-0.3 182,-0.1 182,-0.2 -2,-0.0 -0.588 32.2-128.9 -79.4 136.0 153.3 39.3 52.4 50 81 A T - 0 0 83 -2,-0.3 -1,-0.1 1,-0.0 77,-0.0 -0.792 25.6-121.8 -94.9 112.4 155.6 38.0 49.6 51 82 A P - 0 0 93 0, 0.0 -1,-0.0 0, 0.0 190,-0.0 -0.061 30.2-105.4 -51.8 144.9 153.7 37.7 46.2 52 83 A P - 0 0 44 0, 0.0 2,-1.5 0, 0.0 193,-0.0 -0.300 37.8 -89.7 -76.4 155.4 153.6 34.2 44.4 53 84 A P - 0 0 129 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.470 54.2-156.5 -66.7 87.1 155.6 33.2 41.3 54 85 A T - 0 0 121 -2,-1.5 0, 0.0 1,-0.1 0, 0.0 -0.116 14.2-119.6 -65.1 160.4 153.1 34.3 38.6 55 86 A T - 0 0 77 1,-0.1 -1,-0.1 2,-0.0 5,-0.1 -0.938 38.2-114.8-107.4 118.2 153.0 32.8 35.1 56 87 A P > - 0 0 82 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.243 14.2-115.1 -51.8 167.5 153.5 35.5 32.3 57 88 A E H > S+ 0 0 142 2,-0.2 4,-0.9 1,-0.1 3,-0.1 0.863 109.6 53.2 -72.0 -40.6 151.1 36.8 29.7 58 89 A W H >> S+ 0 0 221 1,-0.2 4,-2.0 2,-0.2 3,-0.8 0.942 108.3 47.2 -62.1 -52.9 153.1 35.5 26.6 59 90 A I H 3> S+ 0 0 77 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.692 103.1 65.4 -67.2 -20.7 153.4 31.8 27.8 60 91 A K H 3< S+ 0 0 46 -4,-0.7 4,-0.2 2,-0.2 -1,-0.2 0.864 111.1 34.6 -67.1 -37.6 149.7 31.7 28.6 61 92 A F H XX S+ 0 0 57 -4,-0.9 3,-0.7 -3,-0.8 4,-0.7 0.834 114.8 56.6 -84.4 -36.7 148.7 32.2 25.0 62 93 A C H 3< S+ 0 0 61 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.689 98.0 60.0 -74.0 -22.3 151.6 30.2 23.4 63 94 A R T 3< S+ 0 0 180 -4,-1.2 3,-0.5 1,-0.2 -1,-0.2 0.702 104.6 51.3 -77.2 -21.6 150.9 26.9 25.3 64 95 A Q T X4 S+ 0 0 23 -3,-0.7 3,-2.2 -4,-0.2 -1,-0.2 0.707 91.6 77.7 -82.0 -24.4 147.5 26.8 23.7 65 96 A L T 3< S+ 0 0 22 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.466 98.1 44.2 -68.8 -3.9 149.1 27.3 20.3 66 97 A F T 3 S+ 0 0 121 -3,-0.5 2,-3.5 4,-0.1 -1,-0.3 -0.060 74.7 147.3-123.6 27.7 150.1 23.6 20.3 67 98 A G S < S- 0 0 28 -3,-2.2 2,-1.1 1,-0.1 3,-0.1 -0.183 74.9 -87.7 -67.2 53.1 146.7 22.4 21.6 68 99 A G S > S+ 0 0 14 -2,-3.5 4,-1.5 1,-0.2 3,-0.4 -0.691 127.1 40.4 86.4 -96.1 146.8 19.1 19.8 69 100 A F H > S+ 0 0 7 -2,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.782 107.1 72.0 -53.9 -31.0 145.3 19.8 16.3 70 101 A S H > S+ 0 0 6 2,-0.2 4,-1.3 1,-0.2 3,-0.4 0.960 100.4 39.8 -48.0 -63.7 147.3 23.0 16.5 71 102 A I H >> S+ 0 0 76 -3,-0.4 4,-1.9 1,-0.3 3,-0.7 0.912 114.8 53.0 -54.9 -50.2 150.7 21.4 16.1 72 103 A L H 3X S+ 0 0 35 -4,-1.5 4,-1.1 1,-0.3 -1,-0.3 0.833 106.4 54.1 -55.1 -37.2 149.4 18.9 13.5 73 104 A L H 3X S+ 0 0 4 -4,-2.5 4,-2.5 -3,-0.4 -1,-0.3 0.778 104.6 54.1 -70.0 -29.1 148.0 21.9 11.5 74 105 A W H S+ 0 0 93 -4,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.711 106.9 46.8 -66.3 -21.1 156.9 22.1 0.9 83 114 A A H > S+ 0 0 23 -4,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.925 111.6 44.6 -82.6 -52.7 154.6 22.5 -2.1 84 115 A Y H X S+ 0 0 72 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.720 115.0 53.0 -65.8 -21.7 154.8 26.3 -2.7 85 116 A G H < S+ 0 0 41 -4,-1.5 5,-0.2 2,-0.2 -1,-0.2 0.923 112.9 38.9 -78.1 -50.3 158.6 25.9 -2.3 86 117 A I H X>S+ 0 0 108 -4,-1.0 4,-1.5 -5,-0.2 5,-1.0 0.817 124.2 45.4 -67.8 -32.5 159.3 23.1 -4.8 87 118 A Q H <5S+ 0 0 52 -4,-2.3 4,-0.5 3,-0.2 -2,-0.2 0.991 109.6 47.6 -72.4 -69.5 156.7 24.8 -7.1 88 119 A A T <5S+ 0 0 46 -4,-1.8 4,-0.2 4,-0.2 -1,-0.2 0.410 121.6 43.0 -60.2 6.1 157.6 28.5 -6.9 89 120 A A T 45S+ 0 0 77 -4,-0.2 3,-0.4 -3,-0.2 -2,-0.2 0.725 129.6 12.4-109.3 -70.7 161.2 27.4 -7.6 90 121 A T T <5S+ 0 0 106 -4,-1.5 2,-0.6 1,-0.2 -3,-0.2 0.960 140.4 25.2 -75.9 -54.9 161.4 24.7 -10.3 91 122 A E S >S+ 0 0 92 -2,-0.3 4,-1.7 1,-0.1 5,-0.6 0.215 77.2 117.2 -94.5 10.9 147.7 31.6 -4.1 97 128 A D H >5S+ 0 0 76 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.913 85.9 10.6 -42.8 -78.1 146.7 27.9 -4.2 98 129 A N H >5S+ 0 0 36 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.597 127.4 59.6 -89.9 -14.1 149.0 26.1 -1.7 99 130 A L H >5S+ 0 0 48 2,-0.2 4,-2.7 -4,-0.2 -2,-0.2 0.980 114.0 35.1 -68.5 -67.2 150.4 29.4 -0.2 100 131 A Y H X5S+ 0 0 152 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.792 118.1 55.8 -56.7 -33.7 146.9 30.6 0.9 101 132 A L H XX S+ 0 0 59 -4,-2.7 4,-2.1 1,-0.2 3,-0.8 0.952 102.1 52.6 -57.2 -58.9 148.2 30.0 5.5 104 135 A V H 3X S+ 0 0 59 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.904 103.6 59.9 -43.7 -54.7 144.6 29.3 6.6 105 136 A L H 3< S+ 0 0 6 -4,-1.5 4,-0.4 1,-0.2 -1,-0.2 0.829 111.2 37.9 -43.3 -49.9 145.7 26.1 8.4 106 137 A S H XX S+ 0 0 21 -4,-1.1 3,-2.2 -3,-0.8 4,-1.1 0.942 115.6 49.1 -73.3 -51.7 148.1 28.0 10.8 107 138 A T H 3X S+ 0 0 65 -4,-2.1 4,-1.4 1,-0.3 5,-0.3 0.560 95.2 76.3 -70.0 -7.1 146.0 31.1 11.4 108 139 A V H 3X S+ 0 0 21 -4,-1.5 4,-0.6 -5,-0.3 -1,-0.3 0.830 102.4 41.2 -61.8 -32.5 143.2 28.7 12.1 109 140 A V H <> S+ 0 0 6 -3,-2.2 4,-2.5 -4,-0.4 -2,-0.2 0.912 107.5 58.7 -80.3 -47.8 145.1 28.3 15.4 110 141 A I H < S+ 0 0 70 -4,-1.1 4,-0.3 1,-0.2 -2,-0.1 0.910 114.9 34.6 -51.9 -54.9 146.0 31.9 16.1 111 142 A V H >< S+ 0 0 99 -4,-1.4 3,-0.8 1,-0.2 -1,-0.2 0.804 118.0 54.3 -71.5 -31.4 142.4 33.3 16.2 112 143 A T H >X S+ 0 0 18 -4,-0.6 3,-3.1 -5,-0.3 4,-1.0 0.770 89.6 79.5 -68.6 -28.4 141.3 30.0 17.7 113 144 A G H 3X S+ 0 0 2 -4,-2.5 4,-1.5 1,-0.3 -1,-0.2 0.784 84.7 61.1 -48.4 -31.1 143.9 30.6 20.4 114 145 A C H <4 S+ 0 0 73 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.530 97.8 58.3 -77.3 -8.4 141.5 33.0 22.0 115 146 A F H <> S+ 0 0 74 -3,-3.1 4,-0.6 2,-0.2 -1,-0.2 0.797 114.7 33.0 -89.5 -36.1 139.0 30.2 22.5 116 147 A S H X S+ 0 0 19 -4,-1.0 4,-1.3 2,-0.2 -2,-0.2 0.594 115.7 57.9 -93.0 -16.3 141.3 28.0 24.6 117 148 A Y H < S+ 0 0 73 -4,-1.5 -1,-0.2 -5,-0.3 -3,-0.2 0.275 111.0 45.7 -84.6 6.0 142.8 31.1 26.0 118 149 A Y H >4 S+ 0 0 121 -5,-0.1 212,-0.5 3,-0.1 3,-0.5 0.583 111.6 50.7-109.3 -28.4 139.1 31.7 27.0 119 150 A Q H 3< S+ 0 0 15 -4,-0.6 212,-1.2 1,-0.2 211,-0.3 0.771 118.2 36.3 -79.0 -30.0 138.7 28.1 28.3 120 151 A E T 3< S+ 0 0 73 -4,-1.3 -1,-0.2 210,-0.1 2,-0.1 -0.327 79.7 138.1-127.1 48.5 141.8 28.2 30.5 121 152 A A < - 0 0 38 -3,-0.5 2,-0.3 207,-0.1 -3,-0.1 -0.456 37.5-147.8 -82.8 164.7 142.0 31.7 32.0 122 153 A K - 0 0 92 -2,-0.1 2,-1.4 207,-0.1 207,-0.1 -0.865 15.6-162.1-146.5 110.4 142.9 32.3 35.7 123 154 A S + 0 0 60 -2,-0.3 2,-0.8 590,-0.1 205,-0.0 -0.680 28.0 167.9 -85.6 84.9 141.7 35.1 38.0 124 155 A S + 0 0 81 -2,-1.4 3,-0.1 1,-0.1 590,-0.1 -0.722 22.0 130.6-108.4 82.4 144.5 34.6 40.6 125 156 A R > + 0 0 161 -2,-0.8 4,-1.4 588,-0.2 -1,-0.1 -0.157 28.1 122.8-121.5 34.6 144.5 37.6 43.1 126 157 A I H >> S+ 0 0 7 2,-0.2 4,-2.1 1,-0.2 3,-1.1 0.985 75.9 46.3 -53.6 -64.2 144.5 35.6 46.3 127 158 A M H 3> S+ 0 0 8 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.780 110.4 53.7 -56.6 -33.7 147.7 37.2 47.7 128 159 A D H 3> S+ 0 0 97 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.807 107.7 50.6 -71.0 -30.9 146.4 40.7 46.8 129 160 A S H << S+ 0 0 6 -4,-1.4 4,-0.5 -3,-1.1 -2,-0.2 0.890 112.5 47.0 -71.1 -41.0 143.2 40.1 48.7 130 161 A F H >< S+ 0 0 0 -4,-2.1 3,-1.7 1,-0.2 4,-0.3 0.921 107.7 56.6 -62.6 -45.9 145.3 38.9 51.7 131 162 A K H >< S+ 0 0 64 -4,-2.6 3,-1.3 1,-0.3 -1,-0.2 0.807 96.3 65.1 -58.6 -32.8 147.6 42.0 51.4 132 163 A N T 3< S+ 0 0 113 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.786 91.4 65.3 -57.9 -27.4 144.5 44.2 51.7 133 164 A M T < S+ 0 0 18 -3,-1.7 82,-0.3 -4,-0.5 -1,-0.2 0.606 81.1 87.5 -79.2 -12.9 144.0 43.0 55.2 134 165 A V S < S- 0 0 33 -3,-1.3 18,-0.1 -4,-0.3 34,-0.0 -0.799 85.8-123.1 -83.1 122.8 147.3 44.5 56.5 135 166 A P - 0 0 24 0, 0.0 16,-0.1 0, 0.0 3,-0.1 -0.163 11.8-123.5 -60.8 159.6 146.6 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0.613 124.9 66.9 -69.2 -16.0 154.9 35.7 56.1 233 264 A R G < S+ 0 0 88 -3,-2.5 -1,-0.2 4,-0.1 -2,-0.2 0.467 76.7 102.3 -92.0 -3.2 155.5 34.3 59.5 234 265 A T S <> S- 0 0 0 -3,-1.1 4,-2.0 -4,-0.3 5,-0.2 -0.341 88.3-105.6 -72.8 160.1 152.0 35.2 61.0 235 266 A V H > S+ 0 0 9 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.916 122.8 33.4 -53.3 -47.1 149.4 32.5 61.3 236 267 A M H > S+ 0 0 1 -22,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.692 107.8 67.3 -86.5 -22.9 147.4 33.8 58.3 237 268 A G H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.903 104.1 47.7 -56.5 -42.4 150.5 35.0 56.4 238 269 A R H X S+ 0 0 52 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.897 108.4 53.7 -65.6 -40.4 151.2 31.3 56.2 239 270 A I H X S+ 0 0 1 -4,-1.0 4,-3.3 2,-0.2 5,-0.2 0.898 107.6 52.0 -60.8 -40.3 147.6 30.7 55.1 240 271 A A H X S+ 0 0 0 -4,-2.6 4,-4.3 2,-0.2 5,-0.3 0.976 111.2 45.2 -58.6 -58.3 148.1 33.2 52.3 241 272 A T H X S+ 0 0 32 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.902 116.0 48.0 -50.7 -48.7 151.3 31.6 51.0 242 273 A L H < S+ 0 0 0 -4,-2.8 4,-0.3 2,-0.2 -1,-0.2 0.950 118.2 39.7 -57.5 -52.2 149.6 28.2 51.2 243 274 A A H >< S+ 0 0 0 -4,-3.3 3,-0.8 -5,-0.2 -2,-0.2 0.932 120.3 44.2 -66.2 -48.4 146.5 29.4 49.4 244 275 A S H 3< S+ 0 0 16 -4,-4.3 -3,-0.2 -5,-0.2 -2,-0.2 0.939 115.0 46.9 -61.2 -49.2 148.3 31.5 46.9 245 276 A G T 3< S+ 0 0 32 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.209 80.8 123.2 -88.4 13.6 151.0 29.0 46.0 246 277 A L < - 0 0 19 -3,-0.8 2,-0.9 -4,-0.3 -3,-0.0 -0.343 69.8-108.3 -71.5 155.7 149.0 25.8 45.5 247 278 A E - 0 0 170 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.772 26.7-157.5 -89.3 102.9 149.2 23.9 42.3 248 279 A V - 0 0 69 -2,-0.9 -1,-0.2 1,-0.1 2,-0.0 0.902 28.7-172.9 -43.5 -67.5 145.8 24.4 40.5 249 280 A G - 0 0 63 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.099 26.7 -42.7 94.1 171.6 145.8 21.3 38.3 250 281 A R - 0 0 150 1,-0.1 3,-0.0 4,-0.0 0, 0.0 -0.562 50.1-135.7 -80.2 132.2 143.8 19.8 35.4 251 282 A T > - 0 0 22 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.316 26.3-109.0 -72.3 163.9 139.9 19.8 35.5 252 283 A P H > S+ 0 0 9 0, 0.0 4,-2.5 0, 0.0 3,-0.4 0.986 119.3 48.9 -55.4 -59.6 137.9 16.7 34.6 253 284 A I H > S+ 0 0 1 78,-0.3 4,-2.0 1,-0.3 5,-0.2 0.877 110.4 51.8 -50.4 -45.6 136.6 18.2 31.3 254 285 A A H > S+ 0 0 12 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.911 111.5 47.1 -53.8 -46.1 140.2 19.2 30.4 255 286 A I H X S+ 0 0 52 -4,-2.0 4,-1.8 -3,-0.4 -2,-0.2 0.823 109.3 54.6 -68.1 -33.3 141.4 15.6 31.0 256 287 A E H X S+ 0 0 3 -4,-2.5 4,-0.8 2,-0.2 -1,-0.2 0.858 111.3 45.3 -66.3 -36.2 138.4 14.3 29.0 257 288 A I H >X S+ 0 0 32 -4,-2.0 4,-2.5 -5,-0.2 3,-0.8 0.942 109.9 51.7 -72.3 -52.1 139.5 16.5 26.0 258 289 A E H 3X S+ 0 0 85 -4,-2.6 4,-1.3 1,-0.3 -2,-0.2 0.888 110.9 51.2 -50.8 -41.4 143.2 15.6 26.3 259 290 A H H 3X S+ 0 0 51 -4,-1.8 4,-1.4 1,-0.2 -1,-0.3 0.769 108.5 51.0 -67.9 -29.5 142.1 12.0 26.2 260 291 A F H X S+ 0 0 2 -4,-2.7 4,-1.9 2,-0.2 3,-0.9 0.953 114.0 41.5 -57.4 -57.7 142.0 11.3 17.5 265 296 A T H 3X S+ 0 0 46 -4,-3.0 4,-2.2 1,-0.2 5,-0.3 0.913 108.1 65.6 -52.3 -46.3 145.7 11.4 16.9 266 297 A G H 3< S+ 0 0 39 -4,-3.0 4,-0.4 1,-0.2 -1,-0.2 0.752 111.4 31.8 -50.6 -34.3 145.7 7.6 17.3 267 298 A V H S+ 0 0 140 -4,-0.4 4,-1.3 -5,-0.3 -2,-0.2 0.920 120.4 29.4 -72.0 -45.5 147.1 4.8 11.9 271 302 A L H X S+ 0 0 46 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.876 114.4 64.2 -77.6 -41.8 145.3 5.7 8.6 272 303 A G H < S+ 0 0 0 -4,-1.1 24,-0.2 -5,-0.4 -3,-0.2 0.900 116.8 28.4 -46.2 -50.6 147.8 8.4 7.8 273 304 A V H >X S+ 0 0 65 -4,-1.3 3,-2.3 1,-0.2 4,-1.9 0.784 111.2 67.2 -83.2 -30.8 150.6 5.9 7.5 274 305 A S H 3X S+ 0 0 36 -4,-1.3 4,-1.1 1,-0.3 -2,-0.2 0.741 103.1 50.3 -62.3 -22.7 148.3 3.0 6.4 275 306 A F H 3< S+ 0 0 34 -4,-1.8 -1,-0.3 2,-0.2 -2,-0.1 -0.149 103.9 58.2-107.8 33.0 147.8 5.0 3.3 276 307 A F H <> S+ 0 0 40 -3,-2.3 4,-1.4 16,-0.1 -2,-0.2 0.505 111.0 40.3-112.6 -42.5 151.6 5.4 2.8 277 308 A I H X S+ 0 0 96 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.839 119.1 46.3 -74.1 -36.0 152.1 1.7 2.7 278 309 A L H X S+ 0 0 67 -4,-1.1 4,-0.7 -5,-0.2 -3,-0.2 0.895 112.2 50.3 -74.1 -40.8 149.0 1.0 0.6 279 310 A S H 4 S+ 0 0 3 1,-0.2 3,-0.3 2,-0.2 5,-0.3 0.850 111.6 51.0 -61.4 -33.4 149.9 3.9 -1.7 280 311 A L H >X S+ 0 0 75 -4,-1.4 3,-1.8 1,-0.2 4,-0.6 0.934 104.2 54.0 -69.9 -48.7 153.4 2.3 -2.0 281 312 A I H 3< S+ 0 0 143 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.654 108.9 54.3 -57.6 -16.2 152.1 -1.2 -2.9 282 313 A L T 3< S- 0 0 89 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.2 0.454 132.4 -80.3-102.1 -2.8 150.2 0.6 -5.7 283 314 A G T <4 S+ 0 0 61 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.846 80.4 134.9 105.3 52.8 153.2 2.3 -7.3 284 315 A Y < - 0 0 27 -4,-0.6 -1,-0.3 -5,-0.3 -2,-0.1 -0.998 40.5-139.7-131.9 134.6 154.0 5.5 -5.4 285 316 A S >> - 0 0 49 -2,-0.4 4,-3.2 1,-0.1 3,-0.8 0.025 40.1 -88.3 -77.9-173.1 157.5 6.7 -4.4 286 317 A W T 34 S+ 0 0 185 1,-0.2 -1,-0.1 2,-0.2 -6,-0.0 0.159 130.7 58.4 -81.8 17.5 158.7 8.3 -1.1 287 318 A L T 34 S+ 0 0 143 3,-0.1 -1,-0.2 4,-0.0 4,-0.2 0.468 117.8 27.9-115.2 -17.9 157.7 11.5 -2.9 288 319 A E T <> S+ 0 0 81 -3,-0.8 4,-1.0 2,-0.1 -2,-0.2 0.743 119.8 50.0-113.8 -44.9 154.1 10.4 -3.3 289 320 A A H X S+ 0 0 0 -4,-3.2 4,-0.8 1,-0.2 -3,-0.2 0.717 115.0 49.0 -69.3 -21.9 153.4 8.0 -0.5 290 321 A V H > S+ 0 0 43 -5,-0.4 4,-1.8 2,-0.2 5,-0.3 0.894 105.3 54.4 -82.0 -45.5 154.8 10.6 1.9 291 322 A I H > S+ 0 0 68 1,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.723 109.7 50.6 -62.0 -22.7 152.8 13.6 0.6 292 323 A F H X S+ 0 0 27 -4,-1.0 4,-3.3 2,-0.2 -1,-0.2 0.830 103.7 55.8 -83.9 -37.9 149.6 11.6 1.2 293 324 A L H < S+ 0 0 61 -4,-0.8 -2,-0.2 2,-0.3 -3,-0.1 0.967 116.2 37.4 -57.0 -57.6 150.4 10.6 4.8 294 325 A I H < S+ 0 0 19 -4,-1.8 3,-0.4 1,-0.2 4,-0.3 0.823 112.2 64.6 -59.4 -34.1 150.8 14.3 5.7 295 326 A G H < S+ 0 0 37 -4,-0.6 2,-3.4 -5,-0.3 3,-0.4 0.977 90.1 64.5 -47.9 -62.4 147.9 14.7 3.3 296 327 A I S < S+ 0 0 5 -4,-3.3 -1,-0.3 -24,-0.2 -24,-0.2 -0.218 81.2 88.2 -68.2 54.9 145.6 12.7 5.6 297 328 A I S >> S+ 0 0 25 -2,-3.4 3,-2.4 -3,-0.4 4,-2.1 0.668 81.6 45.9-106.2 -77.3 145.7 15.2 8.4 298 329 A V G >4 S+ 0 0 16 -3,-0.4 3,-0.7 -4,-0.3 5,-0.2 0.833 110.8 55.5 -29.1 -66.8 142.9 17.8 7.7 299 330 A A G 34 S+ 0 0 12 -4,-0.3 -1,-0.3 1,-0.3 457,-0.2 0.769 117.3 35.9 -41.8 -37.8 140.4 15.0 7.0 300 331 A N G <4 S+ 0 0 0 -3,-2.4 -1,-0.3 -32,-0.1 -2,-0.2 0.731 106.0 76.1 -90.6 -25.4 141.2 13.4 10.4 301 332 A V S << S- 0 0 2 -4,-2.1 2,-1.0 -3,-0.7 3,-0.1 -0.802 75.7-141.8 -92.5 111.6 141.7 16.7 12.4 302 333 A P >> - 0 0 0 0, 0.0 3,-0.9 0, 0.0 4,-0.5 -0.642 17.3-174.5 -73.0 102.4 138.4 18.5 13.2 303 334 A E T 34 S+ 0 0 16 -2,-1.0 4,-0.4 1,-0.2 3,-0.2 0.764 82.8 47.9 -68.6 -27.1 139.4 22.2 12.8 304 335 A G T 3> S+ 0 0 4 1,-0.1 4,-1.7 2,-0.1 -1,-0.2 0.481 88.9 85.2 -92.7 -3.8 136.0 23.3 14.1 305 336 A L H <> S+ 0 0 3 -3,-0.9 4,-2.6 2,-0.2 5,-0.2 0.897 86.3 51.0 -72.3 -41.4 135.9 21.2 17.2 306 337 A L H X S+ 0 0 40 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.965 112.1 47.8 -54.1 -55.7 137.9 23.4 19.5 307 338 A A H > S+ 0 0 12 -4,-0.4 4,-2.7 1,-0.2 5,-0.2 0.853 112.7 50.5 -54.7 -39.8 135.7 26.4 18.7 308 339 A T H X S+ 0 0 2 -4,-1.7 4,-3.0 2,-0.2 5,-0.2 0.968 108.3 48.2 -66.0 -56.5 132.5 24.3 19.2 309 340 A V H X S+ 0 0 11 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.879 115.7 49.1 -51.0 -39.0 133.4 22.9 22.6 310 341 A T H X S+ 0 0 1 -4,-2.2 4,-3.8 -5,-0.2 -2,-0.2 0.942 110.9 44.9 -69.5 -52.8 134.3 26.5 23.6 311 342 A V H X S+ 0 0 41 -4,-2.7 4,-3.3 2,-0.2 -2,-0.2 0.883 115.4 51.9 -59.5 -36.8 131.1 28.2 22.4 312 343 A C H X S+ 0 0 1 -4,-3.0 4,-2.0 -5,-0.2 -2,-0.2 0.962 112.8 42.9 -61.0 -53.4 129.2 25.3 24.0 313 344 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.949 117.9 47.4 -53.4 -52.6 131.0 25.9 27.3 314 345 A T H X S+ 0 0 24 -4,-3.8 4,-1.8 1,-0.2 -2,-0.2 0.880 110.4 51.1 -57.8 -44.7 130.6 29.6 26.9 315 346 A L H X S+ 0 0 47 -4,-3.3 4,-1.0 -5,-0.2 -1,-0.2 0.840 110.9 48.5 -67.0 -33.2 126.9 29.4 26.0 316 347 A T H >X S+ 0 0 1 -4,-2.0 4,-1.6 2,-0.2 3,-0.6 0.934 108.4 53.5 -70.3 -48.1 126.2 27.2 29.0 317 348 A A H 3X S+ 0 0 17 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.864 104.0 57.7 -50.6 -40.3 128.1 29.6 31.3 318 349 A K H 3X S+ 0 0 127 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.864 104.1 51.4 -63.8 -36.4 125.9 32.4 30.0 319 350 A R H << S+ 0 0 37 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.876 108.8 50.9 -65.0 -39.6 122.7 30.6 31.1 320 351 A M H ><>S+ 0 0 3 -4,-1.6 5,-1.3 1,-0.2 3,-0.9 0.798 105.1 55.4 -72.6 -31.1 124.1 30.1 34.6 321 352 A A H ><5S+ 0 0 43 -4,-1.9 3,-1.7 1,-0.2 -1,-0.2 0.897 102.5 58.2 -61.0 -40.9 125.0 33.8 34.8 322 353 A R T 3<5S+ 0 0 183 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.519 104.2 52.4 -67.0 -5.9 121.2 34.2 34.1 323 354 A K T < 5S- 0 0 79 -3,-0.9 -1,-0.3 2,-0.1 -2,-0.2 -0.048 127.3 -98.9-114.6 31.1 120.6 32.2 37.2 324 355 A N T < 5S+ 0 0 82 -3,-1.7 397,-0.9 1,-0.1 396,-0.7 0.918 87.0 126.0 50.5 51.2 122.8 34.4 39.4 325 356 A C E < -I 719 0B 5 -5,-1.3 2,-0.3 394,-0.2 394,-0.2 -0.775 45.4-157.6-142.2 94.2 125.7 32.0 39.2 326 357 A L E -I 718 0B 75 392,-2.5 392,-3.2 -2,-0.3 2,-0.5 -0.537 3.0-163.0 -83.1 132.3 129.1 33.4 38.0 327 358 A V E -I 717 0B 25 -2,-0.3 390,-0.2 390,-0.2 6,-0.1 -0.958 10.5-172.9-116.8 125.7 131.7 31.2 36.4 328 359 A K S S+ 0 0 54 388,-2.9 2,-0.4 -2,-0.5 389,-0.1 0.650 74.7 45.9 -89.8 -19.2 135.3 32.5 36.2 329 360 A N - 0 0 25 387,-0.7 3,-0.3 1,-0.1 4,-0.2 -0.964 69.1-141.9-127.9 143.0 136.5 29.6 34.1 330 361 A L S > S+ 0 0 11 -212,-0.5 3,-1.8 -2,-0.4 4,-0.3 0.915 104.8 55.6 -67.6 -41.9 135.1 27.8 31.1 331 362 A E T >> S+ 0 0 19 -212,-1.2 3,-1.1 1,-0.3 4,-1.0 0.760 94.0 70.4 -60.8 -24.7 136.2 24.4 32.3 332 363 A A H 3> S+ 0 0 5 -3,-0.3 4,-0.7 1,-0.3 -1,-0.3 0.561 78.2 79.7 -73.8 -9.0 134.3 25.0 35.6 333 364 A V H <4 S+ 0 0 2 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.883 103.1 33.2 -61.0 -38.9 131.0 24.7 33.7 334 365 A E H X> S+ 0 0 3 -3,-1.1 3,-3.0 -4,-0.3 4,-0.6 0.858 97.7 77.8 -88.1 -40.1 131.3 20.9 33.8 335 366 A T H >< S+ 0 0 0 -4,-1.0 3,-1.7 1,-0.3 4,-0.4 0.808 86.2 62.8 -50.2 -42.0 133.1 20.0 37.1 336 367 A L T 3< S+ 0 0 2 -4,-0.7 3,-0.4 1,-0.3 -1,-0.3 0.771 103.3 52.5 -52.6 -26.0 130.0 20.5 39.2 337 368 A G T <4 S+ 0 0 3 -3,-3.0 469,-0.4 1,-0.2 -1,-0.3 0.638 108.6 47.5 -85.7 -17.9 128.4 17.6 37.2 338 369 A S S << S+ 0 0 1 -3,-1.7 2,-0.4 -4,-0.6 342,-0.3 0.206 85.1 128.0-102.3 11.6 131.3 15.2 37.8 339 370 A T + 0 0 1 -3,-0.4 342,-0.2 -4,-0.4 3,-0.1 -0.562 29.6 173.1 -82.6 125.0 131.4 15.9 41.5 340 371 A S + 0 0 30 340,-2.3 241,-2.9 -2,-0.4 2,-0.4 0.805 69.9 29.1 -95.9 -36.8 131.3 13.0 43.9 341 372 A T E -jk 581 681B 12 339,-1.8 341,-2.0 239,-0.2 2,-0.5 -0.988 62.0-158.6-130.6 134.9 131.9 14.8 47.2 342 373 A I E -jk 582 682B 2 239,-3.1 241,-3.1 -2,-0.4 2,-0.8 -0.959 4.5-160.0-108.6 125.0 131.0 18.3 48.4 343 374 A C E -jk 583 683B 3 339,-2.7 341,-1.9 -2,-0.5 2,-0.5 -0.886 20.1-169.2-101.6 104.1 132.9 19.8 51.3 344 375 A S E -jk 584 684B 0 239,-2.2 241,-2.9 -2,-0.8 341,-0.2 -0.798 19.9-137.7-101.0 133.3 130.8 22.6 52.6 345 376 A D > - 0 0 2 339,-2.8 5,-0.7 -2,-0.5 241,-0.2 -0.457 19.6-144.3 -67.5 153.7 131.7 25.2 55.1 346 377 A K I >>> + 0 0 1 239,-0.3 5,-2.2 3,-0.2 3,-1.6 0.943 69.6 71.5 -86.9 -67.4 128.8 25.8 57.6 347 378 A T I 345S- 0 0 0 1,-0.3 339,-0.2 2,-0.2 -1,-0.1 -0.359 119.3 -6.0 -72.4 117.3 128.6 29.5 58.6 348 379 A G I 345S+ 0 0 0 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-1,-0.2 0.781 101.9 27.2 -59.4 -29.3 119.9 15.0 19.1 908 939 A T < - 0 0 1 -3,-0.9 -1,-0.1 -4,-0.2 5,-0.1 -0.991 52.3-166.6-139.0 146.9 119.4 11.8 21.3 909 940 A R S S+ 0 0 15 -2,-0.3 -1,-0.1 3,-0.1 83,-0.1 0.615 96.7 0.9 -99.1 -18.6 121.5 8.9 22.5 910 941 A R S S+ 0 0 84 2,-0.1 69,-0.2 68,-0.0 -2,-0.1 0.580 110.4 83.4-135.1 -52.5 118.6 6.8 23.8 911 942 A N S S- 0 0 26 1,-0.1 2,-0.2 -4,-0.1 -3,-0.1 -0.163 77.2-109.9 -63.7 153.1 115.3 8.4 23.2 912 943 A S >> - 0 0 8 1,-0.1 4,-2.8 63,-0.1 3,-2.0 -0.568 24.1-122.3 -73.3 146.0 113.3 8.4 20.0 913 944 A I H 3> S+ 0 0 22 1,-0.3 4,-0.7 -2,-0.2 -1,-0.1 0.679 119.0 61.5 -60.9 -15.1 113.1 11.7 18.1 914 945 A F H 34 S+ 0 0 157 2,-0.2 -1,-0.3 1,-0.1 4,-0.1 0.617 109.0 38.7 -85.1 -15.8 109.4 11.0 18.6 915 946 A Q H <4 S+ 0 0 110 -3,-2.0 -2,-0.2 2,-0.1 -1,-0.1 0.824 120.2 42.4 -97.2 -45.6 109.9 11.1 22.4 916 947 A Q H >< S- 0 0 18 -4,-2.8 3,-0.5 1,-0.1 -3,-0.2 0.689 96.4-162.4 -72.7 -20.6 112.4 13.9 22.6 917 948 A G T 3< - 0 0 26 -4,-0.7 -1,-0.1 -5,-0.3 3,-0.1 -0.103 31.5 -80.6 62.3-167.4 110.4 16.0 20.0 918 949 A M T 3 S+ 0 0 65 1,-0.1 -1,-0.2 -4,-0.1 6,-0.1 -0.426 76.5 129.4-130.5 57.6 111.9 18.9 18.2 919 950 A K < + 0 0 143 -3,-0.5 2,-1.2 1,-0.0 3,-0.1 0.618 39.4 107.3 -86.1 -14.7 111.7 21.8 20.6 920 951 A N > - 0 0 6 1,-0.2 4,-1.8 -3,-0.1 5,-0.1 -0.518 45.3-179.9 -68.7 97.6 115.3 22.8 20.3 921 952 A K H > S+ 0 0 99 -2,-1.2 4,-2.7 1,-0.2 -1,-0.2 0.804 77.6 58.4 -72.2 -29.5 114.9 26.0 18.2 922 953 A I H > S+ 0 0 43 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.914 106.5 49.8 -64.8 -42.0 118.7 26.6 18.0 923 954 A L H > S+ 0 0 0 -133,-0.4 4,-1.5 2,-0.2 3,-0.2 0.939 111.7 46.5 -57.7 -52.9 119.1 23.2 16.4 924 955 A I H X S+ 0 0 28 -4,-1.8 4,-2.1 1,-0.3 3,-0.3 0.930 108.5 55.9 -57.6 -47.6 116.4 23.9 13.8 925 956 A F H X S+ 0 0 33 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.869 103.6 58.5 -46.9 -38.6 117.9 27.3 13.2 926 957 A G H X S+ 0 0 0 -4,-1.5 4,-2.6 -3,-0.2 -2,-0.2 0.912 104.0 48.5 -60.8 -45.7 121.1 25.3 12.5 927 958 A L H X S+ 0 0 26 -4,-1.5 4,-2.3 -3,-0.3 5,-0.2 0.941 114.8 43.9 -60.8 -51.2 119.4 23.4 9.6 928 959 A F H X S+ 0 0 59 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.961 118.3 42.4 -59.8 -53.7 118.0 26.4 7.9 929 960 A E H X S+ 0 0 32 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.869 113.2 53.2 -66.4 -38.4 121.1 28.6 8.2 930 961 A E H X S+ 0 0 5 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.928 112.3 44.5 -57.6 -48.3 123.4 25.7 7.3 931 962 A T H X S+ 0 0 12 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.895 110.9 54.6 -65.8 -40.7 121.4 25.0 4.1 932 963 A A H X S+ 0 0 7 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.855 107.6 51.1 -60.0 -36.0 121.3 28.8 3.4 933 964 A L H X S+ 0 0 54 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.922 111.1 47.1 -66.9 -44.9 125.1 28.9 3.6 934 965 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.950 111.1 49.8 -64.0 -50.8 125.5 26.0 1.2 935 966 A A H X S+ 0 0 4 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.893 112.1 51.9 -51.6 -42.9 123.0 27.5 -1.3 936 967 A F H X S+ 0 0 98 -4,-1.8 4,-3.1 -5,-0.2 -2,-0.2 0.978 108.3 47.5 -56.5 -60.9 125.0 30.7 -1.0 937 968 A L H < S+ 0 0 16 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.795 118.2 45.1 -54.1 -29.8 128.4 29.1 -1.7 938 969 A S H < S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.955 124.7 25.8 -77.6 -52.1 126.8 27.3 -4.7 939 970 A Y H < S+ 0 0 13 -4,-3.0 342,-0.2 -5,-0.2 -3,-0.2 0.641 88.9 106.7 -97.7 -18.7 124.8 30.1 -6.3 940 971 A C S >< S- 0 0 26 -4,-3.1 3,-1.2 -5,-0.3 2,-0.2 -0.475 75.1-118.3 -64.6 127.0 126.6 33.3 -5.3 941 972 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.470 98.4 31.0 -68.1 136.1 128.5 34.7 -8.3 942 973 A G T >> S+ 0 0 38 -2,-0.2 4,-2.9 7,-0.1 3,-2.0 -0.104 91.6 94.0 104.9 -32.9 132.3 34.9 -7.7 943 974 A T T <4 S+ 0 0 17 -3,-1.2 6,-3.1 1,-0.3 4,-0.4 0.520 73.2 72.4 -69.6 -2.6 132.3 31.9 -5.4 944 975 A D T 34 S+ 0 0 38 4,-0.3 -1,-0.3 3,-0.2 6,-0.1 0.480 114.8 20.8 -87.5 -3.6 133.1 30.0 -8.6 945 976 A V T <4 S+ 0 0 117 -3,-2.0 -2,-0.2 3,-0.1 -1,-0.1 0.565 123.6 52.9-126.4 -40.8 136.6 31.5 -8.4 946 977 A A S < S+ 0 0 82 -4,-2.9 -3,-0.2 1,-0.2 -2,-0.1 0.730 138.8 4.8 -69.9 -22.3 137.0 32.6 -4.8 947 978 A L S S- 0 0 52 -4,-0.4 -3,-0.2 -5,-0.3 -1,-0.2 0.351 93.9-119.7-142.1 0.3 136.1 29.0 -3.7 948 979 A R + 0 0 105 -6,-0.3 2,-0.5 1,-0.2 -4,-0.3 0.857 62.3 150.6 54.9 36.5 135.8 27.0 -7.0 949 980 A M - 0 0 1 -6,-3.1 -1,-0.2 -12,-0.1 -63,-0.1 -0.890 29.0-159.0-100.8 125.6 132.1 26.4 -6.0 950 981 A Y - 0 0 22 -65,-0.5 2,-0.1 -2,-0.5 -10,-0.1 -0.651 23.6 -93.0-107.7 158.6 129.8 25.9 -8.9 951 982 A P - 0 0 3 0, 0.0 2,-0.4 0, 0.0 -12,-0.1 -0.422 37.9-138.4 -68.0 144.0 126.0 26.2 -9.3 952 983 A L - 0 0 0 -17,-0.1 5,-0.1 -2,-0.1 -14,-0.0 -0.889 11.3-123.7-108.3 133.1 123.9 23.1 -8.9 953 984 A K >> - 0 0 3 -2,-0.4 3,-2.1 1,-0.1 4,-0.6 -0.468 35.1-110.5 -66.6 141.3 120.9 22.0 -11.0 954 985 A P G >4 S+ 0 0 71 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.844 118.9 59.4 -48.7 -41.4 117.8 21.5 -8.8 955 986 A S G >4 S+ 0 0 53 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.830 94.0 66.0 -52.9 -37.3 118.0 17.8 -9.4 956 987 A W G X4 S+ 0 0 9 -3,-2.1 3,-1.0 1,-0.3 4,-0.3 0.769 89.8 68.2 -53.4 -30.5 121.5 17.7 -7.9 957 988 A W G << S+ 0 0 36 -3,-1.7 -1,-0.3 -4,-0.6 -2,-0.2 0.693 98.5 48.0 -68.0 -18.4 120.0 18.7 -4.5 958 989 A F G X S+ 0 0 117 -3,-1.7 3,-0.5 -4,-0.3 -1,-0.2 0.419 78.0 98.3-108.8 0.6 118.2 15.4 -4.0 959 990 A C T < S+ 0 0 13 -3,-1.0 4,-0.3 -4,-0.3 -1,-0.1 0.946 90.8 40.9 -51.8 -55.5 120.9 12.8 -4.8 960 991 A A T >> S+ 0 0 2 -4,-0.3 4,-1.9 1,-0.2 3,-1.8 0.675 88.9 98.5 -69.4 -18.8 121.7 12.2 -1.1 961 992 A F H <> S+ 0 0 73 -3,-0.5 4,-2.6 1,-0.3 3,-0.4 0.840 81.1 48.6 -42.7 -55.4 118.1 12.3 -0.0 962 993 A P H 3> S+ 0 0 70 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.849 114.7 49.1 -55.0 -30.6 117.6 8.5 0.1 963 994 A Y H <> S+ 0 0 3 -3,-1.8 4,-1.5 -4,-0.3 -2,-0.2 0.792 108.4 52.1 -77.5 -31.0 120.9 8.3 2.1 964 995 A S H X S+ 0 0 13 -4,-1.9 4,-1.9 -3,-0.4 -1,-0.2 0.922 113.0 44.6 -69.5 -44.2 119.8 11.1 4.5 965 996 A L H X S+ 0 0 101 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.899 108.5 56.7 -67.6 -39.5 116.5 9.2 5.2 966 997 A I H X S+ 0 0 32 -4,-1.9 4,-3.6 -5,-0.3 5,-0.2 0.907 106.4 51.6 -57.8 -40.4 118.2 5.8 5.6 967 998 A I H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 5,-0.3 0.972 109.1 49.4 -58.3 -56.4 120.4 7.4 8.3 968 999 A F H X S+ 0 0 50 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.921 118.0 40.5 -43.7 -54.6 117.4 8.7 10.2 969 1000 A L H X S+ 0 0 92 -4,-2.6 4,-3.4 2,-0.2 5,-0.2 0.917 111.7 54.8 -65.3 -48.8 115.7 5.2 10.0 970 1001 A Y H X S+ 0 0 32 -4,-3.6 4,-2.1 -5,-0.2 -1,-0.2 0.916 116.1 38.0 -51.7 -48.5 118.8 3.2 10.7 971 1002 A D H X S+ 0 0 1 -4,-2.6 4,-2.2 2,-0.2 5,-0.3 0.913 115.3 50.9 -75.6 -44.0 119.5 5.0 13.9 972 1003 A E H X S+ 0 0 21 -4,-2.5 4,-1.0 -5,-0.3 -2,-0.2 0.871 112.8 50.2 -56.4 -39.9 115.9 5.4 15.0 973 1004 A M H X S+ 0 0 114 -4,-3.4 4,-1.4 -5,-0.2 -2,-0.2 0.933 110.9 48.9 -56.8 -50.1 115.7 1.6 14.3 974 1005 A R H X S+ 0 0 10 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.803 110.5 47.0 -69.0 -35.1 118.8 0.9 16.4 975 1006 A R H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.718 105.2 60.9 -81.8 -22.5 117.8 3.0 19.5 976 1007 A F H X S+ 0 0 101 -4,-1.0 4,-1.6 -5,-0.3 -2,-0.2 0.880 108.3 45.5 -64.4 -39.3 114.5 1.3 19.4 977 1008 A I H X S+ 0 0 72 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.975 109.1 55.4 -61.5 -58.1 116.5 -1.8 19.9 978 1009 A I H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.867 109.8 45.6 -40.2 -52.4 118.6 -0.2 22.7 979 1010 A R H < S+ 0 0 41 -4,-2.2 -1,-0.2 -69,-0.2 -2,-0.2 0.941 111.9 49.5 -65.3 -52.5 115.6 0.7 24.7 980 1011 A R H < S+ 0 0 196 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.899 120.8 36.7 -49.8 -49.0 113.8 -2.7 24.4 981 1012 A S < + 0 0 52 -4,-2.6 6,-0.4 1,-0.2 -1,-0.3 -0.685 68.7 165.2-112.1 77.7 117.0 -4.6 25.4 982 1013 A P + 0 0 67 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.942 66.1 61.7 -54.4 -54.4 118.7 -2.4 28.1 983 1014 A G S S- 0 0 64 4,-0.1 -2,-0.1 5,-0.0 -5,-0.0 0.857 106.2 -6.1 -36.7 -75.0 121.0 -5.1 29.3 984 1015 A G S > S+ 0 0 25 3,-0.1 4,-2.3 4,-0.1 5,-0.2 0.841 93.2 26.8-104.4-104.6 123.3 -6.2 26.4 985 1016 A W H > S+ 0 0 88 1,-0.2 4,-1.1 2,-0.2 5,-0.2 0.775 109.3 31.9 -62.3 -68.3 124.2 -6.0 22.8 986 1017 A V H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.868 123.0 51.8 -57.1 -37.4 123.5 -2.8 20.8 987 1018 A E H > S+ 0 0 49 -6,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.909 110.2 45.3 -65.9 -45.3 123.9 -0.8 24.0 988 1019 A Q H < S+ 0 0 102 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.607 120.9 41.4 -77.8 -9.2 127.3 -2.2 24.9 989 1020 A E H < S+ 0 0 47 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.713 133.4 13.0-103.4 -29.3 128.5 -1.8 21.3 990 1021 A T H < S+ 0 0 10 -4,-2.2 2,-1.7 -5,-0.2 -3,-0.2 0.406 84.4 115.5-134.7 1.0 127.1 1.6 20.3 991 1022 A Y < 0 0 48 -4,-1.9 -173,-0.1 -5,-0.3 -174,-0.1 -0.491 360.0 360.0 -87.4 71.6 125.9 3.5 23.4 992 1023 A Y 0 0 16 -2,-1.7 -1,-0.1 -175,-0.4 -174,-0.1 0.428 360.0 360.0 31.9 360.0 128.2 6.5 23.6 993 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 994 28 B R 0 0 254 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 99.5 138.7 -5.3 22.1 995 29 B T - 0 0 67 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.519 360.0-129.8-126.6-164.2 136.6 -8.3 23.1 996 30 B G S S+ 0 0 55 -2,-0.2 0, 0.0 3,-0.0 0, 0.0 -0.941 82.0 6.2-159.1 137.4 136.8 -12.1 22.9 997 31 B S S S+ 0 0 131 -2,-0.3 -1,-0.0 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