==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGAND BINDING PROTEIN 09-MAR-08 3CHG . COMPND 2 MOLECULE: GLYCINE BETAINE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.H.J.SMITS,M.HOING,J.LECHER,M.JEBBAR,L.SCHMITT,E.BREMER . 1031 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 726 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 100 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 135 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 281 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.0 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 7 0 8 6 4 0 0 3 7 4 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 7 2 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 5 3 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 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 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 16 D K 0 0 132 0, 0.0 28,-0.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 69.2 34.4 -27.7 17.3 2 17 D T - 0 0 67 26,-0.2 51,-0.5 29,-0.0 2,-0.3 -0.952 360.0-131.1-146.2 159.6 31.2 -25.6 16.7 3 18 D I E -a 30 0A 6 26,-2.5 28,-2.1 -2,-0.3 2,-0.5 -0.900 17.9-136.7-110.9 150.7 27.7 -25.0 18.1 4 19 D I E +ab 31 54A 30 49,-3.4 51,-2.4 -2,-0.3 2,-0.1 -0.935 32.7 173.7-106.4 124.4 24.5 -24.9 16.0 5 20 D G - 0 0 0 26,-2.1 29,-0.3 -2,-0.5 2,-0.1 -0.444 24.2-117.6-116.3-172.0 22.1 -22.1 16.8 6 21 D I - 0 0 3 1,-0.3 27,-1.0 27,-0.2 -1,-0.1 -0.228 67.3 -10.2-112.4-155.8 18.9 -20.4 15.7 7 22 D D > - 0 0 23 25,-0.2 3,-1.6 -2,-0.1 -1,-0.3 -0.031 61.6-125.6 -51.1 138.2 17.9 -17.0 14.3 8 23 D P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.874 106.7 40.3 -47.1 -53.3 20.6 -14.2 14.5 9 24 D G T 3 S+ 0 0 37 4,-0.1 2,-0.2 182,-0.0 -2,-0.1 0.016 89.8 127.2 -94.2 28.0 18.6 -11.6 16.4 10 25 D S X> - 0 0 1 -3,-1.6 4,-1.3 -4,-0.1 3,-0.6 -0.577 68.3-117.8 -88.7 149.6 16.9 -14.1 18.8 11 26 D G T 34 S+ 0 0 2 1,-0.2 3,-0.5 -2,-0.2 4,-0.1 0.865 113.5 45.9 -47.0 -51.4 16.9 -13.8 22.6 12 27 D I T >> S+ 0 0 8 1,-0.2 3,-1.0 2,-0.2 4,-0.8 0.781 105.8 61.8 -67.4 -27.9 18.8 -17.0 23.3 13 28 D M H <> S+ 0 0 3 -3,-0.6 4,-1.1 1,-0.3 -1,-0.2 0.816 101.4 51.5 -69.4 -32.7 21.4 -16.2 20.6 14 29 D S H 3< S+ 0 0 64 -4,-1.3 4,-0.3 -3,-0.5 -1,-0.3 0.418 109.6 52.4 -83.4 -1.4 22.5 -13.1 22.5 15 30 D L H <> S+ 0 0 18 -3,-1.0 4,-0.9 -4,-0.1 -2,-0.2 0.507 100.9 57.9-110.3 -11.4 22.9 -15.3 25.6 16 31 D T H X S+ 0 0 1 -4,-0.8 4,-2.5 -3,-0.2 5,-0.2 0.846 102.2 57.9 -76.5 -38.3 25.1 -17.9 23.9 17 32 D D H X S+ 0 0 66 -4,-1.1 4,-0.6 1,-0.2 -2,-0.1 0.878 110.6 40.8 -55.6 -45.1 27.6 -15.0 23.1 18 33 D K H > S+ 0 0 89 -4,-0.3 4,-3.5 2,-0.2 -1,-0.2 0.804 112.7 55.5 -76.1 -30.4 27.9 -14.1 26.8 19 34 D A H X S+ 0 0 1 -4,-0.9 4,-1.8 2,-0.2 5,-0.3 0.870 102.5 55.8 -67.0 -37.3 28.0 -17.8 27.8 20 35 D M H X>S+ 0 0 36 -4,-2.5 5,-3.0 2,-0.2 4,-0.5 0.757 116.0 39.7 -62.3 -26.0 31.0 -18.3 25.4 21 36 D K H <5S+ 0 0 139 -4,-0.6 -2,-0.2 3,-0.2 -1,-0.2 0.883 112.9 52.8 -87.1 -48.7 32.6 -15.5 27.3 22 37 D D H <5S+ 0 0 52 -4,-3.5 -2,-0.2 1,-0.2 -3,-0.2 0.760 121.2 33.2 -55.8 -29.6 31.5 -16.6 30.8 23 38 D Y H <5S- 0 0 15 -4,-1.8 -1,-0.2 -5,-0.2 -3,-0.2 0.577 111.5-118.8-116.9 -18.6 32.8 -20.1 30.3 24 39 D D T <5 + 0 0 112 -4,-0.5 2,-0.7 -5,-0.3 -3,-0.2 0.916 51.4 160.2 102.2 53.3 35.7 -19.1 28.2 25 40 D L > < + 0 0 6 -5,-3.0 3,-0.5 1,-0.2 -1,-0.1 -0.502 9.7 141.6-124.8 51.7 35.0 -20.9 25.1 26 41 D N T 3 + 0 0 122 -2,-0.7 -1,-0.2 1,-0.3 -5,-0.0 0.343 58.8 62.7-113.8 -6.8 36.9 -19.3 22.4 27 42 D D T 3 S+ 0 0 92 2,-0.0 -1,-0.3 229,-0.0 2,-0.3 -0.001 98.7 94.7 -90.2 20.8 38.3 -21.7 19.9 28 43 D W < - 0 0 27 -3,-0.5 2,-0.3 -8,-0.1 -26,-0.2 -0.771 61.9-156.2-107.8 159.6 34.5 -22.2 19.5 29 44 D T - 0 0 82 -28,-0.3 -26,-2.5 -2,-0.3 2,-0.7 -0.999 12.6-137.0-142.9 135.4 32.0 -20.6 17.0 30 45 D L E -a 3 0A 21 -2,-0.3 2,-0.8 -28,-0.2 -26,-0.2 -0.826 18.3-145.9 -96.5 115.1 28.3 -20.0 17.1 31 46 D I E -a 4 0A 84 -28,-2.1 -26,-2.1 -2,-0.7 2,-0.6 -0.698 10.1-146.8 -84.8 107.5 26.5 -20.9 13.8 32 47 D S + 0 0 73 -2,-0.8 -25,-0.2 -28,-0.1 -26,-0.1 -0.644 42.2 136.9 -75.9 116.6 23.6 -18.4 13.2 33 48 D A - 0 0 27 -27,-1.0 2,-0.3 -2,-0.6 -27,-0.2 -0.046 49.7 -85.9-128.6-137.3 21.0 -20.4 11.4 34 49 D S >> - 0 0 70 -29,-0.3 4,-2.3 -27,-0.1 3,-0.7 -0.948 34.8-109.2-143.9 157.6 17.2 -20.9 11.4 35 50 D S H 3> S+ 0 0 16 -2,-0.3 4,-1.4 1,-0.2 5,-0.3 0.847 115.8 62.4 -54.8 -37.1 15.0 -23.3 13.3 36 51 D A H 34 S+ 0 0 85 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.857 113.0 31.9 -58.9 -41.3 14.4 -25.3 10.1 37 52 D A H <> S+ 0 0 47 -3,-0.7 4,-3.0 2,-0.2 5,-0.3 0.780 107.1 70.9 -90.6 -31.2 18.0 -26.2 9.7 38 53 D M H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.951 110.0 32.3 -45.7 -61.8 18.9 -26.4 13.4 39 54 D T H X S+ 0 0 10 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.661 113.4 63.1 -77.2 -19.3 16.9 -29.6 13.9 40 55 D A H > S+ 0 0 51 -4,-0.4 4,-1.7 -5,-0.3 3,-0.3 0.942 107.0 43.8 -63.3 -48.5 17.6 -30.8 10.3 41 56 D T H X S+ 0 0 49 -4,-3.0 4,-1.6 1,-0.2 -2,-0.2 0.787 108.5 59.6 -67.0 -30.2 21.3 -30.9 11.3 42 57 D L H X S+ 0 0 2 -4,-1.2 4,-3.1 -5,-0.3 5,-0.3 0.839 104.5 48.7 -66.5 -38.8 20.4 -32.6 14.6 43 58 D K H X S+ 0 0 120 -4,-1.5 4,-1.7 -3,-0.3 5,-0.2 0.909 108.4 55.5 -64.2 -44.1 18.8 -35.5 12.7 44 59 D K H < S+ 0 0 131 -4,-1.7 4,-0.2 1,-0.2 -2,-0.2 0.873 118.9 32.9 -52.8 -41.1 21.9 -35.7 10.6 45 60 D S H ><>S+ 0 0 13 -4,-1.6 5,-2.7 2,-0.2 3,-0.6 0.919 115.5 51.2 -85.8 -48.7 24.0 -36.1 13.8 46 61 D Y H ><5S+ 0 0 31 -4,-3.1 3,-1.0 1,-0.3 -3,-0.2 0.859 112.4 47.0 -63.4 -38.3 21.8 -38.0 16.2 47 62 D D T 3<5S+ 0 0 99 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.635 116.9 44.7 -81.9 -15.0 21.0 -40.8 13.8 48 63 D R T < 5S- 0 0 146 -3,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.081 112.3-123.4-107.1 19.3 24.7 -41.0 12.9 49 64 D K T < 5 + 0 0 133 -3,-1.0 -3,-0.2 1,-0.2 -2,-0.1 0.864 56.1 157.9 43.0 50.6 25.6 -40.9 16.6 50 65 D K < - 0 0 113 -5,-2.7 2,-0.2 1,-0.0 -1,-0.2 -0.798 49.1-101.4-104.0 147.4 27.8 -37.8 16.0 51 66 D P + 0 0 100 0, 0.0 2,-0.3 0, 0.0 191,-0.0 -0.494 52.1 165.8 -65.9 134.1 28.9 -35.2 18.6 52 67 D I - 0 0 8 -2,-0.2 2,-0.5 191,-0.1 -49,-0.1 -0.991 28.2-154.7-154.2 137.2 26.8 -32.0 18.3 53 68 D I + 0 0 13 -51,-0.5 -49,-3.4 -2,-0.3 2,-0.4 -0.978 21.8 179.7-119.2 124.0 26.1 -28.9 20.4 54 69 D I E -bC 4 241A 2 187,-3.4 187,-3.1 -2,-0.5 2,-1.4 -0.933 39.3-113.5-124.2 145.5 22.8 -27.0 19.9 55 70 D T E - C 0 240A 0 -51,-2.4 185,-0.2 -2,-0.4 2,-0.2 -0.662 54.8-176.7 -67.9 93.7 21.1 -24.0 21.3 56 71 D G E + C 0 239A 0 183,-2.5 183,-2.6 -2,-1.4 2,-0.3 -0.551 15.6 179.9 -97.6 163.4 18.3 -25.9 22.9 57 72 D W E - C 0 238A 14 181,-0.3 181,-0.3 -2,-0.2 -2,-0.0 -0.975 26.3 -97.2-158.2 150.2 15.2 -24.8 24.9 58 73 D T S S+ 0 0 13 179,-4.0 179,-0.1 -2,-0.3 2,-0.1 -0.960 97.8 47.6-116.0 135.7 12.3 -26.4 26.6 59 74 D P S S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 106,-0.3 0.372 84.4 128.4 -81.5 137.6 9.4 -26.8 25.5 60 75 D H > - 0 0 10 104,-0.1 3,-0.6 -2,-0.1 54,-0.1 -0.976 61.3-126.2-152.3 153.6 10.5 -28.3 22.2 61 76 D W T >> S+ 0 0 4 -2,-0.3 3,-1.2 1,-0.2 4,-0.9 0.701 98.9 76.9 -75.6 -21.2 9.6 -31.5 20.2 62 77 D M H 3> S+ 0 0 0 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.799 80.6 69.2 -62.7 -29.4 13.3 -32.6 19.8 63 78 D F H <4 S+ 0 0 61 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.179 105.8 43.7 -71.2 19.1 13.2 -33.8 23.5 64 79 D S H <4 S+ 0 0 31 -3,-1.2 -2,-0.2 3,-0.1 -1,-0.2 0.520 109.1 48.8-137.6 -28.7 10.9 -36.5 22.2 65 80 D R H < S+ 0 0 87 -4,-0.9 2,-0.3 -3,-0.2 -2,-0.2 0.816 125.7 21.7 -78.7 -34.1 12.3 -37.7 18.9 66 81 D Y S < S- 0 0 11 -4,-1.9 2,-0.7 178,-0.0 -1,-0.2 -0.903 83.9-109.3-130.1 158.1 15.7 -38.1 20.6 67 82 D K + 0 0 84 -2,-0.3 177,-2.2 -3,-0.1 2,-0.3 -0.812 51.6 172.6 -86.0 114.5 17.1 -38.5 24.1 68 83 D L E -D 243 0A 10 -2,-0.7 2,-0.3 175,-0.2 173,-0.0 -0.854 19.5-155.0-131.0 157.6 18.8 -35.2 24.9 69 84 D K E -D 242 0A 31 173,-2.2 173,-1.8 -2,-0.3 2,-0.2 -0.991 14.2-129.5-140.8 141.2 20.4 -33.4 27.8 70 85 D Y E -D 241 0A 59 -2,-0.3 2,-0.5 171,-0.2 171,-0.2 -0.567 30.5-118.0 -79.6 147.9 21.2 -29.8 29.1 71 86 D L - 0 0 11 169,-1.6 180,-0.3 -2,-0.2 169,-0.2 -0.786 38.9-105.1 -88.3 127.6 24.7 -28.9 30.2 72 87 D D B -e 251 0B 100 178,-1.5 180,-1.1 -2,-0.5 181,-0.2 0.017 30.1-145.2 -48.7 156.6 24.8 -27.9 33.8 73 88 D D + 0 0 38 1,-0.1 3,-0.4 178,-0.1 -1,-0.1 -0.836 34.3 155.8-136.2 96.4 25.2 -24.1 34.6 74 89 D P S S+ 0 0 30 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 0.912 85.1 48.4 -76.6 -49.8 27.1 -22.9 37.6 75 90 D K S S- 0 0 135 -56,-0.1 -53,-0.1 1,-0.0 -52,-0.0 -0.272 99.0-142.6 -84.7 56.9 27.9 -19.5 36.1 76 91 D Q + 0 0 54 -2,-1.3 4,-0.1 -3,-0.4 -3,-0.1 0.298 39.1 159.9 -34.1 92.2 24.3 -19.1 35.2 77 92 D S S S+ 0 0 3 1,-0.2 -1,-0.2 2,-0.1 -59,-0.1 0.844 72.3 43.5 -88.3 -35.4 24.8 -17.4 31.9 78 93 D Y S S- 0 0 4 1,-0.2 -1,-0.2 160,-0.1 -2,-0.1 0.705 108.5-125.3 -78.0 -22.2 21.4 -18.1 30.4 79 94 D G - 0 0 22 1,-0.1 159,-0.3 134,-0.1 -1,-0.2 -0.123 11.9-136.7 82.9 166.6 19.5 -17.3 33.6 80 95 D S S S+ 0 0 25 470,-0.2 472,-0.1 -4,-0.1 -1,-0.1 0.362 78.9 79.6-144.8 5.9 17.1 -19.8 35.1 81 96 D A + 0 0 17 470,-0.1 470,-0.2 154,-0.1 156,-0.1 -0.277 68.3 159.1-111.0 47.0 13.8 -18.2 36.2 82 97 D E B +F 236 0C 6 154,-0.5 154,-1.6 -3,-0.1 153,-1.0 -0.314 18.1 172.4 -87.0 151.8 12.2 -18.1 32.8 83 98 D E E -G 211 0D 29 128,-2.5 128,-3.2 151,-0.2 2,-0.3 -0.987 28.9-125.8-152.4 142.5 8.6 -17.8 31.5 84 99 D I E -G 210 0D 5 149,-0.4 149,-1.5 -2,-0.3 2,-0.3 -0.684 38.0-168.0 -86.8 149.1 6.8 -17.3 28.3 85 100 D H E -G 209 0D 16 124,-1.9 124,-1.4 -2,-0.3 2,-0.5 -0.881 25.8-124.2-144.3 157.6 4.4 -14.4 28.3 86 101 D T E - H 0 230D 0 144,-1.7 143,-1.5 -2,-0.3 144,-1.3 -0.939 32.4-179.6-110.7 120.8 1.6 -12.7 26.5 87 102 D I E -GH 206 228D 0 119,-2.1 119,-3.0 -2,-0.5 2,-0.3 -0.961 5.8-172.3-126.9 141.5 2.0 -9.0 25.5 88 103 D T E -GH 205 227D 0 139,-2.9 139,-2.4 -2,-0.4 117,-0.3 -0.817 31.8 -92.5-123.1 164.4 -0.2 -6.5 23.8 89 104 D R > - 0 0 40 115,-2.7 3,-1.2 -2,-0.3 4,-0.3 -0.272 58.5 -78.0 -69.3 162.3 0.2 -3.0 22.5 90 105 D K T 3 S+ 0 0 117 135,-0.5 -1,-0.1 108,-0.3 137,-0.1 -0.369 115.1 18.0 -64.8 138.3 -0.7 0.0 24.6 91 106 D G T 3> S+ 0 0 40 -3,-0.1 4,-1.0 135,-0.1 3,-0.4 0.655 89.1 118.5 76.6 18.8 -4.4 0.8 25.0 92 107 D F H <> + 0 0 0 -3,-1.2 4,-1.9 1,-0.2 8,-0.2 0.887 59.3 65.9 -77.8 -40.8 -5.5 -2.6 23.8 93 108 D S H 4 S+ 0 0 61 -4,-0.3 -1,-0.2 1,-0.2 -3,-0.1 0.542 111.1 36.3 -64.3 -4.8 -7.3 -3.8 26.9 94 109 D K H 4 S+ 0 0 181 -3,-0.4 -1,-0.2 2,-0.1 -2,-0.2 0.673 108.7 57.2-129.7 -36.0 -10.0 -1.1 26.4 95 110 D E H < S+ 0 0 107 -4,-1.0 -2,-0.2 1,-0.2 -3,-0.1 0.984 132.2 13.7 -49.7 -65.2 -10.4 -0.9 22.7 96 111 D Q S X S+ 0 0 26 -4,-1.9 4,-1.8 1,-0.1 -1,-0.2 -0.756 71.2 168.5-118.8 84.2 -11.3 -4.6 22.7 97 112 D P T 4 S+ 0 0 82 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.726 77.4 61.9 -66.8 -21.6 -11.9 -5.6 26.4 98 113 D N T >> S+ 0 0 37 2,-0.2 4,-0.9 1,-0.1 3,-0.8 0.968 106.8 39.5 -65.4 -57.4 -13.2 -8.9 25.1 99 114 D A H >> S+ 0 0 0 1,-0.3 4,-2.8 2,-0.2 3,-0.8 0.886 111.6 55.9 -63.8 -44.7 -10.0 -10.1 23.4 100 115 D A H 3X S+ 0 0 8 -4,-1.8 4,-0.8 1,-0.3 -1,-0.3 0.648 107.0 53.0 -64.4 -16.1 -7.6 -8.9 26.1 101 116 D K H <> S+ 0 0 63 -3,-0.8 4,-0.5 -4,-0.4 -1,-0.3 0.664 108.6 48.5 -90.9 -22.3 -9.7 -11.0 28.5 102 117 D L H X< S+ 0 0 0 -4,-0.9 3,-1.1 -3,-0.8 4,-0.3 0.948 113.5 47.7 -69.8 -53.8 -9.3 -14.1 26.3 103 118 D L H >< S+ 0 0 1 -4,-2.8 3,-1.1 1,-0.3 -2,-0.2 0.810 107.3 57.2 -53.7 -37.0 -5.5 -13.4 26.1 104 119 D S H 3< S+ 0 0 46 -4,-0.8 127,-0.3 1,-0.3 -1,-0.3 0.704 104.0 48.6 -83.3 -20.5 -5.2 -12.9 29.8 105 120 D Q T << S+ 0 0 43 -3,-1.1 2,-0.9 -4,-0.5 -1,-0.3 0.283 80.3 122.4 -99.5 7.6 -6.6 -16.2 30.9 106 121 D F < + 0 0 2 -3,-1.1 2,-0.4 -4,-0.3 125,-0.1 -0.636 30.8 151.3 -74.4 103.5 -4.4 -18.2 28.5 107 122 D K + 0 0 87 -2,-0.9 2,-0.3 33,-0.1 126,-0.2 -0.988 8.3 151.5-129.8 144.7 -2.3 -20.6 30.5 108 123 D W - 0 0 8 124,-2.1 2,-0.1 -2,-0.4 -2,-0.0 -0.970 31.8-109.7-170.7 164.5 -0.9 -24.0 29.4 109 124 D T > - 0 0 64 -2,-0.3 4,-1.3 124,-0.1 5,-0.2 -0.312 29.3-102.0-111.3 178.0 1.9 -26.4 30.0 110 125 D Q H > S+ 0 0 77 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.860 117.0 38.9 -74.5 -40.1 5.0 -27.7 28.3 111 126 D D H > S+ 0 0 81 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.772 108.4 62.8 -78.3 -28.5 3.7 -31.1 27.2 112 127 D E H 4 S+ 0 0 19 2,-0.2 4,-0.3 1,-0.2 -2,-0.2 0.783 110.0 41.4 -68.4 -30.3 0.2 -29.8 26.2 113 128 D M H >X S+ 0 0 2 -4,-1.3 3,-3.0 2,-0.2 4,-1.5 0.919 107.7 60.0 -73.8 -52.8 1.9 -27.6 23.6 114 129 D G H 3X S+ 0 0 10 -4,-1.7 4,-2.8 1,-0.3 5,-0.3 0.813 92.6 68.9 -49.7 -35.2 4.3 -30.3 22.5 115 130 D E H 3X S+ 0 0 16 -4,-1.8 4,-0.8 1,-0.2 -1,-0.3 0.882 107.7 37.3 -42.7 -44.3 1.3 -32.3 21.6 116 131 D I H <> S+ 0 0 4 -3,-3.0 4,-2.0 -4,-0.3 -2,-0.2 0.829 114.1 55.5 -84.4 -34.2 0.7 -29.8 18.8 117 132 D M H X S+ 0 0 5 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.870 104.8 51.8 -64.3 -43.1 4.4 -29.3 17.9 118 133 D I H X S+ 0 0 7 -4,-2.8 4,-1.1 2,-0.2 -1,-0.2 0.849 112.2 46.7 -66.7 -36.2 5.1 -33.0 17.3 119 134 D K H X>S+ 0 0 44 -4,-0.8 5,-1.8 -5,-0.3 4,-1.3 0.875 110.5 52.5 -70.8 -40.2 2.2 -33.2 14.9 120 135 D V H <5S+ 0 0 38 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.861 112.1 47.6 -64.3 -35.4 3.4 -30.0 13.2 121 136 D E H <5S+ 0 0 69 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.670 98.4 66.1 -79.3 -19.1 6.7 -31.7 12.9 122 137 D E H <5S- 0 0 101 -4,-1.1 -2,-0.2 -5,-0.1 -1,-0.2 0.867 128.8 -98.4 -52.4 -43.3 5.0 -34.8 11.6 123 138 D G T <5S+ 0 0 67 -4,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.436 78.5 137.1 130.0 22.1 4.2 -32.5 8.7 124 139 D E < - 0 0 77 -5,-1.8 -1,-0.2 1,-0.1 0, 0.0 -0.333 57.7 -99.7 -78.3 166.0 0.7 -31.5 9.4 125 140 D K > - 0 0 126 1,-0.1 4,-2.0 -2,-0.1 5,-0.3 -0.756 26.1-121.2-105.5 144.7 -0.6 -27.9 9.0 126 141 D P H > S+ 0 0 43 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.681 106.3 45.1 -67.3 -25.9 -0.9 -25.6 12.0 127 142 D A H > S+ 0 0 57 2,-0.2 4,-2.9 3,-0.1 5,-0.2 0.923 110.4 51.6 -80.7 -48.9 -4.6 -24.8 11.7 128 143 D K H > S+ 0 0 120 1,-0.2 4,-0.8 2,-0.2 -1,-0.1 0.885 113.3 46.5 -53.4 -42.6 -5.9 -28.3 11.1 129 144 D V H X S+ 0 0 6 -4,-2.0 4,-1.9 2,-0.2 3,-0.5 0.894 110.9 52.2 -69.8 -39.4 -3.9 -29.6 14.1 130 145 D A H X S+ 0 0 2 -4,-1.3 4,-2.2 -5,-0.3 -2,-0.2 0.909 104.4 56.6 -59.9 -44.2 -5.2 -26.6 16.3 131 146 D A H < S+ 0 0 32 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.763 108.0 49.3 -59.9 -26.8 -8.8 -27.5 15.3 132 147 D E H >X S+ 0 0 96 -4,-0.8 4,-1.0 -3,-0.5 3,-1.0 0.890 109.4 50.0 -76.8 -42.7 -8.1 -31.0 16.7 133 148 D Y H 3< S+ 0 0 6 -4,-1.9 4,-0.5 1,-0.3 -2,-0.2 0.804 103.3 59.5 -67.7 -31.0 -6.7 -29.7 20.0 134 149 D V T 3< S+ 0 0 15 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.695 110.2 46.1 -67.9 -18.4 -9.7 -27.3 20.5 135 150 D N T <4 S+ 0 0 97 -3,-1.0 -2,-0.2 -4,-0.3 3,-0.2 0.668 114.4 44.1 -95.5 -21.1 -11.8 -30.5 20.4 136 151 D K S < S+ 0 0 92 -4,-1.0 2,-1.0 1,-0.4 -3,-0.1 0.911 119.0 35.5 -87.0 -89.6 -9.8 -32.7 22.7 137 152 D H S S+ 0 0 24 -4,-0.5 -1,-0.4 1,-0.2 4,-0.2 -0.622 78.0 153.7 -53.4 100.3 -8.9 -30.5 25.6 138 153 D K + 0 0 117 -2,-1.0 4,-0.3 -3,-0.2 -1,-0.2 0.269 60.7 55.6-128.1 5.6 -12.2 -28.7 25.5 139 154 D D S S+ 0 0 64 2,-0.1 -2,-0.1 3,-0.1 -1,-0.0 0.249 101.1 58.1-122.9 6.2 -12.6 -27.5 29.1 140 155 D Q S >> S+ 0 0 5 2,-0.1 4,-3.2 3,-0.1 3,-0.6 0.738 108.0 48.8 -83.8 -42.0 -9.3 -25.7 29.1 141 156 D I H 3> S+ 0 0 23 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.921 103.8 58.7 -58.7 -46.1 -10.6 -23.7 26.2 142 157 D A H 34 S+ 0 0 58 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.751 113.6 40.0 -58.7 -23.9 -13.9 -23.0 28.0 143 158 D E H X4 S+ 0 0 50 -3,-0.6 3,-1.9 2,-0.2 -2,-0.2 0.857 105.6 61.3 -90.4 -45.8 -11.7 -21.4 30.7 144 159 D W H 3< S+ 0 0 5 -4,-3.2 -39,-0.4 1,-0.3 -2,-0.2 0.755 122.0 30.2 -41.9 -24.8 -9.3 -19.7 28.3 145 160 D T T >< S+ 0 0 23 -4,-1.3 3,-1.8 -5,-0.2 2,-0.6 0.005 77.5 145.9-135.9 25.8 -12.6 -18.0 27.3 146 161 D K T < S+ 0 0 95 -3,-1.9 3,-0.1 1,-0.3 -3,-0.1 -0.591 85.6 10.6 -66.3 112.2 -14.8 -17.9 30.4 147 162 D G T 3 S+ 0 0 50 -2,-0.6 2,-0.7 1,-0.2 -1,-0.3 0.665 94.8 129.1 89.7 19.8 -16.7 -14.6 29.9 148 163 D V < - 0 0 16 -3,-1.8 2,-0.3 -47,-0.1 -1,-0.2 -0.904 46.6-152.4-109.6 103.7 -15.6 -14.0 26.3 149 164 D Q - 0 0 162 -2,-0.7 31,-0.1 1,-0.1 -3,-0.0 -0.577 28.6 -98.2 -78.9 133.1 -18.6 -13.4 24.1 150 165 D K - 0 0 162 -2,-0.3 31,-0.2 1,-0.1 2,-0.2 -0.185 45.6-141.2 -48.3 135.0 -18.5 -14.3 20.4 151 166 D V - 0 0 22 29,-3.7 2,-0.5 3,-0.1 -1,-0.1 -0.527 14.2-117.2-105.9 168.7 -17.6 -11.2 18.3 152 167 D K S S- 0 0 206 -2,-0.2 29,-0.1 1,-0.1 30,-0.1 -0.387 74.8 -68.5-104.6 53.9 -18.7 -9.9 14.9 153 168 D G + 0 0 40 -2,-0.5 2,-0.3 1,-0.2 29,-0.2 0.889 70.0 166.3 59.0 43.6 -15.5 -10.1 13.0 154 169 D D - 0 0 94 1,-0.0 29,-1.6 0, 0.0 2,-0.3 -0.642 42.4-114.8 -59.6 141.6 -13.5 -7.4 14.7 155 170 D K E -j 183 0E 142 -2,-0.3 2,-0.4 27,-0.2 29,-0.2 -0.682 29.9-166.3 -92.9 144.0 -10.0 -8.1 13.4 156 171 D I E -j 184 0E 2 27,-2.6 29,-1.2 -2,-0.3 2,-0.5 -0.997 11.4-143.3-132.1 132.1 -7.1 -9.2 15.7 157 172 D N E -j 185 0E 25 -2,-0.4 48,-2.0 27,-0.2 2,-0.5 -0.837 11.6-172.4-100.4 124.2 -3.4 -9.2 14.7 158 173 D L B -i 205 0D 1 27,-2.0 2,-0.3 -2,-0.5 48,-0.2 -0.742 7.4-177.6-117.1 79.4 -1.2 -12.0 16.0 159 174 D A + 0 0 2 46,-0.9 48,-0.3 -2,-0.5 2,-0.3 -0.623 16.3 164.3 -72.5 133.6 2.4 -11.1 15.2 160 175 D Y B -k 188 0F 24 27,-1.6 29,-2.3 -2,-0.3 2,-0.4 -0.906 40.5-115.0-141.4 168.4 4.7 -13.9 16.2 161 176 D V - 0 0 7 -2,-0.3 2,-1.8 27,-0.2 5,-0.1 -0.948 37.0-119.8-107.6 136.8 8.3 -15.2 15.8 162 177 D A + 0 0 29 27,-0.5 2,-0.3 -2,-0.4 -127,-0.1 -0.240 58.6 140.6 -83.3 51.0 8.3 -18.7 14.1 163 178 D W > - 0 0 13 -2,-1.8 3,-1.0 1,-0.1 -2,-0.1 -0.703 67.2-108.7 -78.8 144.7 10.1 -20.8 16.7 164 179 D D G > S+ 0 0 24 -2,-0.3 3,-2.4 1,-0.3 4,-0.5 0.872 118.9 52.1 -43.1 -57.2 8.4 -24.2 16.9 165 180 D S G >> S+ 0 0 0 1,-0.3 3,-1.2 -106,-0.3 4,-0.8 0.852 107.5 53.2 -46.0 -45.1 6.7 -23.5 20.3 166 181 D E G <4 S+ 0 0 1 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.107 100.7 59.3 -89.7 21.8 5.3 -20.3 19.0 167 182 D I G <4 S+ 0 0 36 -3,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.286 106.6 50.1-111.9 -1.3 3.7 -21.9 16.0 168 183 D A T <4 S+ 0 0 1 -3,-1.2 4,-0.2 -4,-0.5 -2,-0.2 0.618 119.9 32.9-102.2 -21.9 1.7 -24.1 18.5 169 184 D S S < S+ 0 0 5 -4,-0.8 4,-0.3 2,-0.1 5,-0.2 0.783 113.8 55.2-102.9 -39.5 0.5 -21.2 20.6 170 185 D T S > S+ 0 0 0 1,-0.2 4,-1.2 -5,-0.2 3,-0.2 0.802 115.7 42.0 -65.4 -27.5 0.0 -18.4 18.1 171 186 D N H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.706 105.2 60.9 -92.5 -24.2 -2.2 -20.7 16.1 172 187 D V H > S+ 0 0 1 2,-0.3 4,-0.7 -4,-0.2 -1,-0.2 0.411 118.3 32.4 -79.5 2.2 -4.2 -22.3 18.9 173 188 D I H > S+ 0 0 1 -4,-0.3 4,-0.7 -3,-0.2 -2,-0.2 0.468 107.8 69.2-144.6 -24.2 -5.4 -18.7 19.8 174 189 D G H X S+ 0 0 5 -4,-1.2 4,-2.3 -5,-0.2 -2,-0.3 0.954 113.9 26.4 3.9 -95.6 -5.2 -18.2 16.4 175 190 D K H X S+ 0 0 38 -4,-2.4 4,-4.4 2,-0.2 5,-0.2 0.907 115.9 57.8 -80.4 -46.0 -8.2 -20.6 16.3 176 191 D V H < S+ 0 0 3 -4,-0.7 -1,-0.2 2,-0.2 -3,-0.2 0.865 113.8 44.9 -53.2 -38.7 -9.8 -20.2 19.8 177 192 D L H ><>S+ 0 0 1 -4,-0.7 3,-2.9 2,-0.2 5,-0.7 0.991 113.6 47.7 -62.6 -67.1 -10.1 -16.5 18.8 178 193 D E H ><5S+ 0 0 98 -4,-2.3 3,-2.9 1,-0.3 -2,-0.2 0.891 96.9 72.6 -33.2 -54.8 -11.4 -17.2 15.3 179 194 D D T 3<5S+ 0 0 69 -4,-4.4 -1,-0.3 1,-0.3 -2,-0.2 0.613 99.0 51.4 -45.3 -9.6 -13.8 -19.7 16.8 180 195 D L T < 5S- 0 0 29 -3,-2.9 -29,-3.7 -5,-0.2 -1,-0.3 0.042 127.8 -87.4-124.4 23.7 -15.6 -16.6 18.0 181 196 D G T < 5S+ 0 0 35 -3,-2.9 -3,-0.2 1,-0.3 -2,-0.1 0.013 81.6 135.1 99.7 -29.2 -16.0 -14.5 14.9 182 197 D Y < - 0 0 11 -5,-0.7 2,-0.4 -29,-0.2 -1,-0.3 -0.211 53.4-130.2 -51.6 137.7 -12.7 -12.6 15.1 183 198 D E E -j 155 0E 88 -29,-1.6 -27,-2.6 -3,-0.1 2,-0.5 -0.833 27.4-152.2 -93.1 134.8 -10.8 -12.3 11.8 184 199 D V E +j 156 0E 33 -2,-0.4 2,-0.3 -29,-0.2 -27,-0.2 -0.926 24.0 172.9-118.3 125.7 -7.1 -13.4 12.1 185 200 D T E -j 157 0E 79 -29,-1.2 -27,-2.0 -2,-0.5 2,-0.5 -0.988 19.8-153.8-133.6 150.2 -3.9 -12.5 10.3 186 201 D L - 0 0 50 -2,-0.3 2,-0.4 -29,-0.2 -27,-0.2 -0.795 6.3-149.7-143.8 70.9 -0.9 -13.8 11.7 187 202 D T - 0 0 60 -2,-0.5 -27,-1.6 1,-0.1 2,-0.5 -0.353 2.8-149.0 -92.3 112.7 2.2 -11.9 11.0 188 203 D Q B +k 160 0F 141 -2,-0.4 2,-0.3 -29,-0.2 -27,-0.2 -0.564 34.4 151.4 -80.7 117.8 5.6 -13.7 10.8 189 204 D V - 0 0 41 -29,-2.3 -27,-0.5 -2,-0.5 2,-0.2 -0.854 44.3 -95.3-137.6 169.0 8.5 -11.5 11.9 190 205 D E > - 0 0 135 -2,-0.3 4,-2.3 -29,-0.1 2,-0.3 -0.577 49.3 -95.1 -80.4 149.1 11.9 -11.6 13.5 191 206 D A T 4 S+ 0 0 4 -2,-0.2 -1,-0.1 2,-0.2 -182,-0.0 -0.573 118.1 37.6 -61.4 125.6 12.5 -11.2 17.2 192 207 D G T > S+ 0 0 12 -2,-0.3 4,-2.2 -3,-0.0 -1,-0.2 -0.767 114.9 50.1 118.7 -88.2 13.3 -7.5 17.4 193 208 D P H > S+ 0 0 64 0, 0.0 4,-3.0 0, 0.0 -2,-0.2 0.805 104.9 66.0 -50.7 -31.3 10.8 -6.2 14.8 194 209 D M H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -3,-0.1 0.982 104.1 40.4 -53.0 -61.8 8.3 -8.3 16.7 195 210 D W H > S+ 0 0 2 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.907 114.8 54.0 -53.9 -47.9 8.7 -6.1 19.8 196 211 D T H X S+ 0 0 48 -4,-2.2 4,-2.3 1,-0.2 5,-0.4 0.934 104.0 54.3 -50.3 -55.0 8.7 -3.0 17.7 197 212 D A H X>S+ 0 0 10 -4,-3.0 5,-1.7 1,-0.2 4,-1.2 0.871 113.9 42.9 -49.8 -43.9 5.5 -3.9 15.9 198 213 D I H <5S+ 0 0 1 -4,-1.7 -108,-0.3 3,-0.2 3,-0.3 0.974 114.9 47.1 -65.4 -57.2 3.8 -4.2 19.3 199 214 D A H <5S+ 0 0 23 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.684 120.5 38.3 -64.2 -21.7 5.3 -1.1 20.9 200 215 D T H <5S- 0 0 100 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.602 115.1-115.5-104.0 -19.4 4.5 1.1 17.9 201 216 D G T <5S+ 0 0 33 -4,-1.2 -3,-0.2 -5,-0.4 -4,-0.1 0.614 74.8 129.7 99.3 17.1 1.2 -0.6 17.3 202 217 D S S -G 84 0D 9 -2,-0.5 5,-2.8 -126,-0.2 -126,-0.2 -0.937 43.3-132.1-111.8 105.5 10.4 -15.3 26.9 211 226 D L E 5 -G 83 0D 11 -128,-3.2 -128,-2.5 -2,-0.6 -2,-0.0 -0.832 46.1 -0.3-131.7 164.3 11.1 -13.2 30.0 212 227 D P T 5S+ 0 0 72 0, 0.0 -1,-0.2 0, 0.0 -130,-0.1 -0.667 131.0 7.6-120.2 49.4 12.4 -11.7 32.2 213 228 D N T > 5S+ 0 0 35 -3,-0.2 3,-0.7 -130,-0.1 4,-0.4 0.412 116.0 62.3-150.3 -62.6 15.8 -12.5 30.8 214 229 D T T 3 5S+ 0 0 10 1,-0.3 3,-0.3 2,-0.1 -3,-0.2 0.921 125.0 22.3 -47.5 -53.7 15.7 -14.2 27.4 215 230 D H T >> + 0 0 115 -3,-0.7 4,-1.9 -6,-0.2 5,-0.3 0.744 62.7 62.7 -25.6 -52.8 15.3 -8.8 28.4 217 232 D A H 3> S+ 0 0 71 -4,-0.4 4,-1.1 -3,-0.3 -1,-0.2 0.900 107.5 39.4 -53.8 -51.4 17.0 -6.4 26.0 218 233 D Y H <> S+ 0 0 39 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-51.7 39.7 319 75 A H > - 0 0 10 -2,-0.1 3,-1.6 104,-0.1 4,-0.4 -0.854 63.2-127.6-167.5 129.4 8.7 -50.0 36.3 320 76 A W T >> S+ 0 0 5 1,-0.3 4,-1.3 -2,-0.3 3,-0.6 0.635 98.4 87.0 -52.0 -17.6 10.5 -46.7 35.4 321 77 A M H >> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 3,-0.5 0.907 83.6 50.7 -44.5 -53.7 7.2 -46.1 33.5 322 78 A F H <4 S+ 0 0 60 -3,-1.6 5,-0.3 1,-0.2 -1,-0.2 0.705 108.7 51.5 -70.3 -22.1 5.4 -44.5 36.5 323 79 A S H <4 S+ 0 0 26 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.763 117.7 37.7 -81.2 -27.9 8.3 -42.1 37.3 324 80 A R H << S+ 0 0 103 -4,-1.3 2,-0.3 -3,-0.5 -2,-0.2 0.750 121.3 37.2 -97.5 -28.9 8.4 -40.8 33.7 325 81 A Y S < S- 0 0 20 -4,-2.6 2,-0.9 -5,-0.2 -1,-0.1 -0.942 83.4-115.0-123.2 147.4 4.7 -40.7 32.7 326 82 A K + 0 0 87 -2,-0.3 177,-2.6 -3,-0.1 178,-0.3 -0.727 57.3 163.6 -79.9 103.8 1.7 -39.8 34.8 327 83 A L E -O 502 0G 16 -2,-0.9 2,-0.3 -5,-0.3 173,-0.0 -0.802 25.2-163.4-129.5 162.4 -0.1 -43.2 34.9 328 84 A K E -O 501 0G 28 173,-2.2 173,-2.5 -2,-0.3 2,-0.1 -0.999 17.2-129.5-147.6 146.6 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69.3-173.4 -5.0 -61.9 41.7 339 95 A S S S+ 0 0 47 1,-0.2 133,-0.2 -3,-0.1 157,-0.0 -0.986 83.2 13.3-140.4 147.8 -3.8 -60.4 45.0 340 96 A A - 0 0 29 -2,-0.3 2,-0.2 1,-0.1 -1,-0.2 0.962 69.8-171.3 58.8 67.4 -0.5 -59.9 47.0 341 97 A E E -Q 495 0I 4 154,-0.7 154,-2.4 -3,-0.1 2,-0.3 -0.528 4.2-169.8 -92.7 156.1 2.2 -60.7 44.4 342 98 A E E - R 0 470I 45 128,-2.2 128,-2.0 152,-0.2 2,-0.4 -0.934 23.5-122.8-137.9 157.8 5.9 -61.1 45.1 343 99 A I E -QR 492 469I 2 149,-2.3 149,-0.8 -2,-0.3 148,-0.8 -0.858 37.5-159.8 -98.1 144.3 9.3 -61.5 43.3 344 100 A H E -QR 490 468I 19 124,-3.2 124,-1.2 -2,-0.4 2,-0.5 -0.919 21.3-133.7-131.7 150.8 11.2 -64.6 44.2 345 101 A T E -Q 489 0I 0 144,-3.4 143,-1.4 -2,-0.3 144,-1.2 -0.910 32.5-176.3-101.5 123.4 14.7 -66.1 44.1 346 102 A I E -QR 487 465I 0 119,-3.0 119,-2.1 -2,-0.5 2,-0.3 -0.942 7.6-172.4-127.8 144.5 14.8 -69.6 42.7 347 103 A T E -QR 486 464I 1 139,-2.0 139,-3.6 -2,-0.4 117,-0.2 -0.928 30.6 -96.9-134.5 155.3 17.6 -72.2 42.3 348 104 A R E > -Q 485 0I 50 115,-2.2 3,-1.6 -2,-0.3 4,-0.2 -0.197 63.1 -70.4 -64.0 162.1 18.1 -75.6 40.7 349 105 A K T 3 S+ 0 0 122 135,-0.5 -1,-0.2 108,-0.5 135,-0.0 -0.307 118.4 8.5 -56.9 132.9 17.8 -78.7 42.8 350 106 A G T >> S+ 0 0 29 -3,-0.1 4,-0.9 1,-0.1 3,-0.7 0.523 83.8 132.2 76.9 8.4 20.6 -79.3 45.3 351 107 A F H <> + 0 0 0 -3,-1.6 4,-2.0 1,-0.2 3,-0.4 0.850 66.9 59.8 -60.3 -37.6 22.1 -75.8 44.7 352 108 A S H 34 S+ 0 0 57 -4,-0.2 -1,-0.2 1,-0.2 7,-0.2 0.859 100.6 57.1 -56.3 -37.9 22.4 -75.1 48.4 353 109 A K H <4 S+ 0 0 186 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.851 113.7 34.7 -64.2 -37.6 24.7 -78.2 48.8 354 110 A E H < S+ 0 0 117 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.791 132.3 23.0 -95.7 -34.1 27.4 -77.1 46.3 355 111 A Q X + 0 0 31 -4,-2.0 4,-1.8 1,-0.1 -1,-0.2 -0.512 65.2 158.8-130.1 67.2 27.5 -73.3 46.7 356 112 A P H > S+ 0 0 83 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.650 76.9 56.7 -67.4 -14.3 26.1 -72.7 50.3 357 113 A N H > S+ 0 0 22 2,-0.2 4,-1.5 3,-0.1 5,-0.1 0.941 108.2 42.8 -75.2 -54.4 27.8 -69.3 50.2 358 114 A A H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.737 114.9 53.7 -65.9 -25.2 26.2 -68.0 47.0 359 115 A A H X S+ 0 0 8 -4,-1.8 4,-4.4 2,-0.2 5,-0.3 0.958 107.4 48.1 -68.8 -54.6 22.9 -69.4 48.3 360 116 A K H < S+ 0 0 82 -4,-1.5 4,-0.4 1,-0.2 -2,-0.2 0.745 111.8 52.4 -60.5 -26.1 23.1 -67.5 51.6 361 117 A L H >< S+ 0 0 1 -4,-1.5 3,-0.9 2,-0.1 -1,-0.2 0.970 117.1 37.0 -68.3 -57.1 23.9 -64.4 49.6 362 118 A L H >< S+ 0 0 0 -4,-2.0 3,-3.3 1,-0.2 -2,-0.2 0.936 108.5 62.5 -58.3 -52.9 20.9 -64.9 47.4 363 119 A S T 3< S+ 0 0 47 -4,-4.4 127,-0.3 1,-0.3 -1,-0.2 0.704 110.3 43.1 -49.6 -21.1 18.6 -66.2 50.2 364 120 A Q T < S+ 0 0 70 -3,-0.9 2,-0.4 -4,-0.4 -1,-0.3 0.232 81.8 125.9-113.1 10.6 19.1 -62.8 51.9 365 121 A F < + 0 0 2 -3,-3.3 2,-0.3 39,-0.0 -20,-0.1 -0.613 33.6 157.2 -76.2 128.2 18.7 -60.5 48.8 366 122 A K + 0 0 108 -2,-0.4 2,-0.2 33,-0.1 126,-0.2 -0.977 9.7 150.1-152.6 146.4 16.1 -57.9 49.4 367 123 A W - 0 0 12 124,-2.2 2,-0.1 -2,-0.3 -2,-0.0 -0.871 33.2-114.9-177.8 155.6 15.0 -54.4 48.1 368 124 A T >> - 0 0 75 -2,-0.2 4,-1.0 124,-0.1 3,-0.9 -0.356 36.1-106.9 -87.5 170.2 12.1 -52.0 47.6 369 125 A Q H 3> S+ 0 0 66 1,-0.2 4,-2.1 2,-0.2 3,-0.3 0.864 114.3 67.6 -63.0 -38.3 10.7 -50.6 44.3 370 126 A D H 3> S+ 0 0 52 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.717 103.9 42.8 -53.4 -29.2 12.2 -47.2 45.0 371 127 A E H <> S+ 0 0 23 -3,-0.9 4,-0.7 2,-0.2 -1,-0.2 0.726 109.8 53.6 -95.7 -29.0 15.8 -48.5 44.7 372 128 A M H X S+ 0 0 1 -4,-1.0 4,-3.0 -3,-0.3 3,-0.3 0.794 101.1 63.9 -71.9 -30.9 15.2 -50.6 41.6 373 129 A G H X S+ 0 0 12 -4,-2.1 4,-3.2 1,-0.2 5,-0.4 0.930 93.9 61.6 -54.2 -49.4 13.8 -47.4 40.0 374 130 A E H X S+ 0 0 15 -4,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.863 113.6 34.0 -36.6 -53.1 17.3 -46.0 40.4 375 131 A I H X S+ 0 0 4 -4,-0.7 4,-3.2 -3,-0.3 5,-0.3 0.902 115.7 54.7 -79.6 -44.7 18.7 -48.7 38.1 376 132 A M H X S+ 0 0 5 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.895 112.3 44.5 -56.5 -45.5 15.7 -49.0 35.8 377 133 A I H X S+ 0 0 3 -4,-3.2 4,-2.2 2,-0.2 -1,-0.2 0.941 113.9 49.2 -64.5 -49.5 15.7 -45.3 35.0 378 134 A K H X>S+ 0 0 43 -4,-1.5 5,-1.8 -5,-0.4 4,-0.8 0.904 114.6 45.0 -57.4 -44.8 19.5 -45.2 34.5 379 135 A V H ><5S+ 0 0 38 -4,-3.2 3,-0.7 1,-0.2 -1,-0.2 0.883 112.3 52.5 -64.9 -39.9 19.3 -48.2 32.2 380 136 A E H 3<5S+ 0 0 46 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.784 100.1 62.7 -65.6 -29.4 16.3 -46.6 30.5 381 137 A E H 3<5S- 0 0 47 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.812 130.0 -97.5 -61.2 -32.2 18.5 -43.4 30.0 382 138 A G T <<5S+ 0 0 36 -4,-0.8 2,-0.5 -3,-0.7 -3,-0.2 0.487 77.9 140.0 123.0 16.5 20.7 -45.6 27.9 383 139 A E < - 0 0 66 -5,-1.8 -1,-0.2 1,-0.1 5,-0.1 -0.813 61.4 -99.2-103.4 124.7 23.4 -46.6 30.4 384 140 A K - 0 0 136 -2,-0.5 5,-0.1 1,-0.1 -1,-0.1 0.007 25.7-146.8 -42.9 127.5 24.9 -50.1 30.6 385 141 A P S >> S+ 0 0 36 0, 0.0 4,-1.6 0, 0.0 3,-0.8 0.817 92.5 58.8 -70.4 -33.3 23.2 -52.2 33.3 386 142 A A T 34 S+ 0 0 39 1,-0.2 -2,-0.1 2,-0.2 4,-0.1 0.896 116.1 32.9 -64.6 -42.3 26.3 -54.2 34.2 387 143 A K T 34 S+ 0 0 138 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.028 112.9 59.8-110.0 24.7 28.4 -51.2 35.1 388 144 A V T <> S+ 0 0 10 -3,-0.8 4,-1.6 -5,-0.1 3,-0.3 0.543 94.5 65.3-103.8 -29.2 25.6 -49.0 36.5 389 145 A A H X S+ 0 0 0 -4,-1.6 4,-1.0 1,-0.2 -2,-0.2 0.618 95.8 60.7 -65.4 -14.0 25.0 -51.7 39.1 390 146 A A H > S+ 0 0 26 2,-0.2 4,-1.4 3,-0.1 -1,-0.2 0.911 98.3 53.7 -75.0 -47.4 28.4 -50.8 40.3 391 147 A E H >> S+ 0 0 92 -3,-0.3 4,-2.5 1,-0.3 3,-0.6 0.907 106.6 54.3 -53.8 -43.4 27.4 -47.2 41.0 392 148 A Y H 3X S+ 0 0 4 -4,-1.6 4,-2.9 1,-0.3 -1,-0.3 0.908 104.4 53.2 -55.0 -46.5 24.6 -48.6 43.1 393 149 A V H 3< S+ 0 0 26 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.749 115.1 42.3 -65.3 -24.4 27.0 -50.6 45.2 394 150 A N H << S+ 0 0 119 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.742 116.3 46.4 -91.9 -27.6 29.0 -47.4 45.8 395 151 A K H < S+ 0 0 89 -4,-2.5 2,-0.2 -5,-0.2 -2,-0.2 0.961 119.0 42.0 -74.1 -57.6 25.9 -45.2 46.5 396 152 A H < + 0 0 36 -4,-2.9 0, 0.0 -5,-0.2 0, 0.0 -0.602 62.8 153.6 -80.9 149.9 24.3 -47.7 48.8 397 153 A K > + 0 0 144 -2,-0.2 4,-1.6 3,-0.0 5,-0.2 0.443 64.9 61.0-143.7 -46.2 26.6 -49.5 51.3 398 154 A D H > S+ 0 0 92 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.874 107.6 52.9 -50.2 -39.6 24.6 -50.6 54.4 399 155 A Q H > S+ 0 0 16 2,-0.2 4,-3.6 1,-0.2 -1,-0.2 0.909 106.4 47.4 -68.4 -48.1 22.5 -52.7 52.0 400 156 A I H > S+ 0 0 22 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.734 110.1 56.5 -70.1 -21.8 25.4 -54.6 50.3 401 157 A A H < S+ 0 0 57 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.875 113.2 39.5 -68.7 -42.1 26.7 -55.2 53.8 402 158 A E H >< S+ 0 0 107 -4,-1.6 3,-1.4 2,-0.2 -2,-0.2 0.888 112.3 56.1 -74.1 -42.7 23.3 -56.8 54.7 403 159 A W H 3< S+ 0 0 6 -4,-3.6 -39,-0.2 1,-0.3 -2,-0.2 0.891 119.9 32.3 -52.4 -43.2 23.1 -58.5 51.3 404 160 A T T >< S+ 0 0 31 -4,-1.4 3,-1.3 -5,-0.2 2,-0.3 -0.173 82.6 148.7-114.1 38.2 26.4 -60.2 52.0 405 161 A K T < S+ 0 0 83 -3,-1.4 3,-0.1 1,-0.2 -3,-0.1 -0.594 79.2 4.6 -69.6 128.8 26.3 -60.6 55.8 406 162 A G T 3 S+ 0 0 55 -2,-0.3 2,-0.7 1,-0.2 -1,-0.2 0.689 98.2 145.2 70.4 22.0 28.3 -63.7 56.8 407 163 A V < - 0 0 24 -3,-1.3 2,-0.4 -47,-0.1 -1,-0.2 -0.826 41.6-146.0-107.5 108.1 29.4 -64.2 53.2 408 164 A Q - 0 0 153 -2,-0.7 31,-0.0 -3,-0.1 -51,-0.0 -0.555 20.2-121.6 -73.0 120.5 32.9 -65.5 52.6 409 165 A K - 0 0 159 -2,-0.4 2,-0.2 1,-0.1 31,-0.2 -0.312 36.9-146.2 -55.9 140.6 34.6 -64.2 49.4 410 166 A V - 0 0 27 29,-3.2 2,-0.6 3,-0.1 -1,-0.1 -0.658 11.4-125.0-114.7 167.3 35.5 -67.1 47.1 411 167 A K S S- 0 0 189 -2,-0.2 2,-0.4 29,-0.1 30,-0.1 -0.967 81.2 -29.0-113.2 115.2 38.2 -68.2 44.7 412 168 A G S S+ 0 0 35 -2,-0.6 30,-0.4 28,-0.3 28,-0.1 -0.007 79.4 156.8 86.2 -27.4 37.1 -69.2 41.1 413 169 A D - 0 0 65 -2,-0.4 29,-1.4 28,-0.1 -1,-0.2 0.034 28.9-146.2 -47.5 129.4 33.5 -70.5 41.7 414 170 A K E +s 442 0I 125 27,-0.2 29,-0.1 29,-0.0 2,-0.1 -0.379 21.8 168.7 -84.9 172.3 31.1 -70.4 38.7 415 171 A I E -s 443 0I 3 27,-0.6 29,-0.8 -2,-0.1 2,-0.7 -0.396 25.2-140.8 172.9 105.8 27.4 -69.8 38.8 416 172 A N E -s 444 0I 25 27,-0.1 47,-1.9 -2,-0.1 48,-1.8 -0.667 15.5-158.1 -83.3 110.4 25.0 -69.1 35.9 417 173 A L E -st 445 464I 1 27,-1.9 29,-2.9 -2,-0.7 2,-0.4 -0.746 7.6-158.5 -84.5 131.1 22.3 -66.5 36.7 418 174 A A E +st 446 465I 0 46,-2.7 48,-0.7 -2,-0.4 2,-0.3 -0.901 16.7 165.8-111.0 139.5 19.2 -66.6 34.5 419 175 A Y E -s 447 0I 30 27,-1.9 29,-2.2 -2,-0.4 2,-0.4 -0.932 33.2-122.3-138.9 166.0 16.8 -63.7 33.9 420 176 A V - 0 0 6 -2,-0.3 2,-3.3 27,-0.2 5,-0.2 -0.913 42.2-103.3-107.2 144.6 14.0 -62.8 31.5 421 177 A A S S+ 0 0 44 -2,-0.4 2,-0.4 27,-0.3 -126,-0.1 -0.108 76.3 129.1 -70.5 48.0 14.4 -59.5 29.6 422 178 A W >> - 0 0 12 -2,-3.3 4,-1.3 1,-0.1 3,-0.8 -0.828 65.0-127.4 -94.0 141.3 12.0 -57.5 31.8 423 179 A D H >> S+ 0 0 29 -2,-0.4 4,-2.9 1,-0.3 3,-1.0 0.932 110.1 54.8 -57.7 -49.3 13.6 -54.2 33.0 424 180 A S H 3> S+ 0 0 0 1,-0.3 4,-1.8 -106,-0.3 -1,-0.3 0.806 118.7 36.6 -51.2 -32.8 12.7 -55.0 36.6 425 181 A E H <> S+ 0 0 0 -3,-0.8 4,-0.6 2,-0.2 -1,-0.3 0.444 112.9 55.5-102.7 -6.0 14.6 -58.2 36.2 426 182 A I H < S+ 0 0 0 -4,-1.0 3,-0.5 2,-0.2 -2,-0.2 0.946 116.9 38.2 -75.2 -53.6 22.8 -55.8 40.7 432 188 A I H >X S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 3,-1.2 0.881 114.4 56.6 -61.7 -40.4 23.2 -59.3 42.1 433 189 A G H 3X S+ 0 0 2 -4,-3.5 4,-0.8 1,-0.3 -1,-0.2 0.718 106.6 49.9 -65.0 -26.1 25.6 -60.1 39.2 434 190 A K H << S+ 0 0 27 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.1 -0.390 108.8 53.5-105.5 48.0 27.8 -57.2 40.2 435 191 A V H <4 S+ 0 0 4 -3,-1.2 -2,-0.2 -32,-0.0 -3,-0.1 0.248 110.3 43.7-145.5 -23.3 27.8 -58.4 43.8 436 192 A L H ><>S+ 0 0 0 -4,-1.3 3,-1.0 2,-0.2 5,-0.6 0.771 108.7 60.0 -85.5 -34.5 29.0 -62.0 43.1 437 193 A E T 3<5S+ 0 0 96 -4,-0.8 3,-0.2 1,-0.3 -3,-0.1 0.660 104.3 51.2 -65.3 -19.3 31.5 -60.5 40.6 438 194 A D T 3 5S+ 0 0 84 1,-0.2 -1,-0.3 -29,-0.0 -2,-0.2 0.606 107.4 52.8 -91.3 -13.9 33.1 -58.6 43.5 439 195 A L T < 5S- 0 0 31 -3,-1.0 -29,-3.2 -4,-0.1 -2,-0.2 0.233 126.3 -86.6-109.3 11.2 33.4 -61.6 45.8 440 196 A G T 5S+ 0 0 39 1,-0.3 -28,-0.3 -3,-0.2 -3,-0.1 -0.365 82.8 128.7 122.0 -52.2 35.3 -63.9 43.4 441 197 A Y < - 0 0 4 -5,-0.6 2,-0.9 1,-0.1 -1,-0.3 0.056 57.5-129.9 -44.9 137.9 32.6 -65.6 41.2 442 198 A E E -s 414 0I 122 -29,-1.4 -27,-0.6 -30,-0.4 2,-0.1 -0.823 35.5-143.4 -91.1 102.5 32.9 -65.6 37.4 443 199 A V E -s 415 0I 31 -2,-0.9 2,-0.4 -10,-0.2 -27,-0.1 -0.384 21.1-173.3 -75.1 136.0 29.5 -64.4 36.4 444 200 A T E -s 416 0I 70 -29,-0.8 -27,-1.9 -2,-0.1 2,-0.6 -0.986 11.5-153.1-119.0 139.2 27.4 -65.5 33.4 445 201 A L E -s 417 0I 64 -2,-0.4 2,-0.6 -29,-0.2 -27,-0.2 -0.939 10.1-163.7-111.0 109.7 24.1 -63.9 32.4 446 202 A T E -s 418 0I 53 -29,-2.9 -27,-1.9 -2,-0.6 2,-0.7 -0.853 8.3-149.4 -96.4 118.0 21.8 -66.2 30.5 447 203 A Q E +s 419 0I 137 -2,-0.6 2,-0.3 -29,-0.2 -27,-0.2 -0.776 33.6 153.6 -85.4 112.4 19.0 -64.5 28.7 448 204 A V - 0 0 38 -29,-2.2 -27,-0.3 -2,-0.7 2,-0.2 -0.925 38.6-105.4-138.0 165.7 15.9 -66.8 28.5 449 205 A E > - 0 0 136 -2,-0.3 4,-2.5 -29,-0.1 5,-0.2 -0.490 46.2 -82.3 -92.2 157.7 12.2 -66.6 28.2 450 206 A A T 4 S+ 0 0 3 2,-0.2 -1,-0.1 1,-0.2 18,-0.0 -0.424 122.9 20.8 -56.8 120.5 9.4 -67.1 30.8 451 207 A G T >> S+ 0 0 5 -2,-0.2 4,-3.0 -3,-0.1 3,-0.9 -0.801 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T E -u 547 0J 47 -2,-0.5 51,-0.6 26,-0.2 2,-0.6 -0.969 34.2-175.2-143.4 121.9 23.8 -25.8 44.9 521 18 B I E -uv 548 571J 5 26,-3.1 28,-1.9 -2,-0.4 2,-0.4 -0.961 28.0-145.1-108.5 112.9 20.5 -24.9 46.7 522 19 B I E +uv 549 572J 12 49,-2.5 51,-1.8 -2,-0.6 28,-0.1 -0.642 29.0 171.1 -82.6 128.2 17.7 -24.9 44.2 523 20 B G - 0 0 0 26,-2.8 29,-0.2 -2,-0.4 2,-0.1 -0.391 25.0-110.5-124.8-163.4 15.0 -22.2 44.8 524 21 B I - 0 0 2 1,-0.3 27,-0.5 27,-0.1 28,-0.1 -0.320 65.2 -21.5-117.7-164.9 11.9 -20.3 43.5 525 22 B D > - 0 0 20 25,-0.2 3,-0.8 1,-0.1 -1,-0.3 -0.083 58.0-131.7 -41.7 142.4 10.9 -16.8 42.2 526 23 B P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 26,-0.0 0.750 101.4 63.2 -81.2 -23.8 13.4 -14.2 43.3 527 24 B G T 3 S+ 0 0 27 4,-0.1 2,-0.1 5,-0.0 -2,-0.1 0.576 85.5 109.3 -71.3 -8.6 10.9 -11.6 44.6 528 25 B S S <> S- 0 0 2 -3,-0.8 4,-1.0 1,-0.1 3,-0.4 -0.353 74.0-130.4 -76.4 149.6 9.9 -14.3 47.2 529 26 B G H > S+ 0 0 3 1,-0.2 4,-3.5 2,-0.2 3,-0.3 0.856 107.8 52.6 -66.4 -40.8 10.6 -14.0 50.9 530 27 B I H > S+ 0 0 9 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.699 108.5 53.8 -68.5 -19.0 12.1 -17.5 51.3 531 28 B M H 4 S+ 0 0 7 -3,-0.4 4,-0.3 -6,-0.2 -1,-0.2 0.715 114.1 40.8 -84.7 -26.4 14.4 -16.5 48.4 532 29 B S H >X S+ 0 0 59 -4,-1.0 4,-1.2 -3,-0.3 3,-0.9 0.853 113.6 51.7 -84.1 -43.6 15.5 -13.4 50.2 533 30 B L H 3X S+ 0 0 19 -4,-3.5 4,-1.6 1,-0.2 -2,-0.2 0.717 101.1 63.4 -66.7 -21.3 15.7 -15.1 53.7 534 31 B T H 3X S+ 0 0 0 -4,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.769 99.1 54.9 -72.9 -27.0 17.9 -17.8 52.1 535 32 B D H <> S+ 0 0 62 -3,-0.9 4,-1.3 -4,-0.3 -2,-0.2 0.890 111.4 42.9 -66.6 -42.8 20.5 -15.0 51.4 536 33 B K H X S+ 0 0 97 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.758 115.1 51.6 -75.2 -25.3 20.4 -14.1 55.1 537 34 B A H X S+ 0 0 0 -4,-1.6 4,-1.5 2,-0.2 6,-0.2 0.925 108.7 48.9 -71.1 -48.1 20.5 -17.9 55.9 538 35 B M H <>S+ 0 0 24 -4,-2.7 5,-1.6 1,-0.2 -2,-0.2 0.802 115.0 47.6 -61.0 -31.1 23.6 -18.4 53.6 539 36 B K H ><5S+ 0 0 129 -4,-1.3 3,-1.3 3,-0.2 -2,-0.2 0.944 109.0 50.9 -73.6 -51.6 25.2 -15.4 55.3 540 37 B D H 3<5S+ 0 0 49 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.746 116.6 41.6 -55.6 -29.2 24.5 -16.5 58.9 541 38 B Y T 3<5S- 0 0 9 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.256 107.6-116.8-113.3 10.3 25.9 -20.0 58.3 542 39 B D T < 5 + 0 0 113 -3,-1.3 2,-1.8 1,-0.2 3,-0.2 0.703 58.2 153.5 66.5 25.9 29.0 -19.2 56.2 543 40 B L > < + 0 0 5 -5,-1.6 3,-0.5 -6,-0.2 -1,-0.2 -0.396 15.1 135.7 -85.7 61.4 27.7 -21.1 53.2 544 41 B N T 3 + 0 0 119 -2,-1.8 -1,-0.2 1,-0.2 -2,-0.1 0.411 58.8 63.2-102.4 1.4 29.7 -19.0 50.6 545 42 B D T 3 S+ 0 0 88 -3,-0.2 -26,-0.5 2,-0.0 -1,-0.2 -0.133 95.5 94.4-100.9 32.6 31.1 -21.7 48.3 546 43 B W < - 0 0 36 -3,-0.5 2,-0.4 -28,-0.1 -26,-0.2 -0.729 65.3-142.8-116.6 166.7 27.4 -22.4 47.5 547 44 B T E -u 520 0J 47 -28,-0.9 -26,-3.1 -2,-0.2 2,-0.9 -0.988 5.1-148.2-136.9 125.7 24.9 -21.2 44.9 548 45 B L E -u 521 0J 21 -2,-0.4 2,-0.4 -28,-0.2 -26,-0.2 -0.832 22.4-147.2 -91.3 104.1 21.2 -20.4 45.2 549 46 B I E -u 522 0J 23 -28,-1.9 -26,-2.8 -2,-0.9 2,-0.6 -0.604 8.7-141.6 -74.0 122.9 19.7 -21.3 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0.166 72.5 145.6 114.0 -13.9 -2.8 -32.7 36.8 642 139 B E < - 0 0 58 -5,-1.7 -1,-0.3 1,-0.1 -2,-0.0 -0.085 59.7 -94.7 -52.9 151.9 -6.5 -32.1 37.7 643 140 B K > - 0 0 35 1,-0.1 4,-2.0 2,-0.0 3,-0.3 -0.596 27.2-132.4 -77.5 131.4 -7.9 -28.6 36.8 644 141 B P H > S+ 0 0 31 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.666 103.4 49.8 -58.1 -24.9 -7.8 -26.1 39.7 645 142 B A H > S+ 0 0 29 2,-0.2 4,-1.9 3,-0.1 5,-0.1 0.900 110.6 48.6 -79.0 -44.1 -11.4 -24.9 39.2 646 143 B K H > S+ 0 0 79 -3,-0.3 4,-1.0 2,-0.2 5,-0.1 0.894 113.3 46.0 -62.0 -46.5 -12.9 -28.4 39.1 647 144 B V H X S+ 0 0 8 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.876 109.9 55.3 -68.2 -37.0 -11.1 -29.6 42.3 648 145 B A H X S+ 0 0 1 -4,-0.9 4,-2.0 -5,-0.3 -2,-0.2 0.878 110.7 45.1 -59.5 -41.0 -12.0 -26.3 44.1 649 146 B A H < S+ 0 0 22 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.649 111.6 53.2 -78.8 -17.6 -15.7 -27.0 43.3 650 147 B E H >X S+ 0 0 93 -4,-1.0 4,-1.7 -5,-0.1 3,-0.6 0.826 108.4 51.2 -78.2 -36.2 -15.1 -30.7 44.4 651 148 B Y H 3X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.2 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