==== 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 TOXIN 25-JAN-06 2DDB . COMPND 2 MOLECULE: PSEUDECIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDECHIS PORPHYRIACUS; . AUTHOR N.SUZUKI,Y.YAMAZAKI,Z.FUJIMOTO,T.MORITA,H.MIZUNO . 832 4 32 32 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38323.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 512 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 14.9 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 . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 . 39 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 4 8 0 4 4 0 4 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 12 0 0 0 0 4 0 4 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 . 8 4 0 0 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 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 4 A N > 0 0 138 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 109.2 13.4 6.1 130.0 2 5 A Y H > + 0 0 108 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.816 360.0 57.1 -59.7 -36.4 14.6 9.6 128.9 3 6 A Q H > S+ 0 0 64 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.955 110.6 44.3 -62.6 -49.1 15.3 8.5 125.3 4 7 A K H > S+ 0 0 123 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.935 113.5 50.8 -56.7 -49.9 11.7 7.4 124.9 5 8 A E H X S+ 0 0 68 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.912 113.0 46.5 -53.0 -47.6 10.4 10.6 126.7 6 9 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.927 116.4 41.7 -65.1 -48.7 12.4 12.8 124.4 7 10 A V H X S+ 0 0 18 -4,-2.4 4,-2.7 -5,-0.2 20,-0.2 0.928 115.9 50.1 -67.4 -44.4 11.5 11.1 121.1 8 11 A D H X S+ 0 0 75 -4,-3.0 4,-2.1 -5,-0.3 -2,-0.2 0.882 111.1 48.7 -64.2 -38.3 7.9 10.8 122.1 9 12 A K H X S+ 0 0 53 -4,-2.4 4,-2.2 -5,-0.3 5,-0.2 0.951 112.5 47.9 -66.6 -51.2 7.6 14.4 123.1 10 13 A H H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.926 113.9 47.5 -49.1 -49.3 9.2 15.6 119.8 11 14 A N H X S+ 0 0 8 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.874 108.7 53.7 -67.0 -34.1 6.9 13.4 117.8 12 15 A A H < S+ 0 0 41 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.908 113.8 42.6 -65.7 -42.3 3.8 14.5 119.6 13 16 A L H >< S+ 0 0 15 -4,-2.2 3,-1.0 1,-0.2 4,-0.3 0.921 113.4 52.8 -65.4 -45.1 4.6 18.1 118.9 14 17 A R H >< S+ 0 0 1 -4,-2.7 3,-0.7 1,-0.3 7,-0.2 0.869 111.0 45.1 -61.2 -41.7 5.6 17.4 115.3 15 18 A R T 3< S+ 0 0 63 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.508 112.1 53.9 -80.4 -5.4 2.4 15.5 114.4 16 19 A S T < S+ 0 0 69 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.313 77.4 132.3-113.4 6.2 0.2 18.2 116.1 17 20 A V < - 0 0 3 -3,-0.7 4,-0.2 -4,-0.3 -3,-0.0 -0.203 52.8-115.9 -62.7 149.6 1.5 21.4 114.3 18 21 A K S S+ 0 0 145 2,-0.1 2,-0.2 131,-0.0 72,-0.2 -0.991 104.8 41.8-134.6 123.8 -0.9 24.0 112.7 19 22 A P S S- 0 0 53 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.527 113.7-113.4 -62.3 156.9 -0.9 24.5 109.9 20 23 A T - 0 0 39 -2,-0.2 130,-2.3 1,-0.1 2,-0.4 -0.249 27.7-120.5 -65.9 154.0 -0.7 20.7 109.4 21 24 A A B -A 149 0A 7 128,-0.2 132,-0.7 -4,-0.2 128,-0.2 -0.817 20.5-171.1-104.8 134.7 2.4 19.2 107.8 22 25 A R S S+ 0 0 68 126,-3.1 133,-2.2 -2,-0.4 134,-0.2 0.628 89.9 30.3 -92.8 -14.7 2.5 17.1 104.6 23 26 A N S S+ 0 0 12 125,-0.6 2,-0.6 131,-0.1 -1,-0.1 0.071 75.6 143.4-133.8 25.1 6.2 16.0 104.9 24 27 A M - 0 0 2 139,-0.3 141,-3.1 124,-0.2 2,-0.1 -0.558 41.6-140.7 -73.7 113.0 7.0 15.8 108.6 25 28 A L B -b 165 0B 1 85,-1.9 2,-0.3 -2,-0.6 141,-0.2 -0.469 15.6-114.0 -74.3 145.0 9.4 12.9 109.3 26 29 A Q - 0 0 72 139,-3.0 2,-0.2 -2,-0.1 -1,-0.1 -0.622 35.1-130.9 -68.8 132.5 9.1 10.7 112.4 27 30 A M - 0 0 3 -2,-0.3 2,-0.3 -20,-0.2 87,-0.2 -0.622 24.1-173.2 -87.8 148.1 12.1 11.1 114.7 28 31 A K E -d 114 0C 119 85,-1.9 87,-1.9 -2,-0.2 2,-0.1 -0.960 31.8 -96.3-135.9 155.6 14.1 8.2 116.1 29 32 A W E -d 115 0C 40 -2,-0.3 2,-0.4 85,-0.2 87,-0.2 -0.439 32.2-162.5 -69.9 140.0 16.9 8.1 118.7 30 33 A N > - 0 0 31 85,-2.1 4,-2.0 -2,-0.1 5,-0.1 -0.986 10.2-157.9-126.9 121.3 20.5 8.0 117.3 31 34 A S H > S+ 0 0 89 -2,-0.4 4,-1.6 2,-0.2 5,-0.1 0.766 93.2 56.3 -70.1 -29.9 23.2 6.8 119.6 32 35 A H H > S+ 0 0 86 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.939 110.8 44.5 -63.2 -50.9 26.0 8.5 117.6 33 36 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 83,-0.2 0.884 112.2 53.1 -57.8 -41.6 24.2 11.9 118.0 34 37 A A H X S+ 0 0 12 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.810 106.7 52.2 -67.6 -31.9 23.6 11.2 121.7 35 38 A Q H X S+ 0 0 102 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.934 110.7 47.7 -67.3 -46.9 27.3 10.5 122.3 36 39 A N H X S+ 0 0 25 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.888 113.0 48.4 -58.4 -44.2 28.2 13.8 120.7 37 40 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.890 112.0 49.6 -64.8 -40.2 25.5 15.6 122.7 38 41 A K H X S+ 0 0 103 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.894 107.1 53.7 -64.7 -43.8 26.8 13.9 125.9 39 42 A R H < S+ 0 0 148 -4,-2.6 4,-0.2 1,-0.2 -1,-0.2 0.865 115.8 41.9 -60.8 -34.0 30.4 14.9 125.2 40 43 A W H ><>S+ 0 0 30 -4,-1.5 3,-1.4 -5,-0.2 5,-0.5 0.930 113.3 49.1 -76.5 -49.7 29.2 18.5 124.9 41 44 A A H ><5S+ 0 0 0 -4,-3.1 3,-2.1 1,-0.3 -2,-0.2 0.878 103.8 61.5 -58.8 -38.8 26.8 18.6 127.9 42 45 A D T 3<5S+ 0 0 80 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.621 90.4 69.4 -67.9 -13.2 29.3 17.1 130.2 43 46 A R T < 5S- 0 0 164 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.496 97.3-140.6 -80.8 -5.0 31.6 20.1 129.6 44 47 A a T < 5 + 0 0 37 -3,-2.1 2,-0.5 -4,-0.2 -3,-0.1 0.787 53.2 135.7 54.5 35.2 29.1 22.3 131.5 45 48 A T < - 0 0 68 -5,-0.5 2,-1.4 2,-0.1 -1,-0.2 -0.966 54.5-137.6-120.9 122.8 29.4 25.2 129.2 46 49 A F + 0 0 67 -2,-0.5 2,-0.3 -3,-0.1 21,-0.1 -0.631 67.1 92.6 -82.4 93.3 26.3 27.1 127.9 47 50 A A S S- 0 0 44 -2,-1.4 2,-0.3 0, 0.0 -2,-0.1 -0.963 80.9 -82.7-169.4 159.5 27.3 27.6 124.3 48 51 A H - 0 0 103 -2,-0.3 -2,-0.0 17,-0.1 17,-0.0 -0.613 44.6-123.2 -74.8 134.2 26.8 26.0 120.9 49 52 A S - 0 0 1 -2,-0.3 5,-0.1 1,-0.1 -1,-0.1 -0.435 38.6 -90.8 -69.4 147.6 29.2 23.2 120.0 50 53 A P > - 0 0 54 0, 0.0 3,-2.1 0, 0.0 4,-0.4 -0.402 34.4-120.4 -56.8 138.0 31.3 23.6 116.9 51 54 A P G > S+ 0 0 64 0, 0.0 3,-1.5 0, 0.0 10,-0.4 0.840 112.3 62.2 -50.5 -36.5 29.5 22.1 113.8 52 55 A N G 3 S+ 0 0 121 1,-0.3 3,-0.3 8,-0.1 -3,-0.0 0.742 97.5 57.4 -62.2 -26.4 32.5 19.8 113.3 53 56 A T G < S+ 0 0 55 -3,-2.1 -1,-0.3 1,-0.2 2,-0.2 0.532 104.5 53.2 -83.0 -9.6 31.9 18.1 116.8 54 57 A R S < S+ 0 0 19 -3,-1.5 7,-2.2 -4,-0.4 2,-0.4 -0.570 73.8 126.5-130.7 69.0 28.4 17.1 115.9 55 58 A T E -K 60 0D 52 -3,-0.3 2,-0.5 -2,-0.2 5,-0.2 -0.928 42.2-156.2-120.4 145.7 28.4 15.1 112.7 56 59 A V E > S-K 59 0D 19 3,-2.1 3,-2.3 -2,-0.4 2,-0.2 -0.949 72.1 -52.8-120.6 108.1 26.9 11.7 112.1 57 60 A G T 3 S- 0 0 62 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.492 124.0 -20.2 57.5-122.7 28.8 10.2 109.1 58 61 A K T 3 S+ 0 0 197 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.539 115.2 107.1 -86.6 -9.9 28.4 12.9 106.5 59 62 A L E < -K 56 0D 47 -3,-2.3 -3,-2.1 76,-0.1 2,-0.5 -0.562 62.3-144.1 -79.5 126.9 25.4 14.6 108.1 60 63 A R E -K 55 0D 90 -2,-0.4 76,-2.2 -5,-0.2 2,-0.3 -0.759 22.7-144.4 -82.9 130.8 25.9 17.9 109.9 61 64 A b - 0 0 0 -7,-2.2 73,-0.2 -2,-0.5 -7,-0.1 -0.787 1.8-138.7-102.0 143.8 23.6 18.0 112.9 62 65 A G E -E 133 0C 4 71,-3.0 71,-1.7 -2,-0.3 2,-0.3 -0.251 21.5-141.1 -85.4 179.9 21.8 21.0 114.3 63 66 A E E -E 132 0C 12 69,-0.2 2,-0.4 -2,-0.1 69,-0.2 -0.991 19.0-168.3-154.9 136.5 21.6 21.7 118.1 64 67 A N E -E 131 0C 2 67,-2.5 67,-2.7 -2,-0.3 2,-0.4 -0.985 17.3-172.5-118.9 134.6 19.2 23.0 120.7 65 68 A I E -E 130 0C 6 -2,-0.4 2,-0.4 65,-0.2 65,-0.2 -0.968 4.4-175.5-127.1 146.7 20.6 23.9 124.2 66 69 A F E -E 129 0C 0 63,-2.6 63,-2.7 -2,-0.4 2,-0.4 -0.998 3.2-170.0-138.8 140.1 18.8 24.9 127.3 67 70 A M E +E 128 0C 33 -2,-0.4 212,-1.7 61,-0.2 2,-0.3 -0.999 10.9 168.4-131.6 137.3 20.0 26.0 130.8 68 71 A S E -EF 127 278C 2 59,-2.3 59,-3.1 -2,-0.4 210,-0.2 -0.951 38.4-135.3-140.4 158.8 18.1 26.4 134.0 69 72 A S S S+ 0 0 1 208,-1.6 57,-0.2 -2,-0.3 209,-0.1 0.515 98.0 46.0 -93.3 -6.8 18.8 26.9 137.7 70 73 A Q S S- 0 0 7 207,-0.3 57,-0.2 55,-0.1 2,-0.1 -0.936 98.1-103.9-122.7 153.3 16.2 24.3 138.7 71 74 A P - 0 0 72 0, 0.0 -2,-0.1 0, 0.0 50,-0.0 -0.418 35.2-165.4 -76.2 155.3 15.9 20.9 137.0 72 75 A F - 0 0 40 -2,-0.1 2,-0.0 -4,-0.1 -4,-0.0 -0.977 26.7-104.8-135.4 149.3 13.2 20.1 134.5 73 76 A P >> - 0 0 74 0, 0.0 4,-1.5 0, 0.0 3,-0.6 -0.414 38.9-113.2 -64.9 152.2 11.7 17.0 133.0 74 77 A W H 3> S+ 0 0 17 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.864 117.2 61.4 -53.8 -36.5 12.9 16.5 129.4 75 78 A S H 3> S+ 0 0 43 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 105.5 46.7 -61.9 -37.8 9.3 17.0 128.2 76 79 A G H <> S+ 0 0 24 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.777 109.2 54.3 -72.8 -29.8 9.4 20.5 129.7 77 80 A V H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.937 111.1 45.1 -68.0 -44.4 12.7 21.3 128.1 78 81 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.916 111.9 52.0 -66.9 -40.4 11.4 20.4 124.7 79 82 A Q H X S+ 0 0 53 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.875 105.1 57.5 -58.4 -38.0 8.2 22.4 125.3 80 83 A A H < S+ 0 0 7 -4,-1.8 4,-0.3 2,-0.2 -1,-0.2 0.890 108.6 44.4 -62.8 -41.4 10.3 25.4 126.3 81 84 A W H >< S+ 0 0 0 -4,-1.7 3,-1.6 1,-0.2 23,-0.3 0.952 113.4 51.8 -64.1 -47.4 12.1 25.3 122.9 82 85 A Y H >< S+ 0 0 33 -4,-2.5 3,-2.2 1,-0.3 -2,-0.2 0.845 93.8 73.0 -56.4 -36.8 8.8 24.8 121.1 83 86 A D G >< S+ 0 0 66 -4,-2.4 3,-1.8 1,-0.3 -1,-0.3 0.567 70.5 84.8 -66.0 -8.0 7.2 27.8 122.9 84 87 A E G X + 0 0 15 -3,-1.6 3,-2.0 1,-0.3 -1,-0.3 0.611 68.9 86.8 -60.5 -13.8 9.2 30.2 120.7 85 88 A I G X + 0 0 47 -3,-2.2 3,-2.2 1,-0.3 -1,-0.3 0.760 68.3 76.4 -53.6 -28.5 6.2 29.6 118.4 86 89 A K G < S+ 0 0 175 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.671 102.5 38.9 -59.5 -18.1 4.5 32.5 120.3 87 90 A N G < S+ 0 0 68 -3,-2.0 8,-2.3 13,-0.1 2,-0.4 -0.101 104.8 90.3-119.8 30.7 6.8 34.8 118.3 88 91 A F E < -L 94 0E 20 -3,-2.2 2,-0.4 6,-0.2 6,-0.2 -0.963 50.3-168.1-128.4 141.5 6.6 32.8 115.0 89 92 A V E >> -L 93 0E 64 4,-2.0 4,-3.3 -2,-0.4 3,-2.0 -0.968 31.9-118.2-129.7 120.1 4.2 33.1 112.0 90 93 A Y T 34 S+ 0 0 57 -2,-0.4 55,-0.2 1,-0.3 54,-0.1 -0.288 101.1 21.1 -55.6 131.0 4.2 30.3 109.4 91 94 A G T 34 S+ 0 0 50 53,-2.7 -1,-0.3 1,-0.1 54,-0.1 -0.090 131.1 44.2 98.5 -33.1 5.2 31.8 106.1 92 95 A I T <4 S- 0 0 100 -3,-2.0 2,-0.4 52,-0.3 -2,-0.2 0.761 88.7-155.5-110.6 -37.9 6.9 34.9 107.5 93 96 A G E < +L 89 0E 2 -4,-3.3 -4,-2.0 51,-0.4 2,-0.3 -0.818 58.1 34.8 103.4-137.7 9.0 33.6 110.5 94 97 A A E -L 88 0E 22 -2,-0.4 -6,-0.2 -6,-0.2 -9,-0.1 -0.401 68.5-154.1 -62.7 118.5 10.1 35.7 113.5 95 98 A K S S+ 0 0 133 -8,-2.3 -2,-0.1 -2,-0.3 -3,-0.0 -0.943 92.4 36.7-135.6 114.9 7.5 38.3 114.5 96 99 A P S > S- 0 0 79 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 0.572 107.3-127.7 -56.3 154.2 8.7 40.7 115.9 97 100 A P T 3 S+ 0 0 122 0, 0.0 -3,-0.2 0, 0.0 -2,-0.1 0.665 102.7 55.4 -58.8 -24.8 11.7 40.3 113.5 98 101 A G T 3 S+ 0 0 79 2,-0.1 2,-0.1 0, 0.0 -3,-0.1 0.489 82.1 116.1 -87.8 -5.1 14.4 40.2 116.2 99 102 A S S < S- 0 0 28 -3,-1.9 2,-0.6 -12,-0.1 -5,-0.1 -0.364 70.5-119.0 -65.7 140.5 12.8 37.3 118.1 100 103 A V + 0 0 58 1,-0.2 -13,-0.1 -2,-0.1 -1,-0.1 -0.723 45.7 154.5 -80.1 119.5 14.6 34.0 118.4 101 104 A I > + 0 0 8 -2,-0.6 4,-2.4 2,-0.1 5,-0.2 0.345 42.2 102.2-121.0 -1.2 12.5 31.2 116.8 102 105 A G H > S+ 0 0 17 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.713 77.5 52.6 -63.7 -28.9 15.4 28.8 115.9 103 106 A H H > S+ 0 0 32 2,-0.2 4,-1.9 3,-0.1 -1,-0.2 0.921 112.1 47.3 -71.6 -42.7 14.8 26.3 118.7 104 107 A Y H > S+ 0 0 2 -23,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.957 111.4 49.6 -59.1 -50.6 11.2 26.0 117.8 105 108 A T H < S+ 0 0 0 -4,-2.4 33,-0.2 1,-0.3 -1,-0.2 0.784 109.8 52.3 -64.5 -26.7 11.9 25.5 114.1 106 109 A Q H >< S+ 0 0 3 -4,-1.1 3,-1.0 -5,-0.2 -1,-0.3 0.871 105.6 54.1 -73.8 -37.4 14.5 22.9 114.9 107 110 A V H 3< S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.928 119.7 33.9 -61.7 -41.5 12.0 20.9 117.0 108 111 A V T 3< S+ 0 0 0 -4,-2.0 2,-0.4 -5,-0.1 -1,-0.2 0.193 82.0 143.2 -98.9 14.6 9.6 20.9 114.0 109 112 A W X - 0 0 4 -3,-1.0 3,-1.0 1,-0.2 38,-0.2 -0.415 46.2-144.8 -63.5 116.0 12.1 20.7 111.2 110 113 A Y T 3 S+ 0 0 24 36,-2.5 -85,-1.9 -2,-0.4 -1,-0.2 0.844 94.1 42.3 -50.3 -43.0 10.5 18.4 108.6 111 114 A K T 3 S+ 0 0 25 35,-0.3 2,-1.1 -87,-0.1 -1,-0.3 0.659 85.5 98.2 -85.9 -19.1 13.8 16.8 107.5 112 115 A S < + 0 0 0 -3,-1.0 24,-0.1 1,-0.2 -1,-0.0 -0.572 38.1 153.5 -74.6 101.2 15.5 16.2 111.0 113 116 A H + 0 0 25 -2,-1.1 -85,-1.9 21,-0.9 2,-0.4 0.465 50.6 67.5-113.3 -1.9 14.7 12.6 111.7 114 117 A L E +dG 28 134C 15 20,-2.2 20,-2.9 -87,-0.2 2,-0.3 -0.963 59.6 175.7-120.0 136.1 17.6 11.6 113.9 115 118 A I E +dG 29 133C 0 -87,-1.9 -85,-2.1 -2,-0.4 2,-0.3 -1.000 10.8 175.9-140.7 140.6 18.0 13.0 117.5 116 119 A G E + G 0 132C 0 16,-2.3 16,-3.1 -2,-0.3 2,-0.3 -0.983 12.6 178.1-145.6 141.3 20.3 12.4 120.4 117 120 A c E - G 0 131C 1 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.899 12.5-177.1-140.9 161.9 20.4 14.3 123.7 118 121 A A E - G 0 130C 10 12,-2.2 12,-2.6 -2,-0.3 2,-0.3 -0.976 10.2-153.1-157.0 154.2 22.1 14.5 127.1 119 122 A S E - 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0 0 14 -76,-2.2 4,-0.4 -2,-0.2 3,-0.3 -0.267 29.7-142.8 -59.3 138.8 20.4 19.9 110.6 137 140 A G S S+ 0 0 5 -4,-0.2 -31,-0.1 1,-0.2 -74,-0.1 -0.265 77.9 49.2 -84.2-178.3 17.4 22.1 110.6 138 141 A N S S+ 0 0 60 -33,-0.2 5,-0.2 1,-0.1 -1,-0.2 0.502 102.5 77.2 67.6 9.6 17.2 25.9 109.9 139 142 A I S > S+ 0 0 94 -3,-0.3 2,-1.9 3,-0.1 3,-0.6 0.788 81.7 37.7-112.4 -86.9 19.4 25.2 106.7 140 143 A R T 3 S+ 0 0 107 -4,-0.4 -1,-0.1 1,-0.2 -2,-0.1 -0.473 120.2 22.7 -85.1 69.1 18.1 23.8 103.5 141 144 A G T 3 S- 0 0 40 -2,-1.9 4,-0.3 -3,-0.1 -1,-0.2 0.655 108.3 -70.5 145.8 41.3 14.6 25.4 103.1 142 145 A S X - 0 0 71 -3,-0.6 3,-1.3 1,-0.1 -3,-0.1 0.858 28.8-128.9 58.2 119.8 13.7 28.6 104.9 143 146 A I T 3 S+ 0 0 65 1,-0.3 -1,-0.1 -5,-0.2 -50,-0.1 0.654 106.0 69.3 -64.9 -17.7 13.2 29.0 108.6 144 147 A A T 3 S+ 0 0 11 1,-0.3 -53,-2.7 -53,-0.1 -51,-0.4 0.731 109.7 31.8 -77.3 -24.4 9.8 30.7 107.9 145 148 A T < + 0 0 49 -3,-1.3 -1,-0.3 -4,-0.3 -55,-0.0 -0.727 68.8 173.8-132.0 81.6 8.4 27.4 106.6 146 149 A P S S+ 0 0 0 0, 0.0 -36,-2.5 0, 0.0 2,-0.3 0.582 74.8 17.3 -70.2 -9.7 10.1 24.6 108.7 147 150 A Y S S- 0 0 5 -38,-0.2 2,-0.5 -37,-0.1 -38,-0.1 -0.943 92.5 -95.1-148.1 165.5 7.8 22.0 107.1 148 151 A K - 0 0 91 -2,-0.3 -126,-3.1 1,-0.0 -125,-0.6 -0.747 42.9-130.4 -85.7 123.9 5.6 21.9 104.0 149 152 A S B +A 21 0A 55 -2,-0.5 -128,-0.2 -128,-0.2 -129,-0.1 -0.539 57.9 87.5 -77.5 141.9 2.0 22.8 104.9 150 153 A G S S- 0 0 19 -130,-2.3 3,-0.1 -2,-0.2 -127,-0.1 -0.947 79.3 -24.1 158.5-175.4 -0.8 20.4 103.8 151 154 A P S > S- 0 0 82 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.335 82.2 -89.3 -59.9 138.8 -2.7 17.3 104.6 152 155 A P T 3 S+ 0 0 48 0, 0.0 -130,-0.2 0, 0.0 12,-0.1 -0.247 108.0 1.8 -54.2 136.8 -0.8 15.0 106.9 153 156 A d T > S+ 0 0 8 -132,-0.7 3,-1.8 10,-0.5 6,-0.2 0.603 79.6 139.5 64.0 19.3 1.4 12.6 105.0 154 157 A A T < S+ 0 0 34 -3,-1.9 -131,-0.1 1,-0.3 -1,-0.1 0.844 78.4 48.2 -58.4 -29.2 0.5 13.9 101.5 155 158 A D T 3 S+ 0 0 40 -133,-2.2 -1,-0.3 -4,-0.3 -132,-0.1 0.322 121.9 33.1 -95.4 6.8 4.2 13.4 100.7 156 159 A e X + 0 0 1 -3,-1.8 3,-2.4 -134,-0.2 -1,-0.2 -0.211 64.7 157.2-151.0 54.1 4.4 9.9 102.1 157 160 A P T 3 S+ 0 0 109 0, 0.0 3,-0.2 0, 0.0 -3,-0.1 0.709 83.6 37.3 -65.2 -15.5 1.1 8.2 101.5 158 161 A S T 3 S+ 0 0 129 1,-0.2 -5,-0.0 -5,-0.0 7,-0.0 0.179 118.6 49.7-113.8 16.7 2.6 4.7 101.8 159 162 A A S < S+ 0 0 22 -3,-2.4 7,-2.4 -6,-0.2 2,-0.4 -0.446 80.8 125.9-149.9 62.7 5.1 5.5 104.5 160 163 A d E +C 165 0B 54 5,-0.2 2,-0.4 -3,-0.2 5,-0.2 -0.986 28.9 176.8-138.4 121.6 3.0 7.2 107.2 161 164 A V E > S-C 164 0B 67 3,-3.0 3,-1.8 -2,-0.4 -8,-0.1 -0.977 75.2 -19.5-131.6 119.8 2.6 6.4 110.9 162 165 A N T 3 S- 0 0 113 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.903 128.6 -49.0 51.2 48.4 0.5 8.6 113.2 163 166 A R T 3 S+ 0 0 105 1,-0.2 -10,-0.5 -11,-0.1 2,-0.4 0.351 118.5 107.5 77.1 -0.6 0.7 11.6 110.8 164 167 A L E < - C 0 161B 0 -3,-1.8 -3,-3.0 -12,-0.1 -139,-0.2 -0.876 67.3-120.0-115.8 145.3 4.5 11.4 110.4 165 168 A e E -bC 25 160B 1 -141,-3.1 -139,-3.0 -2,-0.4 -5,-0.2 -0.458 16.1-171.5 -80.6 144.9 6.5 10.2 107.4 166 169 A T + 0 0 64 -7,-2.4 -6,-0.1 -141,-0.2 -1,-0.1 0.138 64.5 86.6-117.9 18.7 9.0 7.3 107.6 167 170 A N + 0 0 22 -8,-0.4 39,-2.5 2,-0.0 -1,-0.1 -0.521 53.0 175.4-122.2 63.3 10.7 7.7 104.1 168 171 A P B -m 206 0F 21 0, 0.0 2,-0.5 0, 0.0 39,-0.2 -0.372 37.1-114.7 -68.6 145.9 13.6 10.2 104.3 169 172 A f - 0 0 4 37,-2.9 29,-0.1 1,-0.1 33,-0.1 -0.725 23.4-163.4 -75.9 125.1 15.7 10.7 101.2 170 173 A N + 0 0 134 -2,-0.5 -1,-0.1 2,-0.1 28,-0.1 0.602 61.8 95.0 -89.3 -10.9 19.2 9.4 102.1 171 174 A Y - 0 0 134 26,-0.1 2,-0.4 27,-0.1 -2,-0.1 -0.370 69.5-139.3 -67.7 158.6 20.8 11.1 99.1 172 175 A N - 0 0 83 -2,-0.1 2,-0.3 35,-0.1 -2,-0.1 -0.986 3.7-138.0-128.9 120.5 22.4 14.5 99.8 173 176 A N - 0 0 17 -2,-0.4 23,-0.2 23,-0.2 22,-0.1 -0.617 7.8-150.6 -73.5 131.7 22.1 17.5 97.4 174 177 A D S S+ 0 0 84 21,-3.2 2,-0.3 -2,-0.3 22,-0.1 0.659 77.3 46.7 -80.4 -15.8 25.4 19.4 97.1 175 178 A F S > S- 0 0 83 20,-0.5 3,-0.9 1,-0.1 -2,-0.0 -0.938 73.7-132.1-129.3 154.9 23.8 22.8 96.5 176 179 A S T 3 S+ 0 0 100 -2,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.632 106.8 54.3 -74.9 -18.9 20.9 24.8 98.0 177 180 A N T 3> S+ 0 0 95 1,-0.2 4,-1.7 2,-0.1 -1,-0.2 0.012 71.6 117.5-105.3 29.2 19.3 25.5 94.5 178 181 A g H <> + 0 0 2 -3,-0.9 4,-2.5 1,-0.2 5,-0.2 0.817 67.7 57.9 -66.2 -34.9 19.1 21.8 93.5 179 182 A K H > S+ 0 0 150 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.939 110.3 43.6 -63.2 -46.4 15.3 21.7 93.2 180 183 A S H > S+ 0 0 64 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.834 113.1 52.1 -63.5 -39.3 15.3 24.5 90.6 181 184 A L H X S+ 0 0 36 -4,-1.7 4,-1.9 2,-0.2 6,-0.4 0.895 111.3 47.2 -65.5 -42.6 18.3 23.0 88.7 182 185 A A H X>S+ 0 0 11 -4,-2.5 4,-1.4 2,-0.2 5,-0.7 0.931 113.6 48.8 -60.1 -48.3 16.5 19.6 88.6 183 186 A K H <5S+ 0 0 159 -4,-2.5 -2,-0.2 1,-0.2 3,-0.2 0.926 114.8 43.2 -57.0 -52.8 13.2 21.4 87.4 184 187 A K H <5S+ 0 0 144 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.843 123.7 35.2 -62.7 -40.6 14.9 23.5 84.7 185 188 A S H ><5S- 0 0 16 -4,-1.9 3,-1.4 -5,-0.2 -1,-0.2 0.537 94.8-133.4 -93.8 -10.6 17.1 20.7 83.3 186 189 A K T 3<5 - 0 0 150 -4,-1.4 -3,-0.2 1,-0.2 -4,-0.1 0.757 63.9 -76.3 53.7 28.2 14.7 17.8 83.8 187 190 A h T 3 S- 0 0 61 1,-0.1 4,-1.6 -4,-0.1 3,-0.4 -0.718 75.4-139.7 -85.1 125.5 22.6 17.1 82.6 190 193 A E H > S+ 0 0 149 -2,-0.5 4,-1.7 1,-0.2 -1,-0.1 0.859 99.9 50.8 -54.0 -42.0 25.1 14.7 83.9 191 194 A W H > S+ 0 0 124 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.860 105.8 54.8 -68.9 -34.9 26.6 17.1 86.5 192 195 A I H > S+ 0 0 8 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.875 109.2 48.2 -65.4 -37.6 23.1 18.0 88.0 193 196 A K H < S+ 0 0 61 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.863 113.8 48.5 -66.3 -38.4 22.4 14.3 88.6 194 197 A K H < S+ 0 0 155 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.915 124.0 28.6 -66.6 -44.0 25.8 13.9 90.2 195 198 A K H < S+ 0 0 54 -4,-2.6 -21,-3.2 1,-0.2 -20,-0.5 0.547 126.5 43.2-100.7 -13.1 25.5 16.9 92.5 196 199 A g X + 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 -0.357 65.9 144.5-123.8 53.0 21.7 17.0 93.0 197 200 A P H > S+ 0 0 17 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.829 70.7 54.4 -66.9 -30.2 21.0 13.3 93.5 198 201 A A H > S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 3,-0.3 0.976 112.5 41.9 -61.9 -55.8 18.2 13.9 96.0 199 202 A S H 4 S+ 0 0 16 1,-0.2 -1,-0.2 2,-0.2 -6,-0.1 0.837 121.3 43.2 -60.9 -34.5 16.3 16.2 93.7 200 203 A h H < S+ 0 0 6 -4,-2.2 -1,-0.2 -8,-0.2 -2,-0.2 0.713 128.6 21.6 -85.9 -21.3 16.9 13.9 90.7 201 204 A F H < S+ 0 0 106 -4,-1.8 3,-0.2 -3,-0.3 -2,-0.2 0.383 103.4 75.1-132.6 2.8 16.3 10.5 92.3 202 205 A f >< + 0 0 6 -4,-2.1 3,-1.7 1,-0.2 5,-0.1 -0.253 46.5 143.3-112.9 47.6 14.1 10.9 95.4 203 206 A H T 3 S+ 0 0 149 1,-0.3 -1,-0.2 -3,-0.1 4,-0.1 0.842 80.7 33.4 -55.4 -37.1 10.7 11.5 93.8 204 207 A N T 3 S+ 0 0 144 -3,-0.2 2,-0.3 2,-0.1 -1,-0.3 0.134 108.7 78.3-108.3 17.7 8.9 9.5 96.5 205 208 A K S < S- 0 0 104 -3,-1.7 2,-0.7 -7,-0.1 -3,-0.1 -0.826 90.1 -93.9-121.3 162.4 11.1 10.3 99.5 206 209 A I B m 168 0F 6 -39,-2.5 -37,-2.9 -2,-0.3 -2,-0.1 -0.693 360.0 360.0 -81.0 115.3 11.3 13.4 101.8 207 210 A I 0 0 76 -2,-0.7 -96,-0.1 -39,-0.2 -35,-0.1 -0.840 360.0 360.0 -98.7 360.0 14.0 15.7 100.5 208 !* 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 0.0 209 2 B K 0 0 231 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -60.7 -4.1 38.7 130.3 210 3 B K - 0 0 152 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.495 360.0-106.7 -64.9 120.9 -4.2 37.9 134.0 211 4 B N > - 0 0 92 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.167 20.4-125.1 -54.7 141.6 -1.8 40.4 135.7 212 5 B Y H > S+ 0 0 96 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.850 107.1 59.6 -60.1 -37.7 1.5 38.9 136.8 213 6 B Q H > S+ 0 0 67 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.925 109.4 42.1 -56.5 -48.5 1.1 40.2 140.4 214 7 B K H > S+ 0 0 122 -3,-0.3 4,-3.0 1,-0.2 5,-0.3 0.897 112.4 55.6 -65.4 -41.3 -2.2 38.3 140.9 215 8 B E H X S+ 0 0 52 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.902 111.0 44.3 -54.7 -45.4 -0.7 35.2 139.1 216 9 B I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.925 116.3 44.7 -69.0 -47.2 2.3 35.2 141.6 217 10 B V H X S+ 0 0 20 -4,-2.2 4,-2.7 -5,-0.2 20,-0.2 0.949 115.4 48.0 -62.9 -48.4 0.1 35.7 144.7 218 11 B D H X S+ 0 0 72 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.888 111.9 49.5 -60.7 -41.5 -2.5 33.2 143.6 219 12 B K H X S+ 0 0 52 -4,-2.0 4,-2.0 -5,-0.3 5,-0.2 0.938 112.2 47.5 -64.7 -46.9 0.2 30.5 142.8 220 13 B H H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.933 114.0 47.8 -58.9 -46.0 1.9 31.0 146.1 221 14 B N H X S+ 0 0 7 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.872 108.1 53.4 -67.2 -36.5 -1.4 30.7 148.0 222 15 B A H X S+ 0 0 44 -4,-2.4 4,-0.6 2,-0.2 -1,-0.2 0.915 114.3 43.3 -63.0 -42.5 -2.6 27.6 146.2 223 16 B L H >< S+ 0 0 17 -4,-2.0 3,-0.7 -5,-0.2 4,-0.3 0.923 115.7 48.7 -64.9 -45.4 0.6 25.9 147.1 224 17 B R H >< S+ 0 0 1 -4,-2.7 3,-0.8 1,-0.2 -2,-0.2 0.875 109.5 50.3 -66.9 -37.9 0.5 27.2 150.7 225 18 B R H 3< S+ 0 0 61 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.639 111.8 50.8 -75.5 -10.5 -3.1 26.2 151.3 226 19 B S T << S+ 0 0 63 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.288 76.5 136.8-110.6 7.8 -2.4 22.7 150.1 227 20 B V < - 0 0 7 -3,-0.8 4,-0.3 -4,-0.3 -3,-0.0 -0.235 47.8-121.4 -60.3 140.6 0.7 21.6 152.0 228 21 B K S S+ 0 0 156 2,-0.1 2,-0.2 131,-0.0 72,-0.1 -0.999 97.3 49.5-125.2 133.3 1.0 18.1 153.6 229 22 B P S S- 0 0 54 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.456 114.2-103.9 -61.3 151.9 1.4 17.6 156.5 230 23 B T - 0 0 43 -2,-0.2 130,-1.9 1,-0.1 2,-0.4 -0.175 35.0-129.1 -52.2 141.2 -1.5 20.0 157.2 231 24 B A B -N 359 0G 12 -4,-0.3 132,-1.4 128,-0.3 128,-0.3 -0.775 20.3-171.3 -98.9 138.9 -0.4 23.4 158.5 232 25 B R S S+ 0 0 66 126,-3.2 133,-2.4 -2,-0.4 134,-0.2 0.631 88.3 30.5 -98.2 -14.4 -1.9 25.1 161.6 233 26 B N S S+ 0 0 8 125,-0.7 2,-0.7 131,-0.1 -1,-0.1 0.036 73.5 143.6-135.5 29.3 -0.2 28.5 161.1 234 27 B M - 0 0 3 139,-0.2 141,-3.1 124,-0.2 87,-0.1 -0.624 39.6-144.2 -79.3 112.7 0.2 29.1 157.3 235 28 B L B -o 375 0H 1 85,-1.9 2,-0.3 -2,-0.7 141,-0.2 -0.434 15.3-112.9 -75.6 149.8 -0.4 32.8 156.5 236 29 B Q - 0 0 65 139,-2.5 2,-0.3 -2,-0.1 -1,-0.1 -0.625 34.3-133.9 -75.8 135.5 -2.0 34.1 153.4 237 30 B M - 0 0 3 -2,-0.3 2,-0.3 -20,-0.2 87,-0.2 -0.642 23.4-177.1 -90.5 150.1 0.4 36.0 151.1 238 31 B K E -h 324 0C 104 85,-2.1 87,-2.5 -2,-0.3 2,-0.2 -0.955 33.1 -90.3-138.6 162.4 -0.3 39.4 149.5 239 32 B W E -h 325 0C 40 -2,-0.3 2,-0.4 85,-0.2 87,-0.2 -0.446 31.9-165.3 -70.7 139.8 1.6 41.6 147.1 240 33 B N > - 0 0 36 85,-2.4 4,-1.7 -2,-0.2 5,-0.1 -0.979 9.3-159.8-129.0 119.2 3.9 44.3 148.5 241 34 B S H > S+ 0 0 74 -2,-0.4 4,-1.9 2,-0.2 5,-0.1 0.812 91.5 56.6 -70.1 -33.3 5.0 47.0 146.1 242 35 B H H > S+ 0 0 84 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.911 109.2 47.6 -63.0 -44.9 8.1 48.1 148.1 243 36 B A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 83,-0.2 0.880 109.9 54.4 -59.0 -41.8 9.3 44.5 148.0 244 37 B A H X S+ 0 0 14 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.859 105.6 52.0 -61.4 -39.5 8.6 44.5 144.2 245 38 B Q H X S+ 0 0 107 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.911 110.0 48.2 -64.4 -46.3 10.8 47.7 143.8 246 39 B N H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.936 111.9 50.0 -57.4 -48.1 13.7 46.1 145.6 247 40 B A H X S+ 0 0 0 -4,-2.3 4,-3.2 1,-0.2 -2,-0.2 0.913 110.6 50.0 -58.3 -46.4 13.3 42.9 143.5 248 41 B K H X S+ 0 0 119 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.913 107.3 53.5 -58.6 -48.2 13.3 45.0 140.3 249 42 B R H < S+ 0 0 123 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.875 115.7 40.7 -56.1 -38.7 16.4 46.9 141.2 250 43 B W H >< S+ 0 0 36 -4,-1.9 3,-1.4 -5,-0.2 5,-0.5 0.943 113.5 51.9 -74.1 -48.2 18.2 43.6 141.8 251 44 B A H >< S+ 0 0 0 -4,-3.2 3,-1.8 1,-0.3 -2,-0.2 0.855 102.5 59.8 -57.7 -39.4 16.8 41.8 138.7 252 45 B D T 3< S+ 0 0 89 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.667 91.5 69.1 -65.9 -17.8 17.8 44.6 136.3 253 46 B R T < S- 0 0 173 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.574 96.7-141.1 -75.7 -11.9 21.4 44.1 137.3 254 47 B i < + 0 0 37 -3,-1.8 2,-0.5 -4,-0.3 -3,-0.1 0.799 52.3 136.2 57.4 37.6 21.3 40.8 135.5 255 48 B T - 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0 0 140 -4,-1.6 -3,-0.1 1,-0.2 -4,-0.1 0.770 65.1 -77.6 57.5 28.6 5.4 24.2 245.5 815 190 D f T 3 S+ 0 0 25 -5,-0.4 -1,-0.2 -6,-0.3 -5,-0.1 0.770 103.8 128.1 48.7 34.3 2.2 25.3 243.7 816 191 D Q < + 0 0 147 -3,-1.5 2,-0.3 -6,-0.1 -2,-0.1 0.600 48.6 87.8 -87.8 -13.0 0.5 25.9 247.1 817 192 D T S > S- 0 0 60 1,-0.1 4,-1.4 -4,-0.0 3,-0.2 -0.710 76.5-136.6 -91.1 137.4 -0.6 29.4 246.0 818 193 D E H >> S+ 0 0 119 -2,-0.3 4,-1.8 1,-0.2 3,-0.6 0.944 98.8 48.1 -58.4 -57.8 -3.9 29.7 244.2 819 194 D W H 3> S+ 0 0 119 1,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.768 107.9 58.3 -59.8 -28.2 -3.1 32.2 241.4 820 195 D I H 3> S+ 0 0 7 -3,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.896 105.4 48.6 -68.5 -42.2 0.0 30.1 240.5 821 196 D K H << S+ 0 0 53 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.892 117.0 43.2 -62.5 -40.9 -2.1 27.0 239.9 822 197 D K H < S+ 0 0 139 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.943 124.2 34.3 -66.4 -49.9 -4.4 29.1 237.7 823 198 D K H < S+ 0 0 87 -4,-3.0 -21,-2.9 1,-0.2 -20,-0.5 0.629 124.2 40.8 -88.4 -18.0 -1.7 31.0 235.9 824 199 D e X + 0 0 0 -4,-2.4 4,-2.2 -23,-0.2 5,-0.2 -0.340 64.2 147.8-125.4 52.6 1.0 28.3 235.7 825 200 D P H >>S+ 0 0 18 0, 0.0 4,-3.5 0, 0.0 5,-0.7 0.871 72.9 52.7 -60.5 -40.3 -1.0 25.0 234.9 826 201 D A H >5S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -27,-0.1 0.977 113.7 41.5 -56.5 -58.2 1.9 23.5 232.8 827 202 D S H 45S+ 0 0 21 1,-0.2 -1,-0.2 2,-0.2 -6,-0.1 0.807 124.9 38.3 -60.4 -32.1 4.5 24.0 235.6 828 203 D f H <5S+ 0 0 12 -4,-2.2 -2,-0.2 -8,-0.2 -1,-0.2 0.873 128.1 23.7 -87.4 -41.0 2.1 22.9 238.3 829 204 D F H <5S+ 0 0 92 -4,-3.5 2,-0.8 -5,-0.2 -3,-0.2 0.681 91.7 95.8-108.9 -22.5 -0.0 20.1 236.8 830 205 D d << - 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