==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DEHALOGENASE 31-AUG-93 2EDC . COMPND 2 MOLECULE: HALOALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOBACTER AUTOTROPHICUS; . AUTHOR K.H.G.VERSCHUEREN,B.W.DIJKSTRA . 310 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12720.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 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 . 20 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 17.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 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 1 1 1 0 2 1 1 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 1 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 0 PARALLEL BRIDGES PER LADDER . 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 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 1 A M 0 0 208 0, 0.0 2,-0.6 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0 -42.5 11.1 90.1 46.1 2 2 A I - 0 0 59 30,-0.4 2,-0.3 90,-0.0 29,-0.0 -0.963 360.0-127.7-109.3 105.4 12.8 92.4 43.5 3 3 A N + 0 0 108 -2,-0.6 89,-2.2 88,-0.1 90,-0.4 -0.437 44.9 159.2 -62.1 120.1 10.0 93.3 41.1 4 4 A A E -A 91 0A 27 87,-0.3 2,-0.3 -2,-0.3 211,-0.0 -0.903 29.0-144.6-139.8 164.8 11.3 92.5 37.5 5 5 A I E -A 90 0A 49 85,-1.5 85,-3.0 -2,-0.3 2,-0.4 -0.928 12.8-134.9-131.4 161.2 10.0 91.8 34.1 6 6 A R - 0 0 114 -2,-0.3 83,-0.1 83,-0.2 82,-0.1 -0.944 20.0-120.3-122.1 138.1 11.1 89.6 31.3 7 7 A T - 0 0 9 -2,-0.4 203,-0.1 81,-0.3 201,-0.0 -0.587 40.6-102.9 -73.1 130.3 11.4 90.5 27.6 8 8 A P > - 0 0 66 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.336 23.6-130.4 -57.3 132.2 9.3 88.3 25.3 9 9 A D G > S+ 0 0 104 1,-0.3 3,-2.3 2,-0.2 4,-0.2 0.829 103.5 73.1 -53.4 -35.5 11.4 85.7 23.6 10 10 A Q G > S+ 0 0 156 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.767 81.2 72.2 -53.3 -28.7 9.8 86.7 20.3 11 11 A R G < S+ 0 0 99 -3,-2.1 -1,-0.3 1,-0.3 3,-0.2 0.674 98.5 48.0 -61.7 -20.6 11.8 90.0 20.4 12 12 A F G X S+ 0 0 14 -3,-2.3 3,-1.2 -4,-0.2 -1,-0.3 0.244 79.0 105.3-102.9 7.5 14.9 88.0 19.6 13 13 A S T < S+ 0 0 81 -3,-1.6 -1,-0.1 1,-0.2 -2,-0.1 0.908 84.9 37.3 -53.8 -46.8 13.6 86.0 16.7 14 14 A N T 3 S+ 0 0 154 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 -0.008 77.5 156.8-103.0 28.4 15.3 87.8 13.9 15 15 A L < - 0 0 36 -3,-1.2 3,-0.5 3,-0.1 2,-0.5 -0.267 38.6-128.9 -58.8 139.5 18.7 88.7 15.4 16 16 A D S S- 0 0 59 185,-0.3 -1,-0.1 1,-0.2 -2,-0.0 -0.804 83.4 -6.6 -92.5 122.2 21.5 89.4 12.9 17 17 A Q S S+ 0 0 135 -2,-0.5 -1,-0.2 1,-0.1 -2,-0.0 0.838 100.6 117.9 58.4 39.1 24.8 87.5 13.4 18 18 A Y + 0 0 19 -3,-0.5 -3,-0.1 1,-0.1 -1,-0.1 -0.592 18.4 146.9-131.2 72.6 23.7 86.1 16.7 19 19 A P + 0 0 106 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.156 32.9 125.8 -93.3 19.6 23.6 82.2 16.5 20 20 A F - 0 0 20 1,-0.1 21,-0.1 -3,-0.0 44,-0.0 -0.686 58.9-125.0 -85.3 136.7 24.5 81.6 20.1 21 21 A S - 0 0 77 -2,-0.3 19,-0.4 19,-0.1 2,-0.2 -0.415 28.5-110.0 -78.9 145.6 22.3 79.5 22.3 22 22 A P - 0 0 57 0, 0.0 2,-0.3 0, 0.0 17,-0.1 -0.575 27.8-172.2 -82.7 148.5 21.0 80.8 25.5 23 23 A N E -B 38 0B 52 15,-1.1 15,-2.1 -2,-0.2 2,-0.3 -0.946 12.3-169.5-134.1 136.8 22.1 79.6 28.9 24 24 A Y E -B 37 0B 70 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.942 16.3-166.6-133.3 158.7 20.2 80.8 32.0 25 25 A L E +B 36 0B 5 11,-1.3 11,-2.5 -2,-0.3 3,-0.1 -0.983 12.6 168.3-140.6 130.0 20.7 80.8 35.8 26 26 A D E + 0 0 93 -2,-0.3 7,-0.9 9,-0.2 9,-0.1 0.101 67.4 74.0-129.9 18.3 17.8 81.7 38.2 27 27 A D E +B 32 0B 84 5,-0.1 -1,-0.1 6,-0.1 8,-0.1 -0.316 57.9 147.3-126.9 46.3 19.4 80.4 41.4 28 28 A L E > -B 31 0B 7 3,-0.6 2,-0.7 6,-0.4 3,-0.6 -0.606 56.5-110.5 -83.0 149.0 22.0 83.0 42.1 29 29 A P T 3 S+ 0 0 101 0, 0.0 79,-0.1 0, 0.0 -1,-0.1 -0.751 107.2 16.6 -81.9 116.8 22.7 83.7 45.8 30 30 A G T 3 S+ 0 0 70 -2,-0.7 75,-0.1 78,-0.0 74,-0.0 0.045 116.0 74.9 110.3 -19.1 21.3 87.2 46.5 31 31 A Y E X -B 28 0B 17 -3,-0.6 3,-1.5 3,-0.1 -3,-0.6 -0.398 68.6-175.9-122.3 52.5 19.2 87.3 43.3 32 32 A P E 3 S+B 27 0B 61 0, 0.0 -30,-0.4 0, 0.0 -5,-0.1 -0.259 70.2 0.5 -57.8 121.2 16.2 85.0 44.0 33 33 A G E 3 S+ 0 0 62 -7,-0.9 2,-0.5 1,-0.3 -6,-0.1 0.378 99.5 121.3 80.1 -4.6 13.8 84.5 41.2 34 34 A L E < - 0 0 4 -3,-1.5 2,-0.5 -6,-0.1 -6,-0.4 -0.795 53.9-145.5 -92.8 126.7 15.8 86.7 38.8 35 35 A R E - 0 0 47 -2,-0.5 54,-2.7 -3,-0.1 2,-0.4 -0.859 10.2-160.0-100.1 130.0 17.0 84.9 35.6 36 36 A A E -B 25 0B 2 -11,-2.5 -11,-1.3 -2,-0.5 2,-0.4 -0.868 6.5-146.4-106.3 134.7 20.3 85.8 34.1 37 37 A H E +B 24 0B 1 44,-0.5 44,-3.0 -2,-0.4 2,-0.3 -0.853 23.8 167.2-107.3 140.8 21.2 85.0 30.4 38 38 A Y E -BC 23 80B 25 -15,-2.1 -15,-1.1 -2,-0.4 2,-0.4 -0.982 31.0-128.8-145.3 154.6 24.9 84.2 29.4 39 39 A L E - C 0 79B 1 40,-1.5 40,-2.0 -2,-0.3 2,-0.4 -0.817 17.8-172.3-101.3 141.9 26.6 82.7 26.3 40 40 A D E + C 0 78B 33 -19,-0.4 2,-0.3 -2,-0.4 38,-0.2 -0.835 20.4 170.3-141.2 95.6 29.0 79.8 26.9 41 41 A E E + C 0 77B 52 36,-1.8 36,-3.5 -2,-0.4 2,-0.1 -0.787 35.2 20.9-115.7 150.2 30.8 79.1 23.7 42 42 A G S S- 0 0 41 -2,-0.3 2,-0.5 34,-0.2 34,-0.2 -0.348 110.8 -13.7 85.2-169.1 33.8 76.9 22.7 43 43 A N > - 0 0 93 32,-0.3 3,-2.5 28,-0.3 -2,-0.1 -0.485 54.9-153.3 -67.5 109.8 35.1 73.9 24.6 44 44 A S T 3 S+ 0 0 65 -2,-0.5 -1,-0.1 1,-0.3 32,-0.1 0.437 96.4 53.1 -66.5 -0.9 33.6 73.9 28.1 45 45 A D T 3 S+ 0 0 147 30,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.026 80.8 135.2-116.4 12.2 36.6 72.0 29.4 46 46 A A < - 0 0 16 -3,-2.5 29,-0.1 1,-0.1 28,-0.0 -0.345 58.8-136.2 -62.2 146.8 39.0 74.6 27.9 47 47 A E S S+ 0 0 149 27,-0.2 2,-0.4 1,-0.0 69,-0.1 0.874 90.6 61.1 -70.5 -38.5 41.8 75.6 30.3 48 48 A D - 0 0 37 26,-0.3 28,-2.8 70,-0.0 2,-0.4 -0.735 65.5-169.9 -92.1 131.0 41.3 79.3 29.2 49 49 A V E -de 76 118B 6 68,-1.8 70,-2.6 -2,-0.4 2,-0.6 -0.983 10.1-154.0-121.5 129.9 38.0 81.1 29.8 50 50 A F E -de 77 119B 0 26,-3.0 28,-2.9 -2,-0.4 2,-0.8 -0.922 9.8-158.1-101.2 118.4 37.4 84.6 28.2 51 51 A L E -de 78 120B 0 68,-2.4 70,-2.7 -2,-0.6 2,-0.8 -0.865 8.7-161.2-103.2 107.6 34.9 86.5 30.4 52 52 A C E - e 0 121B 1 26,-3.3 2,-0.4 -2,-0.8 70,-0.2 -0.795 5.6-168.3 -98.5 104.9 33.3 89.2 28.2 53 53 A L - 0 0 0 68,-2.1 70,-0.4 -2,-0.8 73,-0.2 -0.781 5.0-155.3 -98.4 127.6 31.6 92.0 30.0 54 54 A H - 0 0 1 26,-0.5 2,-0.1 -2,-0.4 69,-0.1 -0.302 7.5-159.0 -90.9 175.0 29.3 94.5 28.3 55 55 A G > + 0 0 0 70,-0.2 3,-1.2 4,-0.2 69,-0.1 -0.388 39.9 2.2-132.6-147.9 28.4 98.1 29.2 56 56 A E T 3 S- 0 0 3 1,-0.3 3,-0.1 -2,-0.1 -1,-0.1 -0.697 120.7 -12.0 -86.8 131.1 25.8 100.8 28.6 57 57 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 162,-0.1 -0.466 115.1 82.9-116.4 52.0 23.4 100.4 26.9 58 58 A T < - 0 0 1 -3,-1.2 28,-0.4 27,-0.1 2,-0.3 0.101 50.8-148.5 -97.4-151.0 24.3 97.1 25.2 59 59 A W > - 0 0 1 26,-0.1 3,-2.4 -3,-0.1 -4,-0.2 -0.881 53.0 -65.2-166.2-179.2 24.3 93.3 25.8 60 60 A S G > S+ 0 0 1 1,-0.3 3,-2.6 -2,-0.3 4,-0.3 0.724 118.3 81.5 -54.5 -22.9 26.3 90.2 24.9 61 61 A Y G > S+ 0 0 0 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.809 80.3 69.6 -53.7 -25.8 25.3 91.0 21.3 62 62 A L G < S+ 0 0 1 -3,-2.4 3,-0.3 1,-0.3 -1,-0.3 0.725 95.2 49.5 -68.5 -21.7 28.1 93.4 21.4 63 63 A Y G X> S+ 0 0 0 -3,-2.6 4,-2.5 1,-0.2 3,-1.7 0.345 75.0 116.5 -99.1 9.6 30.8 90.7 21.5 64 64 A R T <4 S+ 0 0 10 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.575 77.2 44.6 -54.2 -14.4 29.4 88.8 18.5 65 65 A K T 34 S+ 0 0 80 -3,-0.3 -1,-0.3 227,-0.2 4,-0.2 0.561 116.6 46.0-104.2 -11.8 32.4 89.3 16.3 66 66 A M T X> S+ 0 0 0 -3,-1.7 4,-1.9 2,-0.1 3,-0.9 0.777 96.7 73.3 -93.6 -39.4 34.9 88.5 19.0 67 67 A I H 3X S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.3 3,-0.2 0.855 97.4 45.2 -41.3 -56.9 33.3 85.4 20.4 68 68 A P H 3> S+ 0 0 63 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.741 108.8 56.7 -67.9 -26.5 34.1 83.1 17.5 69 69 A V H <4 S+ 0 0 9 -3,-0.9 4,-0.4 -4,-0.2 -2,-0.2 0.899 111.8 42.4 -72.6 -35.0 37.7 84.3 17.3 70 70 A F H ><>S+ 0 0 0 -4,-1.9 5,-1.6 1,-0.2 3,-0.7 0.890 114.7 50.2 -71.0 -42.2 38.3 83.3 20.9 71 71 A A H ><5S+ 0 0 22 -4,-2.3 3,-1.6 1,-0.2 -28,-0.3 0.869 105.9 55.5 -65.8 -41.1 36.4 80.1 20.6 72 72 A E T 3<5S+ 0 0 176 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.615 99.3 64.3 -66.9 -14.4 38.4 79.0 17.4 73 73 A S T < 5S- 0 0 62 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.458 126.0 -98.6 -85.8 -6.8 41.5 79.5 19.5 74 74 A G T < 5S+ 0 0 46 -3,-1.6 -26,-0.3 1,-0.3 -27,-0.2 0.530 81.6 130.6 100.8 6.9 40.5 76.7 21.9 75 75 A A < - 0 0 0 -5,-1.6 2,-0.5 -29,-0.1 -32,-0.3 -0.505 59.0-123.8 -95.9 163.6 39.0 78.8 24.6 76 76 A R E - d 0 49B 38 -28,-2.8 -26,-3.0 -2,-0.2 2,-0.5 -0.881 30.0-154.0 -98.7 129.5 35.8 78.8 26.5 77 77 A V E -Cd 41 50B 2 -36,-3.5 -36,-1.8 -2,-0.5 2,-0.4 -0.935 11.2-171.8-111.3 128.0 34.0 82.1 26.1 78 78 A I E +Cd 40 51B 0 -28,-2.9 -26,-3.3 -2,-0.5 -38,-0.2 -0.960 8.6 170.8-119.3 129.5 31.5 83.4 28.7 79 79 A A E -C 39 0B 0 -40,-2.0 -40,-1.5 -2,-0.4 2,-0.2 -0.766 12.2-167.8-143.6 99.7 29.5 86.5 28.0 80 80 A P E -C 38 0B 4 0, 0.0 2,-0.6 0, 0.0 -26,-0.5 -0.466 19.1-131.5 -88.5 155.2 26.7 87.4 30.4 81 81 A D - 0 0 0 -44,-3.0 -44,-0.5 -2,-0.2 3,-0.1 -0.897 30.3-123.2-102.6 122.1 24.0 89.9 30.1 82 82 A F > - 0 0 3 -2,-0.6 3,-2.7 1,-0.1 6,-0.3 -0.292 38.3 -89.1 -61.6 147.9 23.6 92.2 33.2 83 83 A F T 3 S+ 0 0 0 1,-0.3 7,-0.2 4,-0.1 -1,-0.1 -0.355 122.6 37.6 -54.0 132.0 20.2 92.3 34.9 84 84 A G T 3 S+ 0 0 0 5,-1.7 -1,-0.3 1,-0.3 2,-0.3 0.302 112.9 75.1 104.0 -9.1 18.3 95.0 33.1 85 85 A F S X S- 0 0 0 -3,-2.7 3,-1.8 4,-0.3 -1,-0.3 -0.835 89.3 -15.0-136.1 169.5 19.9 94.1 29.7 86 86 A G T 3 S- 0 0 0 -28,-0.4 -79,-0.2 1,-0.3 -27,-0.1 -0.109 121.4 -22.8 44.7-124.8 19.8 91.6 26.8 87 87 A K T 3 S+ 0 0 24 -50,-0.1 -1,-0.3 -81,-0.1 -49,-0.1 0.412 110.4 102.5 -97.8 -0.8 18.0 88.5 27.8 88 88 A S S < S- 0 0 1 -3,-1.8 -81,-0.3 -6,-0.3 -52,-0.2 -0.386 85.0 -89.9 -76.9 165.6 18.4 88.7 31.5 89 89 A D - 0 0 8 -54,-2.7 -5,-1.7 -83,-0.1 -4,-0.3 -0.375 38.7-134.5 -71.8 153.4 15.4 89.8 33.6 90 90 A K E -A 5 0A 1 -85,-3.0 -85,-1.5 -7,-0.2 127,-0.1 -0.888 6.7-136.2-119.8 106.2 15.0 93.6 34.2 91 91 A P E -A 4 0A 1 0, 0.0 -87,-0.3 0, 0.0 126,-0.3 -0.287 17.0-140.3 -55.4 142.0 14.2 95.0 37.7 92 92 A V S S+ 0 0 37 -89,-2.2 2,-0.5 125,-0.1 -88,-0.1 0.629 76.2 72.2 -81.3 -21.6 11.6 97.7 37.2 93 93 A D > - 0 0 89 -90,-0.4 3,-2.0 1,-0.1 4,-0.4 -0.847 68.6-145.0-100.9 126.3 12.8 100.3 39.7 94 94 A E G > S+ 0 0 53 -2,-0.5 3,-0.9 1,-0.3 -1,-0.1 0.770 98.3 69.9 -59.7 -23.3 15.9 102.4 39.1 95 95 A E G 3 S+ 0 0 160 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.678 87.0 64.9 -67.0 -18.8 16.6 102.2 42.8 96 96 A D G < S+ 0 0 42 -3,-2.0 2,-0.6 2,-0.0 -1,-0.2 0.601 86.5 83.2 -77.9 -18.3 17.4 98.5 42.6 97 97 A Y < + 0 0 1 -3,-0.9 2,-0.2 -4,-0.4 3,-0.0 -0.819 54.6 149.3 -96.3 124.2 20.4 99.0 40.5 98 98 A T > - 0 0 51 -2,-0.6 4,-1.3 1,-0.1 5,-0.2 -0.829 59.2-100.8-138.7 172.3 23.6 100.0 42.3 99 99 A F H > S+ 0 0 3 -2,-0.2 4,-1.8 1,-0.2 3,-0.1 0.943 124.4 44.2 -63.6 -44.4 27.3 99.5 41.7 100 100 A E H > S+ 0 0 80 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.865 105.1 61.3 -70.3 -38.3 27.4 96.6 44.2 101 101 A F H > S+ 0 0 25 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.887 114.6 35.7 -57.8 -37.4 24.2 95.0 42.9 102 102 A H H X S+ 0 0 1 -4,-1.3 4,-1.0 2,-0.2 -1,-0.2 0.817 117.1 54.4 -86.6 -27.6 25.8 94.5 39.5 103 103 A R H X S+ 0 0 26 -4,-1.8 4,-1.3 -5,-0.2 3,-0.4 0.923 108.9 47.0 -69.1 -42.5 29.2 93.8 41.1 104 104 A N H X S+ 0 0 68 -4,-3.5 4,-2.3 1,-0.2 -1,-0.2 0.796 104.3 60.8 -67.5 -32.0 27.9 91.0 43.3 105 105 A F H X S+ 0 0 0 -4,-0.9 4,-1.7 -5,-0.3 -1,-0.2 0.826 106.1 50.0 -61.9 -32.3 26.0 89.5 40.4 106 106 A L H X S+ 0 0 0 -4,-1.0 4,-2.0 -3,-0.4 -2,-0.2 0.814 110.3 45.8 -78.0 -37.4 29.4 89.0 38.8 107 107 A L H X S+ 0 0 35 -4,-1.3 4,-2.7 2,-0.2 -2,-0.2 0.849 113.1 52.3 -72.7 -38.7 31.2 87.4 41.7 108 108 A A H X S+ 0 0 14 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.899 110.1 48.2 -61.4 -45.0 28.1 85.2 42.1 109 109 A L H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.883 111.5 49.6 -62.5 -50.0 28.3 84.2 38.4 110 110 A I H X>S+ 0 0 6 -4,-2.0 5,-1.2 2,-0.2 4,-0.9 0.949 113.8 45.6 -60.4 -46.9 32.1 83.4 38.7 111 111 A E H ><5S+ 0 0 129 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.972 112.1 51.5 -58.7 -53.2 31.6 81.3 41.8 112 112 A R H 3<5S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.811 118.9 34.5 -49.3 -44.5 28.6 79.4 40.3 113 113 A L H 3<5S- 0 0 26 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.509 102.6-135.6 -91.2 -7.4 30.3 78.4 37.1 114 114 A D T <<5 - 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0 0 57 0, 0.0 3,-1.7 0, 0.0 5,-0.8 0.512 66.7-140.6 -81.9 172.3 33.3 118.3 26.3 169 169 A A T 3 5S+ 0 0 78 1,-0.3 5,-0.2 4,-0.1 -2,-0.1 0.856 106.0 49.8 -63.2 -33.0 29.6 119.2 25.9 170 170 A D T 3 5S+ 0 0 81 3,-0.1 -1,-0.3 4,-0.1 91,-0.1 0.169 108.8 64.8 -90.0 19.2 29.3 116.7 23.0 171 171 A G T X>5S- 0 0 0 -3,-1.7 4,-2.3 -7,-0.1 3,-1.0 0.301 119.8 -16.2-107.8-126.4 30.9 113.9 25.1 172 172 A F H 3>5S+ 0 0 6 -8,-0.7 4,-2.7 89,-0.3 5,-0.3 0.828 134.0 59.7 -55.0 -32.3 29.5 112.3 28.2 173 173 A T H 3> S+ 0 0 26 -3,-1.0 4,-2.5 -6,-0.3 -2,-0.2 0.890 113.8 52.3 -75.8 -43.7 25.4 114.5 25.3 175 175 A W H X S+ 0 0 3 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.963 113.2 43.3 -56.2 -54.6 25.5 110.8 25.9 176 176 A K H X S+ 0 0 59 -4,-2.7 4,-2.7 1,-0.2 5,-0.4 0.921 112.0 52.8 -59.3 -45.3 23.8 111.1 29.2 177 177 A Y H X S+ 0 0 152 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.945 109.4 51.1 -57.2 -42.5 21.2 113.6 27.9 178 178 A D H < S+ 0 0 21 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.781 117.6 39.2 -62.4 -31.7 20.4 111.2 25.1 179 179 A L H < S+ 0 0 0 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.894 121.9 31.7 -91.1 -50.5 19.8 108.3 27.6 180 180 A V H < S+ 0 0 33 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.1 0.505 113.5 57.1 -94.1 -2.0 18.1 109.7 30.7 181 181 A T S < S+ 0 0 66 -4,-1.1 -3,-0.1 -5,-0.4 -1,-0.1 0.864 78.8 85.2-102.7 -37.2 16.0 112.4 29.2 182 182 A P - 0 0 49 0, 0.0 3,-0.4 0, 0.0 -4,-0.0 -0.409 56.2-155.8 -70.3 144.6 13.7 111.1 26.5 183 183 A S S S+ 0 0 113 1,-0.3 2,-0.3 -2,-0.1 30,-0.2 0.657 97.4 44.9 -84.7 -17.6 10.5 109.7 27.6 184 184 A D S S- 0 0 95 28,-0.1 2,-0.5 2,-0.0 -1,-0.3 -0.720 81.3-176.3-127.9 76.4 10.5 107.6 24.3 185 185 A L - 0 0 14 -3,-0.4 2,-0.6 -2,-0.3 -6,-0.1 -0.639 8.7-165.9 -79.3 120.8 14.1 106.3 24.2 186 186 A R > - 0 0 130 -2,-0.5 4,-2.0 1,-0.1 5,-0.1 -0.948 4.4-165.5-112.2 112.8 14.8 104.4 21.0 187 187 A L H > S+ 0 0 3 -2,-0.6 4,-2.1 1,-0.2 -1,-0.1 0.718 85.7 60.5 -74.2 -20.9 18.1 102.4 21.5 188 188 A D H > S+ 0 0 45 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.941 110.0 40.8 -70.6 -48.4 18.4 101.6 17.7 189 189 A Q H > S+ 0 0 121 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.904 114.9 52.3 -65.6 -43.6 18.6 105.4 16.8 190 190 A F H >X S+ 0 0 11 -4,-2.0 4,-1.8 1,-0.2 3,-0.6 0.928 111.2 48.0 -56.6 -47.0 20.8 106.1 19.9 191 191 A M H 3X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 7,-0.2 0.811 106.0 56.2 -63.0 -37.1 23.2 103.4 18.7 192 192 A K H 3< S+ 0 0 90 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.692 110.1 47.9 -69.7 -18.4 23.3 104.6 15.1 193 193 A R H << S+ 0 0 163 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.2 0.854 119.0 35.4 -86.6 -45.9 24.4 107.9 16.5 194 194 A W H < S+ 0 0 39 -4,-1.8 95,-0.5 1,-0.2 96,-0.4 0.572 129.3 35.7 -86.6 -10.6 27.1 106.7 18.8 195 195 A A S >< S+ 0 0 7 -4,-1.9 3,-2.2 -5,-0.1 -1,-0.2 -0.641 71.6 179.4-140.7 66.5 28.2 103.8 16.5 196 196 A P T 3 S+ 0 0 107 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 0.628 73.1 60.2 -47.7 -19.7 27.8 105.2 13.0 197 197 A T T 3 S+ 0 0 95 2,-0.0 -5,-0.1 0, 0.0 0, 0.0 0.573 75.7 112.8 -91.6 -7.1 29.0 102.1 11.1 198 198 A L < - 0 0 12 -3,-2.2 2,-0.1 -7,-0.2 -3,-0.0 -0.271 66.1-129.7 -59.9 151.5 26.3 99.8 12.5 199 199 A T > - 0 0 72 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.431 29.4-100.8 -93.6 179.6 23.9 98.6 9.8 200 200 A E H > S+ 0 0 156 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.807 122.8 55.3 -69.4 -30.0 20.2 98.9 10.5 201 201 A A H > S+ 0 0 40 2,-0.2 4,-1.1 1,-0.2 -185,-0.3 0.891 109.5 45.3 -68.7 -44.2 20.0 95.2 11.4 202 202 A E H > S+ 0 0 20 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.892 111.0 55.0 -63.5 -46.4 22.7 95.5 14.1 203 203 A A H >X S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.2 4,-0.6 0.920 106.6 49.5 -55.0 -45.5 21.0 98.7 15.4 204 204 A S H >X S+ 0 0 60 -4,-1.7 4,-0.9 1,-0.2 3,-0.7 0.819 100.8 65.2 -66.6 -30.3 17.7 97.0 15.9 205 205 A A H 3< S+ 0 0 1 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.834 100.0 52.6 -62.8 -30.7 19.4 94.2 17.7 206 206 A Y H << S+ 0 0 0 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.2 0.695 111.4 45.4 -79.7 -15.1 20.4 96.7 20.5 207 207 A A H X< S+ 0 0 15 -3,-0.7 3,-1.1 -4,-0.6 -1,-0.2 0.529 90.0 91.4 -99.0 -10.0 16.8 97.8 20.8 208 208 A A T 3< S+ 0 0 7 -4,-0.9 -2,-0.1 1,-0.2 -1,-0.1 0.907 79.2 56.4 -51.5 -43.3 15.5 94.2 20.8 209 209 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.744 101.3 60.5 -63.7 -25.6 15.6 93.8 24.5 210 210 A F < + 0 0 10 -3,-1.1 -23,-0.2 1,-0.2 3,-0.1 -0.813 49.8 174.2-114.5 95.0 13.4 96.8 25.3 211 211 A P S S- 0 0 46 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.783 77.3 -10.9 -63.0 -29.2 9.8 96.7 23.9 212 212 A D S > S- 0 0 84 -26,-0.0 3,-2.3 -28,-0.0 4,-0.2 -0.950 86.5 -80.3-164.1 168.3 8.9 99.9 25.8 213 213 A T G > S+ 0 0 56 1,-0.3 3,-2.0 -2,-0.3 -29,-0.0 0.683 114.9 73.1 -51.9 -25.7 10.3 102.2 28.5 214 214 A S G 3 S+ 0 0 55 1,-0.3 3,-0.5 2,-0.1 -1,-0.3 0.831 96.3 53.0 -62.8 -27.7 9.1 99.9 31.4 215 215 A Y G < S+ 0 0 34 -3,-2.3 3,-0.3 1,-0.2 -1,-0.3 0.448 96.3 71.7 -83.1 -1.4 11.9 97.6 30.4 216 216 A Q <> + 0 0 7 -3,-2.0 4,-2.0 -4,-0.2 -1,-0.2 0.044 51.2 113.7-112.6 32.4 14.7 100.3 30.6 217 217 A A H > S+ 0 0 0 -3,-0.5 4,-1.2 -126,-0.3 -1,-0.2 0.856 85.1 46.8 -66.7 -36.1 15.2 101.2 34.3 218 218 A G H > S+ 0 0 1 -3,-0.3 4,-1.2 -127,-0.3 -1,-0.2 0.817 108.7 55.3 -75.0 -34.7 18.7 99.7 34.2 219 219 A V H 4 S+ 0 0 0 -135,-0.2 3,-0.2 1,-0.2 -2,-0.2 0.915 110.1 46.2 -64.4 -43.9 19.4 101.6 31.0 220 220 A R H X S+ 0 0 54 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.781 110.0 54.7 -67.2 -30.8 18.4 105.0 32.7 221 221 A K H X S+ 0 0 39 -4,-1.2 4,-1.4 1,-0.2 -1,-0.2 0.790 91.4 68.6 -80.9 -29.4 20.5 104.3 35.9 222 222 A F H >X S+ 0 0 0 -4,-1.2 4,-0.8 1,-0.2 3,-0.6 0.938 100.0 48.1 -59.5 -48.7 24.0 103.6 34.5 223 223 A P H >> S+ 0 0 1 0, 0.0 4,-1.3 0, 0.0 3,-0.9 0.897 110.3 53.4 -59.9 -39.7 24.7 107.1 33.3 224 224 A K H 3X S+ 0 0 52 -4,-0.7 4,-1.5 1,-0.3 -2,-0.2 0.695 103.3 55.2 -68.2 -27.2 23.5 108.5 36.6 225 225 A M H << S+ 0 0 18 -4,-1.4 -1,-0.3 -3,-0.6 5,-0.1 0.650 105.2 54.6 -81.1 -10.6 25.9 106.3 38.6 226 226 A V H << S+ 0 0 5 -3,-0.9 3,-0.3 -4,-0.8 -2,-0.2 0.874 114.7 39.6 -80.3 -37.7 28.8 107.7 36.5 227 227 A A H < S+ 0 0 43 -4,-1.3 2,-0.3 1,-0.2 -2,-0.2 0.691 123.6 39.4 -81.1 -30.4 27.8 111.2 37.4 228 228 A Q S < S- 0 0 138 -4,-1.5 2,-0.4 -5,-0.1 -1,-0.2 -0.687 75.7-165.0-130.3 77.1 26.9 110.4 41.1 229 229 A R - 0 0 38 -3,-0.3 -3,-0.1 -2,-0.3 2,-0.1 -0.513 12.4-143.4 -66.3 115.0 29.4 107.9 42.6 230 230 A D >> - 0 0 72 -2,-0.4 4,-1.1 -5,-0.1 3,-0.6 -0.421 29.9-102.2 -74.2 158.9 28.0 106.4 45.9 231 231 A Q H 3> S+ 0 0 123 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.816 117.0 55.9 -55.1 -46.8 30.7 105.8 48.6 232 232 A A H 3> S+ 0 0 29 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.862 106.8 52.5 -56.2 -36.5 31.1 102.0 48.2 233 233 A C H <> S+ 0 0 3 -3,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.841 110.3 47.1 -66.0 -40.2 31.9 102.5 44.5 234 234 A I H X S+ 0 0 22 -4,-1.1 4,-2.1 2,-0.2 -80,-0.2 0.918 115.8 43.7 -69.9 -46.8 34.6 105.1 45.3 235 235 A D H X S+ 0 0 91 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.941 116.8 48.5 -63.5 -48.1 36.2 102.9 48.0 236 236 A I H X S+ 0 0 21 -4,-2.8 4,-1.4 -5,-0.3 -2,-0.2 0.954 114.7 42.6 -58.4 -49.9 35.9 99.8 45.8 237 237 A S H X S+ 0 0 0 -4,-2.7 4,-1.0 -85,-0.3 -1,-0.2 0.831 113.0 54.9 -67.6 -30.0 37.4 101.5 42.7 238 238 A T H X S+ 0 0 48 -4,-2.1 4,-1.0 1,-0.2 3,-0.3 0.901 106.7 48.9 -72.7 -38.3 40.2 103.2 44.7 239 239 A E H X S+ 0 0 125 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.845 106.0 59.2 -71.4 -25.3 41.3 100.0 46.3 240 240 A A H X S+ 0 0 0 -4,-1.4 4,-2.2 -5,-0.2 5,-0.3 0.827 94.7 63.3 -71.0 -25.3 41.4 98.4 42.8 241 241 A I H X S+ 0 0 14 -4,-1.0 4,-2.4 -3,-0.3 5,-0.2 0.966 102.8 50.3 -58.9 -44.4 43.9 101.0 41.6 242 242 A S H X>S+ 0 0 60 -4,-1.0 4,-2.4 1,-0.2 5,-0.6 0.822 108.1 54.0 -56.8 -40.0 46.3 99.6 44.2 243 243 A F H X>S+ 0 0 14 -4,-1.1 5,-2.3 3,-0.2 4,-1.1 0.917 111.1 42.8 -64.5 -52.7 45.6 96.0 42.9 244 244 A W H <5S+ 0 0 1 -4,-2.2 32,-2.6 3,-0.2 -2,-0.2 0.866 117.8 47.1 -69.1 -34.5 46.5 96.9 39.2 245 245 A Q H <5S+ 0 0 99 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.937 132.2 9.3 -74.8 -45.5 49.6 98.9 40.2 246 246 A N H <5S+ 0 0 96 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.795 130.2 39.7-108.0 -28.7 51.2 96.5 42.8 247 247 A D T < - h 0 284B 0 -2,-0.4 3,-1.5 6,-0.2 28,-0.2 -0.770 20.1-159.6 -86.9 106.5 39.0 103.5 20.1 258 258 A M T 3 S+ 0 0 59 26,-1.5 30,-0.2 -2,-0.9 -1,-0.2 0.686 83.1 58.0 -65.4 -24.3 40.6 106.9 19.0 259 259 A K T 3 S+ 0 0 134 28,-2.8 2,-0.5 25,-0.4 -1,-0.3 0.271 76.8 126.1 -91.0 14.4 37.4 108.6 18.0 260 260 A D < - 0 0 16 -3,-1.5 4,-0.4 28,-0.4 28,-0.1 -0.659 40.6-170.1 -81.9 128.2 35.9 108.2 21.5 261 261 A K S S+ 0 0 109 -2,-0.5 -89,-0.3 2,-0.1 -1,-0.2 0.662 84.4 40.0 -80.9 -24.6 34.6 111.4 23.1 262 262 A L S S+ 0 0 4 -91,-0.2 -90,-0.1 -90,-0.1 -98,-0.1 0.926 131.2 9.4 -90.0 -70.9 34.0 109.8 26.5 263 263 A L S S+ 0 0 1 -115,-0.1 -6,-0.2 -6,-0.1 -114,-0.2 -0.280 92.0 129.6-115.6 47.5 36.9 107.4 27.4 264 264 A G S >> S- 0 0 1 -4,-0.4 4,-2.0 -116,-0.1 3,-1.7 0.312 77.3 -44.1 -79.6-153.2 39.5 107.9 24.7 265 265 A P H 3> S+ 0 0 38 0, 0.0 4,-1.8 0, 0.0 -7,-0.1 0.685 129.7 61.4 -53.7 -30.3 43.2 108.6 24.9 266 266 A D H 34 S+ 0 0 123 1,-0.2 -3,-0.1 2,-0.2 -102,-0.0 0.630 116.5 32.6 -74.7 -13.3 43.0 111.1 27.7 267 267 A V H <> S+ 0 0 1 -3,-1.7 4,-0.8 2,-0.1 -1,-0.2 0.692 119.3 53.3-104.5 -35.4 41.5 108.5 30.0 268 268 A M H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.825 102.5 54.1 -73.4 -41.0 43.4 105.4 28.5 269 269 A Y H X S+ 0 0 96 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.934 110.4 48.8 -64.5 -42.8 47.0 106.6 28.7 270 270 A P H > S+ 0 0 43 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.877 111.2 49.3 -67.3 -27.7 46.4 107.3 32.4 271 271 A M H >X S+ 0 0 1 -4,-0.8 4,-1.1 1,-0.2 3,-1.0 0.946 104.5 59.6 -69.8 -45.6 44.9 103.8 32.9 272 272 A K H 3< S+ 0 0 68 -4,-2.9 3,-0.4 1,-0.3 6,-0.3 0.828 102.4 53.3 -51.3 -37.8 47.9 102.3 31.1 273 273 A A H 3< S+ 0 0 81 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.844 106.8 53.5 -70.8 -27.7 50.2 103.7 33.7 274 274 A L H << S+ 0 0 15 -3,-1.0 2,-0.8 -4,-0.9 -1,-0.2 0.666 91.2 79.9 -79.2 -20.4 48.3 102.2 36.5 275 275 A I S >< S- 0 0 3 -4,-1.1 3,-2.1 -3,-0.4 -30,-0.2 -0.822 85.4-126.3 -96.7 111.5 48.3 98.7 35.2 276 276 A N T 3 S+ 0 0 73 -32,-2.6 -26,-0.1 -2,-0.8 -2,-0.1 -0.245 91.2 7.9 -54.9 130.4 51.6 97.0 36.0 277 277 A G T 3 S+ 0 0 60 1,-0.2 -25,-0.3 -4,-0.1 -1,-0.3 0.489 83.1 155.2 76.9 3.6 53.1 95.5 32.9 278 278 A C < - 0 0 13 -3,-2.1 -1,-0.2 -6,-0.3 -25,-0.1 -0.462 31.2-147.5 -64.0 129.5 50.6 97.0 30.4 279 279 A P - 0 0 36 0, 0.0 -1,-0.1 0, 0.0 -25,-0.0 -0.089 36.8 -51.9 -89.7-169.9 52.3 97.3 27.0 280 280 A E - 0 0 180 1,-0.1 -26,-0.3 -27,-0.0 2,-0.2 -0.378 68.2-118.2 -59.3 136.7 52.0 99.8 24.1 281 281 A P - 0 0 21 0, 0.0 2,-0.9 0, 0.0 -26,-0.2 -0.502 10.2-122.0 -84.4 152.2 48.4 100.1 23.2 282 282 A L E -h 255 0B 39 -28,-2.7 -26,-2.1 -2,-0.2 2,-0.6 -0.764 29.6-153.9 -87.0 110.5 46.8 99.2 19.9 283 283 A E E -h 256 0B 96 -2,-0.9 2,-0.8 -28,-0.2 -26,-0.2 -0.743 3.4-158.1 -90.0 123.6 45.2 102.4 18.7 284 284 A I E > -h 257 0B 8 -28,-2.7 -26,-1.5 -2,-0.6 3,-1.4 -0.842 2.4-163.2-105.9 101.2 42.3 101.8 16.4 285 285 A A T 3 S+ 0 0 68 -2,-0.8 -1,-0.2 1,-0.2 -28,-0.0 0.783 84.3 43.1 -53.1 -39.9 41.8 105.1 14.4 286 286 A D T 3 S+ 0 0 109 -28,-0.1 2,-0.3 -27,-0.0 -1,-0.2 0.437 92.9 104.9 -93.5 1.0 38.2 104.5 13.0 287 287 A A < - 0 0 0 -3,-1.4 -28,-2.8 -31,-0.2 -27,-0.2 -0.626 46.8-170.9 -88.9 141.0 36.8 103.2 16.3 288 288 A G - 0 0 24 -2,-0.3 -28,-0.4 2,-0.2 -29,-0.1 0.139 57.6 -52.5 -98.9-146.0 34.5 105.1 18.6 289 289 A H S S+ 0 0 4 -95,-0.5 2,-1.6 -30,-0.2 3,-0.2 0.845 128.6 64.0 -65.8 -42.3 33.4 104.1 22.1 290 290 A F > + 0 0 5 -96,-0.4 3,-2.1 1,-0.2 -2,-0.2 -0.559 61.7 168.4 -85.7 73.8 32.1 100.7 21.1 291 291 A V G > + 0 0 0 -2,-1.6 3,-2.6 1,-0.3 -1,-0.2 0.758 67.6 75.6 -57.3 -24.9 35.6 99.3 20.0 292 292 A Q G > S+ 0 0 1 1,-0.3 3,-1.7 -3,-0.2 -1,-0.3 0.708 77.3 72.8 -62.8 -19.0 33.9 95.8 19.9 293 293 A E G < S+ 0 0 9 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.630 104.5 38.5 -71.4 -11.1 32.4 96.9 16.7 294 294 A F G <> S+ 0 0 55 -3,-2.6 4,-0.8 -4,-0.2 -1,-0.3 -0.333 88.8 131.4-125.4 41.1 35.9 96.5 15.3 295 295 A G H <> + 0 0 0 -3,-1.7 4,-3.4 1,-0.2 5,-0.3 0.753 49.9 68.0 -73.2 -35.7 36.3 93.4 17.5 296 296 A E H > S+ 0 0 98 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 106.4 45.5 -55.5 -39.0 37.7 90.7 15.1 297 297 A Q H > S+ 0 0 85 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.868 114.3 46.5 -69.9 -41.6 40.9 92.8 14.8 298 298 A V H X S+ 0 0 0 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.880 113.1 50.0 -69.4 -44.8 41.2 93.3 18.6 299 299 A A H X S+ 0 0 0 -4,-3.4 4,-2.0 2,-0.2 5,-0.2 0.938 114.0 44.7 -61.3 -47.6 40.5 89.7 19.3 300 300 A R H X S+ 0 0 124 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.905 114.3 48.3 -63.2 -45.3 43.2 88.5 16.8 301 301 A E H X S+ 0 0 69 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.910 110.6 51.5 -65.1 -40.5 45.8 90.9 17.9 302 302 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.910 111.9 44.5 -65.1 -43.9 45.3 90.1 21.5 303 303 A L H X S+ 0 0 36 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.783 112.4 54.5 -67.6 -29.4 45.6 86.4 21.0 304 304 A K H X S+ 0 0 94 -4,-1.8 4,-1.2 -5,-0.2 -2,-0.2 0.899 111.5 44.5 -68.4 -39.3 48.6 87.1 18.9 305 305 A H H < S+ 0 0 66 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.900 113.3 49.3 -68.4 -45.8 50.2 89.2 21.8 306 306 A F H >< S+ 0 0 3 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.770 107.5 56.3 -68.7 -23.1 49.4 86.6 24.4 307 307 A A H >< S+ 0 0 60 -4,-1.2 2,-0.8 1,-0.3 3,-0.5 0.866 90.4 68.2 -75.3 -40.0 50.9 83.8 22.3 308 308 A E T 3< S+ 0 0 147 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.1 0.032 105.9 49.8 -73.2 32.5 54.2 85.4 22.0 309 309 A T T < 0 0 81 -2,-0.8 -1,-0.3 -3,-0.5 -58,-0.1 -0.327 360.0 360.0-169.2 67.8 54.2 84.6 25.7 310 310 A E < 0 0 184 -3,-0.5 -2,-0.1 0, 0.0 -3,-0.1 0.183 360.0 360.0-161.4 360.0 53.3 80.9 26.4