==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE, HYDRLOASE 26-JUL-11 3T4U . COMPND 2 MOLECULE: ARYLESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS; . AUTHOR R.J.KAZLAUSKAS,T.YIN,V.M.PURPERO . 1626 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56298.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1223 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 192 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 90 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 230 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 555 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 8 1 3 6 6 0 0 0 5 19 2 4 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 0 12 12 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 7 0 6 5 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 . 6 0 0 0 0 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 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 S 0 0 55 0, 0.0 12,-2.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 160.0 89.5 -55.3 12.1 2 2 A T E -A 12 0A 62 10,-0.3 2,-0.3 50,-0.0 10,-0.2 -0.983 360.0-170.6-142.3 154.8 89.5 -51.7 13.1 3 3 A F E -A 11 0A 12 8,-1.6 8,-3.0 -2,-0.3 2,-0.5 -0.926 28.2-116.4-134.2 168.2 91.2 -49.4 15.6 4 4 A V E -A 10 0A 91 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.907 26.0-141.7-109.8 124.8 90.5 -45.8 16.5 5 5 A A > - 0 0 5 4,-3.0 3,-2.4 -2,-0.5 70,-0.1 -0.249 36.2 -88.8 -78.1 171.4 93.0 -43.1 15.7 6 6 A K T 3 S+ 0 0 192 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.873 127.9 46.9 -48.9 -44.9 93.8 -40.1 18.0 7 7 A D T 3 S- 0 0 79 1,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.434 125.5 -98.8 -82.4 4.5 91.2 -37.9 16.4 8 8 A G S < S+ 0 0 42 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.389 72.9 147.9 94.6 -2.5 88.5 -40.7 16.6 9 9 A T - 0 0 8 -5,-0.1 -4,-3.0 1,-0.1 2,-0.5 -0.519 44.6-134.8 -66.5 124.4 88.8 -41.8 12.9 10 10 A Q E -A 4 0A 77 -2,-0.3 51,-2.7 -6,-0.2 2,-0.5 -0.715 20.3-159.0 -81.7 126.8 88.1 -45.6 12.7 11 11 A I E -A 3 0A 2 -8,-3.0 -8,-1.6 -2,-0.5 2,-0.3 -0.918 7.0-140.8-112.6 130.1 90.7 -47.3 10.5 12 12 A Y E +A 2 0A 20 -2,-0.5 41,-2.5 41,-0.4 2,-0.3 -0.668 29.5 166.2 -85.7 140.7 90.1 -50.7 8.8 13 13 A F E -B 52 0B 4 -12,-2.8 2,-0.4 -2,-0.3 39,-0.3 -0.983 29.5-137.7-149.7 161.6 92.9 -53.2 8.6 14 14 A K E -B 51 0B 5 37,-2.8 37,-1.8 -2,-0.3 2,-0.4 -0.946 12.2-169.6-118.4 144.9 93.6 -56.9 7.9 15 15 A D E +B 50 0B 46 -2,-0.4 593,-0.4 35,-0.2 2,-0.4 -0.942 17.5 175.8-140.7 105.0 96.0 -58.9 10.0 16 16 A W E -B 49 0B 1 33,-3.3 33,-2.9 -2,-0.4 -2,-0.0 -0.913 35.6 -5.7-121.8 142.4 96.8 -62.3 8.5 17 17 A G S S- 0 0 24 -2,-0.4 2,-0.3 31,-0.2 31,-0.2 -0.146 71.3 -90.0 81.4-172.5 99.1 -65.2 9.4 18 18 A S S S+ 0 0 94 29,-0.4 2,-0.3 25,-0.3 -2,-0.0 -0.952 72.3 52.8-140.7 159.1 101.7 -65.5 12.1 19 19 A G S S+ 0 0 50 -2,-0.3 28,-0.2 28,-0.2 27,-0.1 -0.787 95.9 3.1 117.0-161.4 105.5 -64.8 12.3 20 20 A K S S- 0 0 133 26,-0.5 28,-2.0 -2,-0.3 2,-0.1 -0.403 83.9-115.2 -62.8 134.2 107.6 -61.7 11.6 21 21 A P E -c 48 0B 9 0, 0.0 68,-2.0 0, 0.0 2,-0.4 -0.441 26.6-169.9 -82.2 144.9 105.2 -58.9 10.6 22 22 A V E -cd 49 89B 2 26,-1.8 28,-2.9 66,-0.2 2,-0.5 -0.991 10.5-161.7-129.6 122.1 105.1 -57.1 7.2 23 23 A L E -cd 50 90B 0 66,-2.5 68,-2.6 -2,-0.4 2,-0.4 -0.931 5.2-156.7-116.1 123.4 102.9 -54.0 7.2 24 24 A F E -cd 51 91B 0 26,-2.7 28,-1.0 -2,-0.5 2,-0.5 -0.846 7.1-162.9-109.2 136.7 101.7 -52.6 3.8 25 25 A S E -cd 52 92B 0 66,-3.0 68,-2.5 -2,-0.4 71,-0.2 -0.966 23.4-136.4-121.9 112.7 100.7 -49.0 3.0 26 26 A H - 0 0 0 26,-0.5 6,-0.1 -2,-0.5 3,-0.1 0.036 12.1-111.3 -70.3 171.5 98.7 -48.6 -0.2 27 27 A G > - 0 0 0 4,-0.2 3,-0.5 1,-0.2 2,-0.4 0.224 53.8 -54.7 -82.5-155.0 98.8 -46.1 -3.1 28 28 A W T 3 S+ 0 0 12 1,-0.2 -1,-0.2 29,-0.0 3,-0.1 -0.701 116.9 3.9 -96.0 136.8 96.4 -43.4 -4.1 29 29 A I T 3 S+ 0 0 6 -2,-0.4 -1,-0.2 1,-0.2 2,-0.2 0.927 113.3 91.6 53.6 49.9 92.7 -44.2 -4.8 30 30 A L < - 0 0 12 -3,-0.5 28,-0.3 152,-0.1 2,-0.2 -0.720 60.6-148.8-146.2-173.3 93.2 -47.8 -3.8 31 31 A D > - 0 0 1 -2,-0.2 3,-1.8 26,-0.1 -4,-0.2 -0.827 46.8 -65.7-151.2-170.9 92.8 -49.6 -0.4 32 32 A A G > S+ 0 0 0 1,-0.3 3,-1.7 -2,-0.2 4,-0.1 0.698 119.2 74.8 -56.1 -22.7 94.3 -52.6 1.4 33 33 A D G > S+ 0 0 8 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.727 76.9 76.7 -66.9 -19.6 92.9 -55.0 -1.2 34 34 A M G < S+ 0 0 35 -3,-1.8 -1,-0.3 1,-0.3 3,-0.2 0.781 98.4 46.7 -58.3 -23.1 95.6 -53.8 -3.6 35 35 A W G X> S+ 0 0 0 -3,-1.7 4,-2.8 -4,-0.2 3,-0.6 0.392 76.4 110.7 -96.6 -0.4 97.9 -56.0 -1.5 36 36 A E H <> S+ 0 0 3 -3,-1.8 4,-2.4 1,-0.3 5,-0.2 0.800 80.6 46.6 -52.5 -40.3 95.8 -59.2 -1.3 37 37 A Y H 3> S+ 0 0 35 -4,-0.3 4,-2.2 -3,-0.2 -1,-0.3 0.873 114.0 46.4 -70.4 -39.4 98.1 -61.3 -3.5 38 38 A Q H <> S+ 0 0 1 -3,-0.6 4,-2.8 2,-0.2 5,-0.3 0.913 114.4 49.8 -68.3 -38.8 101.3 -60.3 -1.8 39 39 A M H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.921 113.3 44.3 -62.9 -49.2 99.6 -60.9 1.6 40 40 A E H X S+ 0 0 25 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.923 113.9 52.2 -61.3 -43.4 98.4 -64.4 0.7 41 41 A Y H < S+ 0 0 32 -4,-2.2 4,-0.2 1,-0.2 -2,-0.2 0.939 117.8 35.1 -59.5 -50.2 101.8 -65.1 -0.9 42 42 A L H ><>S+ 0 0 0 -4,-2.8 5,-1.6 1,-0.2 3,-1.2 0.879 115.3 53.9 -75.8 -40.5 103.8 -64.2 2.2 43 43 A S H ><5S+ 0 0 9 -4,-3.0 3,-0.7 -5,-0.3 -25,-0.3 0.771 105.8 54.7 -66.6 -23.3 101.3 -65.4 4.8 44 44 A S T 3<5S+ 0 0 59 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.563 107.6 53.7 -78.7 -11.8 101.3 -68.8 3.2 45 45 A R T < 5S- 0 0 114 -3,-1.2 -1,-0.2 -4,-0.2 -2,-0.2 -0.117 132.4 -79.6-119.2 31.0 105.1 -68.8 3.6 46 46 A G T < 5S+ 0 0 53 -3,-0.7 -26,-0.5 1,-0.3 2,-0.3 0.652 90.2 118.5 91.8 20.8 105.4 -68.1 7.3 47 47 A Y < - 0 0 26 -5,-1.6 2,-0.5 -28,-0.2 -29,-0.4 -0.853 59.4-129.2-115.6 154.9 104.9 -64.4 7.6 48 48 A R E - c 0 21B 62 -28,-2.0 -26,-1.8 -2,-0.3 2,-0.4 -0.891 29.5-162.7 -96.0 128.4 102.3 -62.2 9.3 49 49 A T E -Bc 16 22B 0 -33,-2.9 -33,-3.3 -2,-0.5 2,-0.4 -0.949 9.5-176.7-119.3 136.4 100.9 -59.6 6.9 50 50 A I E +Bc 15 23B 0 -28,-2.9 -26,-2.7 -2,-0.4 2,-0.3 -0.994 4.9 172.2-131.7 134.9 99.0 -56.5 7.9 51 51 A A E -Bc 14 24B 0 -37,-1.8 -37,-2.8 -2,-0.4 2,-0.3 -0.988 10.3-163.5-145.6 138.1 97.5 -53.9 5.6 52 52 A F E -Bc 13 25B 9 -28,-1.0 2,-0.6 -2,-0.3 -26,-0.5 -0.824 25.1-118.7-119.4 155.8 95.2 -50.9 6.4 53 53 A D - 0 0 0 -41,-2.5 -41,-0.4 -2,-0.3 3,-0.1 -0.883 42.3-119.9 -86.8 116.7 92.8 -48.7 4.5 54 54 A R > - 0 0 1 -2,-0.6 3,-2.5 1,-0.1 6,-0.3 -0.264 43.3 -80.1 -53.4 144.2 94.3 -45.2 4.8 55 55 A R T 3 S+ 0 0 3 1,-0.3 7,-0.2 11,-0.1 -1,-0.1 -0.213 123.5 24.8 -42.1 132.2 91.9 -42.7 6.5 56 56 A G T 3 S+ 0 0 0 5,-2.7 131,-2.9 1,-0.3 2,-0.3 0.370 111.4 88.7 87.4 -2.7 89.4 -41.5 3.8 57 57 A F S X S- 0 0 0 -3,-2.5 3,-2.3 4,-0.3 -1,-0.3 -0.828 85.9 -20.1-128.4 160.8 89.8 -44.7 1.7 58 58 A G T 3 S- 0 0 8 124,-0.5 -27,-0.1 -2,-0.3 -2,-0.0 -0.152 125.1 -14.9 49.3-127.1 88.3 -48.1 1.3 59 59 A R T 3 S+ 0 0 76 -47,-0.1 -1,-0.2 127,-0.0 2,-0.1 0.338 109.8 106.0 -94.5 3.9 86.4 -49.2 4.5 60 60 A S S < S- 0 0 5 -3,-2.3 -49,-0.2 -6,-0.3 -6,-0.1 -0.461 80.1 -92.6 -80.2 157.6 87.9 -46.6 6.8 61 61 A D - 0 0 30 -51,-2.7 -5,-2.7 -2,-0.1 -4,-0.3 -0.180 34.2-127.5 -59.0 164.0 86.1 -43.5 8.1 62 62 A Q - 0 0 15 -7,-0.2 225,-0.2 -6,-0.1 -1,-0.1 -0.704 28.0-173.3-124.1 75.4 86.3 -40.3 6.1 63 63 A P - 0 0 20 0, 0.0 225,-0.1 0, 0.0 124,-0.1 -0.399 25.4-139.9 -68.6 149.0 87.5 -37.3 8.3 64 64 A W S S+ 0 0 38 223,-0.4 3,-0.3 225,-0.1 2,-0.2 0.814 86.7 48.3 -68.4 -36.8 87.5 -33.8 6.9 65 65 A T S S+ 0 0 90 1,-0.2 3,-0.1 224,-0.1 125,-0.0 -0.595 90.8 44.6-107.4 165.2 90.8 -33.1 8.7 66 66 A G + 0 0 16 -2,-0.2 2,-1.9 1,-0.2 -1,-0.2 0.610 59.0 141.7 82.0 14.5 94.2 -34.9 9.1 67 67 A N + 0 0 10 -3,-0.3 2,-0.3 4,-0.1 130,-0.2 -0.442 45.8 98.1 -86.3 65.9 94.6 -35.8 5.4 68 68 A D S > S- 0 0 64 -2,-1.9 4,-2.6 -3,-0.1 3,-0.2 -0.941 86.3-101.8-151.1 162.7 98.3 -35.1 5.5 69 69 A Y H > S+ 0 0 4 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.825 115.1 56.9 -67.6 -34.9 101.6 -37.1 5.9 70 70 A D H > S+ 0 0 63 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.939 114.0 41.0 -57.9 -47.0 102.2 -36.3 9.6 71 71 A T H > S+ 0 0 32 2,-0.2 4,-2.7 -3,-0.2 -2,-0.2 0.917 113.8 52.1 -65.6 -44.5 98.8 -37.7 10.5 72 72 A F H X S+ 0 0 1 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.929 111.2 49.2 -56.5 -44.9 99.2 -40.7 8.0 73 73 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.884 111.8 47.6 -63.1 -37.9 102.5 -41.5 9.7 74 74 A D H X S+ 0 0 37 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.828 105.6 58.4 -75.6 -27.4 100.9 -41.2 13.2 75 75 A D H X S+ 0 0 8 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.898 108.2 47.9 -60.9 -42.8 98.0 -43.5 12.1 76 76 A I H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.927 109.7 51.4 -62.7 -47.8 100.7 -46.1 11.2 77 77 A A H X S+ 0 0 3 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.951 110.6 49.9 -53.6 -46.2 102.4 -45.6 14.6 78 78 A Q H X S+ 0 0 53 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.899 111.6 47.6 -64.0 -39.5 99.0 -46.1 16.3 79 79 A L H X S+ 0 0 2 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.950 112.3 48.9 -62.7 -50.9 98.4 -49.3 14.3 80 80 A I H <>S+ 0 0 0 -4,-3.1 5,-2.6 1,-0.2 4,-0.4 0.902 116.1 44.0 -54.2 -43.1 101.9 -50.7 15.1 81 81 A E H <5S+ 0 0 95 -4,-2.6 3,-0.3 -5,-0.2 -1,-0.2 0.849 108.5 57.4 -74.4 -33.7 101.3 -49.8 18.8 82 82 A H H <5S+ 0 0 106 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.890 119.0 32.1 -61.3 -39.5 97.8 -51.3 18.8 83 83 A L T <5S- 0 0 31 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.421 105.7-129.9 -95.6 -2.6 99.2 -54.6 17.6 84 84 A D T 5 - 0 0 93 -4,-0.4 -3,-0.2 -3,-0.3 2,-0.2 0.925 38.4-168.2 48.8 53.4 102.5 -54.1 19.5 85 85 A L < - 0 0 2 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.488 10.7-172.8 -75.4 142.2 104.4 -55.0 16.4 86 86 A K + 0 0 135 -2,-0.2 25,-0.1 1,-0.2 26,-0.1 -0.977 64.5 12.4-136.8 147.7 108.2 -55.7 16.5 87 87 A E S S+ 0 0 104 -2,-0.3 25,-0.3 23,-0.3 2,-0.2 0.894 85.5 178.6 50.7 47.2 110.8 -56.2 13.7 88 88 A V E - e 0 112B 0 23,-3.0 25,-2.5 -3,-0.1 26,-1.4 -0.536 27.4-143.8 -79.3 138.2 108.2 -55.0 11.2 89 89 A T E -de 22 114B 8 -68,-2.0 -66,-2.5 -2,-0.2 2,-0.4 -0.933 19.4-147.1 -97.6 122.1 109.1 -54.7 7.5 90 90 A L E -de 23 115B 0 24,-2.5 26,-3.1 -2,-0.6 2,-0.4 -0.780 14.6-172.3 -93.1 133.4 107.3 -51.6 6.1 91 91 A V E -de 24 116B 0 -68,-2.6 -66,-3.0 -2,-0.4 2,-0.4 -0.986 4.7-178.5-128.4 117.9 106.1 -51.8 2.5 92 92 A G E -de 25 117B 0 24,-2.5 26,-3.0 -2,-0.4 2,-0.4 -0.959 10.8-157.8-120.6 135.8 104.8 -48.6 0.8 93 93 A F E > - e 0 118B 2 -68,-2.5 3,-2.5 -2,-0.4 26,-0.2 -0.945 59.5 -43.2-110.7 134.7 103.4 -48.3 -2.7 94 94 A S T >> S+ 0 0 7 24,-2.6 3,-2.1 -2,-0.4 27,-1.3 -0.205 137.9 6.0 53.2-123.7 103.3 -44.9 -4.5 95 95 A M H >> S+ 0 0 0 1,-0.3 3,-1.0 25,-0.2 4,-0.7 0.787 126.7 69.0 -61.9 -24.0 102.0 -42.3 -2.1 96 96 A G H <> S+ 0 0 0 -3,-2.5 4,-1.4 1,-0.3 -1,-0.3 0.676 84.1 68.5 -67.7 -19.5 102.2 -45.0 0.6 97 97 A G H <> S+ 0 0 0 -3,-2.1 4,-1.9 -5,-0.2 -1,-0.3 0.857 96.6 58.1 -61.3 -33.3 106.0 -44.9 0.4 98 98 A G H S+ 0 0 23 1,-0.2 3,-2.0 100,-0.1 -1,-0.2 0.200 82.6 119.0-108.5 16.6 113.1 -47.3 13.6 110 110 A A T 3 S+ 0 0 101 -3,-0.3 -23,-0.3 1,-0.3 -1,-0.2 0.841 87.5 37.3 -53.1 -37.6 113.1 -49.2 16.9 111 111 A R T 3 S+ 0 0 64 -3,-0.3 -23,-3.0 -25,-0.1 2,-0.5 0.450 102.9 94.6 -91.4 0.3 110.2 -51.4 15.8 112 112 A V E < +e 88 0B 5 -3,-2.0 -23,-0.2 -25,-0.3 3,-0.1 -0.829 39.4 174.7-109.3 126.7 111.4 -51.6 12.1 113 113 A A E S- 0 0 14 -25,-2.5 2,-0.3 -2,-0.5 -24,-0.2 0.678 72.1 -15.4 -93.6 -26.1 113.5 -54.4 10.6 114 114 A G E -e 89 0B 0 -26,-1.4 -24,-2.5 98,-0.2 2,-0.4 -0.991 54.7-131.7-172.4 166.4 113.4 -53.2 7.0 115 115 A L E -ef 90 214B 0 98,-2.2 100,-2.2 -2,-0.3 2,-0.4 -0.999 9.9-166.9-135.1 136.4 111.8 -50.9 4.5 116 116 A V E -ef 91 215B 0 -26,-3.1 -24,-2.5 -2,-0.4 2,-0.6 -0.990 4.5-164.4-122.6 126.1 110.5 -51.5 0.9 117 117 A L E -ef 92 216B 1 98,-2.7 100,-3.1 -2,-0.4 2,-0.5 -0.928 8.6-171.9-111.9 113.8 109.6 -48.6 -1.4 118 118 A L E S-ef 93 217B 0 -26,-3.0 -24,-2.6 -2,-0.6 100,-0.2 -0.900 71.1 -30.4-111.7 120.0 107.5 -49.6 -4.5 119 119 A G S S- 0 0 0 98,-2.4 -1,-0.2 -2,-0.5 99,-0.1 0.824 99.0-179.8 42.3 37.1 106.8 -47.2 -7.3 120 120 A A - 0 0 2 97,-0.4 111,-0.4 -28,-0.2 -25,-0.2 -0.325 46.1-133.6 -82.8 146.3 107.1 -44.6 -4.5 121 121 A V + 0 0 0 -27,-1.3 3,-0.4 -3,-0.1 82,-0.2 0.579 62.8 150.8 -64.9 -14.3 106.7 -40.8 -4.4 122 122 A T + 0 0 0 -28,-0.3 112,-0.4 1,-0.3 111,-0.2 -0.406 51.0 17.1 -66.0 145.9 109.9 -40.7 -2.3 123 123 A P S S- 0 0 0 0, 0.0 80,-2.4 0, 0.0 81,-0.3 -0.994 133.1 -32.0 -91.3 -9.7 112.0 -38.7 -1.9 124 124 A L - 0 0 0 -3,-0.4 78,-0.1 105,-0.3 109,-0.1 -0.890 46.5-173.6-168.6 136.9 110.0 -35.9 -3.5 125 125 A F + 0 0 5 76,-0.5 10,-2.7 73,-0.4 74,-0.2 0.847 65.3 52.6-103.8 -57.7 107.4 -35.9 -6.2 126 126 A G B S-h 135 0C 0 72,-0.5 8,-0.2 73,-0.5 7,-0.1 -0.310 94.0 -82.1 -84.3 165.5 106.5 -32.3 -7.2 127 127 A Q - 0 0 72 8,-2.1 -1,-0.1 7,-0.2 -2,-0.1 -0.355 43.0-178.9 -62.8 144.6 108.8 -29.4 -8.1 128 128 A K B > -I 131 0D 62 3,-0.8 3,-1.8 -4,-0.1 6,-0.2 -0.828 47.6 -95.4-129.7 170.8 110.6 -27.3 -5.4 129 129 A P T 3 S+ 0 0 136 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.897 130.5 37.0 -57.5 -37.2 112.9 -24.3 -6.0 130 130 A D T 3 S+ 0 0 100 1,-0.2 3,-0.1 2,-0.1 -3,-0.0 0.192 118.0 55.4 -93.3 13.2 115.9 -26.7 -5.8 131 131 A Y B X +I 128 0D 11 -3,-1.8 3,-1.8 1,-0.1 -3,-0.8 -0.374 52.0 151.3-142.5 59.4 114.1 -29.5 -7.6 132 132 A P T 3 S+ 0 0 85 0, 0.0 -5,-0.1 0, 0.0 -1,-0.1 0.666 70.8 72.0 -65.1 -14.2 112.8 -28.1 -11.0 133 133 A Q T 3 S+ 0 0 107 -7,-0.1 -6,-0.1 -3,-0.1 96,-0.1 0.666 81.1 94.9 -73.1 -17.8 113.1 -31.7 -12.3 134 134 A G S < S- 0 0 5 -3,-1.8 -8,-0.3 -6,-0.2 -7,-0.2 -0.016 97.1 -69.5 -62.7 177.9 110.0 -32.7 -10.2 135 135 A V B -h 126 0C 23 -10,-2.7 -8,-2.1 1,-0.1 -1,-0.2 -0.563 58.5-108.2 -75.1 128.7 106.5 -32.8 -11.5 136 136 A P >> - 0 0 59 0, 0.0 3,-1.5 0, 0.0 4,-0.6 -0.265 21.1-126.4 -58.6 142.4 105.2 -29.3 -12.2 137 137 A L H >> S+ 0 0 67 1,-0.3 4,-2.4 2,-0.2 3,-0.5 0.785 106.4 71.3 -63.8 -29.4 102.5 -28.3 -9.6 138 138 A D H 3> S+ 0 0 130 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.770 91.9 59.5 -45.7 -38.7 100.2 -27.4 -12.6 139 139 A V H <> S+ 0 0 59 -3,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.913 108.6 41.6 -63.6 -42.8 99.9 -31.1 -13.2 140 140 A F H X S+ 0 0 66 -4,-2.5 4,-2.7 1,-0.2 3,-1.3 0.927 113.0 50.8 -67.7 -45.4 89.2 -32.9 -12.7 147 147 A L H 3X S+ 0 0 0 -4,-3.1 4,-0.7 -5,-0.3 -2,-0.2 0.879 107.5 54.3 -57.4 -38.8 88.4 -34.7 -9.4 148 148 A L H 3< S+ 0 0 63 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.502 114.4 40.9 -80.9 -4.8 86.3 -31.8 -8.3 149 149 A K H <4 S- 0 0 161 -3,-1.3 -2,-0.2 -4,-0.3 -1,-0.2 0.757 141.1 -12.7 -97.7 -44.9 84.2 -32.0 -11.5 150 150 A D H X + 0 0 37 -4,-2.7 4,-2.0 -5,-0.1 -2,-0.2 -0.580 56.8 175.5-164.5 85.0 83.9 -35.9 -11.8 151 151 A R H X S+ 0 0 0 -4,-0.7 4,-2.9 1,-0.2 5,-0.2 0.848 81.5 61.1 -66.4 -34.5 86.1 -38.1 -9.7 152 152 A A H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.922 110.4 39.9 -60.6 -44.1 84.4 -41.4 -11.0 153 153 A Q H > S+ 0 0 42 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.871 111.9 57.1 -73.5 -36.0 85.5 -40.6 -14.6 154 154 A F H X S+ 0 0 19 -4,-2.0 4,-1.6 -8,-0.2 -2,-0.2 0.960 109.9 46.2 -53.8 -52.2 88.9 -39.3 -13.5 155 155 A I H X S+ 0 0 5 -4,-2.9 4,-0.9 2,-0.2 -2,-0.2 0.911 112.2 49.3 -54.7 -47.5 89.4 -42.8 -11.8 156 156 A S H >< S+ 0 0 43 -4,-1.9 3,-0.9 1,-0.2 4,-0.4 0.923 114.0 45.5 -60.1 -49.3 88.2 -44.7 -14.9 157 157 A D H >< S+ 0 0 101 -4,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.743 104.9 63.9 -65.1 -26.4 90.5 -42.8 -17.2 158 158 A F H 3X S+ 0 0 26 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.731 84.8 75.8 -73.0 -24.3 93.4 -43.1 -14.8 159 159 A N H >S+ 0 0 36 -3,-0.6 5,-1.9 -4,-0.4 4,-1.2 0.981 115.4 32.2 -60.9 -56.8 95.1 -46.8 -18.6 161 161 A P H 45S+ 0 0 32 0, 0.0 62,-0.6 0, 0.0 90,-0.6 0.833 117.3 58.8 -70.8 -26.3 98.3 -44.8 -17.6 162 162 A F H <5S+ 0 0 10 -4,-2.3 90,-2.8 1,-0.2 89,-0.5 0.951 119.4 27.6 -61.4 -51.7 98.3 -46.4 -14.1 163 163 A Y H <5S- 0 0 8 -4,-2.5 -1,-0.2 -5,-0.2 -3,-0.1 0.487 108.0-119.9 -90.8 -5.7 98.5 -50.0 -15.5 164 164 A G T ><> + 0 0 1 -4,-1.2 5,-2.5 -5,-0.2 3,-1.2 0.809 63.1 146.4 68.0 32.7 100.4 -49.0 -18.8 165 165 A I G > < + 0 0 53 -5,-1.9 3,-1.1 -6,-0.4 -5,-0.1 0.842 68.8 59.6 -67.7 -33.4 97.5 -50.4 -20.9 166 166 A N G 3 5S+ 0 0 89 -6,-0.5 -1,-0.3 1,-0.3 -6,-0.1 0.525 106.3 49.5 -73.5 -4.4 98.2 -47.5 -23.4 167 167 A K G < 5S- 0 0 150 -3,-1.2 -1,-0.3 -7,-0.2 -2,-0.1 -0.208 131.0 -84.7-126.1 42.3 101.8 -48.9 -23.7 168 168 A G T < 5S+ 0 0 69 -3,-1.1 -3,-0.2 1,-0.2 2,-0.2 0.502 79.2 140.9 72.1 7.8 101.0 -52.6 -24.3 169 169 A Q < - 0 0 46 -5,-2.5 2,-0.6 1,-0.0 -1,-0.2 -0.563 47.1-134.8 -72.2 149.9 100.6 -53.9 -20.8 170 170 A V + 0 0 141 -2,-0.2 2,-0.4 86,-0.1 -5,-0.0 -0.918 33.7 162.3-114.1 115.1 97.7 -56.4 -20.5 171 171 A V - 0 0 17 -2,-0.6 -8,-0.0 -6,-0.0 5,-0.0 -1.000 36.2-114.8-133.2 131.9 95.3 -56.0 -17.6 172 172 A S > - 0 0 26 -2,-0.4 4,-1.7 1,-0.1 5,-0.1 -0.145 18.4-119.5 -66.4 160.2 91.8 -57.6 -17.5 173 173 A Q H > S+ 0 0 119 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.832 115.2 62.5 -61.9 -32.7 88.6 -55.7 -17.4 174 174 A G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.926 104.3 45.3 -60.5 -46.3 88.0 -57.4 -14.1 175 175 A V H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.884 113.0 50.6 -65.2 -39.5 91.0 -55.7 -12.5 176 176 A Q H X S+ 0 0 46 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.922 112.5 47.2 -64.7 -44.6 90.0 -52.4 -14.0 177 177 A T H X S+ 0 0 46 -4,-3.0 4,-2.9 2,-0.2 -2,-0.2 0.908 112.1 48.8 -58.9 -48.0 86.5 -52.8 -12.6 178 178 A Q H X S+ 0 0 16 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.871 110.4 52.9 -61.7 -40.6 87.8 -53.8 -9.1 179 179 A T H X S+ 0 0 14 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.913 112.4 43.6 -60.1 -47.7 90.1 -50.8 -9.2 180 180 A L H X S+ 0 0 16 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.938 112.7 53.0 -63.5 -44.2 87.2 -48.4 -10.0 181 181 A Q H X S+ 0 0 15 -4,-2.9 4,-0.8 1,-0.2 -2,-0.2 0.923 112.3 43.4 -57.3 -47.3 84.9 -50.1 -7.4 182 182 A I H >X S+ 0 0 15 -4,-2.4 3,-0.8 1,-0.2 4,-0.5 0.900 111.2 54.5 -66.5 -43.5 87.5 -49.7 -4.6 183 183 A A H >< S+ 0 0 1 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.848 102.3 58.7 -58.2 -37.3 88.4 -46.1 -5.6 184 184 A L H 3< S+ 0 0 3 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.729 93.4 66.3 -68.2 -23.8 84.7 -45.1 -5.4 185 185 A L H << S+ 0 0 49 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.773 88.0 94.9 -61.5 -31.8 84.5 -46.2 -1.7 186 186 A A S << S- 0 0 1 -3,-1.1 -129,-0.3 -4,-0.5 2,-0.2 -0.235 85.4-101.7 -65.1 153.8 87.0 -43.3 -0.9 187 187 A S > - 0 0 0 -131,-2.9 4,-2.4 1,-0.1 5,-0.1 -0.531 18.0-137.4 -64.8 137.0 86.1 -39.8 0.2 188 188 A L H > S+ 0 0 0 -2,-0.2 4,-2.4 2,-0.2 5,-0.2 0.920 107.2 51.4 -59.5 -47.3 86.1 -37.1 -2.4 189 189 A K H > S+ 0 0 26 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.921 110.8 45.6 -54.8 -53.0 87.8 -34.8 0.2 190 190 A A H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.911 110.5 54.8 -61.0 -42.4 90.5 -37.4 1.1 191 191 A T H X S+ 0 0 0 -4,-2.4 4,-0.9 -135,-0.2 -2,-0.2 0.939 114.6 39.7 -56.2 -48.4 91.2 -38.1 -2.6 192 192 A V H >X S+ 0 0 11 -4,-2.4 4,-1.5 2,-0.2 3,-0.8 0.935 114.4 52.3 -67.0 -46.4 91.8 -34.4 -3.4 193 193 A D H 3X S+ 0 0 30 -4,-3.0 4,-2.6 1,-0.3 -2,-0.2 0.847 102.5 59.8 -60.9 -37.0 93.8 -33.7 -0.1 194 194 A C H 3X S+ 0 0 0 -4,-2.4 4,-3.2 -5,-0.2 5,-0.3 0.866 100.4 56.4 -60.0 -32.1 96.1 -36.6 -0.9 195 195 A V H + 0 0 0 -80,-2.4 4,-1.7 -2,-0.7 -79,-0.2 0.229 53.7 102.3-100.5 10.2 110.7 -36.5 2.1 204 204 A R H > S+ 0 0 56 -81,-0.3 4,-1.1 1,-0.2 3,-0.3 0.943 81.4 52.7 -62.5 -39.6 114.4 -35.8 1.6 205 205 A P H >4 S+ 0 0 87 0, 0.0 3,-0.5 0, 0.0 4,-0.5 0.925 108.1 53.5 -58.2 -39.2 114.9 -35.1 5.3 206 206 A D H >> S+ 0 0 4 1,-0.2 3,-1.2 -4,-0.2 4,-0.6 0.817 96.7 65.0 -58.2 -39.8 113.3 -38.5 5.9 207 207 A M H >< S+ 0 0 3 -4,-1.7 3,-1.2 -3,-0.3 32,-0.4 0.894 99.8 52.2 -55.1 -38.1 115.7 -40.3 3.6 208 208 A A T << S+ 0 0 92 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.680 104.7 56.9 -76.4 -14.8 118.6 -39.5 6.0 209 209 A K T <4 S+ 0 0 127 -3,-1.2 2,-1.0 -4,-0.5 -1,-0.3 0.527 79.1 105.5 -87.9 -7.0 116.7 -40.9 9.0 210 210 A I << + 0 0 5 -3,-1.2 29,-0.4 -4,-0.6 4,-0.1 -0.651 35.7 161.3 -82.8 102.8 116.3 -44.3 7.3 211 211 A D + 0 0 117 -2,-1.0 -1,-0.1 27,-0.1 -3,-0.0 -0.191 45.1 85.9-115.0 36.0 118.8 -46.6 9.1 212 212 A V S S- 0 0 16 27,-0.1 -98,-0.2 -97,-0.0 -99,-0.1 -0.921 93.0 -76.8-131.1 156.8 117.4 -50.0 8.2 213 213 A P - 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0 0 52 0, 0.0 3,-1.6 0, 0.0 4,-0.7 -0.280 23.7-127.7 -55.9 139.4 49.0 -42.3 -11.1 409 137 B L H 3> S+ 0 0 76 1,-0.3 4,-2.5 2,-0.2 3,-0.3 0.772 104.7 69.3 -64.6 -23.5 49.7 -44.9 -8.4 410 138 B D H 3> S+ 0 0 118 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.755 91.2 62.1 -66.3 -17.9 49.9 -47.7 -11.0 411 139 B V H <> S+ 0 0 57 -3,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.915 109.2 40.8 -67.7 -42.9 53.2 -46.1 -12.2 412 140 B F H X S+ 0 0 4 -4,-0.7 4,-2.3 -3,-0.3 -2,-0.2 0.873 109.7 57.6 -72.8 -39.2 54.6 -46.8 -8.7 413 141 B A H X S+ 0 0 52 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.911 108.2 49.3 -54.7 -40.8 53.0 -50.3 -8.5 414 142 B R H X S+ 0 0 160 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.878 105.6 55.1 -71.0 -37.5 54.9 -51.0 -11.7 415 143 B F H X S+ 0 0 41 -4,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.938 111.6 46.8 -51.5 -47.6 58.2 -49.7 -10.2 416 144 B K H X S+ 0 0 50 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.912 109.6 52.0 -66.3 -43.1 57.6 -52.2 -7.4 417 145 B T H < S+ 0 0 69 -4,-2.5 4,-0.4 2,-0.2 -1,-0.2 0.914 114.0 43.7 -58.0 -46.3 56.8 -55.0 -9.7 418 146 B E H >X S+ 0 0 76 -4,-2.5 4,-2.7 1,-0.2 3,-1.3 0.919 111.9 53.1 -67.7 -44.3 60.0 -54.4 -11.7 419 147 B L H 3X S+ 0 0 0 -4,-2.9 4,-0.6 1,-0.2 -2,-0.2 0.868 106.4 53.9 -55.3 -38.8 62.1 -54.0 -8.5 420 148 B L H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.539 114.4 41.0 -80.5 -5.2 60.8 -57.3 -7.2 421 149 B K H <4 S- 0 0 166 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.796 139.8 -11.0 -97.2 -47.2 61.9 -59.1 -10.3 422 150 B D H X + 0 0 38 -4,-2.7 4,-1.8 -5,-0.1 -2,-0.2 -0.605 56.2 174.5-161.1 83.8 65.3 -57.4 -11.0 423 151 B R H X S+ 0 0 0 -4,-0.6 4,-2.5 1,-0.2 5,-0.2 0.834 81.1 61.3 -64.1 -33.8 66.3 -54.3 -9.0 424 152 B A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 109.9 39.8 -61.6 -46.2 69.9 -54.2 -10.5 425 153 B Q H > S+ 0 0 43 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.852 111.9 57.5 -73.3 -33.0 68.6 -53.8 -14.0 426 154 B F H X S+ 0 0 13 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.957 109.9 45.5 -55.1 -49.5 65.8 -51.4 -12.9 427 155 B I H X S+ 0 0 4 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.909 112.2 50.5 -58.0 -50.0 68.5 -49.2 -11.4 428 156 B S H >< S+ 0 0 41 -4,-2.1 3,-0.8 1,-0.2 4,-0.4 0.944 113.7 44.7 -54.4 -50.0 70.7 -49.4 -14.5 429 157 B D H >< S+ 0 0 101 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.777 106.3 62.9 -65.3 -31.6 67.7 -48.5 -16.7 430 158 B F H 3X S+ 0 0 22 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.756 85.0 76.3 -67.2 -28.8 66.7 -45.6 -14.3 431 159 B N H >S+ 0 0 33 -3,-0.7 5,-1.8 -4,-0.4 4,-0.9 0.980 115.5 31.0 -62.8 -57.5 68.9 -42.5 -18.3 433 161 B P H 45S+ 0 0 33 0, 0.0 62,-0.6 0, 0.0 90,-0.5 0.790 116.8 60.9 -72.0 -24.5 65.7 -40.6 -17.2 434 162 B F H <5S+ 0 0 10 -4,-2.4 90,-2.7 1,-0.2 89,-0.4 0.951 118.7 26.9 -57.5 -52.5 67.3 -39.8 -13.8 435 163 B Y H <5S- 0 0 10 -4,-2.5 -1,-0.2 -5,-0.2 -3,-0.1 0.454 109.1-119.6 -91.3 -3.7 70.1 -37.8 -15.4 436 164 B G T ><> + 0 0 2 -4,-0.9 5,-2.2 -5,-0.2 3,-1.5 0.766 65.1 144.4 65.8 26.9 68.1 -36.9 -18.6 437 165 B I G > - 0 0 26 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.182 19.5-118.2 -70.6 161.0 79.9 -39.8 -17.9 445 173 B Q H > S+ 0 0 132 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.861 115.6 60.9 -57.6 -41.8 80.1 -43.6 -17.7 446 174 B G H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.930 105.5 46.2 -51.5 -50.2 82.0 -43.2 -14.4 447 175 B V H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.905 112.8 49.2 -62.4 -42.5 79.0 -41.4 -12.8 448 176 B Q H X S+ 0 0 39 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.905 112.9 48.1 -64.0 -40.8 76.5 -44.0 -14.2 449 177 B T H X S+ 0 0 58 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.917 112.5 47.9 -62.4 -46.2 78.7 -46.8 -12.8 450 178 B Q H X S+ 0 0 16 -4,-2.7 4,-2.5 2,-0.2 5,-0.3 0.903 109.5 54.1 -64.0 -41.2 79.0 -45.1 -9.4 451 179 B T H X S+ 0 0 15 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.946 112.3 43.3 -56.0 -50.3 75.2 -44.5 -9.3 452 180 B L H X S+ 0 0 17 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.909 112.3 53.2 -63.3 -43.1 74.6 -48.2 -9.8 453 181 B Q H X S+ 0 0 15 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.929 113.3 42.9 -59.2 -47.1 77.3 -49.3 -7.3 454 182 B I H >X S+ 0 0 17 -4,-2.5 3,-0.8 1,-0.2 4,-0.6 0.911 112.1 54.0 -64.8 -44.6 75.9 -47.2 -4.5 455 183 B A H >< S+ 0 0 1 -4,-2.3 3,-1.0 -5,-0.3 -1,-0.2 0.848 102.5 57.5 -61.3 -35.0 72.3 -48.2 -5.3 456 184 B L H 3< S+ 0 0 3 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.734 94.1 67.5 -71.0 -23.4 73.2 -51.9 -5.1 457 185 B L H << S+ 0 0 48 -3,-0.8 -1,-0.2 -4,-0.8 -2,-0.2 0.796 87.7 93.3 -58.5 -31.6 74.4 -51.4 -1.5 458 186 B A S << S- 0 0 0 -3,-1.0 -129,-0.2 -4,-0.6 2,-0.2 -0.208 86.7 -98.3 -68.6 158.5 70.8 -50.7 -0.5 459 187 B S > - 0 0 0 -131,-2.9 4,-2.4 1,-0.1 5,-0.2 -0.503 18.3-138.5 -65.8 135.0 68.2 -53.1 0.8 460 188 B L H > S+ 0 0 0 -2,-0.2 4,-2.2 2,-0.2 5,-0.2 0.923 107.8 50.8 -55.9 -45.3 65.7 -54.6 -1.7 461 189 B K H > S+ 0 0 27 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.906 111.2 45.1 -61.5 -48.6 63.1 -54.1 1.1 462 190 B A H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.914 111.1 54.5 -61.2 -42.6 64.0 -50.4 1.8 463 191 B T H X S+ 0 0 0 -4,-2.4 4,-0.8 -135,-0.2 -2,-0.2 0.911 115.2 39.3 -58.5 -45.7 64.1 -49.7 -2.0 464 192 B V H >X S+ 0 0 10 -4,-2.2 4,-1.4 2,-0.2 3,-0.6 0.928 114.5 52.0 -72.3 -45.2 60.6 -51.0 -2.5 465 193 B D H 3X S+ 0 0 29 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.850 102.6 60.3 -59.4 -37.0 59.1 -49.6 0.8 466 194 B C H 3X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.866 99.9 56.6 -60.7 -36.2 60.4 -46.1 -0.1 467 195 B V H + 0 0 0 -80,-3.0 4,-1.8 -2,-0.6 -79,-0.2 0.241 52.6 104.5-102.3 11.1 53.1 -33.4 2.9 476 204 B R H > S+ 0 0 33 -81,-0.4 4,-1.0 1,-0.2 3,-0.2 0.934 81.8 50.1 -60.5 -41.4 50.6 -30.7 2.3 477 205 B P H >> S+ 0 0 81 0, 0.0 4,-0.6 0, 0.0 3,-0.6 0.912 107.4 56.0 -58.2 -40.1 50.0 -30.4 6.1 478 206 B D H >> S+ 0 0 4 1,-0.2 3,-1.3 -4,-0.2 4,-0.5 0.869 97.2 63.2 -58.1 -40.3 53.8 -30.2 6.6 479 207 B M H >< S+ 0 0 2 -4,-1.8 3,-1.3 1,-0.3 32,-0.3 0.880 98.8 53.5 -54.6 -39.8 54.0 -27.2 4.2 480 208 B A H << S+ 0 0 93 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.700 105.5 56.7 -72.4 -13.7 51.9 -25.0 6.6 481 209 B K H << S+ 0 0 117 -3,-1.3 2,-0.9 -4,-0.6 -1,-0.3 0.550 78.6 103.7 -92.3 -7.6 54.3 -25.9 9.4 482 210 B I << + 0 0 7 -3,-1.3 29,-0.4 -4,-0.5 4,-0.1 -0.656 37.8 163.4 -82.3 107.0 57.4 -24.6 7.6 483 211 B D + 0 0 121 -2,-0.9 -1,-0.1 27,-0.1 -3,-0.0 -0.072 45.0 84.0-118.0 30.9 58.1 -21.3 9.3 484 212 B V S S- 0 0 17 27,-0.1 -98,-0.2 1,-0.1 -99,-0.1 -0.879 93.2 -73.8-127.1 161.1 61.7 -20.7 8.2 485 213 B P - 0 0 60 0, 0.0 -98,-2.3 0, 0.0 2,-0.4 -0.284 57.9-169.0 -53.4 136.4 63.4 -19.2 5.0 486 214 B T E -o 387 0F 3 26,-0.3 28,-2.9 -100,-0.2 2,-0.5 -0.998 19.4-163.6-141.1 133.8 63.0 -21.8 2.2 487 215 B L E -op 388 514F 0 -100,-2.7 -98,-2.4 -2,-0.4 2,-0.5 -0.990 7.4-163.2-121.5 123.5 64.5 -22.2 -1.2 488 216 B V E -op 389 515F 2 26,-3.3 28,-3.0 -2,-0.5 2,-0.4 -0.916 10.0-179.4-101.8 125.3 62.9 -24.5 -3.7 489 217 B I E +op 390 516F 0 -100,-2.8 -98,-2.7 -2,-0.5 -97,-0.4 -0.993 8.5 161.8-124.8 135.7 65.0 -25.5 -6.7 490 218 B H E - p 0 517F 0 26,-1.8 28,-2.4 -2,-0.4 2,-0.3 -0.996 35.8-123.9-151.0 145.3 63.7 -27.9 -9.5 491 219 B G E > - p 0 518F 0 -2,-0.3 3,-1.0 31,-0.2 8,-0.3 -0.700 16.6-142.9 -84.9 145.1 64.7 -28.7 -13.0 492 220 B D T 3 S+ 0 0 78 26,-2.1 -1,-0.1 -2,-0.3 8,-0.1 0.490 99.6 56.8 -92.8 7.0 61.9 -28.2 -15.5 493 221 B G T 3 S+ 0 0 30 28,-2.3 2,-0.5 25,-0.3 30,-0.3 0.035 74.4 145.3-106.0 22.6 62.9 -31.2 -17.6 494 222 B D < - 0 0 13 -3,-1.0 5,-0.2 28,-0.3 -60,-0.1 -0.442 26.5-177.2 -66.3 109.9 62.6 -33.5 -14.4 495 223 B Q S S+ 0 0 68 -62,-0.6 -1,-0.2 -2,-0.5 -61,-0.1 0.589 78.0 44.1 -84.4 -10.2 61.3 -36.8 -15.8 496 224 B I S S+ 0 0 28 1,-0.3 -1,-0.1 -63,-0.2 -62,-0.1 0.877 123.9 23.8-100.4 -50.9 61.0 -38.4 -12.3 497 225 B V S S- 0 0 1 -106,-0.0 -1,-0.3 -90,-0.0 6,-0.2 -0.904 89.6-133.5-120.6 97.5 59.5 -35.8 -10.0 498 226 B P >> - 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0 0 57 -5,-2.2 2,-0.7 1,-0.1 -1,-0.3 -0.275 44.5-124.2 -52.5 136.0 19.0 7.2 -19.9 1530 170 F V + 0 0 142 86,-0.1 2,-0.4 -6,-0.0 -1,-0.1 -0.777 42.6 161.4 -91.2 113.9 20.2 3.6 -20.0 1531 171 F V - 0 0 20 -2,-0.7 -8,-0.0 -6,-0.0 85,-0.0 -1.000 36.9-116.2-136.4 133.0 18.7 1.6 -17.2 1532 172 F S > - 0 0 26 -2,-0.4 4,-1.6 1,-0.1 5,-0.1 -0.237 18.2-122.8 -69.0 152.9 18.5 -2.2 -17.0 1533 173 F Q H > S+ 0 0 129 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.824 112.7 62.9 -56.6 -35.0 15.2 -4.1 -17.1 1534 174 F G H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.933 103.0 46.3 -60.4 -44.6 16.4 -5.7 -13.8 1535 175 F V H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.907 113.3 50.0 -64.5 -39.8 16.4 -2.3 -12.0 1536 176 F Q H X S+ 0 0 36 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.926 111.9 48.0 -65.4 -42.8 13.0 -1.5 -13.5 1537 177 F T H X S+ 0 0 60 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.920 112.3 48.4 -61.3 -45.9 11.6 -4.8 -12.3 1538 178 F Q H X S+ 0 0 16 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.895 109.3 54.0 -61.8 -40.7 13.1 -4.4 -8.8 1539 179 F T H X S+ 0 0 15 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.969 112.6 42.8 -59.6 -51.5 11.7 -0.9 -8.6 1540 180 F L H X S+ 0 0 15 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.903 112.1 54.2 -61.5 -42.1 8.2 -2.1 -9.4 1541 181 F Q H X S+ 0 0 13 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.952 112.7 42.6 -56.2 -50.2 8.5 -5.2 -7.1 1542 182 F I H >X S+ 0 0 17 -4,-2.5 3,-0.9 1,-0.2 4,-0.6 0.884 111.5 55.4 -62.8 -42.1 9.4 -3.0 -4.1 1543 183 F A H >< S+ 0 0 0 -4,-2.4 3,-0.9 -5,-0.3 -1,-0.2 0.846 102.4 57.3 -61.0 -36.2 6.7 -0.4 -5.0 1544 184 F L H 3< S+ 0 0 3 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.726 94.1 66.4 -71.2 -19.2 4.1 -3.0 -4.9 1545 185 F L H << S+ 0 0 49 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.779 87.7 93.5 -67.3 -27.4 4.9 -4.0 -1.3 1546 186 F A S << S- 0 0 0 -3,-0.9 -129,-0.3 -4,-0.6 2,-0.2 -0.178 86.2 -99.3 -70.6 158.8 3.7 -0.5 -0.2 1547 187 F S > - 0 0 0 -131,-3.6 4,-2.3 1,-0.1 5,-0.1 -0.551 17.8-138.7 -74.6 138.3 0.2 0.3 1.0 1548 188 F L H > S+ 0 0 0 -2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.935 106.7 51.6 -60.0 -46.6 -2.2 1.9 -1.5 1549 189 F K H > S+ 0 0 26 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.908 111.6 44.7 -54.8 -49.1 -3.4 4.3 1.2 1550 190 F A H > S+ 0 0 0 2,-0.2 4,-2.3 -134,-0.2 -1,-0.2 0.891 110.0 55.8 -67.4 -36.6 0.2 5.3 2.2 1551 191 F T H X S+ 0 0 0 -4,-2.3 4,-0.9 -135,-0.2 -2,-0.2 0.947 114.0 39.8 -60.2 -47.0 1.2 5.8 -1.5 1552 192 F V H >X S+ 0 0 11 -4,-2.3 4,-1.5 1,-0.2 3,-0.6 0.908 113.5 53.9 -67.1 -46.5 -1.8 8.2 -2.0 1553 193 F D H 3X S+ 0 0 29 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.841 101.9 58.8 -60.3 -36.5 -1.4 10.0 1.3 1554 194 F C H 3X S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.855 100.3 57.3 -60.3 -36.0 2.3 10.7 0.6 1555 195 F V H + 0 0 1 -80,-2.4 4,-2.0 -2,-0.7 -79,-0.2 0.264 53.4 105.0 -93.6 10.7 9.4 23.3 4.4 1564 204 F R H > S+ 0 0 61 -81,-0.4 4,-1.0 1,-0.2 3,-0.2 0.945 81.5 50.2 -59.5 -42.1 10.5 26.9 4.1 1565 205 F P H > S+ 0 0 79 0, 0.0 4,-0.5 0, 0.0 3,-0.3 0.871 108.5 54.3 -58.4 -35.5 10.3 27.4 7.9 1566 206 F D H >> S+ 0 0 5 1,-0.2 3,-1.4 -4,-0.2 4,-0.7 0.869 98.5 62.5 -64.7 -40.2 12.4 24.2 8.4 1567 207 F M H >< S+ 0 0 2 -4,-2.0 3,-0.9 1,-0.3 32,-0.4 0.869 100.3 53.2 -53.1 -39.5 15.2 25.5 6.1 1568 208 F A H 3< S+ 0 0 90 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.683 105.9 55.2 -73.2 -16.3 15.7 28.4 8.6 1569 209 F K H << S+ 0 0 123 -3,-1.4 2,-1.0 -4,-0.5 -1,-0.2 0.553 80.3 103.0 -90.2 -10.9 16.1 25.8 11.5 1570 210 F I << + 0 0 6 -3,-0.9 29,-0.4 -4,-0.7 4,-0.1 -0.656 36.3 161.2 -81.5 106.6 18.9 23.9 9.7 1571 211 F D + 0 0 118 -2,-1.0 -1,-0.1 27,-0.1 -3,-0.0 -0.189 44.5 88.8-118.2 34.3 22.1 24.9 11.5 1572 212 F V S S- 0 0 17 27,-0.1 -98,-0.2 1,-0.0 -99,-0.1 -0.883 92.1 -75.9-125.8 161.5 24.4 22.0 10.4 1573 213 F P - 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