==== 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 BIOSYNTHETIC PROTEIN 20-JUN-09 3A3U . COMPND 2 MOLECULE: MENAQUINONE BIOSYNTHETIC ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR R.ARAI,A.NISHINO,K.NAGANO,T.UCHIKUBO-KAMO,K.KATSURA,M.NISHIM . 270 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11208.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 9.3 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 . 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 . 9 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 3 0 1 1 0 3 0 2 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 3 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 . 0 0 0 1 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 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 3 A A 0 0 92 0, 0.0 2,-0.5 0, 0.0 29,-0.2 0.000 360.0 360.0 360.0 -36.6 56.8 18.0 94.6 2 4 A L E -a 30 0A 31 27,-1.9 29,-2.8 48,-0.0 2,-0.3 -0.859 360.0-130.2 -99.9 126.6 53.6 16.6 93.0 3 5 A R E -a 31 0A 94 -2,-0.5 48,-0.9 27,-0.2 2,-0.5 -0.581 21.8-162.7 -74.9 133.0 53.6 12.9 92.0 4 6 A L E -ab 32 51A 0 27,-2.6 29,-2.4 -2,-0.3 2,-0.4 -0.957 4.0-155.4-122.1 111.5 52.4 12.5 88.4 5 7 A G E +ab 33 52A 0 46,-2.7 48,-2.6 -2,-0.5 2,-0.3 -0.708 29.1 135.0 -93.0 135.9 51.3 9.0 87.3 6 8 A F E -a 34 0A 0 27,-1.9 29,-2.0 -2,-0.4 -2,-0.0 -0.964 48.8 -90.7-161.3 170.8 51.3 7.7 83.7 7 9 A S - 0 0 1 -2,-0.3 6,-0.2 27,-0.2 29,-0.2 -0.555 27.0-120.2 -92.9 160.4 52.4 4.7 81.7 8 10 A P S S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 28,-0.1 0.270 73.8 122.8 -79.1 16.3 55.7 4.0 80.0 9 11 A C S >> S- 0 0 4 1,-0.1 4,-2.3 208,-0.0 3,-0.6 -0.476 77.2-111.4 -76.8 149.6 53.9 3.7 76.7 10 12 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.798 113.9 57.8 -51.9 -33.0 55.0 6.0 73.9 11 13 A N H 3> S+ 0 0 7 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.934 110.9 40.6 -67.7 -40.1 51.8 8.0 73.9 12 14 A D H <> S+ 0 0 1 -3,-0.6 4,-2.4 2,-0.2 5,-0.2 0.922 116.9 47.8 -73.2 -43.2 52.0 9.0 77.6 13 15 A T H X S+ 0 0 0 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.868 112.5 51.1 -66.2 -32.2 55.8 9.7 77.5 14 16 A F H < S+ 0 0 8 -4,-2.1 4,-0.5 -5,-0.3 3,-0.3 0.948 112.5 46.3 -65.0 -48.9 55.3 11.7 74.3 15 17 A I H < S+ 0 0 3 -4,-2.1 4,-0.3 1,-0.2 3,-0.2 0.871 121.4 34.8 -62.3 -38.1 52.5 13.8 76.0 16 18 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.484 88.2 99.8 -99.2 -3.7 54.4 14.4 79.3 17 19 A Y H X S+ 0 0 29 -4,-1.1 4,-1.8 -3,-0.3 6,-0.2 0.893 85.9 44.0 -47.1 -51.3 57.9 14.7 77.8 18 20 A A H 4>S+ 0 0 0 -4,-0.5 5,-2.8 180,-0.3 6,-0.9 0.900 114.6 48.0 -66.0 -42.3 57.9 18.5 77.9 19 21 A L H >45S+ 0 0 11 -4,-0.3 3,-0.9 1,-0.2 -1,-0.2 0.899 113.1 48.7 -64.9 -40.6 56.4 18.9 81.3 20 22 A V H 3<5S+ 0 0 41 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.808 116.0 42.6 -71.1 -29.7 58.8 16.4 82.8 21 23 A H T 3<5S- 0 0 85 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.124 113.9-109.5-105.9 20.0 61.9 17.9 81.3 22 24 A G T < 5S+ 0 0 61 -3,-0.9 -3,-0.2 2,-0.1 -4,-0.1 0.732 78.0 130.4 61.8 27.1 61.0 21.6 81.9 23 25 A R S - 0 0 17 -2,-0.3 4,-1.9 -29,-0.2 3,-0.4 -0.359 47.5-116.0 -62.2 148.6 51.0 -0.1 84.0 37 39 A V H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 18,-0.3 0.891 114.8 55.7 -62.3 -35.6 47.6 1.6 83.5 38 40 A E H > S+ 0 0 4 62,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.871 105.5 53.7 -66.6 -29.5 45.8 -1.1 85.6 39 41 A T H > S+ 0 0 13 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.936 110.0 46.5 -66.3 -44.9 48.1 -0.3 88.5 40 42 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.893 109.5 55.5 -64.0 -35.9 47.2 3.4 88.2 41 43 A N H X S+ 0 0 1 -4,-2.6 4,-0.8 2,-0.2 -2,-0.2 0.932 109.9 45.4 -62.0 -45.1 43.5 2.4 88.0 42 44 A R H >X S+ 0 0 104 -4,-2.3 3,-1.1 1,-0.2 4,-0.5 0.941 111.5 52.4 -64.3 -43.9 43.8 0.5 91.3 43 45 A W H ><>S+ 0 0 38 -4,-2.5 5,-2.1 1,-0.3 3,-1.4 0.845 101.5 60.2 -59.6 -37.1 45.7 3.3 92.9 44 46 A A H ><5S+ 0 0 2 -4,-2.1 3,-1.0 1,-0.3 -1,-0.3 0.779 92.7 67.3 -63.2 -26.3 43.1 5.9 92.0 45 47 A L H <<5S+ 0 0 93 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.767 108.2 38.4 -64.5 -25.1 40.6 3.8 94.0 46 48 A E T <<5S- 0 0 127 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.347 112.6-120.4-104.5 1.8 42.5 4.9 97.1 47 49 A G T < 5 + 0 0 5 -3,-1.0 -3,-0.2 -4,-0.3 -2,-0.1 0.844 58.4 155.0 62.6 33.8 43.2 8.4 95.8 48 50 A R < + 0 0 102 -5,-2.1 -4,-0.1 -8,-0.1 -1,-0.1 0.908 51.2 46.8 -62.3 -49.9 46.9 7.8 96.0 49 51 A L - 0 0 2 -9,-0.2 3,-0.1 1,-0.1 -45,-0.1 -0.725 65.7-145.8 -98.5 146.8 48.3 10.2 93.4 50 52 A P S S+ 0 0 9 0, 0.0 130,-2.9 0, 0.0 2,-0.4 0.717 94.0 28.1 -79.5 -18.1 47.4 13.9 93.1 51 53 A L E S+bC 4 179A 0 -48,-0.9 -46,-2.7 128,-0.2 2,-0.3 -0.978 79.5 156.2-143.6 124.2 47.8 13.7 89.3 52 54 A T E -bC 5 178A 2 126,-2.6 126,-3.4 -2,-0.4 2,-0.2 -0.980 43.2-124.6-156.5 141.8 47.3 10.6 87.2 53 55 A K E + C 0 177A 14 -48,-2.6 2,-0.3 -2,-0.3 124,-0.3 -0.598 45.6 176.8 -72.2 143.9 46.5 9.2 83.8 54 56 A L E - C 0 176A 0 122,-2.9 122,-2.9 -2,-0.2 2,-0.1 -0.998 37.3 -97.7-150.9 151.7 43.5 6.8 84.3 55 57 A S E > - C 0 175A 8 -2,-0.3 4,-1.9 -18,-0.3 120,-0.3 -0.474 34.7-129.1 -65.8 142.4 41.2 4.7 82.2 56 58 A Y H > S+ 0 0 1 118,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.900 109.8 56.6 -61.7 -38.3 38.0 6.6 81.5 57 59 A A H 4 S+ 0 0 17 117,-0.4 -1,-0.2 1,-0.2 4,-0.2 0.890 108.7 48.2 -59.3 -36.6 36.0 3.6 82.7 58 60 A A H >4 S+ 0 0 4 45,-0.3 3,-2.0 -3,-0.2 4,-0.4 0.834 101.6 62.7 -72.4 -33.0 37.9 3.9 86.0 59 61 A Y H >< S+ 0 0 0 -4,-1.9 3,-2.1 1,-0.3 4,-0.3 0.904 92.7 65.1 -58.6 -38.1 37.3 7.6 86.3 60 62 A A T 3< S+ 0 0 6 -4,-1.5 202,-0.4 1,-0.3 -1,-0.3 0.672 100.7 53.1 -57.6 -14.5 33.6 6.9 86.5 61 63 A Q T < S+ 0 0 91 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.519 113.6 38.6 -98.1 -9.2 34.4 5.2 89.8 62 64 A V X> + 0 0 12 -3,-2.1 4,-2.4 -4,-0.4 3,-1.6 0.028 67.1 127.7-132.6 30.9 36.3 8.1 91.5 63 65 A R T 34 S+ 0 0 20 1,-0.3 -1,-0.1 -4,-0.3 -3,-0.1 0.646 74.3 57.5 -64.0 -17.5 34.4 11.3 90.5 64 66 A D T 34 S+ 0 0 120 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.628 116.9 34.1 -87.1 -14.2 34.1 12.4 94.1 65 67 A R T <4 S+ 0 0 108 -3,-1.6 116,-2.2 1,-0.2 117,-0.4 0.696 122.7 36.7-108.9 -26.1 37.9 12.3 94.5 66 68 A Y E < -D 180 0A 0 -4,-2.4 2,-0.4 114,-0.3 114,-0.2 -0.898 55.3-159.3-130.0 156.5 39.1 13.3 91.0 67 69 A V E -D 179 0A 8 112,-2.2 112,-2.8 -2,-0.3 2,-0.4 -0.970 29.3-115.7-130.0 146.7 38.2 15.7 88.2 68 70 A A E -De 178 269A 0 200,-1.5 202,-2.1 -2,-0.4 110,-0.2 -0.683 18.0-132.8 -89.3 133.3 39.4 15.2 84.6 69 71 A L - 0 0 1 108,-2.9 108,-0.4 -2,-0.4 4,-0.1 -0.417 17.6-130.0 -70.7 156.0 41.6 17.7 82.8 70 72 A R S S+ 0 0 50 -2,-0.1 170,-1.6 106,-0.1 3,-0.2 0.730 87.8 60.9 -80.8 -19.6 40.4 18.7 79.4 71 73 A S S S+ 0 0 1 168,-0.2 106,-0.4 1,-0.1 167,-0.2 -0.587 86.5 35.0-107.0 164.8 43.8 18.0 78.0 72 74 A G S S+ 0 0 2 165,-3.2 165,-0.2 1,-0.2 -1,-0.1 0.380 80.4 129.5 81.1 0.1 46.2 15.0 77.8 73 75 A G - 0 0 5 163,-0.5 2,-0.5 -3,-0.2 103,-0.3 -0.134 57.5-122.2 -83.5 178.0 43.7 12.3 77.3 74 76 A A E +F 175 0A 8 101,-3.0 100,-2.7 159,-0.1 101,-2.2 -0.980 49.8 135.3-124.7 109.1 43.3 9.4 74.8 75 77 A L E +F 173 0A 0 -2,-0.5 2,-0.3 157,-0.3 161,-0.3 -0.958 19.2 110.4-144.8 158.6 40.1 9.4 72.8 76 78 A G E -F 172 0A 0 96,-1.2 96,-2.9 -2,-0.3 3,-0.2 -0.960 64.7 -88.8 159.9-176.7 39.4 8.9 69.1 77 79 A R S S+ 0 0 86 -2,-0.3 3,-0.3 94,-0.2 88,-0.2 0.789 114.9 37.8 -97.6 -30.7 37.9 6.8 66.3 78 80 A G S S+ 0 0 44 153,-0.2 -1,-0.1 1,-0.2 84,-0.0 -0.187 96.9 80.3-114.0 41.5 40.8 4.6 65.4 79 81 A V + 0 0 3 -3,-0.2 -1,-0.2 93,-0.1 64,-0.2 0.242 61.1 136.3-124.4 8.1 42.3 4.0 68.8 80 82 A G - 0 0 0 -3,-0.3 82,-0.1 1,-0.1 -3,-0.0 -0.197 60.6-106.6 -66.5 147.3 39.9 1.3 69.9 81 83 A P - 0 0 3 0, 0.0 79,-2.4 0, 0.0 80,-0.5 -0.350 37.9-141.1 -66.0 150.8 41.1 -1.8 71.7 82 84 A L E -GH 141 159B 3 59,-1.7 59,-2.7 77,-0.2 2,-0.5 -0.795 7.1-141.1-111.7 157.6 40.9 -5.0 69.5 83 85 A V E -GH 140 158B 0 75,-2.6 74,-3.5 -2,-0.3 75,-1.4 -0.986 30.7-175.7-111.2 129.5 40.0 -8.5 70.3 84 86 A V E +GH 139 156B 0 55,-2.5 55,-2.3 -2,-0.5 2,-0.3 -0.868 10.1 175.7-125.9 159.3 42.3 -10.9 68.4 85 87 A A E - H 0 155B 1 70,-2.3 70,-2.9 -2,-0.3 53,-0.2 -0.917 46.3 -99.4-150.5 173.0 42.5 -14.7 68.0 86 88 A R S S- 0 0 120 51,-0.5 52,-0.1 -2,-0.3 70,-0.1 0.702 104.2 -13.3 -72.3 -19.9 44.5 -17.4 66.1 87 89 A G S S- 0 0 25 68,-0.2 -1,-0.1 67,-0.0 68,-0.1 -0.948 101.6 -47.9-166.4 174.1 41.7 -17.6 63.5 88 90 A P - 0 0 127 0, 0.0 2,-0.4 0, 0.0 69,-0.1 -0.212 49.0-158.3 -58.4 146.8 38.1 -16.5 63.1 89 91 A L - 0 0 60 1,-0.1 3,-0.1 68,-0.0 -4,-0.0 -0.974 18.7-146.4-126.8 138.6 35.6 -17.1 65.9 90 92 A Q S S- 0 0 206 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.857 82.3 -24.4 -70.1 -33.8 31.8 -17.3 65.6 91 93 A A - 0 0 58 2,-0.1 -1,-0.3 -3,-0.1 23,-0.1 -0.976 53.2-117.5-169.8 164.7 31.4 -15.8 69.0 92 94 A L > + 0 0 5 -2,-0.3 3,-2.2 -3,-0.1 26,-0.2 0.490 64.8 134.0 -94.1 -2.5 33.2 -15.3 72.3 93 95 A E T 3 S- 0 0 143 1,-0.3 24,-0.2 24,-0.1 -2,-0.1 -0.228 81.8 -2.2 -50.4 124.6 30.6 -17.3 74.3 94 96 A G T 3 S+ 0 0 53 22,-3.1 -1,-0.3 1,-0.2 2,-0.2 0.395 104.1 123.7 74.0 -0.9 32.3 -19.7 76.6 95 97 A L < - 0 0 40 -3,-2.2 23,-2.7 1,-0.0 2,-0.4 -0.618 65.2-114.6 -95.5 152.6 35.8 -18.9 75.5 96 98 A R E -i 118 0B 104 -2,-0.2 41,-1.9 21,-0.2 42,-1.4 -0.704 32.1-169.8 -84.0 132.0 38.8 -17.7 77.6 97 99 A V E -ij 119 138B 0 21,-2.7 23,-2.2 -2,-0.4 2,-0.3 -0.984 17.9-137.1-126.1 118.6 39.8 -14.2 76.8 98 100 A A E -ij 120 139B 0 40,-2.3 42,-2.9 -2,-0.5 23,-0.2 -0.617 29.7-171.0 -73.0 132.9 43.1 -12.7 78.2 99 101 A V E -i 121 0B 1 21,-2.7 23,-2.7 -2,-0.3 3,-0.1 -0.941 28.4-131.6-129.9 150.1 42.4 -9.1 79.3 100 102 A P S S- 0 0 3 0, 0.0 24,-0.3 0, 0.0 -62,-0.3 0.348 81.6 -25.2 -81.5 4.4 44.7 -6.2 80.4 101 103 A G > - 0 0 0 22,-0.1 3,-1.7 3,-0.1 6,-0.4 -0.314 51.2-124.0 147.8 124.2 42.8 -5.1 83.6 102 104 A R T 3 S+ 0 0 147 1,-0.3 -1,-0.1 -3,-0.1 -64,-0.0 0.685 110.2 51.9 -61.2 -20.1 39.3 -5.3 84.8 103 105 A H T 3 S+ 0 0 51 -3,-0.1 -45,-0.3 4,-0.1 -1,-0.3 0.417 85.6 110.5 -97.8 -0.9 39.0 -1.5 85.3 104 106 A T S <> S- 0 0 5 -3,-1.7 4,-2.2 -47,-0.1 5,-0.1 -0.297 76.8-124.5 -73.3 157.3 40.2 -0.5 81.9 105 107 A T H > S+ 0 0 3 69,-0.3 4,-3.1 1,-0.2 5,-0.2 0.875 113.9 61.7 -65.9 -34.2 37.9 1.1 79.3 106 108 A A H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.937 105.0 45.7 -56.1 -47.7 39.0 -1.8 77.1 107 109 A Y H > S+ 0 0 55 -6,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.920 111.8 51.9 -63.7 -43.1 37.5 -4.3 79.5 108 110 A F H X S+ 0 0 13 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.934 111.2 47.0 -58.8 -45.3 34.3 -2.3 79.9 109 111 A L H X S+ 0 0 0 -4,-3.1 4,-1.9 2,-0.2 3,-0.5 0.913 109.3 52.8 -65.6 -38.7 33.9 -2.1 76.1 110 112 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.909 108.2 53.2 -61.4 -37.4 34.5 -5.9 75.7 111 113 A S H < S+ 0 0 29 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.762 108.6 48.4 -68.8 -25.9 31.8 -6.4 78.4 112 114 A L H < S+ 0 0 10 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.809 114.6 47.9 -77.3 -33.7 29.3 -4.2 76.4 113 115 A Y H < S+ 0 0 77 -4,-1.9 2,-0.3 1,-0.2 -2,-0.2 0.864 125.5 7.2 -75.1 -41.2 30.2 -6.2 73.2 114 116 A A < - 0 0 15 -4,-2.4 -1,-0.2 -5,-0.1 3,-0.1 -0.992 50.3-171.3-144.6 148.1 29.9 -9.8 74.6 115 117 A Q S S+ 0 0 149 -2,-0.3 -1,-0.1 -3,-0.1 -4,-0.1 0.506 71.9 66.8-123.0 -0.7 28.7 -11.4 77.8 116 118 A G S S+ 0 0 19 2,-0.1 -22,-3.1 0, 0.0 2,-0.1 0.259 73.4 110.2-106.8 19.0 29.6 -15.1 77.9 117 119 A F - 0 0 23 -24,-0.2 -21,-0.2 -23,-0.2 -24,-0.1 -0.450 63.9-126.2 -91.9 164.6 33.3 -15.1 78.0 118 120 A V E -i 96 0B 74 -23,-2.7 -21,-2.7 -26,-0.2 2,-0.2 -0.927 27.8-141.8-108.8 109.1 35.8 -16.0 80.7 119 121 A P E -i 97 0B 58 0, 0.0 2,-0.5 0, 0.0 -21,-0.2 -0.470 13.4-167.0 -75.1 139.7 38.2 -13.2 81.5 120 122 A V E -i 98 0B 46 -23,-2.2 -21,-2.7 -2,-0.2 2,-0.5 -0.942 18.6-146.1-124.7 105.7 41.9 -14.0 82.3 121 123 A E E +i 99 0B 71 -2,-0.5 2,-0.3 -23,-0.2 -23,-0.1 -0.631 35.0 141.8 -83.2 120.0 43.5 -10.8 83.7 122 124 A V - 0 0 35 -23,-2.7 2,-0.1 -2,-0.5 5,-0.1 -0.871 57.4 -70.4-145.6 171.4 47.2 -10.3 82.9 123 125 A R > - 0 0 130 -2,-0.3 3,-2.2 1,-0.1 4,-0.5 -0.446 52.9-115.5 -64.4 144.9 49.7 -7.5 82.0 124 126 A Y G > S+ 0 0 41 -24,-0.3 3,-1.2 1,-0.3 4,-0.5 0.809 112.1 61.3 -56.5 -32.3 48.9 -6.3 78.5 125 127 A D G 3 S+ 0 0 95 1,-0.2 -1,-0.3 2,-0.1 -2,-0.0 0.534 97.3 59.6 -76.2 -1.4 52.2 -7.5 77.1 126 128 A R G <> S+ 0 0 107 -3,-2.2 4,-1.9 2,-0.1 -1,-0.2 0.550 86.9 80.4 -95.6 -13.3 51.4 -11.2 78.0 127 129 A I H <> S+ 0 0 0 -3,-1.2 4,-2.2 -4,-0.5 5,-0.2 0.930 86.2 49.2 -66.1 -49.2 48.3 -11.2 75.9 128 130 A L H > S+ 0 0 8 -4,-0.5 4,-2.5 1,-0.2 5,-0.2 0.943 114.5 45.2 -58.7 -48.7 49.6 -11.8 72.3 129 131 A P H > S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 6,-0.3 0.922 110.5 55.0 -62.3 -38.9 51.8 -14.8 73.3 130 132 A M H <>S+ 0 0 11 -4,-1.9 5,-1.9 1,-0.2 6,-1.0 0.901 111.4 44.3 -60.9 -40.3 49.1 -16.3 75.4 131 133 A V H ><5S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.955 114.7 48.0 -68.3 -46.9 46.7 -16.3 72.4 132 134 A A H 3<5S+ 0 0 37 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.814 112.3 49.3 -61.4 -34.3 49.3 -17.6 70.0 133 135 A Q T 3<5S- 0 0 132 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.457 115.9-113.7 -86.4 -2.8 50.3 -20.4 72.3 134 136 A G T < 5S+ 0 0 28 -3,-1.2 -3,-0.2 -4,-0.4 -4,-0.1 0.630 77.8 128.9 81.8 13.0 46.8 -21.5 72.9 135 137 A E S + 0 0 17 -2,-0.3 3,-1.7 -61,-0.2 4,-0.2 -0.700 47.8 25.5-135.6-175.3 45.8 -2.3 73.9 143 145 A H T > S- 0 0 20 1,-0.2 3,-1.1 -2,-0.2 4,-0.1 -0.184 124.8 -14.7 53.1-140.9 48.8 -0.1 73.4 144 146 A E T >> S+ 0 0 20 1,-0.2 3,-1.8 2,-0.1 4,-0.9 0.530 114.2 89.7 -74.5 -5.2 51.3 -1.1 70.7 145 147 A S H <> S+ 0 0 3 -3,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.773 73.8 71.1 -62.3 -24.7 49.8 -4.6 70.4 146 148 A R H <4 S+ 0 0 38 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.1 0.746 103.5 42.1 -64.8 -19.3 47.5 -3.3 67.7 147 149 A F H <4 S+ 0 0 63 -3,-1.8 -1,-0.2 -4,-0.1 -2,-0.2 0.693 119.9 40.0 -97.2 -21.7 50.5 -2.9 65.4 148 150 A T H >< S+ 0 0 15 -4,-0.9 3,-1.9 -3,-0.2 4,-0.4 0.591 80.3 97.3-106.5 -10.7 52.3 -6.2 66.2 149 151 A Y G ><>S+ 0 0 40 -4,-2.0 3,-1.7 1,-0.3 5,-1.4 0.795 77.4 62.9 -53.5 -32.7 49.6 -8.8 66.5 150 152 A P G > 5S+ 0 0 76 0, 0.0 3,-2.2 0, 0.0 -1,-0.3 0.837 92.0 67.4 -62.5 -26.5 50.0 -10.1 62.9 151 153 A R G < 5S+ 0 0 177 -3,-1.9 -2,-0.2 1,-0.3 -3,-0.1 0.741 99.1 51.0 -60.9 -24.0 53.6 -11.1 63.9 152 154 A Y G < 5S- 0 0 104 -3,-1.7 -1,-0.3 -4,-0.4 -3,-0.1 0.298 123.2-109.0 -93.4 4.8 51.9 -13.7 66.2 153 155 A G T < 5S+ 0 0 55 -3,-2.2 -2,-0.1 1,-0.2 2,-0.1 0.524 71.5 145.8 78.1 12.7 49.8 -15.0 63.3 154 156 A L < - 0 0 8 -5,-1.4 2,-0.3 -70,-0.0 -1,-0.2 -0.321 37.1-148.5 -86.7 161.3 46.6 -13.5 64.8 155 157 A V E -H 85 0B 59 -70,-2.9 -70,-2.3 -68,-0.1 2,-0.4 -0.906 26.4-103.0-126.4 153.5 43.5 -12.0 63.3 156 158 A Q E -H 84 0B 92 -2,-0.3 -72,-0.3 -72,-0.2 3,-0.1 -0.632 25.9-177.0 -78.0 126.4 41.2 -9.3 64.5 157 159 A V E S- 0 0 39 -74,-3.5 2,-0.3 -2,-0.4 -73,-0.2 0.833 75.0 -17.1 -85.4 -44.0 37.9 -10.6 65.9 158 160 A V E -H 83 0B 19 -75,-1.4 -75,-2.6 4,-0.0 2,-0.7 -0.965 51.6-135.7-161.6 147.5 36.5 -7.1 66.4 159 161 A D E > -H 82 0B 29 -2,-0.3 4,-2.2 -77,-0.2 -77,-0.2 -0.966 21.7-161.9-103.9 107.9 37.8 -3.5 66.6 160 162 A L H > S+ 0 0 0 -79,-2.4 4,-2.3 -2,-0.7 -78,-0.1 0.713 87.1 58.7 -68.3 -19.5 35.9 -2.2 69.6 161 163 A G H > S+ 0 0 1 -80,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.914 109.6 43.4 -73.4 -42.4 36.6 1.4 68.7 162 164 A A H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.890 113.0 53.1 -66.6 -38.6 34.9 0.8 65.4 163 165 A W H X S+ 0 0 47 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.932 109.9 48.1 -61.4 -45.7 32.1 -1.1 67.2 164 166 A W H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 6,-0.5 0.882 109.9 52.1 -61.6 -41.6 31.6 1.8 69.5 165 167 A E H X S+ 0 0 79 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.931 110.1 48.2 -62.9 -44.0 31.5 4.3 66.6 166 168 A E H < S+ 0 0 166 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.903 116.2 44.8 -62.2 -37.9 28.9 2.3 64.8 167 169 A R H < S+ 0 0 87 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.826 132.7 14.5 -74.9 -34.4 26.8 2.0 68.0 168 170 A T H < S- 0 0 21 -4,-2.5 -3,-0.2 2,-0.2 -2,-0.2 0.586 84.6-128.4-120.2 -17.5 27.1 5.6 69.2 169 171 A G S < S+ 0 0 46 -4,-3.0 -4,-0.2 -5,-0.4 -3,-0.1 0.613 77.0 108.8 72.1 13.4 28.4 7.8 66.3 170 172 A L S S- 0 0 14 -6,-0.5 -1,-0.3 -5,-0.1 -2,-0.2 -0.788 76.2-100.9-122.8 159.9 31.0 9.1 68.7 171 173 A P - 0 0 0 0, 0.0 -94,-0.2 0, 0.0 -1,-0.1 -0.312 45.5-107.3 -70.0 163.4 34.7 8.7 69.4 172 174 A L E - F 0 76A 1 -96,-2.9 -96,-1.2 79,-0.0 2,-0.6 -0.853 20.8-141.8-100.3 122.0 35.8 6.3 72.1 173 175 A P E + F 0 75A 0 0, 0.0 -98,-0.2 0, 0.0 -116,-0.1 -0.727 33.4 159.9 -80.2 122.7 37.1 7.8 75.4 174 176 A L E + 0 0 27 -100,-2.7 -118,-2.8 -2,-0.6 -117,-0.4 0.814 56.7 9.4-107.9 -57.5 40.0 5.5 76.5 175 177 A G E -CF 55 74A 4 -101,-2.2 -101,-3.0 -120,-0.3 -1,-0.4 -0.959 57.5-172.1-132.5 148.4 42.2 7.4 78.9 176 178 A A E -C 54 0A 0 -122,-2.9 -122,-2.9 -2,-0.4 2,-0.5 -0.848 26.3-122.4-129.8 165.4 42.0 10.7 80.8 177 179 A I E -C 53 0A 1 -106,-0.4 -108,-2.9 -108,-0.4 2,-0.4 -0.968 35.9-163.3-108.6 121.5 44.4 12.7 83.0 178 180 A L E -CD 52 68A 0 -126,-3.4 -126,-2.6 -2,-0.5 2,-0.4 -0.866 12.9-155.5-111.3 146.7 42.8 13.3 86.4 179 181 A A E -CD 51 67A 0 -112,-2.8 -112,-2.2 -2,-0.4 2,-0.3 -0.949 30.0-113.4-116.1 135.6 43.7 15.8 89.1 180 182 A R E > - D 0 66A 48 -130,-2.9 3,-2.0 -2,-0.4 -114,-0.3 -0.522 24.2-131.0 -69.9 128.1 42.7 15.1 92.7 181 183 A R G > S+ 0 0 61 -116,-2.2 3,-1.7 -2,-0.3 -1,-0.1 0.774 99.5 70.9 -53.0 -30.6 40.1 17.6 93.8 182 184 A D G 3 S+ 0 0 81 -117,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.467 79.3 79.1 -69.3 1.2 41.9 18.5 97.1 183 185 A L G < S- 0 0 33 -3,-2.0 4,-0.3 -133,-0.1 -1,-0.3 0.700 106.1-110.9 -79.6 -20.0 44.6 20.3 95.1 184 186 A G <> - 0 0 32 -3,-1.7 4,-2.1 -4,-0.2 5,-0.2 0.209 19.3 -92.5 99.2 140.2 42.3 23.3 94.7 185 187 A E H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.867 119.1 49.0 -52.6 -49.5 40.5 24.7 91.6 186 188 A G H > S+ 0 0 53 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 112.4 46.7 -62.0 -44.4 43.1 27.3 90.6 187 189 A L H > S+ 0 0 49 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.862 112.0 52.4 -66.8 -34.4 46.0 24.8 90.7 188 190 A I H X S+ 0 0 8 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.935 110.1 47.4 -68.7 -41.8 44.0 22.3 88.8 189 191 A R H X S+ 0 0 136 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.913 112.4 50.4 -64.0 -40.2 43.1 24.8 86.0 190 192 A A H X S+ 0 0 34 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.887 109.8 50.2 -63.8 -39.2 46.8 25.7 85.9 191 193 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.865 107.0 54.9 -67.3 -35.5 47.8 22.0 85.6 192 194 A D H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.951 110.5 45.5 -62.7 -47.5 45.3 21.6 82.8 193 195 A E H X S+ 0 0 95 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.877 111.8 53.2 -63.8 -34.0 46.9 24.4 80.9 194 196 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.926 109.7 46.9 -66.0 -45.3 50.3 23.0 81.7 195 197 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.907 110.7 52.5 -64.7 -39.0 49.4 19.6 80.3 196 198 A R H X S+ 0 0 53 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.936 109.4 50.2 -62.5 -43.0 47.9 21.2 77.1 197 199 A R H X S+ 0 0 96 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.865 108.6 52.0 -61.3 -37.1 51.2 23.1 76.6 198 200 A S H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -180,-0.3 0.890 110.6 47.6 -66.7 -42.0 53.2 19.8 77.0 199 201 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.951 113.4 48.1 -63.5 -46.8 51.0 18.1 74.4 200 202 A A H X S+ 0 0 42 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.876 109.5 53.8 -61.7 -36.9 51.4 21.1 72.0 201 203 A Y H X S+ 0 0 30 -4,-2.3 4,-2.0 1,-0.2 3,-0.2 0.948 110.4 45.3 -64.0 -49.6 55.2 21.2 72.6 202 204 A A H < S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.901 110.0 55.2 -61.8 -39.4 55.6 17.5 71.7 203 205 A L H < S+ 0 0 82 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.870 114.1 41.6 -60.6 -34.0 53.4 18.0 68.6 204 206 A A H < S+ 0 0 68 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.721 130.5 24.8 -84.0 -25.8 55.7 20.8 67.5 205 207 A H S >X S+ 0 0 71 -4,-2.0 3,-1.5 -5,-0.1 4,-0.6 -0.417 70.3 158.6-136.8 58.6 59.0 19.1 68.4 206 208 A P G >4 S+ 0 0 46 0, 0.0 3,-1.6 0, 0.0 4,-0.4 0.864 70.6 60.4 -52.8 -42.3 58.3 15.4 68.2 207 209 A E G >4 S+ 0 0 136 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.773 94.3 66.3 -59.1 -26.8 61.9 14.3 67.7 208 210 A E G <4 S+ 0 0 81 -3,-1.5 4,-0.3 1,-0.2 -1,-0.3 0.769 99.9 50.3 -67.1 -25.1 62.8 15.9 71.0 209 211 A A G S+ 0 0 9 -3,-1.0 4,-2.7 -4,-0.4 5,-0.2 0.887 81.8 49.6 -58.2 -46.7 62.2 10.4 71.1 211 213 A D H > S+ 0 0 122 -4,-0.4 4,-2.4 -3,-0.2 -1,-0.2 0.915 114.0 47.8 -58.7 -41.5 65.0 9.6 73.6 212 214 A Y H > S+ 0 0 25 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.902 111.3 49.5 -66.7 -43.5 62.5 9.7 76.5 213 215 A M H >X S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.2 4,-0.7 0.942 113.0 47.3 -61.5 -47.1 60.0 7.4 74.6 214 216 A R H >< S+ 0 0 97 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.915 104.3 61.2 -58.9 -44.1 62.8 4.9 73.8 215 217 A A H 3< S+ 0 0 49 -4,-2.4 3,-0.3 1,-0.3 -1,-0.2 0.800 113.4 36.5 -54.6 -30.2 64.1 4.9 77.4 216 218 A H H << S+ 0 0 75 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.428 123.4 40.5-106.1 2.0 60.7 3.7 78.6 217 219 A A X< + 0 0 14 -3,-1.2 3,-2.0 -4,-0.7 -1,-0.2 -0.392 68.8 157.9-143.3 54.6 59.8 1.3 75.7 218 220 A Q T 3 + 0 0 155 -3,-0.3 -3,-0.1 1,-0.3 -4,-0.1 0.626 69.0 56.4 -59.8 -18.7 63.2 -0.2 75.1 219 221 A E T 3 S+ 0 0 186 -3,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.516 91.2 92.1 -92.8 -3.8 61.9 -3.3 73.4 220 222 A L S < S- 0 0 37 -3,-2.0 2,-0.1 -6,-0.2 -3,-0.1 -0.704 74.5-126.6 -95.2 144.0 60.0 -1.3 70.7 221 223 A S > - 0 0 51 -2,-0.3 4,-2.4 1,-0.1 3,-0.4 -0.434 27.3-112.8 -78.8 155.2 61.4 -0.3 67.4 222 224 A D H > S+ 0 0 58 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.836 118.4 60.5 -57.4 -31.7 61.4 3.3 66.4 223 225 A E H > S+ 0 0 150 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.909 107.7 43.0 -63.0 -41.7 58.9 2.4 63.7 224 226 A V H > S+ 0 0 9 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.876 112.5 54.1 -72.3 -36.9 56.5 1.1 66.3 225 227 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.944 111.5 43.7 -62.4 -48.3 57.1 4.1 68.5 226 228 A W H X S+ 0 0 82 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.852 114.4 50.4 -66.6 -33.3 56.3 6.6 65.8 227 229 A A H X S+ 0 0 33 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.904 109.0 53.3 -69.2 -37.7 53.2 4.6 64.7 228 230 A H H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.948 111.8 42.1 -63.7 -50.8 52.0 4.5 68.3 229 231 A V H X S+ 0 0 10 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.902 113.3 54.2 -66.9 -34.9 52.2 8.2 68.9 230 232 A H H < S+ 0 0 157 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.910 114.3 41.3 -64.4 -36.9 50.7 8.9 65.5 231 233 A T H < S+ 0 0 34 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.923 123.7 33.7 -75.5 -43.4 47.7 6.6 66.3 232 234 A Y H < S+ 0 0 14 -4,-2.6 2,-0.5 -5,-0.2 -157,-0.3 0.650 103.5 71.7 -92.4 -17.9 47.0 7.6 69.9 233 235 A V < + 0 0 14 -4,-2.2 2,-0.2 -5,-0.3 -159,-0.1 -0.885 64.6 129.5-103.5 124.1 47.9 11.3 70.0 234 236 A N S >> S- 0 0 47 -2,-0.5 3,-1.7 -159,-0.1 4,-0.7 -0.791 72.6 -56.3-153.5-165.6 45.3 13.5 68.2 235 237 A A H >> S+ 0 0 76 1,-0.3 4,-1.9 -2,-0.2 3,-1.3 0.860 127.8 60.1 -55.8 -36.2 43.1 16.6 68.5 236 238 A F H 34 S+ 0 0 32 1,-0.3 -163,-0.5 -161,-0.3 -1,-0.3 0.745 94.0 64.3 -64.3 -24.1 41.5 15.1 71.6 237 239 A S H <4 S+ 0 0 0 -3,-1.7 -165,-3.2 1,-0.2 -1,-0.3 0.754 106.5 43.7 -68.7 -27.4 44.8 15.0 73.3 238 240 A L H << S- 0 0 56 -3,-1.3 2,-0.3 -4,-0.7 -2,-0.2 0.873 137.7 -9.5 -82.7 -41.8 44.9 18.8 73.2 239 241 A D < - 0 0 53 -4,-1.9 -1,-0.3 -168,-0.1 -168,-0.2 -0.933 56.2-133.4-157.6 132.7 41.3 19.2 74.3 240 242 A V > - 0 0 1 -170,-1.6 4,-1.2 -2,-0.3 5,-0.1 0.867 49.4-164.1 -56.5 -33.7 38.4 16.8 74.7 241 243 A G H > - 0 0 20 3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.024 38.9 -64.6 74.4 172.4 36.2 19.2 72.7 242 244 A E H > S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.863 137.3 48.2 -68.3 -32.4 32.5 19.3 72.5 243 245 A E H > S+ 0 0 52 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.896 110.6 50.6 -74.9 -38.9 32.4 15.9 70.8 244 246 A G H X S+ 0 0 0 -4,-1.2 4,-2.6 1,-0.2 5,-0.2 0.898 108.9 52.3 -63.4 -38.7 34.8 14.3 73.3 245 247 A E H X S+ 0 0 71 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.915 110.1 48.1 -62.9 -40.8 32.6 15.6 76.1 246 248 A R H X S+ 0 0 116 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.884 110.9 52.6 -65.0 -38.2 29.5 14.0 74.4 247 249 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.911 109.4 47.0 -63.9 -45.5 31.5 10.8 74.0 248 250 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.896 110.8 53.1 -65.0 -36.9 32.5 10.6 77.7 249 251 A A H X S+ 0 0 48 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.932 110.6 47.0 -63.0 -43.4 28.9 11.4 78.7 250 252 A R H X S+ 0 0 84 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.901 110.9 51.9 -64.7 -42.7 27.7 8.4 76.5 251 253 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.925 113.8 43.5 -60.0 -42.0 30.3 6.1 78.0 252 254 A F H X S+ 0 0 8 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.857 109.8 56.0 -74.3 -31.0 29.3 7.0 81.5 253 255 A A H X S+ 0 0 48 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.915 108.4 48.8 -65.0 -41.1 25.6 6.7 80.6 254 256 A E H X S+ 0 0 17 -4,-2.4 4,-0.6 2,-0.2 -1,-0.2 0.889 112.0 49.0 -65.4 -36.5 26.3 3.2 79.4 255 257 A A H ><>S+ 0 0 7 -4,-1.8 5,-2.4 1,-0.2 3,-1.2 0.933 110.7 49.8 -68.6 -43.3 28.1 2.4 82.6 256 258 A E H ><5S+ 0 0 70 -4,-3.0 3,-1.8 1,-0.3 -2,-0.2 0.876 102.8 61.3 -63.2 -35.5 25.3 3.9 84.7 257 259 A A H 3<5S+ 0 0 79 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.717 109.5 42.9 -63.3 -19.7 22.8 1.7 82.8 258 260 A R T <<5S- 0 0 105 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.180 114.6-113.7-111.0 15.2 24.6 -1.3 84.1 259 261 A G T < 5S+ 0 0 66 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.733 81.7 125.4 60.9 23.0 25.1 -0.2 87.6 260 262 A L S