==== 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 TRANSFERASE 09-NOV-06 2E28 . COMPND 2 MOLECULE: PYRUVATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR K.SUZUKI . 587 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 430 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 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 0.2 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 . 55 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.2 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 1 1 3 1 2 1 0 0 3 0 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 7 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 . 4 2 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 2 2 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 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 0 183 0, 0.0 2,-0.4 0, 0.0 396,-0.1 0.000 360.0 360.0 360.0 125.8 11.0 54.1 53.2 2 2 A K - 0 0 83 332,-0.1 2,-0.0 415,-0.0 415,-0.0 -0.954 360.0-105.4-129.8 146.4 9.1 53.0 50.1 3 3 A R - 0 0 29 -2,-0.4 331,-0.1 1,-0.1 328,-0.1 -0.377 28.9-168.7 -62.6 141.7 9.4 50.3 47.6 4 4 A K + 0 0 14 412,-0.1 413,-1.7 413,-0.1 414,-0.4 0.855 61.9 75.2 -99.5 -53.2 10.7 51.6 44.3 5 5 A T S S- 0 0 0 411,-0.2 304,-0.2 412,-0.1 303,-0.1 -0.452 81.1-128.3 -70.0 129.1 10.2 48.8 41.8 6 6 A K E -a 309 0A 6 302,-2.4 304,-2.3 408,-0.3 2,-0.5 -0.393 12.7-131.3 -77.4 152.3 6.6 48.3 40.8 7 7 A I E -ab 310 29A 0 21,-0.5 23,-2.6 302,-0.2 24,-2.1 -0.926 15.9-166.9-112.4 125.2 4.7 45.0 41.0 8 8 A V E -ab 311 31A 0 302,-2.6 304,-3.3 -2,-0.5 2,-0.4 -0.939 8.9-165.9-110.6 126.3 2.7 43.7 38.0 9 9 A S E -ab 312 32A 0 22,-2.9 24,-3.0 -2,-0.5 2,-0.4 -0.954 18.8-132.5-121.9 130.2 0.3 40.8 38.7 10 10 A T E - b 0 33A 7 302,-1.7 2,-0.3 -2,-0.4 24,-0.2 -0.603 30.0-133.8 -74.6 125.3 -1.5 38.5 36.1 11 11 A I + 0 0 5 22,-3.0 24,-0.4 -2,-0.4 306,-0.2 -0.595 42.4 130.9 -85.2 144.1 -5.1 38.2 37.1 12 12 A G >> - 0 0 2 304,-0.5 3,-1.4 -2,-0.3 4,-1.0 -0.887 68.2 -50.5-164.0-164.7 -6.9 34.8 37.2 13 13 A P T 34 S+ 0 0 92 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.860 131.0 49.9 -53.0 -39.0 -9.1 32.3 39.0 14 14 A A T 34 S+ 0 0 26 303,-2.2 304,-0.2 1,-0.2 303,-0.1 0.656 126.7 24.4 -76.0 -16.8 -6.9 32.6 42.1 15 15 A S T <4 S+ 0 0 0 -3,-1.4 -1,-0.2 302,-0.5 303,-0.1 0.155 91.2 97.8-135.9 20.8 -7.0 36.4 42.1 16 16 A E < + 0 0 66 -4,-1.0 -2,-0.1 -3,-0.4 34,-0.1 0.689 59.6 95.0 -87.5 -15.8 -10.2 37.4 40.2 17 17 A S S > S- 0 0 57 -4,-0.3 4,-2.3 -5,-0.2 5,-0.1 -0.246 79.9-122.7 -70.3 164.7 -12.5 38.1 43.2 18 18 A V H > S+ 0 0 15 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.892 113.3 48.9 -74.0 -41.5 -12.8 41.5 44.7 19 19 A D H > S+ 0 0 110 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.850 112.6 48.5 -66.0 -36.6 -11.7 40.5 48.1 20 20 A K H >> S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 3,-0.9 0.984 114.5 45.5 -65.5 -56.4 -8.7 38.7 46.6 21 21 A L H 3X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.3 -2,-0.2 0.850 106.9 58.4 -54.2 -38.9 -7.9 41.8 44.5 22 22 A V H 3X S+ 0 0 17 -4,-2.7 4,-1.5 1,-0.2 -1,-0.3 0.894 110.7 45.5 -59.9 -34.9 -8.4 43.9 47.6 23 23 A Q H S+ 0 0 0 -4,-2.5 5,-1.9 1,-0.2 4,-0.9 0.932 111.2 51.2 -49.7 -46.3 -3.3 41.9 46.2 25 25 A M H ><5S+ 0 0 2 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.889 108.6 48.7 -59.2 -43.3 -3.6 45.7 46.2 26 26 A E H 3<5S+ 0 0 113 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.735 107.3 56.7 -71.1 -21.7 -2.8 46.0 49.9 27 27 A A H 3<5S- 0 0 12 -4,-1.9 -1,-0.2 -3,-0.5 -2,-0.2 0.677 133.3 -88.2 -80.1 -19.8 0.2 43.7 49.4 28 28 A G T <<5 + 0 0 10 -4,-0.9 -21,-0.5 -3,-0.6 2,-0.3 0.599 65.2 162.0 124.7 16.0 1.5 46.1 46.8 29 29 A M E < +b 7 0A 5 -5,-1.9 -1,-0.2 -6,-0.2 -21,-0.2 -0.510 6.3 173.7 -68.3 124.8 0.2 45.3 43.4 30 30 A N E + 0 0 29 -23,-2.6 33,-2.0 -2,-0.3 2,-0.4 0.794 64.4 32.3-100.4 -34.7 0.6 48.3 41.1 31 31 A V E -bc 8 63A 0 -24,-2.1 -22,-2.9 31,-0.2 2,-0.6 -0.980 65.4-148.7-129.0 136.7 -0.5 46.9 37.8 32 32 A A E -bc 9 64A 0 31,-2.8 33,-3.0 -2,-0.4 2,-0.5 -0.921 17.2-154.1-105.6 120.2 -3.1 44.2 37.0 33 33 A R E -bc 10 65A 15 -24,-3.0 -22,-3.0 -2,-0.6 2,-0.6 -0.795 5.3-161.6 -97.0 124.7 -2.2 42.2 33.9 34 34 A L E - c 0 66A 3 31,-2.2 33,-2.8 -2,-0.5 2,-0.9 -0.950 12.2-147.8 -92.2 107.1 -4.9 40.5 31.9 35 35 A N E > - c 0 67A 43 -2,-0.6 3,-1.2 -24,-0.4 33,-0.2 -0.791 10.5-169.6 -88.5 105.1 -3.5 37.8 29.6 36 36 A F T 3 S+ 0 0 1 31,-2.9 33,-0.2 -2,-0.9 -1,-0.1 0.326 71.0 88.4 -80.4 8.6 -5.7 37.7 26.5 37 37 A S T 3 S+ 0 0 33 31,-0.2 2,-0.3 30,-0.2 -1,-0.3 0.646 100.4 32.5 -76.7 -12.7 -4.2 34.5 25.2 38 38 A H S < S+ 0 0 135 -3,-1.2 -1,-0.1 2,-0.0 -3,-0.0 -0.992 101.3 31.0-143.5 148.9 -7.0 32.9 27.4 39 39 A G S S- 0 0 35 -2,-0.3 2,-0.3 -3,-0.1 0, 0.0 -0.043 73.7 -93.0 90.8 163.1 -10.5 33.8 28.4 40 40 A D >> - 0 0 82 1,-0.0 4,-1.8 -2,-0.0 3,-1.0 -0.766 37.6 -96.8-114.2 161.7 -13.2 35.8 26.6 41 41 A H H 3> S+ 0 0 55 -2,-0.3 4,-2.7 1,-0.3 5,-0.2 0.797 121.3 58.1 -46.7 -34.1 -14.2 39.5 26.7 42 42 A E H 3> S+ 0 0 134 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.922 108.2 45.6 -63.4 -42.3 -16.9 38.8 29.3 43 43 A E H <> S+ 0 0 62 -3,-1.0 4,-2.3 2,-0.2 3,-0.3 0.961 116.8 42.7 -64.2 -54.3 -14.4 37.3 31.8 44 44 A H H X S+ 0 0 0 -4,-1.8 4,-3.6 1,-0.2 5,-0.3 0.894 110.8 59.5 -60.1 -38.7 -11.8 40.1 31.4 45 45 A G H X S+ 0 0 18 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.2 0.881 109.3 42.2 -56.3 -39.6 -14.8 42.5 31.5 46 46 A R H X S+ 0 0 168 -4,-1.7 4,-2.4 -3,-0.3 -2,-0.2 0.881 114.2 50.0 -76.2 -44.7 -15.7 41.2 34.9 47 47 A R H X S+ 0 0 18 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.951 112.5 48.5 -53.6 -54.9 -12.0 41.1 36.2 48 48 A I H X S+ 0 0 2 -4,-3.6 4,-2.2 1,-0.2 -2,-0.2 0.969 110.6 51.5 -53.2 -50.8 -11.5 44.6 35.0 49 49 A A H X S+ 0 0 51 -4,-1.9 4,-1.2 -5,-0.3 -2,-0.2 0.870 111.6 46.9 -53.6 -49.1 -14.8 45.5 36.7 50 50 A N H X S+ 0 0 40 -4,-2.4 4,-2.9 2,-0.2 5,-0.4 0.848 105.2 58.4 -58.0 -47.1 -13.5 43.9 40.0 51 51 A I H X S+ 0 0 2 -4,-2.7 4,-3.2 1,-0.2 -2,-0.2 0.983 108.9 47.3 -50.8 -51.3 -10.1 45.6 39.8 52 52 A R H X S+ 0 0 93 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.808 112.6 47.9 -61.3 -32.0 -12.0 48.9 39.8 53 53 A E H X S+ 0 0 98 -4,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.863 115.2 44.2 -77.6 -37.2 -14.2 47.9 42.7 54 54 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 6,-0.2 0.867 108.0 60.0 -72.5 -35.3 -11.2 46.7 44.7 55 55 A A H <>S+ 0 0 23 -4,-3.2 5,-1.0 -5,-0.4 -1,-0.2 0.813 112.0 39.9 -60.1 -30.9 -9.4 49.8 43.7 56 56 A K H <5S+ 0 0 183 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.819 105.0 62.2 -86.6 -37.7 -12.2 51.8 45.4 57 57 A R H <5S+ 0 0 149 -4,-2.2 2,-0.2 -5,-0.1 -2,-0.2 0.892 119.8 32.2 -54.3 -37.2 -12.6 49.5 48.4 58 58 A T T <5S- 0 0 15 -4,-2.0 2,-0.3 -5,-0.1 -36,-0.0 -0.678 94.9-116.7-110.3 167.4 -9.0 50.6 49.0 59 59 A G T 5 + 0 0 80 -2,-0.2 2,-0.3 2,-0.1 -3,-0.1 -0.268 68.9 135.8-100.3 50.4 -7.6 54.0 48.1 60 60 A R < - 0 0 110 -5,-1.0 2,-0.7 -2,-0.3 -2,-0.1 -0.769 53.5-138.1-107.4 144.7 -5.1 52.4 45.6 61 61 A T + 0 0 51 -2,-0.3 2,-0.4 359,-0.1 359,-0.1 -0.857 30.0 172.2 -95.9 114.0 -4.1 53.4 42.1 62 62 A V - 0 0 8 -2,-0.7 -31,-0.2 -31,-0.0 2,-0.1 -0.986 19.9-146.6-127.7 122.7 -3.8 50.2 39.9 63 63 A A E -c 31 0A 0 -33,-2.0 -31,-2.8 -2,-0.4 2,-0.6 -0.453 14.9-127.7 -83.0 158.2 -3.2 50.4 36.2 64 64 A I E -c 32 0A 3 -33,-0.2 125,-2.9 -2,-0.1 124,-1.7 -0.934 21.3-167.3-113.5 119.2 -4.7 47.8 33.8 65 65 A L E -cd 33 189A 0 -33,-3.0 -31,-2.2 -2,-0.6 2,-0.7 -0.894 7.8-154.7-108.5 130.0 -2.3 46.1 31.4 66 66 A L E -cd 34 190A 2 123,-2.1 125,-2.3 -2,-0.5 2,-0.8 -0.898 5.0-160.0-105.3 110.0 -3.7 44.1 28.5 67 67 A D E -cd 35 191A 1 -33,-2.8 -31,-2.9 -2,-0.7 -30,-0.2 -0.820 18.8-146.4 -90.4 115.0 -1.2 41.4 27.3 68 68 A T - 0 0 5 123,-2.3 -31,-0.2 -2,-0.8 107,-0.0 -0.211 14.4-126.5 -76.0 170.7 -2.3 40.5 23.8 69 69 A K - 0 0 64 -33,-0.2 -1,-0.1 124,-0.1 -32,-0.1 0.876 47.4-176.6 -84.6 -42.7 -2.0 37.1 22.2 70 70 A G - 0 0 9 102,-0.1 124,-0.1 2,-0.0 104,-0.1 0.077 30.3 -42.0 73.4 175.7 -0.0 38.2 19.2 71 71 A P + 0 0 18 0, 0.0 2,-0.1 0, 0.0 97,-0.0 -0.343 59.7 157.9 -73.2 158.0 1.2 36.4 16.0 72 72 A E - 0 0 75 36,-0.1 2,-0.3 2,-0.0 88,-0.1 -0.457 40.0-121.1 177.0 140.0 2.8 33.0 16.1 73 73 A I + 0 0 13 86,-0.2 86,-2.1 -2,-0.1 2,-0.2 -0.388 40.6 177.6 -76.1 119.4 3.5 30.1 13.8 74 74 A R B -I 158 0B 75 -2,-0.3 34,-0.8 84,-0.2 2,-0.3 -0.658 25.5-114.2-124.4 177.3 1.9 26.9 15.2 75 75 A T B -J 107 0C 4 82,-1.2 32,-0.2 -2,-0.2 3,-0.1 -0.765 26.2-127.9-110.0 158.8 1.5 23.3 14.1 76 76 A H - 0 0 37 30,-1.5 80,-1.4 -2,-0.3 81,-0.3 0.056 51.5 -44.1 -88.2-158.8 -1.7 21.5 13.2 77 77 A N - 0 0 96 78,-0.2 23,-2.2 79,-0.1 2,-1.0 -0.462 42.9-138.5 -76.3 143.5 -3.1 18.2 14.5 78 78 A M > - 0 0 0 3,-0.4 3,-1.2 21,-0.2 23,-0.1 -0.712 59.5 -76.8-101.8 79.8 -0.9 15.1 15.0 79 79 A E T 3 S- 0 0 69 -2,-1.0 2,-3.3 1,-0.3 3,-0.3 0.853 95.8 -39.3 28.1 90.3 -3.2 12.4 13.7 80 80 A N T 3 S- 0 0 174 1,-0.2 -1,-0.3 0, 0.0 75,-0.1 -0.086 135.1 -3.6 66.9 -43.9 -5.7 11.8 16.4 81 81 A G S < S- 0 0 30 -2,-3.3 -3,-0.4 -3,-1.2 74,-0.3 0.392 109.1 -36.1-144.6 -90.8 -3.2 12.2 19.3 82 82 A A - 0 0 40 -3,-0.3 72,-0.2 72,-0.2 2,-0.1 -0.993 40.3-129.4-153.2 158.7 0.5 12.7 19.0 83 83 A I B -K 153 0D 8 70,-2.3 70,-1.7 -2,-0.3 -5,-0.0 -0.435 11.6-147.8-100.3 175.8 3.6 11.8 17.0 84 84 A E + 0 0 130 68,-0.2 67,-0.9 -2,-0.1 -1,-0.1 0.755 15.6 178.4-108.7 -81.3 7.0 10.5 18.1 85 85 A L - 0 0 4 65,-0.1 66,-1.0 67,-0.1 2,-0.1 0.726 15.7-153.7 72.8 118.1 10.1 11.4 16.1 86 86 A K - 0 0 118 64,-0.2 64,-0.1 61,-0.0 65,-0.1 -0.231 48.0 -60.1-106.1-162.6 13.5 10.1 17.4 87 87 A E S S+ 0 0 152 -2,-0.1 62,-0.0 62,-0.1 59,-0.0 0.497 131.9 12.8 -62.5 -0.5 17.1 11.3 17.2 88 88 A G S S+ 0 0 25 2,-0.0 59,-1.4 58,-0.0 3,-0.3 0.270 76.4 143.5-134.0 -95.5 16.6 11.0 13.4 89 89 A S - 0 0 48 57,-0.2 2,-0.9 1,-0.2 58,-0.6 0.473 59.5-100.6 57.6 152.2 13.3 10.5 11.6 90 90 A K E +L 146 0E 146 12,-0.2 2,-0.8 56,-0.2 56,-0.2 -0.733 48.3 177.2-105.9 80.0 12.4 12.0 8.3 91 91 A L E -L 145 0E 0 -2,-0.9 54,-1.6 54,-0.7 2,-0.5 -0.779 4.0-176.9 -91.4 112.0 10.3 14.9 9.4 92 92 A V E -Lm 144 104E 18 11,-3.5 13,-2.1 -2,-0.8 2,-0.5 -0.916 15.5-145.1-109.1 132.1 9.1 17.0 6.5 93 93 A I E -Lm 143 105E 0 50,-2.3 50,-1.2 -2,-0.5 2,-0.4 -0.844 11.6-147.6 -99.3 130.7 7.0 20.1 7.2 94 94 A S E -Lm 142 106E 9 11,-2.9 13,-1.4 -2,-0.5 48,-0.2 -0.816 14.8-142.1-101.3 137.4 4.3 21.0 4.7 95 95 A M S S+ 0 0 14 46,-1.5 2,-0.3 -2,-0.4 11,-0.1 0.098 88.8 66.4 -80.1 23.4 3.4 24.6 3.9 96 96 A S S S- 0 0 75 9,-0.2 -2,-0.2 45,-0.1 2,-0.1 -0.996 102.5 -87.5-146.4 142.2 -0.2 23.2 3.7 97 97 A E + 0 0 123 -2,-0.3 2,-0.3 9,-0.1 -2,-0.1 -0.273 59.9 158.8 -52.0 117.9 -2.5 21.7 6.3 98 98 A V - 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g 0 278A 1 -22,-1.5 4,-2.0 -2,-0.8 35,-0.2 -0.813 4.9-175.1 -99.9 95.5 10.2 37.9 28.8 245 245 A R H > S+ 0 0 13 33,-1.7 4,-2.0 -2,-0.9 -1,-0.2 0.838 80.3 55.0 -60.0 -34.8 13.1 35.7 29.9 246 246 A G H 4 S+ 0 0 19 32,-0.4 4,-0.4 2,-0.2 -1,-0.2 0.953 108.6 45.8 -64.0 -50.5 11.2 32.5 29.2 247 247 A D H >> S+ 0 0 50 1,-0.2 3,-1.4 2,-0.2 4,-0.9 0.884 110.6 54.8 -60.2 -40.6 10.3 33.2 25.6 248 248 A L H >X S+ 0 0 0 -4,-2.0 4,-3.5 1,-0.3 3,-1.1 0.942 99.5 59.8 -58.8 -49.0 13.8 34.3 24.9 249 249 A G H 3< S+ 0 0 42 -4,-2.0 -1,-0.3 1,-0.3 5,-0.2 0.598 97.7 64.3 -57.0 -10.0 15.3 31.0 26.2 250 250 A V H <4 S+ 0 0 26 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.887 119.6 17.4 -81.0 -42.4 13.2 29.4 23.4 251 251 A E H << S+ 0 0 43 -3,-1.1 -2,-0.2 -4,-0.9 -3,-0.1 0.689 124.0 60.9-100.8 -25.6 15.0 30.9 20.5 252 252 A I S < S- 0 0 6 -4,-3.5 5,-0.1 -5,-0.2 -1,-0.1 -0.873 91.9-104.0-110.9 137.4 18.1 32.1 22.2 253 253 A P >> - 0 0 70 0, 0.0 3,-2.0 0, 0.0 4,-1.1 -0.251 29.8-123.8 -54.8 137.8 20.7 29.9 24.0 254 254 A A G >4 S+ 0 0 80 1,-0.3 3,-0.7 -5,-0.2 -5,-0.1 0.889 108.1 61.6 -51.9 -45.4 20.4 30.1 27.8 255 255 A E G 34 S+ 0 0 184 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.633 107.4 46.6 -61.6 -10.3 24.0 31.1 28.2 256 256 A E G <> S+ 0 0 100 -3,-2.0 4,-1.2 2,-0.1 3,-0.5 0.713 92.9 76.1-102.1 -24.8 23.3 34.3 26.2 257 257 A V H XX S+ 0 0 15 -4,-1.1 4,-2.8 -3,-0.7 3,-0.5 0.895 82.7 65.1 -56.0 -48.5 20.1 35.5 27.8 258 258 A P H 3> S+ 0 0 72 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.867 107.3 41.0 -44.2 -48.8 21.5 37.0 31.0 259 259 A L H 3> S+ 0 0 130 -3,-0.5 4,-2.4 -4,-0.2 -2,-0.2 0.815 112.7 57.2 -72.6 -26.8 23.5 39.7 29.2 260 260 A I H S+ 0 0 0 -4,-1.6 5,-2.0 2,-0.2 4,-1.0 0.929 112.3 54.4 -70.8 -42.7 15.1 51.2 28.3 269 269 A N H ><5S+ 0 0 3 -4,-3.2 3,-0.8 1,-0.2 -2,-0.2 0.912 106.8 51.0 -54.2 -46.5 16.7 52.8 31.3 270 270 A M H 3<5S+ 0 0 62 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.796 111.0 47.3 -65.4 -29.0 18.7 55.2 29.1 271 271 A L H 3<5S- 0 0 66 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.567 109.8-123.4 -87.2 -8.5 15.5 56.2 27.2 272 272 A G T <<5 + 0 0 18 -4,-1.0 -3,-0.2 -3,-0.8 120,-0.1 0.799 66.0 137.0 71.9 26.8 13.7 56.7 30.4 273 273 A K < - 0 0 45 -5,-2.0 -1,-0.3 -6,-0.1 -2,-0.2 -0.911 61.1-101.1-110.4 134.7 11.0 54.3 29.4 274 274 A P - 0 0 5 0, 0.0 -33,-2.4 0, 0.0 2,-0.4 -0.134 35.5-162.1 -52.0 138.9 9.5 51.7 31.8 275 275 A V E -g 241 0A 0 -35,-0.2 34,-1.9 31,-0.2 33,-1.2 -0.995 3.6-154.2-130.0 133.0 10.8 48.2 31.5 276 276 A I E -gh 242 309A 0 -35,-2.9 -33,-3.4 -2,-0.4 2,-0.6 -0.912 7.1-147.4-108.5 130.0 9.1 45.0 33.0 277 277 A T E -gh 243 310A 0 32,-2.4 34,-2.1 -2,-0.5 2,-0.3 -0.865 32.8-175.5 -96.1 119.7 11.1 41.9 33.9 278 278 A A E +g 244 0A 0 -35,-3.2 -33,-1.7 -2,-0.6 -32,-0.4 -0.819 25.0 20.3-125.8 161.4 8.8 38.9 33.2 279 279 A T S S+ 0 0 29 32,-0.3 -34,-0.2 -2,-0.3 32,-0.1 0.442 98.9 41.6 67.3 150.9 8.4 35.1 33.5 280 280 A Q S S+ 0 0 109 -35,-0.1 32,-0.1 1,-0.1 -2,-0.0 0.898 77.1 127.6 47.4 51.7 10.3 32.7 35.7 281 281 A M S S- 0 0 0 30,-0.1 18,-0.2 17,-0.0 17,-0.2 0.883 88.1 -16.2 -97.0 -68.3 10.2 35.1 38.7 282 282 A L S > S+ 0 0 0 1,-0.1 3,-3.0 9,-0.1 4,-0.1 -0.187 81.7 149.3-132.0 40.0 8.7 33.2 41.7 283 283 A D G > + 0 0 58 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.792 67.1 61.8 -44.3 -41.4 7.3 30.2 39.8 284 284 A S G >> S+ 0 0 29 1,-0.3 4,-1.7 2,-0.2 3,-1.4 0.724 87.8 76.1 -63.0 -18.5 7.8 27.8 42.7 285 285 A M G <4 S+ 0 0 0 -3,-3.0 36,-0.5 1,-0.3 -1,-0.3 0.474 73.1 78.0 -73.9 0.3 5.4 30.0 44.8 286 286 A Q G <4 S+ 0 0 69 -3,-1.8 34,-2.5 33,-0.2 -1,-0.3 0.807 114.7 21.4 -73.5 -28.8 2.4 28.6 42.9 287 287 A R T <4 S+ 0 0 190 -3,-1.4 -2,-0.2 -4,-0.3 -1,-0.1 0.617 124.8 58.8-109.9 -21.7 2.9 25.6 45.2 288 288 A N < - 0 0 82 -4,-1.7 33,-0.1 1,-0.1 -1,-0.1 -0.894 65.8-139.2-122.6 149.1 4.9 27.1 48.1 289 289 A P S S+ 0 0 41 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.683 95.0 39.3 -67.2 -25.4 4.5 30.0 50.6 290 290 A R S S- 0 0 171 -6,-0.1 -3,-0.1 38,-0.0 2,-0.1 -0.890 83.1-122.3-127.9 158.1 8.1 31.0 50.2 291 291 A P - 0 0 42 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.281 31.8 -94.1 -90.4-179.9 10.4 31.2 47.1 292 292 A T > - 0 0 71 1,-0.1 4,-2.6 -2,-0.1 5,-0.3 -0.584 30.3-114.1 -92.4 157.7 13.7 29.6 46.4 293 293 A R H > S+ 0 0 187 1,-0.2 4,-2.1 -2,-0.2 5,-0.1 0.905 121.2 52.4 -53.9 -42.0 17.2 31.1 47.1 294 294 A A H > S+ 0 0 44 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.942 108.1 47.5 -60.4 -52.0 17.5 31.1 43.3 295 295 A E H > S+ 0 0 31 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.883 112.5 48.9 -60.1 -40.6 14.2 32.9 42.6 296 296 A A H X S+ 0 0 32 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.886 113.4 49.6 -65.9 -36.5 15.0 35.6 45.2 297 297 A S H X S+ 0 0 41 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.882 109.7 49.0 -68.6 -42.1 18.4 35.9 43.6 298 298 A D H X S+ 0 0 59 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.901 114.8 45.4 -66.9 -40.4 17.0 36.3 40.1 299 299 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 -18,-0.2 3,-0.3 0.950 110.6 52.6 -68.0 -49.5 14.5 38.9 41.2 300 300 A A H X S+ 0 0 17 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.898 111.1 48.9 -52.0 -43.1 17.0 40.8 43.2 301 301 A N H X S+ 0 0 66 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.828 102.7 58.1 -70.2 -31.8 19.3 41.0 40.2 302 302 A A H X>S+ 0 0 0 -4,-1.6 5,-2.0 -3,-0.3 4,-0.6 0.877 109.7 48.8 -64.1 -34.1 16.6 42.1 37.8 303 303 A I H ><5S+ 0 0 5 -4,-1.8 3,-1.1 2,-0.2 -2,-0.2 0.923 108.6 49.6 -71.0 -44.7 16.3 45.0 40.2 304 304 A F H 3<5S+ 0 0 100 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.866 105.8 61.0 -61.4 -32.2 20.1 45.7 40.4 305 305 A D H 3<5S- 0 0 29 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.737 124.2-104.2 -64.7 -25.3 19.9 45.6 36.5 306 306 A G T <<5 + 0 0 10 -3,-1.1 -3,-0.2 -4,-0.6 -31,-0.2 0.553 57.4 165.4 113.7 10.6 17.5 48.6 36.6 307 307 A T < - 0 0 0 -5,-2.0 -1,-0.2 1,-0.2 -31,-0.1 -0.333 30.1-150.5 -61.5 135.4 14.0 47.1 35.9 308 308 A D S S+ 0 0 8 -33,-1.2 -302,-2.4 1,-0.2 2,-0.3 0.872 78.4 11.4 -72.3 -35.2 11.2 49.5 36.7 309 309 A A E -ah 6 276A 0 -34,-1.9 -32,-2.4 -304,-0.2 2,-0.3 -0.965 61.5-142.3-144.4 159.3 8.9 46.6 37.5 310 310 A V E -ah 7 277A 1 -304,-2.3 -302,-2.6 -2,-0.3 2,-0.4 -0.894 23.9-140.6-117.9 148.1 8.7 42.9 38.1 311 311 A M E -a 8 0A 4 -34,-2.1 2,-0.4 -2,-0.3 -32,-0.3 -0.924 7.1-156.6-120.8 138.4 5.9 40.7 36.8 312 312 A L E +a 9 0A 0 -304,-3.3 -302,-1.7 -2,-0.4 -279,-0.2 -0.869 18.0 168.1-106.1 139.4 4.0 37.8 38.4 313 313 A S S >> S+ 0 0 26 -2,-0.4 4,-2.1 -304,-0.2 3,-1.9 0.444 72.3 3.7-113.1-105.5 2.2 35.3 36.1 314 314 A G H 3>>S+ 0 0 21 1,-0.3 5,-3.3 2,-0.2 4,-1.8 0.745 118.5 75.3 -57.7 -23.3 0.9 31.9 37.3 315 315 A E H 345S+ 0 0 1 1,-0.2 6,-0.3 3,-0.2 10,-0.3 0.765 116.5 17.6 -60.6 -26.8 1.9 32.9 40.9 316 316 A T H <45S+ 0 0 0 -3,-1.9 -304,-0.5 9,-0.1 -1,-0.2 0.531 124.2 59.7-118.4 -17.2 -1.1 35.2 41.0 317 317 A A H <5S- 0 0 18 -4,-2.1 -303,-2.2 -306,-0.2 -302,-0.5 0.938 134.2 -16.8 -78.6 -49.8 -3.1 33.9 38.2 318 318 A A T <5S+ 0 0 69 -4,-1.8 -3,-0.2 -305,-0.2 -4,-0.1 0.532 100.9 116.3-133.3 -16.8 -3.7 30.3 39.4 319 319 A G < - 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