==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 02-JUL-12 3VUL . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.NAKANIWA,T.KINOSHITA,T.INOUE . 354 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 218 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 4 0 1 0 0 1 1 1 0 0 1 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 1 0 3 1 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 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 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 7 A D 0 0 183 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-105.3 65.3 -16.2 33.2 2 8 A N - 0 0 104 2,-0.4 2,-0.1 0, 0.0 3,-0.1 -0.025 360.0 -96.1-121.4 32.2 62.7 -14.4 31.0 3 9 A N S S+ 0 0 111 1,-0.3 15,-3.3 14,-0.1 16,-0.3 -0.041 101.1 79.8 86.1 -31.4 64.9 -13.2 28.1 4 10 A F E +A 17 0A 29 13,-0.3 -2,-0.4 -2,-0.1 2,-0.3 -0.330 51.4 174.2-100.9 179.0 65.4 -9.8 29.7 5 11 A Y E -A 16 0A 75 11,-0.5 11,-2.3 -2,-0.1 2,-0.4 -0.933 22.8-112.0 179.7 171.3 67.5 -8.3 32.4 6 12 A S E +A 15 0A 62 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.950 19.8 179.6-132.9 126.0 68.4 -5.0 34.0 7 13 A V E -A 14 0A 51 7,-3.0 7,-2.9 -2,-0.4 2,-0.7 -0.974 25.1-132.3-121.6 147.2 71.3 -2.6 34.2 8 14 A E E -A 13 0A 116 -2,-0.4 2,-0.7 5,-0.2 5,-0.2 -0.865 18.9-176.1 -90.7 113.5 71.6 0.6 36.0 9 15 A I E > -A 12 0A 30 3,-3.5 3,-2.3 -2,-0.7 15,-0.0 -0.938 67.8 -62.1-107.0 101.6 73.1 3.3 33.8 10 16 A G T 3 S- 0 0 66 -2,-0.7 -1,-0.0 1,-0.3 0, 0.0 -0.362 118.3 -16.1 55.8-129.8 73.3 6.1 36.2 11 17 A D T 3 S+ 0 0 169 -3,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.607 123.2 88.2 -78.1 -13.6 69.8 7.0 37.3 12 18 A S E < -A 9 0A 36 -3,-2.3 -3,-3.5 2,-0.0 2,-0.6 -0.724 65.0-147.4 -96.4 138.7 68.2 5.1 34.4 13 19 A T E -A 8 0A 50 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.904 10.4-162.2 -99.9 116.2 67.3 1.4 34.3 14 20 A F E -A 7 0A 1 -7,-2.9 -7,-3.0 -2,-0.6 2,-0.5 -0.925 4.5-171.3 -99.0 128.5 67.7 -0.3 31.0 15 21 A T E +A 6 0A 27 -2,-0.5 2,-0.3 -9,-0.2 -9,-0.2 -0.989 26.4 149.6-119.9 117.6 65.8 -3.6 30.7 16 22 A V E -A 5 0A 0 -11,-2.3 -11,-0.5 -2,-0.5 -2,-0.0 -0.912 50.2 -68.5-150.7 161.8 66.7 -5.4 27.6 17 23 A L E > -A 4 0A 36 -2,-0.3 3,-3.6 -13,-0.2 -13,-0.3 -0.294 47.5-118.1 -60.3 135.9 67.2 -8.8 25.8 18 24 A K T 3 S+ 0 0 100 -15,-3.3 -1,-0.1 1,-0.3 -14,-0.1 0.765 111.6 71.7 -50.7 -22.9 70.2 -10.8 27.2 19 25 A R T 3 S+ 0 0 50 -16,-0.3 21,-4.6 1,-0.1 2,-0.8 0.697 83.6 77.9 -65.2 -22.1 71.7 -10.5 23.7 20 26 A Y E < +B 39 0B 2 -3,-3.6 19,-0.2 19,-0.2 2,-0.2 -0.834 67.6 167.7 -98.0 109.4 72.4 -6.9 24.3 21 27 A Q E +B 38 0B 78 17,-3.3 17,-2.8 -2,-0.8 -2,-0.0 -0.630 42.2 26.9-113.1 170.1 75.4 -6.5 26.5 22 28 A N E S- 0 0 110 15,-0.2 -1,-0.2 -2,-0.2 14,-0.1 0.787 70.6-162.8 54.0 43.6 77.8 -3.8 27.7 23 29 A L E - 0 0 17 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.309 9.6-173.9 -63.7 135.0 75.6 -0.9 27.4 24 30 A K E -B 36 0B 149 12,-2.8 12,-3.4 -15,-0.0 2,-0.2 -0.986 29.8-114.0-123.0 136.7 77.2 2.5 27.4 25 31 A P E +B 35 0B 67 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.548 37.7 169.3 -67.6 134.2 75.3 5.8 27.5 26 32 A I E - 0 0 95 8,-2.7 2,-0.3 1,-0.3 9,-0.2 0.612 50.3 -69.6-120.0 -17.6 75.8 7.7 24.3 27 33 A G E -B 34 0B 36 7,-1.4 7,-3.0 2,-0.0 -1,-0.3 -0.973 42.4 -80.3 162.3-166.2 73.2 10.5 24.4 28 34 A S E -B 33 0B 89 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.781 24.4-164.0-140.1 101.9 69.5 11.7 24.3 29 35 A G - 0 0 27 3,-0.6 2,-1.2 -2,-0.3 134,-0.0 -0.698 57.9 -75.3 -87.4 109.1 67.4 12.3 21.2 30 36 A A S S+ 0 0 78 -2,-0.7 2,-0.3 1,-0.2 136,-0.0 -0.229 127.8 25.5 38.5 -78.2 64.3 14.4 21.8 31 37 A Q S S+ 0 0 29 -2,-1.2 -1,-0.2 134,-0.1 2,-0.2 -0.363 121.1 22.8-109.4 51.0 62.2 11.7 23.6 32 38 A G - 0 0 14 -2,-0.3 -3,-0.6 19,-0.1 2,-0.2 -0.721 67.3-108.2 162.8 147.3 64.7 9.2 25.1 33 39 A I E -BC 28 50B 61 17,-0.6 17,-2.3 -5,-0.2 2,-0.4 -0.616 39.7-147.0 -82.2 152.7 68.1 8.4 26.4 34 40 A V E -BC 27 49B 21 -7,-3.0 -8,-2.7 -2,-0.2 -7,-1.4 -0.979 9.4-158.9-132.1 137.0 70.1 6.1 24.2 35 41 A C E -BC 25 48B 1 13,-3.5 13,-3.6 -2,-0.4 2,-0.3 -0.882 15.9-135.5-109.8 142.2 72.7 3.5 24.9 36 42 A A E +BC 24 47B 17 -12,-3.4 -12,-2.8 -2,-0.4 2,-0.3 -0.741 37.2 177.6 -79.2 144.4 75.4 2.0 22.8 37 43 A A E - C 0 46B 4 9,-2.5 9,-3.0 -2,-0.3 2,-0.4 -0.991 33.9-120.2-142.9 156.5 75.4 -1.9 23.3 38 44 A Y E -BC 21 45B 81 -17,-2.8 -17,-3.3 -2,-0.3 2,-0.7 -0.829 27.2-144.2 -90.0 132.3 77.1 -5.0 22.0 39 45 A D E >> -BC 20 44B 0 5,-2.5 4,-1.5 -2,-0.4 5,-1.2 -0.885 7.4-160.8-103.2 113.5 74.6 -7.4 20.4 40 46 A A T 45S+ 0 0 33 -21,-4.6 -1,-0.1 -2,-0.7 -20,-0.1 0.727 83.3 45.2 -75.1 -18.0 75.7 -10.9 21.2 41 47 A I T 45S+ 0 0 111 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.0 0.962 120.7 34.3 -87.8 -58.4 73.8 -12.7 18.5 42 48 A L T 45S- 0 0 88 2,-0.1 -2,-0.2 -23,-0.1 -1,-0.1 0.657 102.8-133.8 -63.9 -19.9 74.5 -10.5 15.4 43 49 A E T <5 + 0 0 143 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.937 62.9 121.0 61.2 55.9 77.9 -9.9 16.9 44 50 A R E S- 0 0 111 43,-0.2 3,-1.9 -2,-0.2 -1,-0.3 0.762 74.5-179.9 13.4 72.0 56.2 5.5 29.6 54 60 A P T 3 S+ 0 0 3 0, 0.0 3,-0.4 0, 0.0 10,-0.2 0.604 75.9 64.6 -68.1 -11.6 55.8 7.2 26.2 55 61 A F T 3 S+ 0 0 16 41,-0.3 279,-0.2 1,-0.2 6,-0.1 0.560 72.5 104.4 -84.4 -12.5 52.0 7.2 26.7 56 62 A Q S < S+ 0 0 110 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 0.780 86.5 10.0 -28.9 -52.1 52.4 9.5 29.6 57 63 A N S > S- 0 0 49 -3,-0.4 4,-2.5 -4,-0.2 5,-0.3 -0.916 75.4-104.7-144.9 153.0 51.2 12.6 27.8 58 64 A Q H > S+ 0 0 66 -2,-0.3 4,-2.0 2,-0.2 5,-0.2 0.896 118.7 45.5 -43.8 -56.2 49.5 13.9 24.5 59 65 A T H >> S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 3,-0.7 0.987 113.6 47.2 -49.5 -77.5 52.8 15.3 23.1 60 66 A H H 3> S+ 0 0 64 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.758 113.6 48.2 -30.7 -51.0 55.0 12.2 23.9 61 67 A A H 3X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.887 107.0 53.2 -72.1 -42.6 52.4 9.7 22.5 62 68 A K H -F 79 0C 18 3,-0.5 3,-2.1 -2,-0.4 234,-0.0 -0.965 60.4-108.4-171.9 147.2 66.6 3.4 2.9 77 83 A K T 3 S+ 0 0 91 -2,-0.3 82,-0.1 1,-0.3 4,-0.1 0.660 119.0 47.0 -59.7 -14.8 70.4 3.6 2.9 78 84 A N T 3 S+ 0 0 2 82,-0.1 83,-2.0 2,-0.1 2,-0.4 0.066 98.9 75.9-116.7 20.7 70.2 7.2 4.2 79 85 A I B < S-Fg 76 161C 4 -3,-2.1 -3,-0.5 81,-0.3 83,-0.2 -0.989 98.7 -92.9-135.0 124.2 67.7 6.7 7.1 80 86 A I - 0 0 6 81,-2.1 2,-0.4 -2,-0.4 -2,-0.1 0.038 47.1-117.1 -38.2 128.9 68.8 5.1 10.3 81 87 A G - 0 0 10 -4,-0.1 22,-2.0 -6,-0.1 2,-0.2 -0.616 16.7-137.0 -81.0 127.0 68.2 1.3 10.1 82 88 A L E +E 102 0B 46 -2,-0.4 20,-0.2 -11,-0.3 3,-0.1 -0.537 27.0 169.4 -67.9 142.5 65.8 -0.4 12.5 83 89 A L E - 0 0 63 18,-2.6 2,-0.3 1,-0.5 19,-0.2 0.569 60.6 -14.7-127.7 -27.6 67.1 -3.7 13.9 84 90 A N E -E 101 0B 36 17,-1.5 17,-3.5 2,-0.0 -1,-0.5 -0.898 50.4-163.0-174.2 141.7 64.7 -4.7 16.7 85 91 A V E +E 100 0B 4 259,-0.5 2,-0.3 -2,-0.3 15,-0.2 -0.989 22.6 145.8-132.1 153.1 62.0 -3.3 18.9 86 92 A F E -E 99 0B 2 13,-2.2 13,-2.7 -2,-0.3 256,-0.1 -0.984 37.3-137.5-165.5 161.1 60.5 -4.5 22.2 87 93 A T - 0 0 5 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.938 15.9-150.2-113.0 150.0 59.0 -3.9 25.6 88 94 A P S S+ 0 0 16 0, 0.0 2,-0.3 0, 0.0 -84,-0.1 0.625 70.6 98.2 -95.1 -9.9 60.2 -6.1 28.4 89 95 A Q S S- 0 0 30 8,-0.3 -2,-0.1 1,-0.1 6,-0.1 -0.597 72.1-140.3 -74.3 133.7 56.9 -5.8 30.3 90 96 A K + 0 0 169 -2,-0.3 2,-0.3 4,-0.1 -1,-0.1 0.234 70.0 34.6 -88.9 16.8 54.8 -8.9 29.6 91 97 A S S > S- 0 0 33 1,-0.1 4,-3.1 2,-0.0 -2,-0.0 -0.985 70.4-120.0-162.2 155.5 51.2 -7.3 29.2 92 98 A L T 4 S+ 0 0 67 -2,-0.3 -1,-0.1 2,-0.2 246,-0.1 0.879 119.7 56.5 -59.3 -36.5 49.2 -4.3 28.1 93 99 A E T 4 S+ 0 0 171 1,-0.2 -1,-0.2 -3,-0.1 -4,-0.0 0.988 121.1 25.8 -49.7 -60.1 48.1 -4.2 31.7 94 100 A E T 4 S+ 0 0 76 2,-0.0 -2,-0.2 0, 0.0 -1,-0.2 0.527 93.0 123.7 -92.0 -9.6 51.8 -4.0 32.8 95 101 A F < + 0 0 0 -4,-3.1 3,-0.1 1,-0.1 243,-0.1 -0.272 15.3 138.0 -59.5 126.8 53.4 -2.4 29.7 96 102 A Q + 0 0 69 1,-0.3 2,-0.3 -2,-0.1 -41,-0.3 0.621 50.5 54.6-138.4 -31.8 55.4 0.9 30.1 97 103 A D - 0 0 10 -45,-0.2 2,-0.4 -44,-0.2 -8,-0.3 -0.840 53.0-158.4-112.5 147.4 58.7 1.1 28.2 98 104 A V E -D 51 0B 0 -47,-1.7 -47,-2.3 -2,-0.3 2,-0.5 -0.938 6.7-159.0-117.8 144.5 59.6 0.7 24.6 99 105 A Y E -DE 50 86B 0 -13,-2.7 -13,-2.2 -2,-0.4 2,-0.5 -0.989 3.0-166.1-125.5 125.5 63.1 -0.1 23.4 100 106 A I E -DE 49 85B 1 -51,-2.5 -51,-2.6 -2,-0.5 2,-0.5 -0.965 5.3-158.9-113.7 123.3 64.2 0.6 19.8 101 107 A V E +DE 48 84B 0 -17,-3.5 -18,-2.6 -2,-0.5 -17,-1.5 -0.887 21.5 166.0-103.3 131.5 67.4 -1.0 18.6 102 108 A M E -DE 47 82B 14 -55,-2.5 -55,-2.4 -2,-0.5 -20,-0.2 -0.774 42.2 -73.9-131.2 173.5 69.1 0.7 15.6 103 109 A E E -D 46 0B 43 -22,-2.0 2,-0.6 -2,-0.2 -57,-0.2 -0.376 47.0-126.2 -65.3 152.6 72.3 0.7 13.7 104 110 A L - 0 0 51 -59,-0.6 2,-0.1 -2,-0.1 -59,-0.1 -0.893 24.9-166.4-105.6 119.5 75.2 2.5 15.5 105 111 A M - 0 0 19 -2,-0.6 49,-0.2 1,-0.1 3,-0.1 -0.382 27.5-118.4 -93.4-178.6 77.0 5.2 13.5 106 112 A D S S- 0 0 85 47,-1.3 2,-0.3 1,-0.3 48,-0.2 0.857 81.4 -11.2 -89.2 -39.8 80.3 6.9 14.4 107 113 A A E -H 153 0C 11 46,-2.2 46,-4.0 -3,-0.0 -1,-0.3 -0.993 56.4-116.0-159.6 158.5 79.1 10.4 14.9 108 114 A N E -H 152 0C 38 -2,-0.3 3,-0.5 44,-0.3 44,-0.2 -0.589 47.7-101.7 -91.5 161.1 76.4 13.1 14.5 109 115 A L S >> S+ 0 0 0 42,-2.2 3,-2.3 39,-1.2 4,-2.2 0.531 101.3 96.0 -62.6 -3.9 77.2 16.0 12.1 110 116 A S T 34 S+ 0 0 60 38,-0.4 -1,-0.2 1,-0.4 39,-0.1 0.475 93.3 40.8 -47.0 -25.2 77.9 18.2 15.0 111 117 A Q T 34 S+ 0 0 78 -3,-0.5 -1,-0.4 2,-0.2 4,-0.3 -0.124 98.3 64.1 146.4 -59.5 81.1 17.4 14.4 112 118 A V T X4 S+ 0 0 2 -3,-2.3 3,-1.5 2,-0.2 5,-0.2 0.813 100.7 61.2 -82.2 -39.4 81.6 17.3 10.7 113 119 A I T 3< S+ 0 0 6 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.1 0.874 98.8 59.7 -49.1 -35.9 80.9 21.0 10.9 114 120 A Q T 3 S+ 0 0 145 -5,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.778 100.4 63.1 -65.2 -31.8 83.9 21.2 13.2 115 121 A M S < S- 0 0 50 -3,-1.5 2,-0.9 -4,-0.3 240,-0.0 -0.317 90.5 -97.2-104.5-179.1 86.4 19.9 10.7 116 122 A E - 0 0 182 -2,-0.1 -3,-0.1 86,-0.0 -2,-0.1 -0.658 42.3-168.7-109.0 79.7 87.8 20.9 7.3 117 123 A L - 0 0 18 -2,-0.9 2,-0.1 -5,-0.2 -5,-0.0 -0.253 16.6-133.6 -72.3 146.9 86.0 19.1 4.4 118 124 A D > - 0 0 61 144,-0.1 4,-1.9 1,-0.1 3,-0.2 -0.393 38.0 -98.7 -80.5 174.4 87.0 19.1 0.8 119 125 A H H > S+ 0 0 1 144,-0.4 4,-2.5 1,-0.2 5,-0.3 0.807 118.9 58.0 -66.1 -35.3 84.3 19.7 -1.8 120 126 A E H > S+ 0 0 48 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.850 110.5 45.9 -73.7 -23.6 83.5 16.2 -2.7 121 127 A R H > S+ 0 0 59 2,-0.2 4,-3.3 -3,-0.2 5,-0.3 0.965 112.2 47.2 -73.1 -51.5 82.7 15.5 0.9 122 128 A M H X S+ 0 0 7 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.951 118.6 44.3 -54.1 -50.5 80.6 18.5 1.6 123 129 A S H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.931 113.9 47.4 -59.4 -49.5 78.7 17.8 -1.6 124 130 A Y H X S+ 0 0 16 -4,-1.9 4,-3.2 -5,-0.3 -2,-0.2 0.901 112.3 49.4 -67.7 -40.1 78.3 14.1 -1.1 125 131 A L H X S+ 0 0 2 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.973 113.5 46.5 -59.3 -53.7 77.2 14.4 2.5 126 132 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.882 110.3 54.5 -54.9 -41.3 74.6 17.0 1.4 127 133 A Y H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.979 107.3 50.3 -60.3 -53.7 73.6 14.7 -1.5 128 134 A Q H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.865 110.2 49.4 -48.0 -41.0 73.0 11.9 1.0 129 135 A M H X S+ 0 0 1 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.973 111.7 49.1 -64.5 -47.5 70.8 14.2 3.2 130 136 A L H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.868 111.2 49.3 -59.2 -42.0 68.8 15.4 0.3 131 137 A V H X S+ 0 0 1 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.934 111.8 47.4 -65.3 -48.5 68.3 11.8 -0.9 132 138 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.926 114.2 49.4 -53.0 -42.9 67.1 10.7 2.5 133 139 A I H X S+ 0 0 1 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.890 106.9 53.5 -68.1 -35.0 64.9 13.7 2.6 134 140 A K H X S+ 0 0 33 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.899 106.9 54.6 -67.0 -36.0 63.4 13.0 -0.9 135 141 A H H X S+ 0 0 12 -4,-2.2 4,-0.6 2,-0.2 3,-0.4 0.976 109.2 45.2 -61.8 -57.5 62.6 9.5 0.3 136 142 A L H ><>S+ 0 0 1 -4,-2.1 5,-1.7 1,-0.2 3,-1.3 0.916 115.2 49.4 -46.6 -49.2 60.6 10.8 3.4 137 143 A H H ><5S+ 0 0 6 -4,-2.6 3,-2.7 1,-0.3 -1,-0.2 0.868 95.3 69.1 -63.5 -35.8 58.9 13.3 1.2 138 144 A S H 3<5S+ 0 0 52 -4,-2.3 -1,-0.3 -3,-0.4 -2,-0.2 0.679 106.5 43.7 -65.5 -14.4 57.9 10.8 -1.5 139 145 A A T <<5S- 0 0 20 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 -0.241 126.5-102.8-112.6 37.8 55.6 9.4 1.1 140 146 A G T < 5S+ 0 0 49 -3,-2.7 2,-0.5 1,-0.2 -3,-0.2 0.838 75.4 141.1 39.0 46.6 54.4 12.9 2.3 141 147 A I < - 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0 0 1 13,-0.3 4,-1.8 -30,-0.2 3,-1.3 -0.261 22.0-120.0 -64.7 147.4 62.3 26.9 8.9 175 194 A P H 3> S+ 0 0 5 0, 0.0 4,-1.9 0, 0.0 6,-0.3 0.893 113.0 62.6 -55.6 -41.8 60.7 30.3 9.5 176 195 A E H 34>S+ 0 0 7 109,-0.3 5,-1.8 1,-0.2 6,-0.8 0.818 109.4 44.7 -53.6 -26.0 57.4 29.2 8.1 177 196 A V H X45S+ 0 0 40 -3,-1.3 3,-1.1 3,-0.2 -1,-0.2 0.937 112.2 46.6 -85.8 -52.5 57.4 26.7 11.0 178 197 A I H 3<5S+ 0 0 35 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.571 110.7 56.6 -64.3 -14.2 58.6 29.1 13.8 179 198 A L T 3<5S- 0 0 12 -4,-1.9 55,-0.4 -5,-0.2 -1,-0.3 -0.071 109.6-119.3-109.8 33.7 56.0 31.7 12.7 180 199 A G T < 5S+ 0 0 56 -3,-1.1 -3,-0.2 1,-0.1 -2,-0.1 0.738 72.2 140.3 38.1 33.3 53.0 29.3 13.0 181 200 A M < - 0 0 43 -5,-1.8 -4,-0.2 -6,-0.3 -1,-0.1 0.695 60.9 -99.3 -86.7 -26.1 52.8 30.1 9.3 182 201 A G - 0 0 53 -6,-0.8 2,-0.2 -5,-0.1 -1,-0.1 0.150 43.7-148.5 100.4 133.5 51.8 26.9 7.3 183 202 A Y - 0 0 92 -3,-0.1 2,-0.2 -6,-0.1 3,-0.0 -0.619 17.6-162.3-138.4 178.5 54.4 24.8 5.5 184 203 A K > - 0 0 158 -2,-0.2 3,-1.5 0, 0.0 4,-0.2 -0.811 52.8 -71.1-155.7-175.3 55.3 22.5 2.6 185 204 A E T > S+ 0 0 93 1,-0.3 3,-2.1 -2,-0.2 4,-0.2 0.842 121.1 63.4 -65.9 -33.9 58.1 20.0 1.8 186 205 A N T >> S+ 0 0 24 1,-0.3 4,-1.3 2,-0.2 3,-0.8 0.535 72.6 93.5 -72.9 -2.1 60.9 22.5 1.3 187 206 A V H <> S+ 0 0 1 -3,-1.5 4,-1.0 1,-0.2 -13,-0.3 0.873 86.7 53.5 -52.5 -28.4 60.5 23.4 4.9 188 207 A D H <> S+ 0 0 0 -3,-2.1 4,-1.4 -4,-0.2 -1,-0.2 0.727 96.1 65.8 -80.0 -20.1 63.2 20.8 5.1 189 208 A I H <> S+ 0 0 1 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.865 94.8 56.1 -71.1 -33.6 65.4 22.6 2.6 190 209 A W H X S+ 0 0 3 -4,-1.3 4,-2.9 1,-0.2 5,-0.3 0.976 104.5 56.2 -54.7 -52.4 65.9 25.6 4.9 191 210 A S H X S+ 0 0 0 -4,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.896 110.0 43.0 -45.5 -46.1 67.2 23.1 7.4 192 211 A V H X S+ 0 0 0 -4,-1.4 4,-3.6 2,-0.2 5,-0.3 0.912 109.9 56.7 -70.3 -42.3 69.8 21.8 4.9 193 212 A G H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.945 110.2 45.4 -54.5 -53.1 70.7 25.4 3.8 194 213 A V H X S+ 0 0 0 -4,-2.9 4,-3.4 1,-0.2 5,-0.2 0.951 113.4 48.9 -55.2 -50.0 71.6 26.2 7.3 195 214 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.901 113.7 46.1 -61.5 -41.7 73.5 23.0 7.9 196 215 A M H X S+ 0 0 0 -4,-3.6 4,-3.0 2,-0.2 -1,-0.2 0.945 112.1 51.6 -64.5 -46.0 75.5 23.5 4.7 197 216 A G H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.3 -2,-0.2 0.914 112.3 47.0 -53.6 -46.2 76.0 27.1 5.7 198 217 A E H X>S+ 0 0 4 -4,-3.4 4,-2.3 -5,-0.2 5,-0.6 0.853 108.0 55.2 -65.1 -35.8 77.3 25.8 9.0 199 218 A M H <5S+ 0 0 9 -4,-2.4 -2,-0.2 -5,-0.2 -82,-0.2 0.947 112.8 42.8 -65.6 -39.7 79.5 23.2 7.2 200 219 A I H <5S+ 0 0 11 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.945 115.6 45.8 -72.7 -46.9 81.2 25.9 5.3 201 220 A K H <5S- 0 0 75 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.829 101.9-133.6 -64.4 -34.7 81.6 28.5 8.1 202 221 A G T <5S+ 0 0 28 -4,-2.3 2,-0.3 1,-0.3 -3,-0.1 0.581 75.3 29.6 89.2 11.4 82.8 25.7 10.4 203 222 A G S > S- 0 0 78 1,-0.1 4,-1.5 -39,-0.0 3,-0.6 -0.368 91.5 -87.1 -97.2 175.8 66.8 31.8 21.8 211 230 A H T 34 S+ 0 0 94 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.108 130.2 30.7 -78.1 23.0 64.1 31.0 19.2 212 231 A I T 3> S+ 0 0 65 2,-0.0 4,-1.0 3,-0.0 -1,-0.2 0.263 105.1 69.0-145.3 -1.5 63.8 34.7 18.3 213 232 A D H <> S+ 0 0 59 -3,-0.6 4,-1.3 2,-0.2 -2,-0.2 0.642 100.5 57.1 -80.8 -20.5 67.4 36.0 19.0 214 233 A Q H X S+ 0 0 6 -4,-1.5 4,-3.0 -6,-0.2 3,-0.4 0.984 96.9 62.6 -55.2 -66.5 68.0 33.8 15.9 215 234 A W H > S+ 0 0 3 1,-0.3 4,-3.5 2,-0.2 5,-0.3 0.727 106.0 42.1 -34.8 -52.4 65.4 35.9 14.0 216 235 A N H X S+ 0 0 23 -4,-1.0 4,-4.1 2,-0.2 -1,-0.3 0.964 116.3 46.4 -66.9 -51.8 67.4 39.1 14.3 217 236 A K H X S+ 0 0 53 -4,-1.3 4,-1.1 -3,-0.4 -2,-0.2 0.870 115.9 50.4 -53.1 -39.7 70.8 37.6 13.5 218 237 A V H X S+ 0 0 2 -4,-3.0 4,-3.0 2,-0.2 5,-0.4 0.957 117.0 36.6 -63.0 -55.2 69.0 35.8 10.7 219 238 A I H X S+ 0 0 3 -4,-3.5 4,-2.1 1,-0.2 -2,-0.2 0.866 110.0 63.4 -70.0 -36.7 67.3 38.9 9.2 220 239 A E H < S+ 0 0 59 -4,-4.1 29,-0.4 -5,-0.3 -1,-0.2 0.864 117.5 30.1 -45.3 -39.4 70.4 41.0 10.0 221 240 A Q H < S+ 0 0 26 -4,-1.1 29,-2.0 -3,-0.4 -2,-0.2 0.849 128.5 33.3 -98.8 -44.0 72.2 38.7 7.6 222 241 A L H < S- 0 0 30 -4,-3.0 -3,-0.2 27,-0.2 -2,-0.2 0.726 112.9-116.3 -84.4 -22.4 69.8 37.5 4.9 223 242 A G < - 0 0 5 -4,-2.1 25,-0.2 -5,-0.4 -3,-0.1 0.052 40.6 -54.2 98.0 147.8 67.9 40.8 5.0 224 243 A T - 0 0 44 23,-2.2 22,-0.1 1,-0.1 61,-0.0 -0.257 68.0-107.7 -55.3 133.9 64.4 41.6 6.0 225 244 A P - 0 0 9 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.250 46.3 -73.5 -71.7 159.4 61.9 39.5 4.1 226 245 A S >> - 0 0 38 2,-0.1 3,-1.5 1,-0.1 4,-0.9 0.003 32.5-126.4 -53.2 147.7 59.7 40.9 1.3 227 246 A P H >> S+ 0 0 85 0, 0.0 3,-3.1 0, 0.0 4,-1.2 0.990 112.8 54.1 -52.7 -59.5 56.7 43.1 2.1 228 247 A E H 34 S+ 0 0 124 1,-0.3 -2,-0.1 2,-0.2 4,-0.1 0.134 106.0 54.1 -75.9 29.5 54.4 40.8 0.1 229 248 A F H <4 S+ 0 0 4 -3,-1.5 -1,-0.3 -2,-0.6 4,-0.2 0.376 97.9 64.3-115.1 -24.5 55.7 37.9 2.2 230 249 A M H X< S+ 0 0 9 -3,-3.1 3,-1.8 -4,-0.9 -2,-0.2 0.878 93.9 61.3 -69.2 -39.2 54.8 39.8 5.4 231 250 A K T 3< S+ 0 0 120 -4,-1.2 -1,-0.2 1,-0.3 7,-0.1 0.969 92.2 64.7 -43.2 -64.4 51.1 39.6 4.4 232 251 A K T 3 S+ 0 0 126 -4,-0.1 -1,-0.3 6,-0.0 -2,-0.2 0.620 91.3 92.5 -41.6 -17.1 51.2 35.9 4.5 233 252 A L S < S- 0 0 10 -3,-1.8 -53,-0.1 -4,-0.2 -3,-0.0 -0.339 90.7 -92.5 -79.3 161.7 51.8 36.2 8.2 234 253 A Q >> - 0 0 89 -55,-0.4 4,-4.2 1,-0.1 3,-1.5 -0.489 30.1-125.9 -59.4 135.8 49.3 36.2 11.1 235 254 A P H 3> S+ 0 0 104 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.877 116.4 60.6 -50.4 -34.2 48.2 39.7 12.0 236 255 A T H 34 S+ 0 0 102 1,-0.2 4,-0.4 2,-0.2 -3,-0.0 0.807 118.6 25.7 -53.1 -37.0 49.4 38.5 15.5 237 256 A V H <> S+ 0 0 26 -3,-1.5 4,-2.7 2,-0.2 5,-0.2 0.788 109.3 67.8-108.8 -41.5 52.9 37.9 14.1 238 257 A R H X S+ 0 0 64 -4,-4.2 4,-3.4 1,-0.2 5,-0.3 0.867 99.3 57.6 -46.7 -44.6 53.1 40.4 11.1 239 258 A T H X S+ 0 0 79 -4,-1.4 4,-1.1 -5,-0.3 -1,-0.2 0.944 109.4 43.2 -52.9 -52.2 53.0 43.1 13.8 240 259 A Y H >> S+ 0 0 74 -4,-0.4 4,-1.7 2,-0.2 3,-0.6 0.958 119.9 40.7 -62.3 -54.3 56.1 41.7 15.5 241 260 A V H >< S+ 0 0 6 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.970 114.5 51.7 -58.7 -54.9 58.1 41.0 12.3 242 261 A E H 3< S+ 0 0 82 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.706 108.8 54.8 -55.5 -20.8 57.0 44.2 10.6 243 262 A N H << S+ 0 0 129 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.857 84.6 98.0 -87.2 -37.0 58.2 46.1 13.7 244 263 A R S << S- 0 0 91 -4,-1.7 -3,-0.0 -3,-0.7 -20,-0.0 0.026 91.9 -86.5 -37.2 148.8 61.7 44.7 13.9 245 264 A P - 0 0 65 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.152 50.6-113.3 -51.7 165.3 64.5 47.0 12.4 246 265 A K - 0 0 179 -3,-0.1 2,-0.4 -22,-0.1 -26,-0.0 -0.902 29.9-163.6-111.5 136.8 64.9 46.5 8.7 247 266 A Y - 0 0 76 -2,-0.4 -23,-2.2 1,-0.1 -26,-0.0 -0.957 22.9-152.4-125.2 138.6 68.0 45.0 7.1 248 267 A A - 0 0 107 -2,-0.4 -1,-0.1 -25,-0.2 -27,-0.1 0.798 42.4-146.3 -65.0 -30.3 69.3 45.0 3.5 249 268 A G - 0 0 22 -29,-0.4 2,-0.3 -26,-0.1 -27,-0.2 -0.200 14.8 -88.9 79.2 177.7 71.2 41.7 4.0 250 269 A Y - 0 0 120 -29,-2.0 -29,-0.0 -2,-0.1 2,-0.0 -0.897 36.5-102.3-122.0 152.7 74.5 40.7 2.5 251 270 A S > - 0 0 63 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.294 34.5-112.5 -60.2 159.6 75.3 39.0 -0.7 252 271 A F H > S+ 0 0 33 1,-0.2 4,-3.6 2,-0.2 -1,-0.1 0.843 117.9 60.0 -66.4 -27.0 76.2 35.4 -0.6 253 272 A E H 4 S+ 0 0 114 2,-0.2 -1,-0.2 1,-0.2 5,-0.1 0.892 109.7 41.0 -64.0 -38.0 79.7 36.3 -1.7 254 273 A K H 4 S+ 0 0 138 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.880 120.4 44.2 -83.3 -30.3 80.1 38.5 1.3 255 274 A L H < S+ 0 0 6 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.849 130.3 23.0 -73.8 -38.7 78.4 36.0 3.6 256 275 A F S < S- 0 0 3 -4,-3.6 -1,-0.2 -5,-0.2 2,-0.2 -0.700 86.4-179.7-129.2 79.9 80.2 32.9 2.3 257 276 A P > - 0 0 45 0, 0.0 3,-2.5 0, 0.0 4,-0.4 -0.532 42.0-101.8 -84.7 152.8 83.4 34.2 0.7 258 277 A D G > S+ 0 0 102 1,-0.3 3,-2.7 2,-0.2 -5,-0.0 0.791 114.1 70.1 -27.2 -54.2 86.1 32.1 -1.0 259 278 A V G 3 S+ 0 0 131 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.839 97.5 52.7 -48.7 -35.8 88.4 32.2 1.9 260 279 A L G < S+ 0 0 64 -3,-2.5 -1,-0.3 2,-0.0 -2,-0.2 0.635 99.6 75.0 -73.8 -18.3 86.0 29.9 3.8 261 280 A F S < S- 0 0 19 -3,-2.7 3,-0.1 -4,-0.4 -143,-0.1 -0.542 83.7-109.0 -92.4 163.7 85.8 27.2 1.1 262 281 A P - 0 0 39 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.329 55.6 -63.1 -80.9 174.9 88.3 24.6 0.2 263 282 A A - 0 0 89 1,-0.1 -144,-0.4 8,-0.1 2,-0.2 -0.184 63.5 -95.2 -51.4 137.6 90.4 24.6 -3.0 264 283 A D - 0 0 88 -3,-0.1 7,-0.2 1,-0.1 -1,-0.1 -0.418 50.9-120.3 -60.4 124.6 88.3 24.3 -6.2 265 284 A S - 0 0 23 5,-1.8 5,-0.1 2,-0.2 -1,-0.1 -0.246 17.9-106.4 -70.8 156.9 88.4 20.6 -7.0 266 285 A E S S+ 0 0 202 2,-0.0 2,-0.5 0, 0.0 -1,-0.1 0.711 100.5 94.4 -41.8 -27.2 89.7 19.0 -10.2 267 286 A H S > S- 0 0 34 3,-0.2 3,-1.0 1,-0.1 -2,-0.2 -0.667 81.1-132.7 -86.8 125.0 86.1 18.6 -10.9 268 287 A N T 3 S+ 0 0 146 -2,-0.5 -1,-0.1 1,-0.2 -3,-0.0 0.751 99.3 34.6 -23.0 -59.3 84.2 21.2 -13.0 269 288 A K T 3 S+ 0 0 69 1,-0.2 2,-1.7 31,-0.1 -1,-0.2 0.599 93.0 88.1 -93.9 -13.9 81.1 21.7 -10.8 270 289 A L < + 0 0 0 -3,-1.0 -5,-1.8 -5,-0.1 2,-0.3 -0.569 65.4 123.0 -90.7 78.1 82.6 21.3 -7.3 271 290 A K S >> S- 0 0 57 -2,-1.7 4,-2.4 -7,-0.2 3,-0.6 -0.891 75.4-110.1-138.5 155.2 83.6 24.9 -6.9 272 291 A A H 3> S+ 0 0 3 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.833 114.8 60.7 -60.3 -32.0 82.8 27.6 -4.4 273 292 A S H 3> S+ 0 0 57 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.866 110.1 41.0 -67.7 -30.4 80.7 29.6 -6.9 274 293 A Q H <> S+ 0 0 55 -3,-0.6 4,-3.2 2,-0.2 5,-0.3 0.884 112.9 52.6 -81.6 -40.4 78.3 26.6 -7.2 275 294 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.971 112.5 46.4 -56.1 -48.6 78.3 25.9 -3.6 276 295 A R H X S+ 0 0 19 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.915 111.9 52.8 -60.4 -41.6 77.4 29.5 -3.0 277 296 A D H X S+ 0 0 55 -4,-1.7 4,-1.0 -5,-0.3 -1,-0.2 0.961 111.1 43.9 -56.4 -54.0 74.8 29.3 -5.7 278 297 A L H >X S+ 0 0 0 -4,-3.2 3,-1.3 1,-0.2 4,-0.7 0.949 113.6 52.2 -60.0 -48.1 73.1 26.3 -4.2 279 298 A L H >X S+ 0 0 0 -4,-3.0 4,-3.2 -5,-0.3 3,-1.7 0.913 106.2 52.0 -52.1 -49.2 73.3 27.8 -0.8 280 299 A S H 3< S+ 0 0 37 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.690 110.2 51.4 -68.1 -15.3 71.7 31.1 -1.9 281 300 A K H << S+ 0 0 91 -3,-1.3 10,-2.1 -4,-1.0 -1,-0.3 0.569 119.2 34.6 -90.8 -7.6 68.8 29.0 -3.4 282 301 A M H << S+ 0 0 0 -3,-1.7 2,-1.5 -4,-0.7 -2,-0.2 0.795 104.4 64.1-114.5 -48.7 68.2 27.1 -0.3 283 302 A L S < S+ 0 0 2 -4,-3.2 2,-0.3 -5,-0.2 -1,-0.1 -0.095 75.9 134.2 -75.7 38.4 68.9 29.4 2.6 284 303 A V - 0 0 23 -2,-1.5 6,-0.1 -3,-0.2 -91,-0.1 -0.727 50.2-149.8 -94.7 144.5 65.9 31.6 1.5 285 304 A I S S+ 0 0 30 -2,-0.3 2,-0.8 1,-0.1 -109,-0.3 0.911 81.9 70.7 -81.7 -48.5 63.4 32.8 4.1 286 305 A D S > S- 0 0 15 1,-0.2 3,-1.8 3,-0.1 -1,-0.1 -0.656 73.6-154.1 -77.3 112.8 60.3 33.0 1.8 287 306 A A G > S+ 0 0 21 -2,-0.8 3,-1.8 1,-0.3 -1,-0.2 0.825 91.3 59.5 -57.2 -37.6 59.5 29.4 1.2 288 307 A S G 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.615 109.2 46.3 -73.1 -8.1 57.7 30.1 -2.1 289 308 A K G < S+ 0 0 149 -3,-1.8 2,-0.4 2,-0.1 -1,-0.3 0.223 96.5 101.0-104.1 7.4 61.0 31.5 -3.3 290 309 A R S < S- 0 0 10 -3,-1.8 -8,-0.2 -5,-0.1 -104,-0.1 -0.823 78.4-109.4-102.1 130.7 63.0 28.6 -2.0 291 310 A I - 0 0 14 -10,-2.1 2,-0.1 -2,-0.4 -102,-0.1 -0.009 32.0-126.3 -38.5 144.9 64.3 25.6 -4.1 292 311 A S > - 0 0 44 1,-0.1 4,-2.3 -103,-0.1 5,-0.2 -0.487 28.9 -99.5 -90.7 175.2 62.6 22.1 -3.7 293 312 A V H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.871 123.1 53.0 -61.7 -38.2 64.5 18.9 -3.0 294 313 A D H > S+ 0 0 88 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.960 109.2 47.6 -62.9 -49.0 64.4 17.9 -6.6 295 314 A E H > S+ 0 0 108 1,-0.2 4,-0.5 2,-0.2 -2,-0.2 0.916 111.5 50.7 -59.5 -42.8 66.0 21.1 -7.8 296 315 A A H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.3 6,-0.3 0.926 111.8 48.6 -62.4 -40.6 68.6 20.8 -5.1 297 316 A L H 3< S+ 0 0 2 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.826 112.3 48.2 -66.3 -28.4 69.2 17.3 -6.4 298 317 A Q H 3< S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.411 88.0 116.2 -90.1 -0.2 69.4 18.6 -10.0 299 318 A H S XX S- 0 0 9 -3,-1.1 4,-3.0 -4,-0.5 3,-2.2 -0.543 76.4-120.6 -83.0 138.2 71.8 21.4 -9.0 300 319 A P T 34 S+ 0 0 46 0, 0.0 4,-0.5 0, 0.0 -31,-0.1 0.714 111.8 52.5 -52.0 -32.2 75.2 21.3 -10.5 301 320 A Y T 34 S+ 0 0 0 -27,-0.2 -26,-0.1 1,-0.1 -4,-0.1 0.837 123.4 27.3 -68.9 -34.0 76.9 21.1 -7.1 302 321 A I T X4 S+ 0 0 0 -3,-2.2 3,-1.8 -6,-0.3 -1,-0.1 0.808 104.7 72.3 -98.1 -36.0 74.8 18.1 -6.0 303 322 A N G >< S+ 0 0 51 -4,-3.0 3,-2.8 1,-0.3 -2,-0.1 0.642 72.7 87.9 -68.5 -12.5 73.8 16.3 -9.2 304 323 A V G 3 S+ 0 0 27 -4,-0.5 -1,-0.3 -5,-0.3 -2,-0.1 0.779 98.7 37.3 -54.4 -25.1 77.4 14.9 -9.7 305 324 A W G < S+ 0 0 8 -3,-1.8 -1,-0.3 -182,-0.1 -2,-0.2 0.152 86.2 145.8-103.9 15.1 76.4 12.0 -7.5 306 325 A Y < + 0 0 58 -3,-2.8 -3,-0.1 -9,-0.1 -8,-0.0 -0.329 21.7 178.6 -74.8 135.7 72.9 11.7 -8.7 307 326 A D >> - 0 0 54 1,-0.1 3,-3.4 -2,-0.0 4,-3.0 -0.863 24.6-153.2-137.2 108.7 71.6 8.1 -8.8 308 327 A P H 3> S+ 0 0 72 0, 0.0 4,-2.7 0, 0.0 -1,-0.1 0.770 100.0 52.1 -49.9 -34.1 68.0 7.3 -10.0 309 328 A S H 34 S+ 0 0 94 2,-0.2 4,-0.0 1,-0.2 -2,-0.0 0.548 116.1 40.2 -78.5 -14.8 68.0 4.1 -7.9 310 329 A E H X4 S+ 0 0 17 -3,-3.4 3,-0.7 2,-0.1 -1,-0.2 0.816 125.9 35.2 -90.2 -49.9 69.1 6.0 -4.8 311 330 A A H 3< S+ 0 0 5 -4,-3.0 -2,-0.2 1,-0.2 -14,-0.0 0.686 118.8 45.2 -83.8 -20.0 66.9 9.0 -5.4 312 331 A E T 3< S+ 0 0 116 -4,-2.7 -1,-0.2 -5,-0.4 -3,-0.1 -0.071 71.4 149.2-120.1 34.1 63.8 7.6 -7.0 313 332 A A < - 0 0 30 -3,-0.7 -3,-0.1 1,-0.1 -175,-0.0 -0.309 61.0 -86.7 -59.9 151.9 63.1 4.6 -4.7 314 333 A P - 0 0 109 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.394 55.8-100.1 -63.7 132.7 59.3 3.6 -4.3 315 334 A P - 0 0 73 0, 0.0 -179,-0.1 0, 0.0 -180,-0.1 -0.109 33.5-104.5 -55.5 149.0 57.7 5.6 -1.6 316 335 A P - 0 0 11 0, 0.0 2,-0.5 0, 0.0 -242,-0.1 -0.385 40.9-132.6 -52.0 153.7 57.2 4.1 1.8 317 336 A K - 0 0 163 -244,-0.4 -178,-0.1 -3,-0.1 -244,-0.0 -0.944 21.3-168.5-121.8 115.9 53.5 3.3 2.0 318 337 A I - 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