==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-NOV-04 1WBW . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.TICKLE,A.CLEASBY,L.A.DEVINE,H.JHOTI . 351 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17587.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 64.1 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 . 37 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 31 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 1 2 0 0 1 0 1 0 1 0 2 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 0 2 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 4 A E 0 0 237 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 147.6 -3.5 42.6 24.8 2 5 A R - 0 0 72 1,-0.1 89,-0.0 89,-0.0 0, 0.0 -0.600 360.0-133.0 -74.9 125.8 -1.3 40.2 22.8 3 6 A P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.199 24.2 -98.4 -72.9 170.1 1.8 41.7 21.4 4 7 A T - 0 0 87 1,-0.0 15,-2.1 13,-0.0 2,-0.3 -0.690 38.6-150.7 -87.4 140.9 3.0 41.3 17.8 5 8 A F E -A 18 0A 24 -2,-0.3 2,-0.3 13,-0.3 11,-0.0 -0.802 5.3-155.7-108.7 152.0 5.7 38.7 17.3 6 9 A Y E -A 17 0A 60 11,-2.3 11,-1.9 -2,-0.3 2,-0.4 -0.955 13.2-134.6-126.9 156.7 8.5 38.5 14.7 7 10 A R E +A 16 0A 163 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.829 27.5 160.6-116.0 138.1 10.3 35.4 13.4 8 11 A Q E -A 15 0A 56 7,-2.0 7,-3.4 -2,-0.4 2,-0.6 -0.973 38.9-115.8-156.0 145.5 14.0 34.8 12.8 9 12 A E E +A 14 0A 140 -2,-0.3 2,-0.4 5,-0.3 5,-0.3 -0.743 33.0 177.9 -85.2 122.0 16.3 31.8 12.5 10 13 A L E > -A 13 0A 21 3,-3.4 3,-0.6 -2,-0.6 15,-0.1 -0.868 67.6 -29.9-131.6 95.7 18.9 31.7 15.3 11 14 A N T 3 S- 0 0 117 -2,-0.4 2,-0.2 1,-0.2 -1,-0.2 0.991 125.3 -37.5 52.3 79.7 21.2 28.7 15.2 12 15 A K T 3 S+ 0 0 195 -3,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.245 124.7 87.0 69.6 -12.3 19.2 26.0 13.5 13 16 A T E < S-A 10 0A 27 -3,-0.6 -3,-3.4 -2,-0.2 2,-0.7 -0.936 75.7-125.2-122.9 146.1 15.9 27.1 15.3 14 17 A I E -A 9 0A 100 -2,-0.4 2,-0.6 -5,-0.3 -5,-0.3 -0.770 25.6-155.7 -88.9 111.3 13.2 29.6 14.4 15 18 A W E -A 8 0A 3 -7,-3.4 -7,-2.0 -2,-0.7 2,-0.5 -0.825 9.3-171.4 -92.8 124.5 12.7 32.1 17.2 16 19 A E E +A 7 0A 51 -2,-0.6 -9,-0.2 -9,-0.2 -2,-0.0 -0.958 23.2 154.8-115.2 107.9 9.3 33.8 17.4 17 20 A V E -A 6 0A 0 -11,-1.9 -11,-2.3 -2,-0.5 2,-0.1 -0.918 47.3 -84.6-135.2 154.7 9.3 36.5 20.1 18 21 A P E > -A 5 0A 2 0, 0.0 3,-2.5 0, 0.0 -13,-0.3 -0.366 41.7-114.6 -62.8 143.6 7.5 39.8 20.8 19 22 A E T 3 S+ 0 0 108 -15,-2.1 22,-0.1 1,-0.3 -14,-0.1 0.669 108.3 76.3 -49.5 -32.4 8.8 43.0 19.1 20 23 A R T 3 S+ 0 0 59 -16,-0.2 21,-2.5 20,-0.1 2,-0.6 0.823 84.9 74.9 -48.2 -36.4 9.9 44.5 22.5 21 24 A Y E < +B 40 0B 2 -3,-2.5 2,-0.3 19,-0.2 19,-0.2 -0.747 68.3 169.4 -88.7 115.7 12.9 42.1 22.4 22 25 A Q E +B 39 0B 70 17,-2.9 17,-3.7 -2,-0.6 -2,-0.0 -0.760 44.5 32.5-121.9 162.7 15.5 43.2 19.9 23 26 A N E - 0 0 118 -2,-0.3 2,-0.3 15,-0.2 -1,-0.2 0.871 68.3-174.3 62.8 45.8 19.1 42.3 18.9 24 27 A L E + 0 0 17 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.557 10.9 163.6 -71.1 130.8 19.0 38.6 19.7 25 28 A S E -B 37 0B 63 12,-1.4 12,-2.3 -2,-0.3 -15,-0.1 -0.962 45.3 -92.2-144.0 138.4 22.2 36.7 19.4 26 29 A P E -B 36 0B 61 0, 0.0 2,-0.3 0, 0.0 10,-0.2 -0.084 48.0-166.4 -42.8 138.0 23.1 33.2 20.8 27 30 A V > + 0 0 51 8,-2.6 2,-1.1 10,-0.0 3,-0.9 -0.828 51.2 19.4-134.8 170.3 24.7 33.3 24.2 28 31 A G T 3 S- 0 0 45 -2,-0.3 8,-0.0 1,-0.2 0, 0.0 -0.679 105.2 -85.3 69.3-101.8 26.6 31.0 26.6 29 32 A S T 3 S- 0 0 104 -2,-1.1 -1,-0.2 4,-0.3 5,-0.1 0.185 75.7 -62.5 175.6 25.7 27.8 28.4 24.0 30 33 A G S < S+ 0 0 63 -3,-0.9 3,-0.4 3,-0.3 -2,-0.1 0.397 114.8 115.1 78.7 3.9 24.8 26.0 23.8 31 34 A A S S+ 0 0 70 1,-0.2 -3,-0.1 -4,-0.1 3,-0.1 0.724 76.1 37.0 -78.7 -27.7 25.7 25.5 27.5 32 35 A Y S S- 0 0 75 1,-0.5 2,-0.3 -5,-0.3 -1,-0.2 0.308 121.2-102.4-102.4 7.0 22.4 26.9 29.0 33 36 A G S S- 0 0 39 -3,-0.4 2,-1.5 2,-0.1 -1,-0.5 -0.742 80.2 -16.2 103.1-162.2 20.2 25.5 26.2 34 37 A S E S+ C 0 51B 47 17,-0.6 17,-2.3 -2,-0.3 2,-0.4 -0.724 87.9 162.5 -74.5 90.2 18.9 27.6 23.4 35 38 A V E - C 0 50B 16 -2,-1.5 -8,-2.6 -8,-0.4 2,-0.4 -0.970 19.8-171.5-116.3 131.4 19.6 31.0 25.1 36 39 A C E -BC 26 49B 2 13,-2.7 13,-3.1 -2,-0.4 2,-0.2 -0.940 19.2-136.5-113.6 141.2 19.7 34.4 23.4 37 40 A A E +BC 25 48B 13 -12,-2.3 -12,-1.4 -2,-0.4 2,-0.3 -0.620 38.0 167.3 -79.0 154.9 20.8 37.7 24.8 38 41 A A E - C 0 47B 8 9,-1.9 9,-2.1 -2,-0.2 2,-0.5 -0.979 38.4-111.1-161.4 163.3 18.5 40.5 23.8 39 42 A F E -BC 22 46B 75 -17,-3.7 -17,-2.9 -2,-0.3 2,-0.9 -0.955 22.8-151.1-106.0 122.6 17.5 44.1 24.4 40 43 A D E >>> -BC 21 45B 3 5,-2.7 4,-2.9 -2,-0.5 5,-0.6 -0.788 9.3-171.4 -94.6 101.9 14.1 44.6 26.0 41 44 A T T 345S+ 0 0 80 -21,-2.5 -1,-0.2 -2,-0.9 -20,-0.1 0.702 81.0 60.0 -70.1 -23.4 13.0 48.0 24.8 42 45 A K T 345S+ 0 0 160 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.1 0.858 123.2 19.9 -72.6 -35.8 10.0 48.1 27.2 43 46 A T T <45S- 0 0 51 -3,-0.6 -2,-0.2 2,-0.2 -1,-0.1 0.599 95.5-127.1-108.2 -15.1 12.1 47.9 30.3 44 47 A G T <5 + 0 0 47 -4,-2.9 2,-0.2 1,-0.3 -3,-0.2 0.520 65.8 135.1 76.1 8.1 15.6 49.0 29.0 45 48 A L E < -C 40 0B 61 -5,-0.6 -5,-2.7 -6,-0.0 2,-0.5 -0.585 59.1-129.0 -93.4 147.8 17.0 45.8 30.5 46 49 A R E -C 39 0B 177 -2,-0.2 59,-2.3 -7,-0.2 2,-0.3 -0.872 42.5-178.8 -92.5 129.8 19.5 43.4 28.8 47 50 A V E -CD 38 104B 0 -9,-2.1 -9,-1.9 -2,-0.5 2,-0.4 -0.869 32.2-128.3-133.5 155.1 18.0 40.0 29.2 48 51 A A E -CD 37 103B 17 55,-2.7 55,-2.4 -2,-0.3 2,-0.5 -0.928 23.5-159.4-103.7 134.9 18.6 36.3 28.4 49 52 A V E -CD 36 102B 1 -13,-3.1 -13,-2.7 -2,-0.4 2,-0.5 -0.980 4.1-162.6-117.3 113.9 15.7 34.6 26.5 50 53 A K E -CD 35 101B 49 51,-2.7 51,-2.8 -2,-0.5 2,-0.6 -0.889 5.1-159.7 -99.3 124.9 15.6 30.8 26.7 51 54 A K E -CD 34 100B 18 -17,-2.3 -17,-0.6 -2,-0.5 2,-0.3 -0.918 25.1-128.0 -97.5 118.9 13.5 28.9 24.2 52 55 A L - 0 0 16 47,-2.4 2,-0.5 -2,-0.6 47,-0.4 -0.521 21.1-124.5 -70.0 128.3 12.8 25.4 25.7 53 56 A S S S- 0 0 98 -2,-0.3 -1,-0.1 1,-0.3 45,-0.1 -0.629 77.7 -26.5 -78.4 117.8 13.7 22.6 23.3 54 57 A R S > S- 0 0 120 -2,-0.5 3,-0.8 1,-0.1 -1,-0.3 0.925 75.5-176.3 46.9 69.5 10.8 20.2 22.5 55 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.733 74.0 35.3 -79.5 -20.3 9.1 20.9 25.8 56 59 A F T 3 S+ 0 0 8 41,-0.3 -2,-0.1 1,-0.1 6,-0.1 -0.106 76.2 115.8-123.3 32.3 6.2 18.4 25.4 57 60 A Q S < S+ 0 0 96 -3,-0.8 2,-0.3 1,-0.1 -1,-0.1 0.747 86.9 6.2 -70.9 -26.1 7.9 15.4 23.6 58 61 A S S > S- 0 0 33 -4,-0.2 4,-2.9 -3,-0.1 5,-0.2 -0.917 78.7-102.8-146.0 173.4 7.4 13.0 26.5 59 62 A I H > S+ 0 0 82 -2,-0.3 4,-2.4 2,-0.2 5,-0.2 0.875 123.9 52.0 -66.5 -38.5 5.7 12.8 30.0 60 63 A I H > S+ 0 0 95 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.923 114.0 42.6 -60.9 -46.3 9.1 13.3 31.5 61 64 A H H > S+ 0 0 52 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.891 113.2 51.4 -70.5 -41.5 9.7 16.4 29.4 62 65 A A H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.930 112.9 45.9 -60.5 -45.4 6.2 17.9 29.8 63 66 A K H X S+ 0 0 35 -4,-2.4 4,-3.2 2,-0.2 -2,-0.2 0.897 112.4 51.2 -65.5 -39.9 6.5 17.5 33.6 64 67 A R H X S+ 0 0 55 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.873 109.0 50.0 -61.4 -44.5 10.0 19.1 33.5 65 68 A T H X S+ 0 0 10 -4,-2.4 4,-2.0 -10,-0.4 5,-0.2 0.905 113.1 47.3 -56.7 -48.3 8.7 22.0 31.5 66 69 A Y H X S+ 0 0 14 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.933 111.7 51.8 -60.3 -49.2 5.9 22.4 34.0 67 70 A R H X S+ 0 0 26 -4,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.878 110.5 46.5 -50.3 -48.6 8.4 22.1 36.9 68 71 A E H X S+ 0 0 26 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.923 114.1 46.4 -69.4 -45.6 10.8 24.8 35.6 69 72 A L H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.918 112.8 50.4 -60.0 -46.3 8.1 27.3 34.8 70 73 A R H X S+ 0 0 37 -4,-2.6 4,-1.4 -5,-0.2 -2,-0.2 0.956 113.4 45.8 -55.7 -52.3 6.4 26.7 38.2 71 74 A L H X S+ 0 0 11 -4,-2.4 4,-1.4 1,-0.2 3,-0.3 0.903 112.9 47.9 -59.5 -48.9 9.7 27.2 40.0 72 75 A L H < S+ 0 0 11 -4,-2.6 11,-0.6 1,-0.2 -1,-0.2 0.857 108.8 55.4 -65.1 -37.3 10.8 30.3 38.1 73 76 A K H < S+ 0 0 39 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.809 109.5 48.5 -60.4 -32.7 7.3 31.9 38.6 74 77 A H H < S+ 0 0 34 -4,-1.4 2,-0.7 -3,-0.3 244,-0.2 0.845 86.5 96.6 -75.2 -36.4 7.7 31.5 42.4 75 78 A M < + 0 0 2 -4,-1.4 8,-0.5 1,-0.1 2,-0.3 -0.448 36.1 156.3 -74.4 108.8 11.1 32.9 42.9 76 79 A K + 0 0 165 -2,-0.7 2,-0.3 6,-0.1 6,-0.1 -0.727 30.6 116.5-127.2 80.1 11.0 36.5 44.0 77 80 A H > - 0 0 19 3,-0.4 3,-1.6 -2,-0.3 57,-0.1 -0.996 67.5-123.4-149.3 145.5 14.3 37.3 45.8 78 81 A E T 3 S+ 0 0 131 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.771 113.1 45.6 -58.2 -33.2 17.3 39.6 45.2 79 82 A N T 3 S+ 0 0 6 83,-0.1 84,-2.2 2,-0.1 2,-0.3 0.030 106.7 69.1-103.0 26.0 19.7 36.6 45.3 80 83 A V B < S-f 163 0C 1 -3,-1.6 -3,-0.4 82,-0.3 84,-0.2 -0.995 92.9 -91.4-141.7 144.1 17.7 34.3 43.0 81 84 A I - 0 0 19 82,-2.6 2,-0.3 -2,-0.3 -4,-0.1 -0.243 43.6-156.2 -46.9 134.0 16.9 34.3 39.3 82 85 A G - 0 0 21 -6,-0.1 2,-0.7 -4,-0.1 22,-0.3 -0.899 18.4-116.3-116.3 152.1 13.5 36.1 38.8 83 86 A L + 0 0 16 -11,-0.6 20,-0.2 -8,-0.5 3,-0.1 -0.796 28.6 179.5 -91.9 113.5 11.2 35.5 35.8 84 87 A L - 0 0 24 18,-2.8 2,-0.3 -2,-0.7 19,-0.2 0.862 67.9 -16.6 -74.8 -39.9 11.0 38.8 33.8 85 88 A D E -E 102 0B 20 17,-1.3 17,-2.4 262,-0.1 2,-0.3 -0.986 49.6-162.8-160.5 154.7 8.6 37.3 31.2 86 89 A V E +E 101 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.966 27.0 160.4-140.8 139.9 7.3 34.0 29.8 87 90 A F E -E 100 0B 15 13,-1.8 13,-1.2 -2,-0.3 256,-0.1 -0.986 26.7-158.2-154.9 162.2 5.5 33.8 26.4 88 91 A T - 0 0 12 -2,-0.3 11,-0.1 2,-0.2 -71,-0.1 -0.992 26.4-133.2-138.3 143.0 4.4 31.7 23.5 89 92 A P S S+ 0 0 18 0, 0.0 2,-0.3 0, 0.0 -84,-0.1 0.502 77.7 110.1 -63.4 -4.1 3.5 32.7 19.9 90 93 A A - 0 0 12 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.589 54.2-164.9 -88.2 134.4 0.4 30.5 20.3 91 94 A R S S+ 0 0 174 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.448 77.0 25.4 -92.6 -2.7 -3.1 32.1 20.5 92 95 A S S >> S- 0 0 24 1,-0.1 4,-1.4 0, 0.0 3,-0.6 -0.988 80.1-108.9-154.9 160.3 -4.6 28.8 21.9 93 96 A L T 34 S+ 0 0 56 -2,-0.3 -1,-0.1 1,-0.2 246,-0.0 0.839 115.2 61.0 -56.8 -36.3 -3.8 25.6 23.8 94 97 A E T 34 S+ 0 0 160 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.827 112.4 36.0 -64.2 -35.0 -4.3 23.6 20.5 95 98 A E T <4 S+ 0 0 97 -3,-0.6 -1,-0.2 2,-0.0 -2,-0.2 0.599 90.4 121.2 -92.8 -13.1 -1.4 25.5 18.8 96 99 A F < + 0 0 0 -4,-1.4 3,-0.1 1,-0.2 243,-0.1 -0.257 20.5 126.8 -54.1 126.7 0.7 25.7 22.0 97 100 A N + 0 0 66 1,-0.4 2,-0.4 -42,-0.0 -41,-0.3 0.427 53.3 59.1-159.6 -13.3 4.1 24.1 21.6 98 101 A D - 0 0 54 -44,-0.1 -1,-0.4 -43,-0.1 2,-0.4 -0.996 53.7-163.0-135.4 137.2 6.9 26.4 22.5 99 102 A V - 0 0 0 -47,-0.4 -47,-2.4 -2,-0.4 2,-0.4 -0.946 4.4-168.0-120.4 143.8 7.8 28.1 25.8 100 103 A Y E -DE 51 87B 1 -13,-1.2 -13,-1.8 -2,-0.4 2,-0.3 -0.998 3.8-163.0-134.4 132.4 10.2 31.1 26.1 101 104 A L E -DE 50 86B 8 -51,-2.8 -51,-2.7 -2,-0.4 2,-0.4 -0.904 2.6-158.3-123.7 146.7 11.5 32.4 29.4 102 105 A V E +DE 49 85B 1 -17,-2.4 -18,-2.8 -2,-0.3 -17,-1.3 -0.989 20.0 152.2-131.5 127.8 13.1 35.7 30.1 103 106 A T E -D 48 0B 18 -55,-2.4 -55,-2.7 -2,-0.4 -20,-0.1 -0.876 52.3 -63.0-138.8 177.3 15.5 36.8 32.9 104 107 A H E -D 47 0B 72 -22,-0.3 2,-0.4 -2,-0.3 -57,-0.3 -0.324 58.9-104.0 -59.9 140.4 18.3 39.4 33.5 105 108 A L - 0 0 40 -59,-2.3 -59,-0.1 1,-0.2 -1,-0.1 -0.566 30.7-155.8 -70.1 123.8 21.4 38.9 31.3 106 109 A M + 0 0 45 -2,-0.4 2,-1.5 1,-0.2 -1,-0.2 0.986 16.5 176.6 -71.0 -60.4 24.0 37.3 33.6 107 110 A G + 0 0 75 49,-0.1 2,-0.4 47,-0.0 -1,-0.2 -0.445 65.7 33.0 86.0 -67.1 27.3 38.4 31.9 108 111 A A - 0 0 31 -2,-1.5 47,-2.4 47,-0.4 2,-0.2 -0.984 64.6-163.3-126.8 142.0 29.7 36.8 34.5 109 112 A D B > -G 154 0C 16 -2,-0.4 4,-1.2 45,-0.3 45,-0.2 -0.474 42.7 -93.5-105.3-178.0 29.4 33.8 36.8 110 113 A L H > S+ 0 0 0 40,-2.0 4,-2.2 43,-1.3 5,-0.2 0.727 121.3 61.3 -76.5 -24.0 31.4 32.9 39.9 111 114 A N H > S+ 0 0 29 39,-0.5 4,-3.2 2,-0.2 5,-0.3 0.913 103.7 52.9 -60.7 -43.9 34.0 30.8 38.0 112 115 A N H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.904 112.3 42.9 -56.6 -45.5 34.9 34.0 36.1 113 116 A I H X S+ 0 0 5 -4,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.878 118.5 43.8 -75.8 -33.8 35.4 36.0 39.3 114 117 A V H < S+ 0 0 18 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.934 121.1 39.9 -71.2 -48.4 37.4 33.2 41.1 115 118 A K H < S+ 0 0 152 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.913 128.1 29.5 -66.4 -43.5 39.5 32.4 38.1 116 119 A C H < S+ 0 0 90 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.671 117.2 45.6 -97.6 -21.8 40.1 36.0 36.8 117 120 A Q S < S- 0 0 104 -4,-1.4 2,-0.4 -5,-0.3 0, 0.0 -0.826 75.6-117.9-125.0 160.0 40.0 38.2 39.9 118 121 A K - 0 0 178 -2,-0.3 2,-0.5 -3,-0.0 -4,-0.1 -0.850 27.6-143.1-104.0 137.0 41.5 38.1 43.4 119 122 A L - 0 0 40 -2,-0.4 2,-0.1 94,-0.3 -5,-0.0 -0.851 3.1-150.2-112.5 126.2 39.2 38.0 46.4 120 123 A T > - 0 0 76 -2,-0.5 4,-1.8 1,-0.1 3,-0.5 -0.405 38.0-104.2 -79.1 165.9 39.6 39.7 49.8 121 124 A D H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.775 124.2 56.8 -61.7 -28.2 38.1 38.1 52.8 122 125 A D H > S+ 0 0 62 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.755 102.9 53.0 -77.9 -26.2 35.4 40.7 52.7 123 126 A H H > S+ 0 0 70 -3,-0.5 4,-2.9 2,-0.2 -2,-0.2 0.913 109.8 49.0 -68.5 -42.0 34.5 39.7 49.1 124 127 A V H X S+ 0 0 1 -4,-1.8 4,-2.3 2,-0.2 5,-0.4 0.894 109.7 52.1 -64.7 -41.1 34.1 36.1 50.3 125 128 A Q H X S+ 0 0 21 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.961 114.5 42.2 -54.0 -51.1 32.0 37.3 53.2 126 129 A F H X S+ 0 0 46 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.904 115.6 48.1 -67.3 -42.9 29.7 39.2 50.9 127 130 A L H X S+ 0 0 0 -4,-2.9 4,-1.5 2,-0.2 -1,-0.2 0.944 117.5 40.5 -64.6 -49.6 29.6 36.5 48.2 128 131 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.881 110.5 59.1 -67.2 -41.3 28.8 33.6 50.6 129 132 A Y H X S+ 0 0 15 -4,-2.6 4,-2.0 -5,-0.4 -1,-0.2 0.914 108.7 46.4 -48.4 -48.8 26.4 35.8 52.6 130 133 A Q H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.832 109.7 51.5 -69.0 -39.1 24.3 36.3 49.5 131 134 A I H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.920 113.7 46.1 -61.3 -40.1 24.4 32.6 48.5 132 135 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.829 109.7 53.9 -76.4 -33.2 23.1 31.7 52.0 133 136 A R H X S+ 0 0 9 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.878 112.1 43.3 -63.9 -45.9 20.5 34.5 52.0 134 137 A G H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.805 113.6 53.7 -68.9 -30.5 19.0 33.2 48.7 135 138 A L H X S+ 0 0 0 -4,-1.6 4,-3.1 1,-0.2 5,-0.3 0.923 103.2 55.2 -73.9 -41.3 19.3 29.6 50.1 136 139 A K H X S+ 0 0 47 -4,-2.6 4,-0.9 1,-0.2 181,-0.3 0.870 111.9 45.3 -52.3 -40.3 17.4 30.6 53.2 137 140 A Y H X S+ 0 0 11 -4,-1.2 4,-0.7 2,-0.2 180,-0.6 0.936 115.3 45.4 -69.6 -51.2 14.6 31.8 50.9 138 141 A I H ><>S+ 0 0 0 -4,-2.5 5,-1.8 1,-0.2 3,-1.5 0.958 114.4 47.5 -56.9 -55.2 14.7 28.7 48.6 139 142 A H H ><5S+ 0 0 12 -4,-3.1 3,-1.2 1,-0.3 -1,-0.2 0.715 102.6 64.0 -62.5 -24.0 14.9 26.2 51.5 140 143 A S H 3<5S+ 0 0 46 -4,-0.9 -1,-0.3 -5,-0.3 -2,-0.2 0.709 102.4 49.8 -74.5 -21.2 12.0 28.0 53.3 141 144 A A T <<5S- 0 0 3 -3,-1.5 -1,-0.3 -4,-0.7 -2,-0.2 0.133 122.9-111.3 -93.9 16.2 9.8 27.0 50.3 142 145 A D T < 5S+ 0 0 123 -3,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.849 71.7 146.0 48.4 40.0 11.1 23.4 50.8 143 146 A I < - 0 0 6 -5,-1.8 2,-0.5 -6,-0.1 -1,-0.2 -0.872 35.8-157.3-101.1 139.6 12.9 23.8 47.5 144 147 A I - 0 0 54 -2,-0.4 55,-0.1 1,-0.2 56,-0.1 -0.969 9.4-159.1-116.9 125.9 16.3 22.1 47.1 145 148 A H - 0 0 2 -2,-0.5 -1,-0.2 54,-0.2 54,-0.0 0.959 15.3-175.7 -68.8 -47.3 18.7 23.4 44.5 146 149 A R + 0 0 74 53,-0.1 -1,-0.1 1,-0.1 41,-0.1 0.261 69.4 58.9 73.7 -9.9 20.7 20.1 44.3 147 150 A D + 0 0 11 18,-0.1 2,-0.6 39,-0.1 5,-0.1 -0.137 61.5 157.7-146.3 39.8 23.3 21.6 41.9 148 151 A L + 0 0 2 37,-0.1 61,-0.1 18,-0.1 17,-0.0 -0.647 17.2 138.5 -78.3 119.6 25.0 24.6 43.4 149 152 A K > - 0 0 21 -2,-0.6 3,-1.5 59,-0.0 -39,-0.1 -0.924 67.6 -93.2-148.5 164.9 28.3 25.3 41.8 150 153 A P G > S+ 0 0 3 0, 0.0 -40,-2.0 0, 0.0 3,-1.1 0.724 117.2 64.4 -51.6 -28.0 30.1 28.5 40.7 151 154 A S G 3 S+ 0 0 36 1,-0.3 -3,-0.1 -41,-0.2 14,-0.0 0.667 101.2 47.7 -79.7 -19.3 28.7 28.3 37.2 152 155 A N G < S+ 0 0 4 -3,-1.5 12,-2.8 -5,-0.1 2,-0.5 0.066 95.0 90.5-105.0 29.8 25.1 28.7 38.1 153 156 A L E < - H 0 163C 0 -3,-1.1 -43,-1.3 10,-0.2 2,-0.4 -0.958 66.7-153.4-121.9 108.7 25.9 31.7 40.3 154 157 A A E -GH 109 162C 9 8,-2.0 8,-2.2 -2,-0.5 2,-0.4 -0.671 12.2-174.5 -86.0 134.9 25.7 35.1 38.6 155 158 A V E - 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0 0 40 -2,-1.6 3,-2.0 42,-0.4 4,-1.2 -0.972 60.2-140.1-133.9 136.8 34.3 17.2 36.1 181 184 A A H 3> S+ 0 0 41 -2,-0.4 4,-0.6 1,-0.3 -1,-0.1 0.735 97.8 79.1 -61.4 -23.1 33.1 20.3 37.9 182 185 A T H 34 S+ 0 0 32 -7,-0.3 -1,-0.3 1,-0.2 -11,-0.1 0.649 107.3 27.0 -57.7 -19.8 29.6 18.7 37.6 183 186 A R H X4 S+ 0 0 0 -3,-2.0 3,-1.8 39,-0.1 -1,-0.2 0.636 97.5 86.0-116.0 -22.1 30.4 16.5 40.6 184 187 A W H 3< S+ 0 0 28 -4,-1.2 36,-0.4 1,-0.3 -2,-0.1 0.672 95.2 43.2 -58.0 -23.5 33.0 18.4 42.7 185 188 A Y T 3< S+ 0 0 10 -4,-0.6 -1,-0.3 34,-0.1 2,-0.2 0.334 88.6 115.7-106.7 4.5 30.5 20.4 44.7 186 189 A R S < S- 0 0 26 -3,-1.8 16,-0.1 1,-0.1 -39,-0.1 -0.559 71.1-112.0 -79.3 137.5 28.0 17.6 45.4 187 190 A A >> - 0 0 0 -2,-0.2 4,-2.3 14,-0.1 3,-1.0 -0.391 28.2-120.0 -62.6 141.7 27.3 16.3 48.9 188 191 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.817 109.6 62.8 -53.8 -34.5 28.7 12.8 49.5 189 192 A E H 34>S+ 0 0 3 1,-0.2 5,-2.4 2,-0.2 6,-0.7 0.819 112.5 35.1 -70.5 -29.1 25.2 11.4 50.3 190 193 A I H <45S+ 0 0 17 -3,-1.0 3,-0.3 3,-0.2 -1,-0.2 0.872 113.3 56.9 -83.0 -45.2 23.9 12.3 46.8 191 194 A M H <5S+ 0 0 15 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.1 0.899 125.4 24.2 -49.0 -42.9 27.1 11.6 44.8 192 195 A L T <5S- 0 0 35 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.308 106.6-123.1-110.0 0.7 27.1 8.0 46.2 193 196 A N T 5 + 0 0 117 -3,-0.3 -3,-0.2 -5,-0.2 59,-0.2 0.949 49.9 159.3 56.2 59.2 23.4 7.7 46.9 194 197 A W < - 0 0 3 -5,-2.4 55,-1.5 1,-0.3 54,-1.3 0.731 60.9 -21.1 -84.1 -27.4 23.7 6.9 50.6 195 198 A M S S- 0 0 32 -6,-0.7 -1,-0.3 52,-0.2 2,-0.2 -0.972 89.7 -57.8-171.1 163.3 20.2 7.9 51.7 196 199 A H - 0 0 184 -2,-0.3 2,-0.1 -3,-0.1 -6,-0.1 -0.459 66.9-142.6 -55.1 119.6 17.1 9.9 50.8 197 200 A Y - 0 0 97 -2,-0.2 2,-0.2 -8,-0.1 -1,-0.1 -0.328 21.5-175.7 -87.0 171.7 18.7 13.4 50.6 198 201 A N > - 0 0 59 -2,-0.1 3,-2.1 -52,-0.0 4,-0.2 -0.820 48.9 -61.1-152.9-167.6 17.4 16.8 51.6 199 202 A Q T >> S+ 0 0 55 1,-0.3 3,-1.1 -2,-0.2 4,-0.5 0.634 113.2 79.2 -67.0 -17.1 18.1 20.6 51.6 200 203 A T H >> S+ 0 0 21 1,-0.2 4,-1.1 2,-0.2 3,-0.5 0.685 77.3 75.7 -59.8 -24.9 21.3 20.1 53.7 201 204 A V H <> S+ 0 0 0 -3,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.856 89.4 56.4 -56.2 -39.6 23.0 19.0 50.5 202 205 A D H <> S+ 0 0 0 -3,-1.1 4,-2.5 -4,-0.2 -1,-0.2 0.827 100.0 58.7 -62.0 -30.0 23.2 22.6 49.3 203 206 A I H S- 0 0 59 -47,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.953 88.6 -73.9-174.0-176.3 36.1 10.2 39.8 225 228 A H H > S+ 0 0 56 -2,-0.3 4,-1.8 2,-0.2 5,-0.1 0.887 127.6 40.9 -61.5 -44.0 33.5 9.4 42.4 226 229 A I H > S+ 0 0 59 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.940 113.8 50.1 -75.6 -51.2 35.7 7.2 44.5 227 230 A D H > S+ 0 0 47 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.897 112.2 51.8 -48.0 -41.1 38.8 9.4 44.3 228 231 A Q H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.880 106.0 52.2 -68.6 -39.1 36.5 12.3 45.3 229 232 A L H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 5,-0.3 0.902 108.5 53.1 -57.2 -43.2 35.1 10.4 48.4 230 233 A K H X S+ 0 0 110 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.952 108.0 49.0 -60.8 -48.5 38.7 9.8 49.4 231 234 A L H X S+ 0 0 53 -4,-2.1 4,-1.7 1,-0.2 5,-0.2 0.946 113.6 48.5 -51.6 -48.7 39.5 13.5 49.2 232 235 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.942 112.6 44.9 -58.9 -52.0 36.4 14.3 51.2 233 236 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.796 106.4 61.0 -68.9 -29.5 37.1 11.7 54.0 234 237 A R H < S+ 0 0 161 -4,-2.2 31,-0.2 -5,-0.3 -1,-0.2 0.935 115.4 33.3 -60.0 -47.2 40.7 12.7 54.2 235 238 A L H < S+ 0 0 10 -4,-1.7 30,-2.5 -3,-0.2 -2,-0.2 0.915 131.2 32.0 -68.4 -45.6 39.7 16.3 55.2 236 239 A V H < S- 0 0 19 -4,-2.6 28,-0.4 28,-0.3 52,-0.2 0.590 108.3-112.9-101.7 -14.2 36.6 15.5 57.1 237 240 A G < - 0 0 5 -4,-2.3 -1,-0.2 26,-0.4 -3,-0.1 0.085 37.3 -72.4 92.9 150.0 37.3 12.1 58.7 238 241 A T - 0 0 27 24,-2.1 26,-0.1 1,-0.1 50,-0.1 -0.413 65.2 -88.0 -70.2 150.9 35.8 8.7 58.0 239 242 A P - 0 0 15 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.232 36.1-134.5 -62.1 151.0 32.2 8.2 59.3 240 243 A G > - 0 0 45 -3,-0.1 4,-2.1 1,-0.0 3,-0.4 -0.462 37.2 -90.4 -92.6 175.9 31.4 6.9 62.8 241 244 A A H > S+ 0 0 60 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.790 124.6 60.6 -58.5 -31.4 28.8 4.3 63.7 242 245 A E H > S+ 0 0 112 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.924 109.0 39.7 -62.9 -49.6 26.2 6.9 64.1 243 246 A L H > S+ 0 0 11 -3,-0.4 4,-0.8 2,-0.2 -2,-0.2 0.827 112.6 58.1 -69.6 -34.0 26.5 8.1 60.5 244 247 A L H >< S+ 0 0 24 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.958 100.7 55.3 -61.3 -50.8 26.9 4.5 59.2 245 248 A K H 3< S+ 0 0 159 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.865 105.1 55.2 -43.4 -45.3 23.5 3.5 60.7 246 249 A K H 3< S+ 0 0 61 -4,-1.1 2,-0.9 -5,-0.1 -1,-0.3 0.697 83.1 95.9 -67.4 -21.6 21.9 6.4 58.7 247 250 A I << - 0 0 0 -3,-1.6 -52,-0.2 -4,-0.8 6,-0.1 -0.622 54.1-173.4 -76.7 106.3 23.3 5.1 55.3 248 251 A S + 0 0 80 -54,-1.3 2,-1.2 -2,-0.9 -53,-0.2 0.810 61.6 91.8 -71.6 -33.6 20.3 3.1 53.9 249 252 A S > - 0 0 35 -55,-1.5 4,-2.9 1,-0.2 5,-0.2 -0.530 61.0-166.7 -68.8 96.9 22.4 1.8 51.0 250 253 A E H > S+ 0 0 109 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.855 88.2 50.4 -51.2 -40.1 23.7 -1.5 52.5 251 254 A S H > S+ 0 0 88 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.941 111.1 46.1 -67.0 -50.2 26.2 -1.7 49.6 252 255 A A H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.899 113.0 51.3 -60.5 -42.1 27.5 1.9 50.0 253 256 A R H X S+ 0 0 61 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.818 108.4 51.2 -65.3 -36.6 27.8 1.4 53.8 254 257 A N H < S+ 0 0 103 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.878 109.3 51.5 -68.8 -39.7 29.8 -1.8 53.3 255 258 A Y H >X S+ 0 0 73 -4,-2.2 3,-1.3 2,-0.2 4,-0.6 0.914 107.2 51.0 -61.6 -43.5 32.1 0.0 50.9 256 259 A I H >< S+ 0 0 5 -4,-2.0 3,-1.7 1,-0.3 -2,-0.2 0.931 105.3 57.4 -63.1 -41.2 32.8 2.9 53.4 257 260 A Q T 3< S+ 0 0 121 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.583 94.3 67.6 -66.6 -10.2 33.7 0.4 56.1 258 261 A S T <4 S+ 0 0 79 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.775 86.1 91.5 -73.9 -26.0 36.4 -1.0 53.8 259 262 A L S << S- 0 0 38 -3,-1.7 2,-0.2 -4,-0.6 3,-0.1 -0.392 88.1-106.3 -75.7 144.2 38.3 2.2 54.2 260 263 A T - 0 0 123 -2,-0.1 -1,-0.1 1,-0.1 -22,-0.1 -0.473 46.7 -99.9 -66.4 132.8 41.0 2.8 56.9 261 264 A Q - 0 0 158 -2,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.300 44.8-173.9 -65.2 135.1 39.7 5.0 59.6 262 265 A M - 0 0 64 -23,-0.1 -24,-2.1 -29,-0.1 2,-0.2 -0.993 18.2-129.7-128.7 136.5 40.8 8.6 59.4 263 266 A P - 0 0 110 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.521 36.7 -93.7 -80.9 152.2 40.4 11.6 61.7 264 267 A K - 0 0 95 -28,-0.4 -28,-0.3 -2,-0.2 -29,-0.1 -0.415 48.5-123.6 -54.4 132.5 39.0 15.0 60.7 265 268 A M - 0 0 63 -30,-2.5 2,-0.7 -31,-0.2 -1,-0.1 -0.296 25.3 -94.0 -77.3 165.2 42.0 17.3 59.8 266 269 A N >> - 0 0 87 1,-0.2 4,-0.9 -2,-0.1 3,-0.8 -0.748 30.5-159.6 -78.8 112.9 42.7 20.6 61.4 267 270 A F H 3> S+ 0 0 0 -2,-0.7 4,-3.7 1,-0.2 -1,-0.2 0.790 90.1 65.0 -68.0 -28.2 41.1 23.2 59.0 268 271 A A H 34 S+ 0 0 49 1,-0.2 5,-0.3 2,-0.2 -1,-0.2 0.780 107.4 43.0 -63.6 -27.3 43.4 25.9 60.4 269 272 A N H <4 S+ 0 0 114 -3,-0.8 3,-0.3 3,-0.1 -1,-0.2 0.622 116.6 46.7 -90.5 -17.0 46.2 23.9 58.9 270 273 A V H < S+ 0 0 52 -4,-0.9 2,-0.7 1,-0.2 -2,-0.2 0.889 118.8 39.6 -81.8 -45.7 44.3 23.3 55.6 271 274 A F S >< S- 0 0 9 -4,-3.7 3,-1.9 -5,-0.1 -1,-0.2 -0.509 87.4-168.6-103.8 61.4 43.1 26.9 55.2 272 275 A I T 3 + 0 0 130 -2,-0.7 -3,-0.1 -3,-0.3 3,-0.1 -0.283 70.0 10.2 -58.4 128.1 46.4 28.6 56.2 273 276 A G T 3 S+ 0 0 81 1,-0.3 -1,-0.3 -5,-0.3 -5,-0.1 0.246 93.7 137.9 87.6 -11.0 46.0 32.4 56.7 274 277 A A < - 0 0 29 -3,-1.9 -1,-0.3 -6,-0.2 -3,-0.0 -0.295 69.3 -89.4 -65.3 151.1 42.2 32.2 56.5 275 278 A N >> - 0 0 47 1,-0.1 4,-1.9 -3,-0.1 3,-1.2 -0.443 35.4-129.7 -57.3 126.6 40.1 34.3 58.9 276 279 A P H 3> S+ 0 0 102 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.810 110.3 56.2 -53.4 -32.5 39.5 32.0 61.9 277 280 A L H 3> S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 27,-0.3 0.823 105.1 51.3 -67.4 -34.8 35.8 32.8 61.6 278 281 A A H <> S+ 0 0 0 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.891 111.0 48.9 -63.7 -43.8 35.8 31.6 58.0 279 282 A V H X S+ 0 0 14 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.861 109.3 51.3 -64.2 -43.3 37.5 28.3 59.1 280 283 A D H X S+ 0 0 54 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.908 110.9 48.0 -63.7 -46.7 34.9 27.8 61.9 281 284 A L H >X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 3,-0.9 0.950 109.8 53.7 -58.9 -48.7 32.0 28.2 59.5 282 285 A L H >X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.3 3,-0.6 0.932 104.1 55.2 -51.4 -49.2 33.6 25.8 57.1 283 286 A E H 3< S+ 0 0 57 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.817 111.1 45.8 -53.3 -30.8 34.0 23.2 59.9 284 287 A K H << S+ 0 0 90 -4,-1.1 10,-1.9 -3,-0.9 -1,-0.2 0.649 116.1 44.2 -91.7 -19.8 30.2 23.5 60.4 285 288 A M H << S+ 0 0 0 -4,-1.7 2,-1.5 -3,-0.6 -2,-0.2 0.851 107.0 58.9 -80.8 -40.3 29.2 23.4 56.8 286 289 A L S < S+ 0 0 4 -4,-2.9 2,-0.4 -5,-0.2 -1,-0.2 -0.493 73.2 139.8 -99.5 63.1 31.6 20.5 55.8 287 290 A V - 0 0 36 -2,-1.5 6,-0.1 -3,-0.2 -3,-0.1 -0.899 50.2-144.1-109.3 132.5 30.1 17.9 58.2 288 291 A L S S+ 0 0 16 -2,-0.4 2,-0.8 -52,-0.2 -99,-0.2 0.952 89.2 67.6 -66.6 -45.3 29.8 14.4 56.9 289 292 A D S > S- 0 0 10 1,-0.2 3,-1.8 -3,-0.1 4,-0.3 -0.641 74.2-157.3 -77.7 110.3 26.5 13.8 58.8 290 293 A S G > S+ 0 0 8 -2,-0.8 3,-0.7 1,-0.3 -1,-0.2 0.661 87.7 65.9 -67.0 -23.9 24.0 16.1 57.1 291 294 A D G 3 S+ 0 0 106 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.768 103.5 50.3 -62.7 -28.1 21.7 16.2 60.1 292 295 A K G < S+ 0 0 110 -3,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.401 86.8 115.0 -92.7 -2.4 24.6 18.0 61.9 293 296 A R S < S- 0 0 11 -3,-0.7 2,-0.3 -4,-0.3 -8,-0.2 -0.288 74.1-106.7 -65.9 153.7 25.2 20.6 59.2 294 297 A I - 0 0 21 -10,-1.9 2,-0.1 -13,-0.2 -1,-0.1 -0.648 38.4-132.4 -72.3 136.6 24.7 24.3 59.8 295 298 A T > - 0 0 46 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.423 20.7-107.0 -85.3 169.3 21.5 25.4 58.0 296 299 A A H > S+ 0 0 2 2,-0.2 4,-1.7 1,-0.2 -160,-0.2 0.870 121.6 49.2 -65.4 -37.9 21.4 28.6 55.8 297 300 A A H > S+ 0 0 54 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.902 114.0 44.3 -70.5 -41.3 19.3 30.4 58.4 298 301 A Q H 4 S+ 0 0 111 1,-0.2 3,-0.4 2,-0.2 -2,-0.2 0.861 112.2 54.8 -67.2 -35.6 21.7 29.4 61.3 299 302 A A H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 6,-0.2 0.801 97.6 61.6 -69.5 -35.4 24.7 30.3 59.0 300 303 A L H 3< S+ 0 0 2 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.797 103.7 51.9 -59.6 -29.0 23.4 33.9 58.3 301 304 A A T 3< S+ 0 0 65 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.406 84.5 119.6 -85.7 -0.4 23.7 34.5 62.1 302 305 A H S X S- 0 0 19 -3,-1.5 3,-2.2 1,-0.1 7,-0.1 -0.475 75.9-119.3 -72.6 139.7 27.3 33.3 62.2 303 306 A A G > S+ 0 0 63 1,-0.3 3,-1.6 -2,-0.2 4,-0.2 0.679 105.4 75.6 -54.4 -22.4 29.9 35.9 63.3 304 307 A Y G 3 S+ 0 0 5 -27,-0.3 -1,-0.3 1,-0.3 3,-0.3 0.791 100.8 42.9 -58.3 -30.4 31.8 35.7 60.0 305 308 A F G X> S+ 0 0 0 -3,-2.2 4,-3.1 -6,-0.2 3,-1.0 0.024 72.0 120.4-107.0 25.0 29.0 37.8 58.3 306 309 A A T <4 S+ 0 0 75 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.877 72.9 61.3 -57.0 -36.7 28.4 40.4 61.1 307 310 A Q T 34 S+ 0 0 138 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.860 121.2 22.1 -52.4 -39.6 29.3 43.1 58.5 308 311 A Y T <4 S+ 0 0 59 -3,-1.0 -2,-0.2 -8,-0.1 -1,-0.2 0.686 90.5 115.2-109.1 -24.9 26.3 42.0 56.4 309 312 A H < + 0 0 62 -4,-3.1 5,-0.1 -7,-0.1 -8,-0.0 -0.285 27.0 163.5 -58.9 120.8 23.8 40.2 58.6 310 313 A D > - 0 0 69 -2,-0.1 3,-1.7 3,-0.1 -9,-0.0 -0.900 22.0-163.3-133.3 112.0 20.4 41.9 59.0 311 314 A P G > S+ 0 0 83 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.664 91.6 57.7 -68.4 -15.7 17.7 39.6 60.4 312 315 A D G 3 S+ 0 0 159 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.365 109.1 46.9 -91.3 6.0 15.0 42.1 59.2 313 316 A D G < S+ 0 0 74 -3,-1.7 -1,-0.2 1,-0.1 -3,-0.1 -0.151 85.6 89.6-138.2 37.4 16.3 41.8 55.6 314 317 A E < - 0 0 9 -3,-0.5 -1,-0.1 -5,-0.1 -14,-0.0 -0.704 68.2-165.1-132.2 77.6 16.7 38.0 55.2 315 318 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.227 13.4-135.0 -76.1 157.8 13.3 37.0 53.8 316 319 A V - 0 0 88 1,-0.1 2,-0.2 -176,-0.1 -179,-0.2 -0.577 27.5-102.9 -99.9 165.6 11.5 33.8 53.5 317 320 A A - 0 0 14 -180,-0.6 3,-0.1 -181,-0.3 -1,-0.1 -0.517 31.3-108.0 -86.9 151.8 9.5 32.5 50.5 318 321 A D - 0 0 117 -244,-0.2 -1,-0.1 -2,-0.2 2,-0.0 -0.358 63.3 -72.5 -62.8 162.3 5.7 32.3 50.2 319 322 A P - 0 0 123 0, 0.0 2,-0.6 0, 0.0 -1,-0.2 -0.366 48.0-147.2 -63.0 142.8 4.5 28.7 50.4 320 323 A Y - 0 0 22 -179,-0.1 2,-0.8 -3,-0.1 -249,-0.0 -0.904 1.2-152.1-117.7 104.1 5.3 26.6 47.4 321 324 A D + 0 0 99 -2,-0.6 3,-0.2 1,-0.1 -180,-0.0 -0.632 26.4 161.5 -69.7 110.8 2.9 23.8 46.5 322 325 A Q > + 0 0 64 -2,-0.8 3,-1.9 1,-0.1 4,-0.3 -0.057 31.3 123.9-120.0 35.2 4.8 21.1 44.7 323 326 A S G > + 0 0 54 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.740 63.5 75.3 -58.2 -26.2 2.2 18.3 45.2 324 327 A F G > S+ 0 0 1 1,-0.2 3,-1.6 -3,-0.2 -1,-0.3 0.754 78.2 75.7 -53.9 -25.0 2.4 18.0 41.4 325 328 A E G < S+ 0 0 57 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.863 97.3 43.1 -61.4 -36.9 5.7 16.2 41.9 326 329 A S G < S+ 0 0 108 -3,-0.9 2,-0.4 -4,-0.3 -1,-0.3 -0.010 96.6 110.9 -94.1 31.0 4.1 13.0 43.0 327 330 A R < - 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