==== 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 13-SEP-96 1WFC . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE P38; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.P.WILSON,M.J.FITZGIBBON,P.R.CARON,J.P.GRIFFITH,W.CHEN,P. . 340 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17078.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 67.6 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 . 40 11.8 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 . 0 0.0 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 . 26 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 1 0 1 1 0 1 1 0 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 . 0 1 2 0 3 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 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 5 A R 0 0 147 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 137.2 21.1 38.7 22.2 2 6 A P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.275 360.0 -93.5 -77.6 175.5 24.1 40.6 20.8 3 7 A T - 0 0 82 -2,-0.1 14,-2.5 2,-0.0 2,-0.4 -0.731 41.7-152.5 -91.0 146.4 25.0 40.5 17.1 4 8 A F E -A 16 0A 22 -2,-0.3 2,-0.3 12,-0.3 10,-0.0 -0.911 6.5-159.4-120.4 139.4 27.6 37.9 16.3 5 9 A Y E -A 15 0A 62 10,-2.6 10,-2.3 -2,-0.4 2,-0.4 -0.914 12.1-140.1-120.8 159.4 30.0 37.9 13.5 6 10 A R E +A 14 0A 153 -2,-0.3 2,-0.3 8,-0.2 8,-0.3 -0.885 24.9 164.7-114.6 136.1 31.8 34.9 12.2 7 11 A Q E -A 13 0A 59 6,-2.5 6,-3.7 -2,-0.4 2,-0.9 -0.985 36.6-118.4-148.3 152.9 35.4 34.6 11.1 8 12 A E E A 12 0A 152 -2,-0.3 4,-0.3 4,-0.3 -2,-0.0 -0.770 360.0 360.0 -95.7 106.2 37.6 31.7 10.4 9 13 A L 0 0 64 2,-2.2 -1,-0.2 -2,-0.9 3,-0.2 0.404 360.0 360.0-129.0 360.0 40.6 31.6 12.8 10 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 11 16 A T 0 0 82 0, 0.0 -2,-2.2 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 166.5 38.2 27.3 13.0 12 17 A I E -A 8 0A 67 -4,-0.3 2,-0.5 -3,-0.2 -4,-0.3 -0.874 360.0-163.7 -90.7 125.8 35.1 29.5 12.5 13 18 A W E -A 7 0A 3 -6,-3.7 -6,-2.5 -2,-0.6 2,-0.6 -0.909 7.7-169.4-103.6 133.0 34.6 31.7 15.5 14 19 A E E +A 6 0A 54 -2,-0.5 -8,-0.2 -8,-0.3 -2,-0.0 -0.950 24.1 159.5-117.5 110.4 31.2 33.3 15.9 15 20 A V E -A 5 0A 1 -10,-2.3 -10,-2.6 -2,-0.6 -2,-0.0 -0.884 47.8 -88.6-128.8 156.3 31.5 35.9 18.7 16 21 A P E > -A 4 0A 2 0, 0.0 3,-2.2 0, 0.0 -12,-0.3 -0.365 44.6-113.5 -56.3 143.1 29.5 39.0 19.7 17 22 A E T 3 S+ 0 0 103 -14,-2.5 22,-0.1 1,-0.3 -13,-0.1 0.606 108.2 79.5 -65.4 -5.9 30.8 42.1 17.9 18 23 A R T 3 S+ 0 0 48 -15,-0.3 21,-2.8 1,-0.1 2,-0.8 0.798 80.5 77.5 -61.1 -24.2 32.0 43.6 21.2 19 24 A Y E < S+B 38 0B 0 -3,-2.2 2,-0.3 19,-0.2 3,-0.2 -0.762 71.9 178.6 -94.1 113.8 35.0 41.3 20.9 20 25 A Q E +B 37 0B 61 17,-3.0 17,-2.7 -2,-0.8 -2,-0.0 -0.781 47.0 19.6-120.8 160.7 37.3 42.7 18.3 21 26 A N E S- 0 0 128 -2,-0.3 -1,-0.2 15,-0.2 2,-0.2 0.928 71.6-163.1 56.7 54.3 40.7 41.9 16.8 22 27 A L E - 0 0 15 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.462 7.5-172.5 -71.5 136.3 40.7 38.3 17.7 23 28 A S E -B 35 0B 69 12,-2.7 12,-3.2 -2,-0.2 2,-0.0 -0.972 26.0-118.9-134.3 117.8 44.1 36.8 17.5 24 29 A P E +B 34 0B 85 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.329 46.1 152.0 -56.9 127.4 44.7 33.1 17.8 25 30 A V E + 0 0 89 8,-3.1 2,-0.3 1,-0.4 9,-0.2 0.397 56.1 20.2-136.7 -6.1 47.0 32.3 20.8 26 31 A G E +B 33 0B 26 7,-2.1 7,-3.1 9,-0.0 -1,-0.4 -0.994 50.6 153.1-164.6 164.0 46.2 28.9 22.1 27 32 A S + 0 0 90 5,-0.3 2,-0.2 -2,-0.3 5,-0.2 -0.931 10.4 136.4-179.1 178.7 44.6 25.6 21.2 28 33 A G S > S- 0 0 46 -2,-0.3 3,-1.8 1,-0.1 23,-0.1 -0.600 76.4 -52.0 134.2 165.8 44.8 22.0 22.2 29 34 A A T 3 S+ 0 0 78 1,-0.3 3,-0.1 -2,-0.2 22,-0.1 0.594 130.7 59.6 -50.3 -11.4 42.2 19.3 22.9 30 35 A Y T 3 S- 0 0 166 1,-0.3 21,-2.9 20,-0.1 -1,-0.3 0.881 120.8 -66.5 -81.0 -40.6 40.5 21.5 25.4 31 36 A G E < - C 0 50B 3 -3,-1.8 -1,-0.3 19,-0.3 2,-0.3 -0.906 48.0 -86.7 162.3 160.0 39.7 24.4 23.1 32 37 A S E - C 0 49B 21 17,-2.0 17,-3.1 -2,-0.3 2,-0.4 -0.681 38.3-150.2 -93.4 156.6 41.2 27.0 21.0 33 38 A V E -BC 26 48B 34 -7,-3.1 -8,-3.1 -2,-0.3 -7,-2.1 -0.991 10.5-170.9-132.2 128.3 42.0 30.4 22.5 34 39 A C E -BC 24 47B 0 13,-2.7 13,-3.2 -2,-0.4 2,-0.3 -0.905 21.2-133.2-110.2 145.9 42.0 33.7 20.9 35 40 A A E +BC 23 46B 11 -12,-3.2 -12,-2.7 -2,-0.4 2,-0.3 -0.757 39.6 171.4 -84.0 144.8 43.3 36.9 22.5 36 41 A A E - C 0 45B 0 9,-2.4 9,-3.2 -2,-0.3 2,-0.6 -0.984 37.0-117.8-151.0 165.7 40.8 39.7 21.9 37 42 A F E -BC 20 44B 61 -17,-2.7 -17,-3.0 -2,-0.3 2,-1.4 -0.924 21.9-146.8-104.5 116.8 39.9 43.2 22.9 38 43 A D E >>> -BC 19 43B 3 5,-2.9 4,-2.9 -2,-0.6 3,-0.8 -0.650 11.7-168.6 -80.1 96.9 36.6 43.6 24.6 39 44 A T T 345S+ 0 0 74 -21,-2.8 -1,-0.2 -2,-1.4 -20,-0.1 0.886 82.8 55.6 -55.5 -33.0 35.5 47.0 23.3 40 45 A K T 345S+ 0 0 150 -22,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.797 123.6 20.9 -76.8 -24.9 32.7 47.1 25.8 41 46 A T T <45S- 0 0 69 -3,-0.8 -1,-0.2 2,-0.2 -2,-0.2 0.566 95.0-129.8-113.7 -9.7 34.8 46.6 28.9 42 47 A G T <5 + 0 0 40 -4,-2.9 2,-0.2 1,-0.3 -3,-0.2 0.643 62.0 141.5 68.9 11.6 38.1 47.7 27.5 43 48 A L E < -C 38 0B 59 -5,-0.5 -5,-2.9 -6,-0.0 2,-0.6 -0.544 58.0-127.6 -84.4 151.4 39.5 44.5 28.9 44 49 A R E -C 37 0B 126 -2,-0.2 59,-2.8 -7,-0.2 2,-0.3 -0.891 45.2-171.1 -90.1 124.9 42.0 42.5 27.1 45 50 A V E -CD 36 102B 0 -9,-3.2 -9,-2.4 -2,-0.6 2,-0.5 -0.779 31.9-132.1-129.0 162.4 40.4 39.0 27.1 46 51 A A E -CD 35 101B 15 55,-3.1 55,-2.4 -2,-0.3 2,-0.6 -0.949 21.9-162.3-107.2 128.0 41.0 35.4 26.4 47 52 A V E -CD 34 100B 0 -13,-3.2 -13,-2.7 -2,-0.5 2,-0.5 -0.941 6.4-165.4-113.0 118.4 38.2 33.8 24.4 48 53 A K E -CD 33 99B 39 51,-3.4 51,-2.3 -2,-0.6 2,-0.7 -0.894 9.1-159.4-106.5 125.0 38.2 30.0 24.6 49 54 A K E -CD 32 98B 20 -17,-3.1 -17,-2.0 -2,-0.5 49,-0.2 -0.899 29.3-126.3 -99.2 112.6 36.2 28.0 22.1 50 55 A L E -C 31 0B 12 47,-2.2 2,-0.5 -2,-0.7 -19,-0.3 -0.269 15.7-124.8 -63.2 136.8 35.7 24.6 23.7 51 56 A S S S- 0 0 35 -21,-2.9 4,-0.2 1,-0.2 -1,-0.1 -0.683 78.6 -30.5 -77.0 126.1 36.7 21.6 21.6 52 57 A R S > S- 0 0 145 -2,-0.5 3,-1.7 1,-0.1 -1,-0.2 0.777 75.6-178.5 42.2 47.4 33.9 19.0 21.3 53 58 A P T 3 S+ 0 0 9 0, 0.0 10,-0.5 0, 0.0 3,-0.3 0.848 75.7 32.5 -56.3 -41.3 32.2 19.9 24.6 54 59 A F T 3 S+ 0 0 20 41,-0.3 -2,-0.1 1,-0.2 3,-0.1 -0.156 80.0 122.6-110.0 44.9 29.4 17.4 24.6 55 60 A Q S < S+ 0 0 104 -3,-1.7 2,-0.3 -4,-0.2 -1,-0.2 0.647 82.6 4.6 -77.5 -12.9 31.2 14.7 22.7 56 61 A S S > S- 0 0 32 -3,-0.3 4,-3.6 -4,-0.2 5,-0.4 -0.979 83.1 -99.2-163.6 153.0 30.7 12.0 25.4 57 62 A I H > S+ 0 0 79 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.955 127.8 49.3 -43.4 -52.9 28.9 11.9 28.8 58 63 A I H > S+ 0 0 108 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.943 112.8 44.2 -52.7 -51.7 32.3 12.5 30.3 59 64 A H H > S+ 0 0 56 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.937 114.9 49.7 -65.2 -41.0 33.1 15.5 28.0 60 65 A A H X S+ 0 0 0 -4,-3.6 4,-2.6 2,-0.2 5,-0.2 0.956 112.9 46.4 -59.8 -46.5 29.6 16.9 28.5 61 66 A K H X S+ 0 0 35 -4,-3.3 4,-2.7 -5,-0.4 -1,-0.2 0.926 112.3 51.5 -64.0 -38.3 29.9 16.5 32.2 62 67 A R H X S+ 0 0 114 -4,-2.7 4,-2.9 -5,-0.3 5,-0.3 0.959 108.5 50.3 -61.3 -49.4 33.3 18.1 32.1 63 68 A T H X S+ 0 0 12 -4,-3.1 4,-2.6 -10,-0.5 5,-0.2 0.944 112.7 48.7 -49.5 -49.3 32.0 21.1 30.1 64 69 A Y H X S+ 0 0 10 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.927 110.3 50.1 -58.0 -46.8 29.4 21.4 32.7 65 70 A R H X S+ 0 0 72 -4,-2.7 4,-3.3 -5,-0.2 5,-0.2 0.957 110.9 48.3 -62.6 -47.4 31.8 21.2 35.6 66 71 A E H X S+ 0 0 55 -4,-2.9 4,-3.3 2,-0.2 5,-0.3 0.969 113.9 46.4 -61.1 -49.2 34.1 23.8 34.1 67 72 A L H X S+ 0 0 3 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 0.934 113.9 49.1 -57.4 -45.8 31.3 26.2 33.4 68 73 A R H X S+ 0 0 42 -4,-2.9 4,-0.8 -5,-0.2 -1,-0.2 0.937 115.0 44.3 -59.4 -47.2 29.8 25.6 36.9 69 74 A L H >X S+ 0 0 26 -4,-3.3 3,-1.7 -5,-0.2 4,-1.1 0.990 114.8 47.1 -60.0 -59.3 33.2 26.2 38.5 70 75 A L H >< S+ 0 0 12 -4,-3.3 11,-0.9 1,-0.3 3,-0.7 0.903 109.8 53.3 -56.7 -42.2 34.1 29.3 36.5 71 76 A K H 3< S+ 0 0 42 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.758 107.5 54.7 -64.2 -17.6 30.7 30.9 37.0 72 77 A H H << S+ 0 0 34 -3,-1.7 2,-0.5 -4,-0.8 240,-0.2 0.830 83.5 95.4 -81.6 -28.1 31.1 30.5 40.8 73 78 A M << + 0 0 6 -4,-1.1 2,-0.4 -3,-0.7 8,-0.3 -0.481 35.4 159.3 -85.5 115.2 34.4 32.2 41.3 74 79 A K + 0 0 154 -2,-0.5 2,-0.3 6,-0.1 5,-0.1 -0.757 32.9 108.6-130.7 88.6 34.3 35.8 42.4 75 80 A H S > S- 0 0 19 3,-0.5 3,-2.3 -2,-0.4 57,-0.0 -0.958 70.2-116.8-160.1 138.8 37.6 36.7 44.1 76 81 A E T 3 S+ 0 0 116 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.839 113.5 44.3 -42.8 -43.2 40.6 38.9 43.2 77 82 A N T 3 S+ 0 0 6 83,-0.1 84,-3.2 51,-0.1 2,-0.4 0.225 104.1 69.2 -94.6 20.1 43.0 36.0 43.3 78 83 A V B < S-f 161 0C 1 -3,-2.3 -3,-0.5 82,-0.3 84,-0.2 -0.996 87.6-107.9-134.6 139.0 41.0 33.4 41.3 79 84 A I - 0 0 22 82,-2.5 2,-0.3 -2,-0.4 -6,-0.1 -0.368 41.2-168.8 -58.7 141.4 40.1 33.5 37.7 80 85 A G - 0 0 17 -4,-0.1 2,-0.6 -6,-0.1 22,-0.3 -0.805 28.7 -95.7-123.7 174.1 36.5 34.3 37.1 81 86 A L - 0 0 14 -11,-0.9 20,-0.2 -8,-0.3 3,-0.1 -0.787 29.6-176.4 -89.9 120.3 34.2 34.2 34.1 82 87 A L S S- 0 0 25 18,-2.6 2,-0.3 -2,-0.6 19,-0.2 0.842 71.4 -21.6 -79.9 -31.2 33.9 37.5 32.3 83 88 A D E -E 100 0B 18 17,-1.2 17,-2.5 258,-0.1 -1,-0.3 -0.964 53.1-162.4-168.2 151.8 31.4 36.2 29.8 84 89 A V E +E 99 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.979 24.1 159.5-139.4 146.4 30.2 32.9 28.2 85 90 A F E -E 98 0B 14 13,-1.6 13,-1.7 -2,-0.3 252,-0.1 -0.974 26.7-160.2-155.7 172.6 28.1 32.7 25.0 86 91 A T - 0 0 12 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.968 26.3-133.8-147.5 142.5 27.0 30.5 22.1 87 92 A P S S+ 0 0 17 0, 0.0 2,-0.1 0, 0.0 -83,-0.1 0.545 72.4 118.1 -69.3 -0.1 25.6 31.8 18.8 88 93 A A - 0 0 14 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.409 53.8-158.4 -81.4 142.0 22.9 29.3 19.1 89 94 A R S S+ 0 0 163 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.534 72.3 14.3 -96.3 -3.8 19.4 30.5 19.4 90 95 A S S >> S- 0 0 24 1,-0.1 4,-0.9 0, 0.0 3,-0.8 -0.982 81.7-100.4-155.6 161.5 17.8 27.5 21.0 91 96 A L G >4 S+ 0 0 64 -2,-0.3 3,-1.2 1,-0.2 -1,-0.1 0.909 121.8 58.6 -47.4 -43.8 18.8 24.3 22.8 92 97 A E G 34 S+ 0 0 159 1,-0.3 -1,-0.2 -3,-0.1 -4,-0.0 0.846 109.4 42.9 -65.6 -27.0 18.2 22.4 19.6 93 98 A E G <4 S+ 0 0 101 -3,-0.8 -1,-0.3 2,-0.0 -2,-0.2 0.606 90.0 121.9 -85.6 -9.6 20.8 24.6 17.8 94 99 A F << + 0 0 0 -3,-1.2 3,-0.1 -4,-0.9 -3,-0.1 -0.258 14.7 118.7 -71.8 133.3 23.2 24.5 20.7 95 100 A N + 0 0 94 1,-0.3 2,-0.3 -2,-0.0 -41,-0.3 0.337 55.3 68.8-149.6 -43.6 26.7 23.1 20.1 96 101 A D - 0 0 54 -43,-0.1 2,-0.4 -44,-0.1 -1,-0.3 -0.704 49.4-171.2-101.1 141.6 29.4 25.7 20.8 97 102 A V - 0 0 0 -2,-0.3 -47,-2.2 -47,-0.2 2,-0.4 -0.971 3.5-170.4-124.2 137.2 30.5 27.2 24.1 98 103 A Y E -DE 49 85B 2 -13,-1.7 -13,-1.6 -2,-0.4 2,-0.4 -0.992 5.5-159.5-127.6 137.3 32.9 30.1 24.3 99 104 A L E -DE 48 84B 5 -51,-2.3 -51,-3.4 -2,-0.4 2,-0.5 -0.951 3.4-156.9-121.5 138.9 34.3 31.3 27.6 100 105 A V E +DE 47 83B 0 -17,-2.5 -18,-2.6 -2,-0.4 -17,-1.2 -0.955 21.1 158.0-121.3 128.4 35.8 34.7 28.1 101 106 A T E -D 46 0B 22 -55,-2.4 -55,-3.1 -2,-0.5 2,-0.2 -0.850 50.5 -68.8-137.0 173.9 38.3 35.5 30.8 102 107 A H E -D 45 0B 59 -22,-0.3 2,-0.4 -2,-0.3 -57,-0.3 -0.486 54.6-112.4 -63.8 133.4 41.0 38.2 31.5 103 108 A L - 0 0 58 -59,-2.8 2,-0.4 -67,-0.2 -59,-0.1 -0.539 41.1-132.5 -61.9 122.3 43.9 37.9 29.1 104 109 A M - 0 0 64 -2,-0.4 3,-0.1 1,-0.1 -1,-0.1 -0.685 11.4-148.8 -94.1 139.9 46.7 36.8 31.4 105 110 A G - 0 0 65 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.992 63.5 -39.4 -62.0 -71.4 50.1 38.3 31.4 106 111 A A E -G 153 0C 30 47,-0.7 47,-3.0 4,-0.0 -1,-0.2 -0.990 54.7-114.0-159.7 157.7 52.4 35.5 32.5 107 112 A D E > -G 152 0C 34 -2,-0.3 4,-2.6 45,-0.3 3,-0.3 -0.466 41.1 -94.8 -95.1 172.8 52.5 32.7 34.9 108 113 A L H > S+ 0 0 2 43,-1.8 4,-2.8 40,-1.2 5,-0.2 0.906 123.9 54.3 -57.1 -45.2 54.8 32.3 37.8 109 114 A N H > S+ 0 0 65 39,-0.5 4,-2.8 2,-0.2 -1,-0.3 0.943 109.7 48.9 -50.9 -43.1 57.4 30.2 35.9 110 115 A N H > S+ 0 0 56 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.970 109.7 51.6 -67.6 -44.8 57.6 33.0 33.4 111 116 A I H >X S+ 0 0 28 -4,-2.6 3,-0.8 1,-0.2 4,-0.8 0.980 111.5 47.4 -49.0 -59.2 58.0 35.6 36.1 112 117 A V H >< S+ 0 0 65 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.901 106.0 57.4 -52.8 -46.2 60.8 33.5 37.6 113 118 A K H 3< S+ 0 0 149 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.904 115.8 38.4 -53.1 -37.3 62.6 33.1 34.2 114 119 A C H << S+ 0 0 100 -4,-1.9 2,-0.3 -3,-0.8 -1,-0.3 0.527 122.4 31.7 -91.0 -2.3 62.7 36.8 33.9 115 120 A Q << - 0 0 103 -3,-1.4 2,-0.5 -4,-0.8 -1,-0.1 -0.990 62.5-126.0-159.2 151.3 63.4 37.7 37.6 116 121 A K - 0 0 186 -2,-0.3 2,-0.2 -3,-0.0 91,-0.0 -0.863 41.2-140.0 -93.0 133.2 65.0 36.9 40.9 117 122 A L - 0 0 29 -2,-0.5 2,-0.3 90,-0.2 3,-0.0 -0.519 8.6-140.6 -95.3 170.8 62.3 37.1 43.5 118 123 A T > - 0 0 65 -2,-0.2 4,-3.1 1,-0.1 5,-0.3 -0.882 29.5-105.8-125.6 151.3 62.7 38.6 46.9 119 124 A D H > S+ 0 0 49 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.845 125.0 54.3 -45.6 -33.0 61.3 37.5 50.3 120 125 A D H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.949 109.6 45.2 -67.1 -45.7 58.9 40.4 49.9 121 126 A H H > S+ 0 0 51 -3,-0.2 4,-3.1 2,-0.2 5,-0.3 0.943 115.3 48.2 -57.1 -46.2 57.8 39.2 46.6 122 127 A V H X S+ 0 0 3 -4,-3.1 4,-2.9 2,-0.2 5,-0.4 0.960 110.8 51.5 -62.7 -49.6 57.5 35.6 48.0 123 128 A Q H X S+ 0 0 20 -4,-3.1 4,-2.5 -5,-0.3 -1,-0.2 0.948 115.2 41.7 -44.0 -56.0 55.6 36.9 51.0 124 129 A F H X S+ 0 0 47 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.907 115.0 49.2 -64.3 -46.5 53.1 38.7 48.8 125 130 A L H X S+ 0 0 0 -4,-3.1 4,-1.7 -5,-0.2 -1,-0.2 0.906 114.6 43.6 -66.5 -42.6 52.8 36.0 46.2 126 131 A I H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.3 5,-0.3 0.948 109.7 57.5 -71.1 -42.5 52.2 33.2 48.7 127 132 A Y H X S+ 0 0 15 -4,-2.5 4,-2.7 -5,-0.4 5,-0.2 0.952 107.1 49.1 -41.7 -55.8 49.8 35.4 50.7 128 133 A Q H X S+ 0 0 8 -4,-2.2 4,-3.1 1,-0.2 -1,-0.2 0.905 109.3 51.4 -58.7 -41.9 47.7 35.9 47.6 129 134 A I H X S+ 0 0 1 -4,-1.7 4,-3.4 1,-0.2 5,-0.2 0.971 113.1 44.4 -61.0 -51.3 47.6 32.1 46.8 130 135 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.881 112.3 53.6 -62.3 -33.8 46.4 31.3 50.4 131 136 A R H X S+ 0 0 9 -4,-2.7 4,-1.7 -5,-0.3 -1,-0.2 0.960 112.1 44.8 -63.4 -50.0 43.9 34.2 50.2 132 137 A G H X S+ 0 0 0 -4,-3.1 4,-2.9 -5,-0.2 -2,-0.2 0.950 113.9 50.2 -56.1 -48.3 42.6 32.7 47.0 133 138 A L H X S+ 0 0 0 -4,-3.4 4,-3.4 2,-0.2 5,-0.3 0.842 102.5 58.5 -65.1 -33.3 42.6 29.3 48.5 134 139 A K H X S+ 0 0 46 -4,-2.7 4,-2.4 -5,-0.2 177,-0.3 0.972 112.1 43.7 -56.6 -46.8 40.7 30.3 51.6 135 140 A Y H X S+ 0 0 11 -4,-1.7 4,-1.3 -5,-0.2 176,-0.6 0.991 115.7 46.5 -58.7 -61.4 38.0 31.4 49.3 136 141 A I H ><>S+ 0 0 0 -4,-2.9 5,-2.1 1,-0.2 3,-0.7 0.941 115.0 47.4 -45.4 -53.0 38.2 28.3 47.1 137 142 A H H ><5S+ 0 0 10 -4,-3.4 3,-2.2 1,-0.2 -1,-0.2 0.866 101.9 63.3 -66.5 -32.2 38.3 26.0 50.1 138 143 A S H 3<5S+ 0 0 50 -4,-2.4 -1,-0.2 -3,-0.4 -2,-0.2 0.851 104.0 48.3 -61.1 -30.6 35.3 27.8 51.8 139 144 A A T <<5S- 0 0 3 -4,-1.3 -1,-0.3 -3,-0.7 175,-0.3 0.270 121.4-115.6 -86.6 16.6 33.2 26.7 48.9 140 145 A D T < 5 + 0 0 111 -3,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.897 67.6 145.2 41.9 47.2 34.7 23.2 49.4 141 146 A I < - 0 0 6 -5,-2.1 2,-0.4 -6,-0.2 -1,-0.2 -0.888 36.1-155.3-102.0 143.5 36.3 23.3 46.0 142 147 A I - 0 0 57 -2,-0.4 51,-0.1 1,-0.1 52,-0.0 -0.965 9.4-158.7-115.0 131.1 39.7 21.6 45.8 143 148 A H - 0 0 4 -2,-0.4 -1,-0.1 50,-0.2 21,-0.1 0.834 16.8-177.6 -80.8 -27.0 42.2 22.7 43.1 144 149 A R + 0 0 106 1,-0.2 -1,-0.1 49,-0.1 -2,-0.0 0.639 69.3 59.3 48.4 14.6 44.1 19.4 43.2 145 150 A D + 0 0 41 2,-0.0 2,-0.4 35,-0.0 19,-0.3 -0.125 62.5 160.0-165.1 49.5 46.6 20.7 40.6 146 151 A L + 0 0 1 33,-0.2 17,-0.0 17,-0.1 5,-0.0 -0.698 15.2 148.7 -83.7 136.6 48.3 23.8 41.9 147 152 A K > - 0 0 31 -2,-0.4 3,-2.0 31,-0.0 -39,-0.1 -0.958 62.6 -99.6-156.3 154.8 51.5 24.4 40.0 148 153 A P G > S+ 0 0 6 0, 0.0 3,-1.2 0, 0.0 -40,-1.2 0.794 121.1 63.2 -53.1 -28.5 53.4 27.6 39.1 149 154 A S G 3 S+ 0 0 43 1,-0.2 -3,-0.0 -42,-0.2 -42,-0.0 0.617 98.9 55.3 -73.7 -6.0 51.9 27.3 35.6 150 155 A N G < S+ 0 0 8 -3,-2.0 12,-3.6 12,-0.1 2,-0.5 0.154 92.7 81.0-108.2 18.7 48.4 27.8 37.1 151 156 A L E < - H 0 161C 0 -3,-1.2 -43,-1.8 10,-0.2 2,-0.5 -0.996 66.0-156.3-132.3 123.3 49.2 31.1 38.8 152 157 A A E -GH 107 160C 1 8,-2.7 8,-2.3 -2,-0.5 2,-0.4 -0.908 9.5-168.2-109.1 133.3 49.1 34.1 36.7 153 158 A V E -GH 106 159C 5 -47,-3.0 -47,-0.7 -2,-0.5 6,-0.2 -0.968 6.3-151.8-125.8 130.7 51.1 37.1 37.9 154 159 A N > - 0 0 54 4,-2.9 3,-3.0 -2,-0.4 4,-0.3 -0.523 39.4 -85.6 -98.0 172.9 50.8 40.5 36.5 155 160 A E T 3 S+ 0 0 183 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.692 128.5 53.0 -45.4 -23.7 53.3 43.4 36.3 156 161 A D T 3 S- 0 0 101 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.153 119.3-106.4-104.3 22.2 52.3 44.4 39.8 157 162 A C S < S+ 0 0 23 -3,-3.0 2,-0.4 1,-0.3 -2,-0.2 0.741 72.9 145.7 61.1 21.8 52.9 41.0 41.4 158 163 A E - 0 0 102 -4,-0.3 -4,-2.9 -30,-0.0 2,-0.3 -0.772 33.2-156.5 -90.7 140.1 49.2 40.5 41.7 159 164 A L E - H 0 153C 4 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.863 19.4-167.0-126.2 146.9 48.3 36.9 41.2 160 165 A K E - H 0 152C 45 -8,-2.3 -8,-2.7 -2,-0.3 2,-0.4 -0.999 25.0-127.9-129.1 131.3 45.3 34.8 40.2 161 166 A I E -fH 78 151C 0 -84,-3.2 -82,-2.5 -2,-0.4 -10,-0.2 -0.635 40.8-171.3 -70.5 131.0 44.9 31.0 40.6 162 167 A L + 0 0 23 -12,-3.6 2,-0.9 -2,-0.4 -12,-0.1 -0.538 40.3 15.3-118.3 179.7 44.0 29.6 37.2 163 168 A D 0 0 100 -2,-0.2 -17,-0.1 1,-0.1 -2,-0.0 -0.459 360.0 360.0 63.9 -92.6 42.8 26.5 35.4 164 169 A F 0 0 53 -2,-0.9 -21,-0.1 -19,-0.3 -20,-0.1 0.155 360.0 360.0 123.2 360.0 41.7 24.3 38.3 165 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 166 175 A T >> 0 0 125 0, 0.0 4,-0.7 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 152.4 46.5 11.3 32.5 167 176 A D G >4 + 0 0 148 1,-0.3 3,-1.4 2,-0.2 0, 0.0 0.868 360.0 51.0 -50.8 -45.4 48.8 8.7 34.1 168 177 A D G >4 S+ 0 0 132 1,-0.3 3,-2.3 2,-0.2 -1,-0.3 0.940 105.4 58.0 -53.6 -43.5 51.4 8.8 31.3 169 178 A E G <4 S+ 0 0 114 -3,-0.6 -1,-0.3 1,-0.3 7,-0.2 0.653 108.2 47.3 -66.3 -9.3 51.4 12.6 31.8 170 179 A M G << S+ 0 0 27 -3,-1.4 2,-0.5 -4,-0.7 -1,-0.3 0.079 91.7 101.3-116.2 27.6 52.4 12.1 35.4 171 180 A T S < S+ 0 0 67 -3,-2.3 2,-0.2 47,-0.1 47,-0.1 -0.903 74.0 2.3-109.0 139.4 55.1 9.6 34.8 172 181 A G S S- 0 0 24 -2,-0.5 2,-2.2 1,-0.1 5,-0.1 -0.469 116.1 -16.3 101.6-166.4 58.7 10.5 34.9 173 182 A Y S S+ 0 0 139 44,-0.2 2,-0.4 -2,-0.2 44,-0.2 -0.546 91.6 145.4 -76.4 76.2 60.7 13.6 35.5 174 183 A V >> - 0 0 39 -2,-2.2 3,-2.1 42,-0.4 4,-1.1 -0.951 57.6-142.1-129.5 133.4 57.6 15.8 35.1 175 184 A A H 3> S+ 0 0 44 -2,-0.4 4,-0.6 1,-0.3 -1,-0.1 0.782 96.9 77.5 -57.6 -22.5 56.3 19.1 36.7 176 185 A T H 34 S+ 0 0 38 -7,-0.2 -1,-0.3 1,-0.2 -6,-0.1 0.733 107.6 28.8 -57.9 -20.7 52.8 17.7 36.5 177 186 A R H X4 S+ 0 0 0 -3,-2.1 3,-1.9 -5,-0.1 -1,-0.2 0.599 96.9 84.8-113.5 -17.7 53.7 15.5 39.6 178 187 A W H 3< S+ 0 0 29 -4,-1.1 36,-0.2 1,-0.3 -2,-0.1 0.762 95.8 44.1 -66.0 -19.6 56.3 17.5 41.5 179 188 A Y T 3< S+ 0 0 12 -4,-0.6 -1,-0.3 2,-0.1 2,-0.2 0.440 88.7 117.3-102.2 3.8 53.7 19.6 43.4 180 189 A R < - 0 0 40 -3,-1.9 16,-0.1 1,-0.1 -3,-0.1 -0.500 69.5-115.3 -80.9 136.7 51.4 16.7 44.2 181 190 A A >> - 0 0 0 -2,-0.2 4,-2.7 14,-0.1 3,-1.3 -0.429 26.9-121.2 -66.1 138.5 50.7 15.7 47.8 182 191 A P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 6,-0.4 0.890 107.4 62.5 -50.6 -47.3 51.9 12.2 48.5 183 192 A E H 34>S+ 0 0 2 1,-0.2 5,-1.8 99,-0.2 6,-0.7 0.853 114.1 33.9 -53.7 -36.2 48.5 10.8 49.5 184 193 A I H X45S+ 0 0 12 -3,-1.3 3,-0.9 3,-0.2 -1,-0.2 0.859 111.2 61.5 -88.8 -34.0 47.2 11.5 46.0 185 194 A M H 3<5S+ 0 0 7 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.1 0.840 125.0 20.9 -58.0 -28.4 50.4 10.8 44.1 186 195 A L T 3<5S- 0 0 42 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.177 107.6-118.3-122.3 14.0 50.3 7.2 45.4 187 196 A N T < 5 + 0 0 125 -3,-0.9 -3,-0.2 -5,-0.2 56,-0.2 0.897 52.9 159.8 50.3 46.2 46.6 7.0 46.3 188 197 A W < - 0 0 6 -5,-1.8 54,-1.8 -6,-0.4 55,-0.8 0.896 64.1 -24.2 -62.2 -37.2 47.2 6.5 50.0 189 198 A M S S- 0 0 29 -6,-0.7 -1,-0.2 52,-0.2 2,-0.1 -0.954 88.7 -59.0-167.3 170.6 43.8 7.5 51.1 190 199 A H - 0 0 172 -2,-0.3 2,-0.2 1,-0.1 -6,-0.1 -0.410 61.2-134.4 -67.2 140.1 40.8 9.6 50.1 191 200 A Y + 0 0 88 -2,-0.1 2,-0.2 -8,-0.1 -1,-0.1 -0.489 25.3 177.2 -99.7 166.8 41.9 13.2 49.6 192 201 A N > - 0 0 65 -2,-0.2 3,-1.4 0, 0.0 4,-0.2 -0.768 54.2 -61.8-144.5-163.8 40.6 16.5 50.6 193 202 A Q T >> S+ 0 0 43 1,-0.2 3,-2.4 -2,-0.2 4,-0.6 0.718 112.3 81.1 -61.9 -19.1 41.6 20.2 50.4 194 203 A T H >> S+ 0 0 16 1,-0.3 4,-1.6 2,-0.2 3,-0.5 0.818 76.1 78.9 -62.3 -26.2 44.8 19.8 52.4 195 204 A V H <> S+ 0 0 1 -3,-1.4 4,-1.6 1,-0.2 -1,-0.3 0.866 88.6 54.7 -38.8 -41.5 46.3 18.6 49.2 196 205 A D H <> S+ 0 0 0 -3,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.892 100.0 57.1 -75.6 -34.4 46.5 22.2 48.1 197 206 A I H S- 0 0 72 -47,-0.1 4,-2.9 -46,-0.1 -1,-0.3 -0.936 90.8 -81.1-165.3 168.7 59.2 9.0 38.9 219 228 A H H > S+ 0 0 52 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.863 125.8 45.3 -45.5 -45.0 56.7 8.5 41.7 220 229 A I H > S+ 0 0 57 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.924 112.7 49.2 -78.8 -39.3 58.9 6.4 43.9 221 230 A D H > S+ 0 0 50 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.967 112.2 50.4 -57.4 -48.6 62.0 8.6 43.6 222 231 A Q H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.939 108.0 52.3 -59.7 -43.6 59.7 11.6 44.4 223 232 A L H X S+ 0 0 0 -4,-2.4 4,-3.2 -5,-0.2 5,-0.2 0.928 107.7 52.2 -55.9 -41.7 58.4 9.8 47.5 224 233 A K H X S+ 0 0 99 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.938 108.3 50.8 -61.1 -45.2 61.9 9.1 48.6 225 234 A L H X S+ 0 0 54 -4,-2.4 4,-1.9 2,-0.2 5,-0.2 0.948 112.4 46.9 -54.2 -49.5 62.7 12.8 48.2 226 235 A I H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.4 0.979 112.5 48.7 -57.6 -53.3 59.7 13.7 50.3 227 236 A L H X S+ 0 0 3 -4,-3.2 4,-2.3 1,-0.3 -1,-0.2 0.874 106.6 56.2 -65.9 -33.4 60.4 11.2 53.0 228 237 A R H < S+ 0 0 147 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.948 115.4 38.8 -58.1 -46.5 64.0 12.3 53.3 229 238 A L H < S+ 0 0 11 -4,-1.9 30,-2.7 -3,-0.2 -2,-0.2 0.974 130.7 25.3 -69.5 -52.5 62.9 15.9 54.0 230 239 A V H < S- 0 0 21 -4,-3.0 28,-0.3 28,-0.2 52,-0.2 0.609 110.5-109.9 -96.6 -3.2 59.8 15.2 56.2 231 240 A G < - 0 0 6 -4,-2.3 -1,-0.1 -5,-0.4 -3,-0.1 0.083 40.9 -69.9 93.5 152.3 60.6 11.8 57.7 232 241 A T - 0 0 23 24,-1.7 26,-0.1 1,-0.1 50,-0.1 -0.326 68.9 -76.6 -75.6 162.3 59.0 8.5 57.0 233 242 A P - 0 0 8 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.211 42.2-143.4 -59.7 137.7 55.4 7.9 58.2 234 243 A G > - 0 0 46 -3,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.435 36.5 -88.0 -88.6-179.6 54.7 7.1 61.8 235 244 A A H > S+ 0 0 75 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.844 120.1 58.1 -59.7 -40.0 52.0 4.7 63.0 236 245 A E H > S+ 0 0 104 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.964 112.7 39.8 -56.9 -53.6 49.1 7.1 63.1 237 246 A L H >> S+ 0 0 8 1,-0.2 3,-0.9 2,-0.2 4,-0.7 0.906 109.9 59.9 -65.0 -40.3 49.4 8.1 59.5 238 247 A L H >< S+ 0 0 22 -4,-2.4 3,-2.1 1,-0.3 -2,-0.2 0.965 101.0 56.4 -52.8 -48.9 50.2 4.5 58.5 239 248 A K H 3< S+ 0 0 164 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.850 105.3 53.1 -49.5 -30.8 46.8 3.5 60.0 240 249 A K H << S+ 0 0 56 -4,-0.9 2,-0.8 -3,-0.9 -1,-0.3 0.567 83.8 90.7 -88.8 -5.1 45.2 6.0 57.7 241 250 A I << - 0 0 0 -3,-2.1 -52,-0.2 -4,-0.7 -53,-0.1 -0.789 63.7-163.4 -86.7 118.3 46.7 4.7 54.5 242 251 A S + 0 0 86 -54,-1.8 2,-0.8 -2,-0.8 -1,-0.2 0.782 59.6 92.0 -79.2 -19.7 44.0 2.3 53.5 243 252 A S > - 0 0 55 -55,-0.8 4,-3.5 1,-0.2 5,-0.2 -0.590 59.2-159.3 -82.3 116.1 46.1 0.3 51.0 244 253 A E H > S+ 0 0 132 -2,-0.8 4,-3.3 2,-0.2 5,-0.2 0.916 94.4 50.1 -52.2 -46.0 47.8 -2.6 52.6 245 254 A S H > S+ 0 0 87 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.974 113.0 46.2 -62.2 -49.1 50.4 -2.8 49.7 246 255 A A H > S+ 0 0 18 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.974 114.0 47.6 -55.6 -53.2 51.1 0.9 50.1 247 256 A R H X S+ 0 0 79 -4,-3.5 4,-2.8 1,-0.2 -1,-0.2 0.955 113.5 50.3 -48.2 -52.0 51.4 0.6 53.8 248 257 A N H X S+ 0 0 97 -4,-3.3 4,-1.0 -5,-0.2 -2,-0.2 0.917 110.3 49.0 -49.3 -51.1 53.6 -2.5 53.2 249 258 A Y H >X S+ 0 0 74 -4,-3.5 3,-1.7 2,-0.2 4,-0.6 0.974 110.2 49.3 -62.4 -50.8 55.8 -0.6 50.8 250 259 A I H >< S+ 0 0 5 -4,-3.2 3,-2.3 1,-0.3 -2,-0.2 0.955 107.4 57.8 -52.0 -46.3 56.2 2.4 53.2 251 260 A Q H 3< S+ 0 0 128 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.764 97.9 60.8 -53.8 -26.1 57.1 -0.2 55.8 252 261 A S H << S+ 0 0 78 -3,-1.7 2,-0.4 -4,-1.0 -1,-0.3 0.673 87.1 91.5 -78.0 -9.9 59.9 -1.4 53.7 253 262 A L S << S- 0 0 35 -3,-2.3 3,-0.1 -4,-0.6 2,-0.1 -0.675 88.4-107.5 -93.6 136.0 61.6 2.0 53.7 254 263 A T - 0 0 125 -2,-0.4 -22,-0.1 1,-0.1 -1,-0.1 -0.285 42.5-106.1 -60.0 129.3 64.2 2.7 56.4 255 264 A Q - 0 0 166 -4,-0.1 -1,-0.1 -24,-0.1 -21,-0.0 -0.346 41.5-175.3 -63.5 135.1 62.8 5.1 58.9 256 265 A M - 0 0 54 -29,-0.1 -24,-1.7 -3,-0.1 2,-0.1 -0.963 19.6-124.0-128.5 144.1 64.3 8.6 58.7 257 266 A P - 0 0 109 0, 0.0 -26,-0.3 0, 0.0 2,-0.0 -0.400 40.1 -82.8 -81.3 163.0 63.6 11.6 61.0 258 267 A K - 0 0 104 -28,-0.3 -28,-0.2 -27,-0.1 -29,-0.1 -0.396 52.0-121.5 -57.0 137.6 62.3 15.0 59.9 259 268 A M - 0 0 83 -30,-2.7 2,-0.8 -31,-0.1 3,-0.1 -0.357 27.5 -97.5 -78.9 167.9 65.2 17.1 58.6 260 269 A N >> - 0 0 89 1,-0.2 4,-1.0 -2,-0.1 3,-0.9 -0.710 32.9-158.4 -83.2 114.3 66.1 20.4 60.2 261 270 A F H 3> S+ 0 0 2 -2,-0.8 4,-3.3 1,-0.3 -1,-0.2 0.847 87.8 62.5 -70.1 -25.0 64.3 22.9 57.9 262 271 A A H 34 S+ 0 0 54 1,-0.2 5,-0.3 2,-0.2 -1,-0.3 0.822 107.2 44.5 -68.3 -27.2 66.6 25.8 58.9 263 272 A N H <4 S+ 0 0 108 -3,-0.9 3,-0.4 3,-0.1 -1,-0.2 0.657 114.9 49.4 -89.9 -12.2 69.5 23.8 57.5 264 273 A V H < S+ 0 0 50 -4,-1.0 2,-1.1 1,-0.2 -2,-0.2 0.873 116.3 39.3 -86.8 -45.0 67.6 22.9 54.4 265 274 A F S >< S- 0 0 11 -4,-3.3 3,-2.3 -5,-0.2 -1,-0.2 -0.433 92.0-162.6-100.4 66.0 66.4 26.4 53.6 266 275 A I T 3 + 0 0 140 -2,-1.1 -3,-0.1 -3,-0.4 3,-0.1 -0.164 68.2 1.4 -58.5 130.2 69.6 28.2 54.6 267 276 A G T 3 S+ 0 0 79 -5,-0.3 -1,-0.3 1,-0.2 -4,-0.1 0.534 92.9 139.4 75.2 2.6 69.3 31.9 55.2 268 277 A A S < S- 0 0 22 -3,-2.3 -1,-0.2 -6,-0.2 -3,-0.1 -0.413 70.1 -85.0 -73.1 162.4 65.6 31.9 54.5 269 278 A N >> - 0 0 50 1,-0.2 4,-2.4 -3,-0.1 3,-1.7 -0.469 38.0-130.2 -61.8 125.4 63.5 34.1 56.8 270 279 A P H 3> S+ 0 0 102 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.817 108.0 59.1 -52.7 -28.8 62.7 32.0 59.9 271 280 A L H 3> S+ 0 0 69 2,-0.2 4,-1.9 1,-0.2 27,-0.2 0.857 107.4 46.6 -69.4 -30.5 59.1 32.9 59.6 272 281 A A H <> S+ 0 0 0 -3,-1.7 4,-3.1 2,-0.2 5,-0.2 0.926 112.1 50.5 -71.5 -47.4 59.1 31.3 56.1 273 282 A V H X S+ 0 0 13 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.962 111.4 48.4 -55.1 -51.4 61.0 28.3 57.4 274 283 A D H X S+ 0 0 51 -4,-3.1 4,-1.1 -5,-0.2 -1,-0.2 0.917 111.7 49.5 -54.1 -44.2 58.4 28.0 60.2 275 284 A L H >X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 3,-1.1 0.962 106.8 55.2 -64.0 -47.0 55.5 28.3 57.7 276 285 A L H 3X S+ 0 0 0 -4,-3.1 4,-3.3 1,-0.3 3,-0.3 0.949 106.2 52.0 -50.1 -48.1 57.1 25.7 55.3 277 286 A E H 3< S+ 0 0 58 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.819 109.5 50.0 -59.0 -27.5 57.2 23.2 58.2 278 287 A K H << S+ 0 0 89 -4,-1.1 10,-1.9 -3,-1.1 3,-0.3 0.805 117.2 39.9 -82.5 -29.4 53.5 23.9 58.9 279 288 A M H < S+ 0 0 0 -4,-2.2 2,-2.1 -3,-0.3 -2,-0.2 0.896 107.7 61.1 -80.8 -46.8 52.5 23.3 55.3 280 289 A L < + 0 0 4 -4,-3.3 2,-0.5 -5,-0.3 -1,-0.2 -0.346 68.6 140.7 -89.5 63.4 54.8 20.4 54.5 281 290 A V - 0 0 37 -2,-2.1 6,-0.1 -3,-0.3 5,-0.1 -0.890 49.7-141.6-104.6 131.9 53.4 17.9 57.0 282 291 A L S S+ 0 0 16 -2,-0.5 2,-0.8 -52,-0.2 -99,-0.2 0.911 89.5 67.5 -59.9 -42.7 53.1 14.3 55.7 283 292 A D S > S- 0 0 11 1,-0.2 3,-2.3 -3,-0.1 4,-0.4 -0.684 76.5-151.9 -80.3 111.2 49.8 13.7 57.5 284 293 A S G > S+ 0 0 6 -2,-0.8 3,-2.0 1,-0.3 -1,-0.2 0.873 90.5 66.4 -54.7 -40.0 47.3 15.9 55.8 285 294 A D G 3 S+ 0 0 108 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.731 103.1 47.3 -50.1 -24.9 45.2 16.1 59.0 286 295 A K G < S+ 0 0 121 -3,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.403 85.7 112.4-107.3 5.5 47.9 18.0 60.6 287 296 A R S < S- 0 0 10 -3,-2.0 -8,-0.2 -4,-0.4 2,-0.1 -0.347 74.9-103.2 -71.2 156.8 48.7 20.6 57.9 288 297 A I - 0 0 23 -10,-1.9 2,-0.2 -13,-0.2 -1,-0.1 -0.455 36.6-126.8 -69.8 149.7 48.0 24.2 58.4 289 298 A T > - 0 0 42 -2,-0.1 4,-3.3 1,-0.1 5,-0.2 -0.670 20.2-111.7 -95.8 163.1 44.9 25.5 56.6 290 299 A A H > S+ 0 0 2 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.937 119.7 51.6 -56.8 -49.1 44.9 28.5 54.2 291 300 A A H > S+ 0 0 47 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.946 114.0 42.3 -52.6 -53.1 42.8 30.4 56.7 292 301 A Q H >4 S+ 0 0 108 1,-0.2 3,-1.1 2,-0.2 4,-0.3 0.919 111.9 55.2 -61.7 -38.4 45.2 29.7 59.5 293 302 A A H >< S+ 0 0 0 -4,-3.3 3,-2.7 1,-0.3 -2,-0.2 0.928 98.8 61.7 -64.4 -38.4 48.2 30.3 57.4 294 303 A L H 3< S+ 0 0 1 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.769 102.1 53.1 -57.2 -23.5 47.0 33.7 56.5 295 304 A A T << S+ 0 0 65 -3,-1.1 2,-0.3 -4,-0.7 -1,-0.3 0.456 82.8 118.0 -89.5 -0.0 47.2 34.6 60.1 296 305 A H S X S- 0 0 24 -3,-2.7 3,-3.2 -4,-0.3 7,-0.1 -0.512 76.4-120.7 -71.5 126.6 50.9 33.4 60.3 297 306 A A G > S+ 0 0 59 -2,-0.3 3,-2.5 1,-0.3 4,-0.3 0.750 105.6 79.6 -29.9 -35.9 53.3 36.2 61.3 298 307 A Y G 3 S+ 0 0 3 1,-0.3 -1,-0.3 -27,-0.2 3,-0.2 0.768 98.9 41.7 -53.5 -19.9 55.1 35.7 58.0 299 308 A F G X> S+ 0 0 0 -3,-3.2 4,-2.8 -6,-0.2 3,-2.6 0.121 73.9 124.6-114.8 23.0 52.3 37.7 56.4 300 309 A A T <4 S+ 0 0 64 -3,-2.5 -1,-0.1 1,-0.3 -2,-0.1 0.912 73.2 56.6 -49.1 -43.5 51.9 40.5 59.0 301 310 A Q T 34 S+ 0 0 155 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.639 121.6 25.5 -65.7 -7.7 52.5 43.1 56.4 302 311 A Y T <4 S+ 0 0 69 -3,-2.6 2,-0.5 -8,-0.1 -2,-0.2 0.605 88.0 115.9-126.4 -22.1 49.6 41.8 54.2 303 312 A H < + 0 0 60 -4,-2.8 3,-0.1 -7,-0.1 5,-0.1 -0.287 28.3 164.4 -62.0 108.5 47.2 40.1 56.6 304 313 A D > - 0 0 72 -2,-0.5 3,-3.1 3,-0.2 -1,-0.1 -0.808 22.6-163.0-123.1 101.6 43.8 41.7 56.8 305 314 A P T 3 S+ 0 0 81 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.688 93.2 52.6 -55.2 -16.3 41.0 39.5 58.4 306 315 A D T 3 S+ 0 0 147 1,-0.2 -3,-0.0 -3,-0.1 -2,-0.0 0.351 108.2 50.1-102.7 5.2 38.4 41.8 56.9 307 316 A D S < S+ 0 0 74 -3,-3.1 -1,-0.2 1,-0.1 -3,-0.2 -0.144 88.5 85.2-127.9 45.6 39.7 41.6 53.4 308 317 A E - 0 0 8 -3,-0.4 -1,-0.1 -5,-0.1 -14,-0.0 -0.566 68.7-167.6-137.5 72.8 40.0 37.9 53.1 309 318 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 -3,-0.0 -0.131 14.0-138.2 -74.8 157.8 36.6 36.8 52.0 310 319 A V - 0 0 90 -172,-0.1 -175,-0.2 1,-0.1 2,-0.1 -0.662 27.7-104.7-106.6 166.2 34.9 33.4 51.8 311 320 A A - 0 0 17 -176,-0.6 3,-0.1 -177,-0.3 -1,-0.1 -0.430 24.0-104.8 -92.8 160.2 32.7 32.1 49.0 312 321 A D - 0 0 122 -240,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.523 63.2 -76.4 -66.9 148.9 29.1 31.5 48.5 313 322 A P - 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.134 40.5-148.2 -48.4 137.7 28.2 27.8 48.7 314 323 A Y - 0 0 18 -175,-0.3 2,-0.9 -3,-0.1 -245,-0.0 -0.958 7.5-152.5-114.1 116.9 29.1 25.7 45.7 315 324 A D + 0 0 101 -2,-0.6 3,-0.3 1,-0.1 -176,-0.0 -0.773 21.3 170.9 -86.8 107.2 26.6 22.9 45.3 316 325 A Q > + 0 0 67 -2,-0.9 3,-2.1 1,-0.2 4,-0.4 0.018 33.7 125.0-106.5 35.2 28.4 20.1 43.5 317 326 A S G > + 0 0 57 1,-0.3 3,-2.0 2,-0.2 -1,-0.2 0.867 63.0 73.6 -58.8 -30.0 25.8 17.4 43.9 318 327 A F G > S+ 0 0 0 -3,-0.3 3,-2.7 1,-0.3 -1,-0.3 0.845 80.1 72.3 -53.9 -28.2 25.9 17.0 40.1 319 328 A E G < S+ 0 0 62 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.836 98.5 48.5 -59.2 -25.8 29.2 15.2 40.6 320 329 A S G < S+ 0 0 106 -3,-2.0 2,-0.5 -4,-0.4 -1,-0.3 0.263 96.1 103.3 -90.3 14.0 27.3 12.3 42.0 321 330 A R < - 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