==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-JUN-04 1TVO . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.KINOSHITA . 350 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17445.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 59.7 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 . 42 12.0 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 . 2 0.6 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 . 21 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 26.9 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 1 3 0 0 1 0 2 1 0 0 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 . 2 2 2 0 0 2 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 8 A G 0 0 140 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 69.1 -12.3 -12.0 39.6 2 9 A A - 0 0 110 3,-0.0 3,-0.0 0, 0.0 0, 0.0 -0.822 360.0-105.5-165.8-156.9 -9.9 -12.5 36.7 3 10 A G - 0 0 49 -2,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.982 24.5-109.9-152.9 163.4 -6.4 -13.6 35.7 4 11 A P - 0 0 93 0, 0.0 10,-0.4 0, 0.0 8,-0.2 0.777 60.4-137.5 -61.7 -31.7 -2.8 -12.5 34.6 5 12 A E - 0 0 82 6,-0.1 7,-2.2 8,-0.1 2,-0.3 0.610 15.3-146.2 76.5 131.6 -3.4 -14.1 31.2 6 13 A M B -A 11 0A 115 5,-0.2 5,-0.2 1,-0.2 -1,-0.1 -0.945 3.6-160.0-126.9 147.5 -0.9 -16.1 29.1 7 14 A V - 0 0 22 3,-1.9 -1,-0.2 -2,-0.3 4,-0.1 0.699 55.9 -66.9 -91.0-103.5 -0.5 -16.2 25.3 8 15 A R S S+ 0 0 168 2,-0.2 3,-0.1 3,-0.1 -2,-0.0 0.673 125.6 32.0-116.7 -68.4 1.2 -19.3 23.9 9 16 A G S S- 0 0 49 1,-0.1 2,-0.3 -3,-0.0 -3,-0.0 0.957 124.8 -33.5 -58.1 -57.8 4.8 -19.3 25.0 10 17 A Q S S- 0 0 117 1,-0.1 -3,-1.9 -5,-0.0 -2,-0.2 -0.873 76.6 -48.5-154.1-173.4 4.4 -17.6 28.4 11 18 A V B -A 6 0A 52 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.199 32.3-153.7 -66.4 154.3 2.7 -15.1 30.7 12 19 A F - 0 0 1 -7,-2.2 2,-1.4 -8,-0.2 9,-0.1 -0.890 5.4-165.5-132.4 98.2 2.0 -11.4 29.9 13 20 A D + 0 0 96 -2,-0.4 -8,-0.1 1,-0.2 82,-0.1 -0.613 45.7 119.3 -88.6 82.5 1.7 -9.2 33.0 14 21 A V > + 0 0 4 -2,-1.4 4,-1.6 -10,-0.4 -1,-0.2 -0.108 47.9 175.0-137.1 38.9 0.1 -6.0 31.7 15 22 A G T 4 + 0 0 60 1,-0.2 4,-0.1 2,-0.2 -2,-0.0 -0.633 43.1 6.4 -99.8 161.5 -3.1 -5.7 33.6 16 23 A P T 4 S+ 0 0 119 0, 0.0 -1,-0.2 0, 0.0 22,-0.2 -0.985 118.9 53.9 -96.2 -8.3 -5.4 -4.1 34.1 17 24 A R T 4 S+ 0 0 77 20,-0.1 21,-2.5 21,-0.0 2,-0.4 0.838 114.6 38.2 -46.1 -45.6 -4.9 -1.3 31.5 18 25 A Y E < S+B 37 0B 6 -4,-1.6 19,-0.2 19,-0.2 2,-0.2 -0.888 71.7 153.5-115.2 144.7 -4.6 -3.8 28.6 19 26 A T E +B 36 0B 45 17,-1.5 17,-2.0 -2,-0.4 -2,-0.0 -0.603 38.3 66.1-143.1-158.3 -6.6 -7.0 28.1 20 27 A N E - 0 0 104 15,-0.2 2,-0.2 -2,-0.2 -1,-0.2 0.849 69.3-158.2 31.6 69.6 -7.9 -9.5 25.5 21 28 A L E - 0 0 32 14,-0.1 2,-0.4 -3,-0.1 14,-0.2 -0.481 15.8-175.2 -78.9 142.6 -4.5 -10.7 24.3 22 29 A S E -B 34 0B 54 12,-1.0 12,-2.4 -2,-0.2 2,-0.1 -0.997 29.1-113.3-139.0 130.7 -3.9 -12.4 21.0 23 30 A Y E +B 33 0B 79 -2,-0.4 10,-0.2 10,-0.2 3,-0.1 -0.395 39.6 161.9 -65.3 134.0 -0.6 -13.9 19.7 24 31 A I E - 0 0 80 8,-2.2 2,-0.3 1,-0.4 9,-0.2 0.715 54.9 -39.2-116.1 -58.7 1.0 -12.1 16.8 25 32 A G E -B 32 0B 21 7,-1.7 7,-1.6 2,-0.0 -1,-0.4 -0.890 36.6-159.9-157.3-173.3 4.6 -13.1 16.6 26 33 A E E +B 31 0B 118 -2,-0.3 5,-0.2 5,-0.3 2,-0.1 -0.603 11.3 169.9 178.7 115.4 7.9 -13.9 18.3 27 34 A G - 0 0 60 3,-1.1 2,-2.3 -2,-0.2 4,-0.1 -0.473 66.3 -77.7-137.3 67.8 11.4 -13.9 16.9 28 35 A A S S+ 0 0 87 1,-0.1 2,-1.8 -2,-0.1 3,-0.1 -0.413 123.3 70.1 78.3 -66.1 14.0 -14.3 19.6 29 36 A Y S S- 0 0 98 -2,-2.3 -1,-0.1 1,-0.1 2,-0.0 -0.422 115.1 -51.7 -85.1 63.3 13.9 -10.7 20.8 30 37 A G - 0 0 10 -2,-1.8 -3,-1.1 20,-0.1 2,-0.5 -0.035 58.2 -83.3 98.3 163.5 10.4 -10.9 22.4 31 38 A M E -BC 26 48B 11 17,-1.6 17,-2.4 -5,-0.2 2,-0.4 -0.932 34.3-149.8-111.7 129.0 6.9 -11.9 21.8 32 39 A V E +BC 25 47B 48 -7,-1.6 -8,-2.2 -2,-0.5 -7,-1.7 -0.824 22.4 170.3-100.7 135.5 4.4 -9.5 20.1 33 40 A C E -BC 23 46B 0 13,-2.3 13,-2.3 -2,-0.4 2,-0.5 -0.879 32.5-119.2-136.9 170.0 0.7 -9.6 21.0 34 41 A S E +BC 22 45B 13 -12,-2.4 -12,-1.0 -2,-0.3 2,-0.2 -0.958 36.4 174.2-115.5 119.2 -2.4 -7.6 20.4 35 42 A A E - C 0 44B 0 9,-1.9 9,-2.5 -2,-0.5 2,-0.6 -0.715 33.7-109.5-119.5 170.2 -4.2 -6.3 23.4 36 43 A Y E -BC 19 43B 79 -17,-2.0 -17,-1.5 -2,-0.2 2,-1.1 -0.899 27.0-141.4-103.2 120.6 -7.2 -4.0 24.1 37 44 A D E > -BC 18 42B 8 5,-2.0 5,-0.9 -2,-0.6 -19,-0.2 -0.679 15.5-160.5 -85.9 99.3 -6.3 -0.6 25.5 38 45 A N T 5S+ 0 0 56 -21,-2.5 2,-1.8 -2,-1.1 4,-0.1 -0.130 76.3 30.9 -64.4 175.4 -8.9 0.4 28.1 39 46 A V T 5S+ 0 0 91 1,-0.1 2,-1.7 2,-0.1 -1,-0.1 -0.559 125.9 45.0 71.8 -90.9 -9.0 4.1 28.9 40 47 A N T 5S- 0 0 102 -2,-1.8 2,-1.2 2,-0.1 -3,-0.2 -0.667 100.0-140.6 -83.6 88.6 -7.9 5.1 25.3 41 48 A K T 5 + 0 0 128 -2,-1.7 2,-0.3 -5,-0.1 -3,-0.2 -0.335 58.9 104.5 -58.3 90.5 -10.3 2.6 23.7 42 49 A V E + 0 0 0 0, 0.0 3,-1.3 0, 0.0 7,-0.3 0.630 40.5 92.8 -85.1 -18.9 16.8 -8.8 27.9 52 59 A F T 3 S+ 0 0 10 40,-0.5 285,-0.1 1,-0.3 41,-0.1 0.710 79.1 61.6 -55.1 -23.9 18.6 -8.6 31.2 53 60 A E T 3 S+ 0 0 161 -3,-0.4 2,-0.3 39,-0.2 -1,-0.3 0.860 105.0 51.7 -70.2 -35.2 20.3 -12.0 30.9 54 61 A H <> - 0 0 116 -3,-1.3 4,-0.9 -4,-0.2 -1,-0.0 -0.820 67.2-147.6-110.1 144.3 22.1 -11.0 27.7 55 62 A Q H >> S+ 0 0 60 -2,-0.3 4,-1.1 2,-0.2 3,-0.7 0.955 101.6 48.9 -67.3 -52.8 24.4 -8.1 27.0 56 63 A T H >> S+ 0 0 77 1,-0.3 4,-1.9 2,-0.2 3,-1.0 0.920 107.6 54.6 -52.5 -51.5 23.4 -7.8 23.3 57 64 A Y H 3> S+ 0 0 20 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.800 105.3 55.8 -54.6 -32.5 19.7 -7.9 24.1 58 65 A C H - 0 0 22 3,-0.4 3,-1.7 -2,-0.3 56,-0.1 -0.978 58.9-127.3-157.8 141.7 7.1 11.8 13.6 74 81 A E T 3 S+ 0 0 128 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.748 111.6 46.9 -60.3 -27.4 4.1 10.5 11.7 75 82 A N T 3 S+ 0 0 9 82,-0.1 83,-2.8 2,-0.1 2,-0.4 0.207 103.0 72.6-102.1 15.5 6.1 8.0 9.8 76 83 A I B < S-f 158 0C 6 -3,-1.7 -3,-0.4 81,-0.3 83,-0.2 -0.996 87.8-116.4-127.4 130.9 7.9 6.6 12.9 77 84 A I - 0 0 2 81,-2.7 2,-0.2 -2,-0.4 -6,-0.1 -0.426 31.5-147.0 -69.3 142.0 6.1 4.4 15.4 78 85 A G - 0 0 30 -2,-0.1 2,-0.6 -4,-0.1 21,-0.4 -0.667 13.1-116.4-106.3 163.7 5.8 6.0 18.8 79 86 A I - 0 0 18 -11,-0.4 19,-0.2 -2,-0.2 3,-0.1 -0.894 24.9-177.6-102.4 119.5 5.8 4.4 22.2 80 87 A N - 0 0 64 17,-2.1 2,-0.3 -2,-0.6 -1,-0.2 0.882 66.2 -9.8 -80.3 -41.0 2.5 4.9 24.1 81 88 A D E -E 97 0B 23 16,-0.7 16,-2.6 2,-0.0 2,-0.3 -0.954 51.9-148.2-153.6 166.0 3.5 3.2 27.3 82 89 A I E -E 96 0B 1 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.902 14.4-159.3-147.8 116.8 6.1 1.0 29.0 83 90 A I E +E 95 0B 39 12,-2.4 12,-2.5 -2,-0.3 2,-0.3 -0.785 28.8 128.6-100.5 135.2 5.3 -1.6 31.7 84 91 A R - 0 0 20 -2,-0.4 10,-0.1 10,-0.2 7,-0.1 -0.968 56.9 -63.7-171.1 166.5 7.8 -3.0 34.2 85 92 A A - 0 0 21 8,-0.4 6,-0.1 -2,-0.3 5,-0.0 -0.218 46.8-112.9 -60.9 150.6 8.5 -3.6 37.9 86 93 A P S S+ 0 0 88 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.634 96.7 36.2 -56.8 -20.9 8.8 -0.6 40.4 87 94 A T S > S- 0 0 40 1,-0.1 4,-0.7 0, 0.0 -2,-0.1 -0.877 80.3-117.3-134.2 166.2 12.5 -1.4 41.0 88 95 A I T >4 S+ 0 0 49 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.930 115.6 56.0 -65.5 -45.2 15.6 -2.6 39.2 89 96 A E T 34 S+ 0 0 154 1,-0.3 -1,-0.2 -3,-0.1 -4,-0.0 0.827 112.1 40.4 -56.2 -38.2 15.7 -5.6 41.5 90 97 A Q T 34 S+ 0 0 129 2,-0.0 2,-0.7 -6,-0.0 -1,-0.3 0.500 92.3 103.3 -91.2 -4.6 12.1 -6.7 40.6 91 98 A M << + 0 0 0 -3,-0.9 3,-0.1 -4,-0.7 250,-0.1 -0.713 26.3 138.7 -86.2 113.7 12.4 -5.9 36.9 92 99 A K + 0 0 157 -2,-0.7 -40,-0.5 1,-0.4 2,-0.4 0.642 68.9 30.8-118.2 -38.8 12.9 -9.0 34.7 93 100 A D - 0 0 42 -43,-0.1 -1,-0.4 -42,-0.1 -8,-0.4 -0.972 64.4-154.8-128.9 143.8 10.7 -8.3 31.7 94 101 A V E -D 49 0B 0 -45,-3.0 -45,-2.6 -2,-0.4 2,-0.5 -0.899 5.0-154.9-114.8 143.1 9.7 -5.0 30.0 95 102 A Y E -DE 48 83B 2 -12,-2.5 -12,-2.4 -2,-0.4 2,-0.4 -0.980 7.2-163.5-121.1 124.3 6.6 -4.4 28.0 96 103 A I E -DE 47 82B 4 -49,-1.7 -49,-1.9 -2,-0.5 2,-0.4 -0.877 7.7-152.4-107.4 138.7 6.5 -1.7 25.3 97 104 A V E +DE 46 81B 0 -16,-2.6 -17,-2.1 -2,-0.4 -16,-0.7 -0.903 18.5 166.1-115.8 140.8 3.3 -0.5 23.9 98 105 A Q E -D 45 0B 33 -53,-2.5 -53,-2.7 -2,-0.4 -19,-0.1 -0.948 47.0 -82.2-142.3 160.2 2.5 1.0 20.4 99 106 A D E -D 44 0B 67 -21,-0.4 2,-0.4 -2,-0.3 -55,-0.2 -0.301 59.9 -98.7 -58.7 151.1 -0.6 1.8 18.4 100 107 A L - 0 0 52 -57,-1.2 2,-0.5 -56,-0.1 -1,-0.1 -0.620 38.3-171.0 -79.2 131.1 -1.8 -1.3 16.7 101 108 A M - 0 0 20 -2,-0.4 50,-0.2 1,-0.1 49,-0.1 -0.989 20.1-140.2-121.8 116.8 -0.8 -1.6 13.0 102 109 A E S S- 0 0 137 -2,-0.5 2,-0.2 47,-0.1 49,-0.2 0.815 71.5 -13.1 -47.1 -44.3 -2.5 -4.5 11.2 103 110 A T E -G 150 0C 23 47,-2.3 47,-3.3 -3,-0.1 2,-0.3 -0.723 58.4-127.6-144.9-169.1 0.5 -5.6 9.1 104 111 A D E > -G 149 0C 27 45,-0.3 4,-2.2 -2,-0.2 45,-0.2 -0.901 38.2 -97.3-142.2 168.7 4.0 -4.8 7.9 105 112 A L H > S+ 0 0 0 43,-1.9 4,-2.1 40,-0.9 41,-0.3 0.873 119.7 54.9 -58.7 -41.8 5.7 -4.7 4.5 106 113 A Y H > S+ 0 0 119 39,-1.3 4,-0.5 1,-0.2 -1,-0.2 0.944 111.9 42.5 -58.0 -50.8 7.2 -8.2 4.8 107 114 A K H >4 S+ 0 0 83 1,-0.2 3,-0.6 38,-0.2 4,-0.4 0.869 114.7 52.1 -63.8 -38.0 3.9 -9.8 5.5 108 115 A L H >X S+ 0 0 39 -4,-2.2 4,-1.8 1,-0.2 3,-0.6 0.801 104.1 54.9 -70.6 -31.4 2.1 -7.8 2.8 109 116 A L H 3< S+ 0 0 13 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.586 92.1 74.5 -79.5 -9.0 4.6 -8.6 0.0 110 117 A K T << S- 0 0 131 -3,-0.6 -1,-0.2 -4,-0.5 -2,-0.2 0.802 122.7 -1.2 -71.6 -29.0 4.0 -12.4 0.6 111 118 A T T <4 S+ 0 0 111 -3,-0.6 2,-0.2 -4,-0.4 -2,-0.2 0.656 114.4 78.2-131.0 -37.2 0.6 -12.3 -1.0 112 119 A Q < - 0 0 109 -4,-1.8 2,-0.7 -5,-0.2 -1,-0.1 -0.556 62.3-143.5 -84.7 146.3 -0.3 -8.8 -2.2 113 120 A H - 0 0 142 -2,-0.2 2,-0.1 -3,-0.1 -4,-0.1 -0.933 23.0-137.5-107.5 108.7 1.0 -7.2 -5.4 114 121 A L - 0 0 12 -2,-0.7 2,-0.2 100,-0.3 103,-0.0 -0.416 12.9-136.7 -69.3 141.2 1.5 -3.5 -4.8 115 122 A S > - 0 0 53 -2,-0.1 4,-2.0 1,-0.1 5,-0.2 -0.506 28.8-102.1 -90.6 165.4 0.4 -1.2 -7.5 116 123 A N H > S+ 0 0 69 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.874 122.0 57.7 -54.5 -42.3 2.5 1.8 -8.6 117 124 A D H > S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.950 111.9 40.7 -51.4 -55.2 0.2 4.2 -6.7 118 125 A H H > S+ 0 0 83 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.747 114.3 52.8 -66.9 -29.6 0.9 2.3 -3.4 119 126 A I H X S+ 0 0 9 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.969 110.5 46.5 -69.8 -54.2 4.6 1.8 -4.2 120 127 A C H X S+ 0 0 3 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.868 115.1 47.9 -53.1 -43.2 5.2 5.5 -4.8 121 128 A Y H X S+ 0 0 57 -4,-1.9 4,-2.4 -5,-0.3 -1,-0.2 0.923 112.2 47.4 -67.3 -45.9 3.2 6.4 -1.6 122 129 A F H X S+ 0 0 4 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.851 111.4 51.5 -66.1 -35.0 5.0 3.9 0.6 123 130 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.922 109.1 51.4 -67.0 -43.9 8.4 5.0 -0.7 124 131 A Y H X S+ 0 0 15 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.951 110.6 46.8 -57.1 -52.7 7.5 8.6 0.0 125 132 A Q H X S+ 0 0 6 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.855 110.4 54.2 -59.0 -36.8 6.5 7.8 3.6 126 133 A I H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.951 113.3 42.0 -60.5 -50.3 9.7 5.7 4.1 127 134 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.789 108.8 58.4 -67.8 -32.9 11.8 8.7 3.0 128 135 A R H X S+ 0 0 17 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.945 112.6 40.5 -63.7 -45.6 9.8 11.3 5.0 129 136 A G H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.879 112.9 54.3 -69.1 -39.0 10.6 9.4 8.1 130 137 A L H X S+ 0 0 1 -4,-2.2 4,-3.2 1,-0.2 5,-0.3 0.906 103.6 56.6 -62.8 -39.8 14.2 8.7 7.1 131 138 A K H X S+ 0 0 25 -4,-2.5 4,-2.1 1,-0.2 187,-0.2 0.911 108.1 48.8 -56.8 -42.2 14.7 12.4 6.6 132 139 A Y H X S+ 0 0 19 -4,-1.3 4,-0.5 2,-0.2 186,-0.5 0.929 113.8 44.4 -64.4 -45.0 13.6 12.9 10.2 133 140 A I H ><>S+ 0 0 1 -4,-2.2 5,-2.0 1,-0.2 3,-1.0 0.914 115.0 47.2 -67.7 -42.3 15.9 10.3 11.6 134 141 A H H ><5S+ 0 0 4 -4,-3.2 3,-2.1 1,-0.2 -1,-0.2 0.878 105.1 60.8 -65.8 -35.9 18.9 11.3 9.6 135 142 A S H 3<5S+ 0 0 45 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.671 101.0 54.9 -64.8 -15.8 18.2 14.9 10.6 136 143 A A T <<5S- 0 0 0 -3,-1.0 186,-2.7 -4,-0.5 -1,-0.3 0.130 122.6-109.3-101.3 19.2 18.7 13.9 14.2 137 144 A N T < 5S+ 0 0 62 -3,-2.1 30,-3.2 1,-0.2 2,-0.3 0.732 77.5 134.4 59.3 26.4 22.1 12.4 13.2 138 145 A V E < -I 166 0D 0 -5,-2.0 2,-0.4 28,-0.2 -1,-0.2 -0.808 43.9-156.4-108.3 148.1 20.8 8.9 13.7 139 146 A L E -I 165 0D 0 26,-2.6 26,-2.0 -2,-0.3 61,-0.0 -0.995 5.6-160.1-122.8 124.1 21.2 5.9 11.4 140 147 A H - 0 0 0 -2,-0.4 23,-0.3 24,-0.2 -1,-0.1 0.904 18.1-173.0 -68.6 -45.6 18.6 3.1 11.6 141 148 A R + 0 0 19 1,-0.1 -1,-0.1 59,-0.1 41,-0.1 0.492 67.4 61.6 64.3 6.3 21.0 0.6 9.9 142 149 A D + 0 0 9 40,-0.1 2,-0.4 18,-0.1 -1,-0.1 0.033 60.6 156.8-151.2 37.1 18.5 -2.2 9.6 143 150 A L + 0 0 1 43,-0.1 67,-0.1 3,-0.1 -2,-0.0 -0.522 19.5 142.3 -67.5 122.0 15.7 -0.9 7.4 144 151 A K > - 0 0 39 -2,-0.4 3,-2.2 66,-0.0 4,-0.3 -0.951 64.9 -87.1-154.2 166.2 13.9 -3.9 5.8 145 152 A P G > S+ 0 0 2 0, 0.0 -39,-1.3 0, 0.0 3,-1.2 0.820 124.6 52.7 -48.6 -40.1 10.3 -4.9 4.9 146 153 A S G 3 S+ 0 0 48 -41,-0.3 -3,-0.1 1,-0.2 -39,-0.0 0.609 102.1 62.2 -75.9 -7.5 9.5 -6.4 8.3 147 154 A N G < S+ 0 0 9 -3,-2.2 12,-1.9 1,-0.1 2,-0.7 0.456 87.8 82.2 -92.8 -3.3 10.7 -3.1 9.9 148 155 A L E < S- H 0 158C 0 -3,-1.2 -43,-1.9 -4,-0.3 10,-0.2 -0.899 70.1-152.9-107.8 108.9 8.0 -1.0 8.2 149 156 A L E -GH 104 157C 25 8,-3.0 8,-2.1 -2,-0.7 2,-0.4 -0.535 9.2-158.3 -80.4 146.9 4.5 -1.1 9.9 150 157 A L E -GH 103 156C 4 -47,-3.3 -47,-2.3 6,-0.2 6,-0.2 -0.982 8.5-152.9-135.3 128.5 1.3 -0.6 7.9 151 158 A N > - 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0 0 55 2,-0.1 3,-1.0 -3,-0.0 30,-0.1 0.990 9.4-177.0 77.2 69.7 29.9 9.4 13.0 169 176 A P G > S+ 0 0 83 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.812 74.0 71.5 -63.8 -36.9 31.5 9.5 9.4 170 177 A D G 3 S+ 0 0 141 1,-0.3 3,-0.2 2,-0.1 -2,-0.1 0.680 102.2 42.4 -56.3 -23.4 35.0 9.8 10.7 171 178 A H G < S+ 0 0 107 -3,-1.0 -1,-0.3 27,-0.2 25,-0.0 -0.130 80.2 106.1-120.0 39.2 35.1 6.3 12.0 172 179 A D < + 0 0 24 -3,-1.5 24,-1.8 26,-0.1 25,-0.3 0.709 52.2 98.4 -89.7 -21.6 33.5 4.4 9.1 173 180 A H B +J 195 0E 82 -4,-0.2 2,-0.3 22,-0.2 22,-0.2 -0.461 43.7 154.6 -74.9 136.9 36.6 2.7 7.6 174 181 A T - 0 0 30 20,-0.9 76,-0.2 -2,-0.2 3,-0.1 -0.895 42.8 -74.3-146.7 174.7 37.4 -0.9 8.5 175 182 A G > - 0 0 38 -2,-0.3 3,-1.0 1,-0.1 2,-0.2 -0.171 59.5 -78.0 -72.6 169.1 39.2 -3.9 7.0 176 183 A F T 3 S+ 0 0 33 1,-0.2 17,-0.2 18,-0.1 -1,-0.1 -0.461 114.3 13.4 -69.3 133.6 38.1 -6.1 4.2 177 184 A L T 3 S+ 0 0 67 15,-1.8 2,-0.3 1,-0.2 -1,-0.2 0.790 83.5 175.9 70.3 33.0 35.5 -8.7 5.1 178 185 A T < - 0 0 42 -3,-1.0 -1,-0.2 13,-0.3 17,-0.1 -0.536 36.1-103.2 -73.1 129.1 34.6 -7.2 8.5 179 186 A E - 0 0 160 -2,-0.3 2,-0.3 1,-0.0 -1,-0.1 -0.015 41.0-171.2 -48.8 150.4 31.8 -8.9 10.4 180 187 A Y - 0 0 39 1,-0.1 4,-0.1 -3,-0.1 46,-0.0 -0.994 21.6-161.6-148.0 149.4 28.4 -7.3 10.4 181 188 A V + 0 0 89 -2,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.766 57.6 99.0-103.9 -31.6 25.1 -7.9 12.2 182 189 A A S S- 0 0 5 1,-0.2 -40,-0.1 -19,-0.1 5,-0.1 -0.132 94.5 -63.9 -57.2 156.0 22.3 -6.1 10.2 183 190 A T > - 0 0 16 1,-0.1 3,-1.4 3,-0.1 -1,-0.2 -0.169 46.9-137.1 -49.0 121.3 20.2 -8.1 7.8 184 191 A R G > S+ 0 0 108 1,-0.3 3,-2.1 2,-0.2 -1,-0.1 0.862 95.7 56.7 -44.3 -60.3 22.3 -9.5 5.0 185 192 A W G 3 S+ 0 0 83 1,-0.3 36,-0.3 38,-0.2 -1,-0.3 0.681 110.6 46.9 -55.0 -19.2 20.0 -8.9 2.0 186 193 A Y G < S+ 0 0 11 -3,-1.4 2,-0.3 34,-0.1 -1,-0.3 0.292 82.3 115.4-109.1 12.7 19.9 -5.2 2.8 187 194 A R < - 0 0 20 -3,-2.1 16,-0.1 -4,-0.2 5,-0.0 -0.648 65.1-122.6 -84.2 135.8 23.6 -4.4 3.4 188 195 A A >> - 0 0 0 -2,-0.3 3,-1.2 14,-0.1 4,-0.5 -0.283 27.3-106.5 -70.5 160.8 25.3 -2.1 0.9 189 196 A P H >> S+ 0 0 0 0, 0.0 3,-0.8 0, 0.0 4,-0.6 0.819 115.4 62.3 -58.2 -35.0 28.4 -3.3 -1.0 190 197 A E H 3>>S+ 0 0 5 99,-0.3 4,-2.0 1,-0.2 5,-1.5 0.719 87.6 72.7 -66.8 -21.6 30.9 -1.2 1.1 191 198 A I H <45S+ 0 0 1 -3,-1.2 -13,-0.3 1,-0.2 4,-0.3 0.908 104.8 38.5 -58.3 -41.9 29.9 -3.1 4.3 192 199 A M H <<5S+ 0 0 0 -3,-0.8 -15,-1.8 -4,-0.5 -1,-0.2 0.592 123.5 44.8 -83.1 -12.5 31.8 -6.2 2.9 193 200 A L H <5S- 0 0 1 -4,-0.6 -2,-0.2 -3,-0.2 60,-0.2 0.919 133.6 -34.5 -97.2 -61.3 34.6 -4.0 1.5 194 201 A N T <5S+ 0 0 7 -4,-2.0 -20,-0.9 -18,-0.1 2,-0.3 0.075 99.6 98.6-158.7 34.6 35.7 -1.3 3.9 195 202 A S B < -J 173 0E 2 -5,-1.5 -22,-0.2 -4,-0.3 -17,-0.1 -0.961 45.5-163.8-136.7 150.5 32.9 0.1 5.9 196 203 A K - 0 0 64 -24,-1.8 -23,-0.1 -2,-0.3 -1,-0.1 0.444 57.3-107.5-102.9 -5.3 31.3 -0.3 9.4 197 204 A G S S+ 0 0 0 -25,-0.3 -25,-0.1 -28,-0.1 -24,-0.1 0.825 73.6 138.2 81.9 35.7 28.0 1.4 8.4 198 205 A Y + 0 0 18 -29,-0.1 2,-0.3 -26,-0.1 -27,-0.2 0.106 51.0 75.6 -99.7 22.0 28.6 4.7 10.3 199 206 A T S > S- 0 0 28 -27,-0.1 3,-1.9 -30,-0.1 4,-0.3 -0.960 85.1-115.2-133.6 153.8 27.2 7.0 7.6 200 207 A K T >> S+ 0 0 82 -2,-0.3 3,-1.6 1,-0.3 4,-1.2 0.776 104.6 77.0 -54.8 -31.4 23.8 7.9 6.3 201 208 A S H 3> S+ 0 0 19 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.699 84.2 67.0 -53.5 -22.2 24.5 6.3 2.8 202 209 A I H <> S+ 0 0 7 -3,-1.9 4,-1.3 2,-0.2 -1,-0.3 0.810 98.7 48.1 -71.2 -32.0 23.9 2.9 4.4 203 210 A D H <> S+ 0 0 0 -3,-1.6 4,-2.3 -4,-0.3 -1,-0.2 0.865 107.3 56.7 -75.7 -35.5 20.2 3.5 5.0 204 211 A I H X S+ 0 0 2 -4,-1.2 4,-2.3 1,-0.2 -2,-0.2 0.900 104.2 52.6 -61.6 -42.9 19.7 4.7 1.5 205 212 A W H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.943 109.8 49.0 -59.3 -45.6 21.1 1.5 0.1 206 213 A S H X S+ 0 0 5 -4,-1.3 4,-1.5 1,-0.2 -1,-0.2 0.877 109.0 53.3 -60.3 -40.3 18.6 -0.5 2.2 207 214 A V H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.901 106.5 51.5 -63.5 -41.6 15.8 1.7 1.1 208 215 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 78,-0.3 3,-0.5 0.906 107.4 53.3 -61.1 -41.2 16.6 1.1 -2.6 209 216 A C H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 11,-0.4 0.839 108.9 50.3 -61.7 -31.8 16.6 -2.6 -1.9 210 217 A I H X S+ 0 0 0 -4,-1.5 4,-1.1 2,-0.2 -1,-0.2 0.717 108.0 53.3 -77.3 -23.2 13.1 -2.1 -0.4 211 218 A L H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.5 -2,-0.2 0.946 110.8 45.3 -73.6 -52.9 12.0 -0.2 -3.5 212 219 A A H X S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.914 112.5 51.7 -55.1 -48.4 13.1 -3.1 -5.8 213 220 A E H X>S+ 0 0 9 -4,-1.9 4,-1.2 1,-0.2 5,-0.6 0.820 108.6 50.5 -62.6 -32.3 11.5 -5.6 -3.6 214 221 A M H <5S+ 0 0 1 -4,-1.1 -100,-0.3 1,-0.2 3,-0.3 0.902 106.8 57.5 -71.4 -37.1 8.2 -3.7 -3.6 215 222 A L H <5S+ 0 0 26 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.639 125.7 14.1 -66.8 -18.1 8.5 -3.6 -7.4 216 223 A S H <5S- 0 0 46 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.278 97.5-114.0-144.3 14.4 8.6 -7.4 -7.9 217 224 A N T <5S+ 0 0 48 -4,-1.2 -3,-0.2 -3,-0.3 -4,-0.1 0.853 85.7 76.6 52.5 44.9 7.6 -9.1 -4.7 218 225 A R S > S- 0 0 121 1,-0.1 4,-1.4 -41,-0.0 3,-1.0 -0.958 93.4 -70.8-155.6 171.2 26.2 -15.9 3.2 226 233 A Y T >4 S+ 0 0 52 -2,-0.3 3,-0.5 1,-0.3 4,-0.5 0.782 125.1 29.1 -32.1 -66.1 28.6 -13.0 3.9 227 234 A L T 3> S+ 0 0 49 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.641 110.6 69.0 -79.0 -14.6 30.5 -12.7 0.5 228 235 A D H <> S+ 0 0 33 -3,-1.0 4,-1.7 1,-0.2 -1,-0.2 0.783 90.7 63.0 -72.2 -28.0 27.6 -14.0 -1.6 229 236 A Q H S+ 0 0 0 -4,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.792 109.0 56.3 -74.5 -29.8 28.3 -8.8 -2.6 231 238 A N H X S+ 0 0 71 -4,-1.2 4,-1.2 2,-0.2 -2,-0.2 0.834 107.5 49.7 -69.5 -31.6 28.3 -11.2 -5.5 232 239 A H H X S+ 0 0 57 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.892 112.3 46.7 -71.9 -41.4 24.6 -10.6 -5.8 233 240 A I H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.2 3,-0.5 0.945 114.5 45.7 -65.2 -50.3 25.0 -6.8 -5.8 234 241 A L H X S+ 0 0 11 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.776 102.9 66.9 -64.4 -28.5 27.8 -6.9 -8.3 235 242 A G H < S+ 0 0 17 -4,-1.2 -1,-0.2 -5,-0.2 31,-0.2 0.917 113.7 28.8 -59.3 -43.1 25.9 -9.3 -10.5 236 243 A I H < S+ 0 0 29 -4,-1.1 30,-2.1 -3,-0.5 -2,-0.2 0.851 122.9 48.4 -86.2 -38.8 23.3 -6.7 -11.2 237 244 A L H < S- 0 0 24 -4,-2.5 28,-0.3 1,-0.2 -3,-0.2 0.736 97.9-138.3 -76.4 -24.2 25.4 -3.5 -10.9 238 245 A G < - 0 0 3 -4,-2.0 26,-0.2 26,-0.3 -1,-0.2 -0.450 47.1 -31.1 93.5-173.2 28.3 -4.6 -13.1 239 246 A S S S- 0 0 52 24,-1.9 26,-0.1 -2,-0.1 3,-0.1 -0.635 73.1-106.3 -81.8 137.8 32.0 -3.9 -12.4 240 247 A P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.393 41.8-104.3 -63.7 139.7 32.7 -0.7 -10.4 241 248 A S - 0 0 48 1,-0.1 -3,-0.0 -2,-0.1 0, 0.0 -0.103 17.7-148.7 -57.4 161.3 34.2 2.0 -12.6 242 249 A Q S S+ 0 0 163 -3,-0.1 -1,-0.1 1,-0.1 0, 0.0 0.821 89.1 73.4 -97.8 -43.2 37.9 2.6 -12.3 243 250 A E S S+ 0 0 159 1,-0.2 2,-0.6 2,-0.1 -1,-0.1 0.767 104.8 38.8 -37.8 -43.8 37.7 6.3 -13.1 244 251 A D + 0 0 73 1,-0.1 -1,-0.2 2,-0.1 46,-0.1 -0.940 60.0 159.9-118.0 110.1 36.1 7.0 -9.7 245 252 A L + 0 0 58 -2,-0.6 -1,-0.1 -5,-0.0 -2,-0.1 -0.307 17.2 173.7-121.0 45.9 37.6 5.0 -6.8 246 253 A N - 0 0 83 3,-0.0 46,-0.1 44,-0.0 47,-0.1 -0.307 63.9 -10.4 -52.8 135.2 36.4 7.3 -4.1 247 254 A C S S+ 0 0 47 1,-0.1 43,-0.0 43,-0.1 -74,-0.0 -0.180 85.4 114.1 63.3-161.3 37.2 5.5 -0.8 248 255 A I + 0 0 11 -54,-0.1 -1,-0.1 -58,-0.1 -54,-0.0 0.997 31.5 150.4 56.8 74.3 38.4 1.9 -1.0 249 256 A I + 0 0 129 -55,-0.1 2,-0.1 5,-0.0 -1,-0.0 0.754 38.3 94.2-102.7 -39.7 41.9 2.6 0.2 250 257 A N S > S- 0 0 29 -76,-0.2 4,-1.6 1,-0.2 3,-0.5 -0.364 73.3-138.8 -61.0 127.1 42.7 -0.8 1.8 251 258 A L H > S+ 0 0 119 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.751 95.4 63.5 -59.5 -28.4 44.4 -3.0 -0.7 252 259 A K H > S+ 0 0 143 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.934 106.2 42.9 -66.2 -42.9 42.5 -6.1 0.2 253 260 A A H > S+ 0 0 0 -3,-0.5 4,-2.0 2,-0.2 5,-0.3 0.968 116.9 46.9 -65.2 -52.5 39.1 -4.7 -0.9 254 261 A R H X S+ 0 0 108 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.909 112.6 50.0 -54.5 -48.4 40.5 -3.1 -4.1 255 262 A N H X S+ 0 0 85 -4,-2.6 4,-0.6 2,-0.2 -1,-0.2 0.843 107.6 53.5 -63.2 -34.2 42.5 -6.3 -5.0 256 263 A Y H >< S+ 0 0 43 -4,-1.7 3,-0.9 2,-0.2 -1,-0.2 0.945 113.4 41.7 -65.8 -48.5 39.4 -8.6 -4.6 257 264 A L H >< S+ 0 0 26 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.890 111.9 57.1 -62.8 -40.1 37.3 -6.5 -6.9 258 265 A L H 3< S+ 0 0 126 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.640 101.7 57.8 -67.1 -14.7 40.3 -6.1 -9.2 259 266 A S T << S+ 0 0 84 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.353 86.7 95.8 -98.9 7.7 40.4 -10.0 -9.4 260 267 A L S < S- 0 0 64 -3,-1.6 3,-0.1 -4,-0.1 -3,-0.0 -0.682 82.3-105.6 -95.5 150.2 36.9 -10.4 -10.8 261 268 A P - 0 0 108 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.334 48.5 -86.0 -69.3 157.8 36.1 -10.8 -14.5 262 269 A H - 0 0 146 -23,-0.1 2,-0.4 -24,-0.0 -24,-0.0 -0.447 52.2-174.0 -63.4 133.9 34.5 -7.8 -16.2 263 270 A K - 0 0 107 -2,-0.1 -24,-1.9 -3,-0.1 2,-0.1 -0.987 16.1-133.2-136.1 125.7 30.8 -8.0 -15.7 264 271 A N - 0 0 122 -2,-0.4 -26,-0.3 -26,-0.2 2,-0.2 -0.430 30.2 -95.9 -79.9 151.0 28.3 -5.7 -17.4 265 272 A K - 0 0 83 -28,-0.3 -28,-0.2 -2,-0.1 -29,-0.1 -0.438 29.4-130.6 -67.6 127.0 25.4 -3.9 -15.6 266 273 A V - 0 0 23 -30,-2.1 5,-0.1 -2,-0.2 -1,-0.1 -0.703 34.3-117.1 -79.2 114.1 22.0 -5.6 -15.9 267 274 A P >> - 0 0 44 0, 0.0 4,-1.2 0, 0.0 3,-1.1 -0.259 12.6-130.9 -56.5 132.8 19.6 -2.8 -17.0 268 275 A W H >> S+ 0 0 19 1,-0.3 4,-2.6 2,-0.2 3,-0.8 0.899 105.8 55.6 -51.1 -50.1 16.9 -2.0 -14.5 269 276 A N H 34 S+ 0 0 103 1,-0.3 -1,-0.3 2,-0.2 6,-0.0 0.785 103.5 56.9 -57.7 -27.4 14.1 -2.1 -17.0 270 277 A R H <4 S+ 0 0 163 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.858 111.8 40.5 -72.1 -35.4 15.2 -5.6 -17.9 271 278 A L H << S+ 0 0 62 -4,-1.2 -2,-0.2 -3,-0.8 -1,-0.2 0.812 128.5 33.0 -79.8 -33.9 14.7 -6.8 -14.3 272 279 A F S < S+ 0 0 10 -4,-2.6 -1,-0.3 -5,-0.2 3,-0.3 -0.785 74.0 173.0-125.8 84.0 11.6 -4.8 -13.9 273 280 A P S S+ 0 0 96 0, 0.0 2,-1.1 0, 0.0 -1,-0.2 0.974 73.3 39.7 -54.0 -67.2 9.9 -4.8 -17.3 274 281 A N S S+ 0 0 152 2,-0.0 2,-0.3 0, 0.0 -5,-0.0 -0.734 89.5 110.8 -94.6 92.1 6.6 -3.1 -16.5 275 282 A A S S- 0 0 34 -2,-1.1 5,-0.1 -3,-0.3 -3,-0.1 -0.951 74.4 -86.3-160.9 140.7 7.5 -0.4 -14.0 276 283 A D > - 0 0 55 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.159 31.7-137.2 -50.0 136.5 7.5 3.5 -14.1 277 284 A S H > S+ 0 0 84 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.842 102.4 56.7 -66.9 -36.9 10.7 4.9 -15.5 278 285 A K H > S+ 0 0 96 2,-0.2 4,-1.9 1,-0.2 27,-0.3 0.904 105.9 51.0 -61.9 -41.2 10.9 7.6 -12.9 279 286 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.933 110.2 50.5 -61.0 -43.5 10.8 5.0 -10.2 280 287 A L H X S+ 0 0 16 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.842 107.2 53.4 -62.8 -36.1 13.6 3.1 -12.0 281 288 A D H X S+ 0 0 70 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.875 111.6 44.7 -68.2 -37.9 15.7 6.3 -12.2 282 289 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.942 109.9 56.2 -68.0 -48.0 15.5 6.9 -8.4 283 290 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.887 106.6 51.9 -48.3 -44.3 16.2 3.2 -7.8 284 291 A D H < S+ 0 0 51 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.943 110.3 46.0 -60.1 -51.2 19.4 3.6 -9.8 285 292 A K H >< S+ 0 0 81 -4,-1.7 10,-1.9 1,-0.2 3,-0.6 0.786 113.1 50.4 -64.5 -28.9 20.5 6.6 -7.7 286 293 A M H 3< S+ 0 0 0 -4,-2.4 -78,-0.3 1,-0.2 -1,-0.2 0.815 113.4 46.0 -78.3 -31.9 19.6 4.8 -4.4 287 294 A L T 3< S+ 0 0 0 -4,-2.1 2,-0.4 -5,-0.3 -1,-0.2 -0.293 76.7 140.8-106.1 47.0 21.6 1.7 -5.4 288 295 A T < - 0 0 31 -3,-0.6 6,-0.2 1,-0.1 -3,-0.1 -0.768 53.4-132.1 -90.8 134.9 24.8 3.3 -6.7 289 296 A F S S+ 0 0 37 -2,-0.4 -99,-0.3 -52,-0.1 -1,-0.1 0.933 89.3 71.5 -44.9 -64.2 27.9 1.3 -5.8 290 297 A N S >> S- 0 0 15 1,-0.2 4,-1.5 -101,-0.1 3,-0.5 -0.418 73.0-151.0 -60.9 116.4 30.0 4.3 -4.5 291 298 A P T 34 S+ 0 0 26 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.760 93.4 56.5 -64.3 -23.6 28.5 5.5 -1.2 292 299 A H T 34 S+ 0 0 105 1,-0.2 -2,-0.1 -46,-0.1 -3,-0.0 0.845 110.8 42.8 -75.7 -31.9 29.6 9.1 -1.8 293 300 A K T <4 S+ 0 0 103 -3,-0.5 -1,-0.2 -47,-0.1 3,-0.1 0.712 89.9 111.1 -83.4 -24.8 27.7 9.4 -5.1 294 301 A R S < S- 0 0 6 -4,-1.5 -8,-0.2 -6,-0.2 2,-0.1 -0.188 80.4-101.4 -51.0 141.8 24.7 7.6 -3.7 295 302 A I - 0 0 9 -10,-1.9 2,-0.2 -13,-0.2 -1,-0.1 -0.395 34.4-134.4 -70.0 145.2 21.7 10.0 -3.4 296 303 A E > - 0 0 130 -3,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.522 26.9 -97.3 -96.8 166.3 20.8 11.3 0.1 297 304 A V H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.859 118.2 43.1 -52.5 -52.6 17.4 11.5 1.7 298 305 A E H > S+ 0 0 63 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.935 115.1 51.9 -62.9 -42.6 16.3 15.1 1.0 299 306 A Q H 4 S+ 0 0 121 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.885 108.9 51.6 -57.8 -40.4 17.6 14.8 -2.6 300 307 A A H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 6,-0.2 0.881 105.3 54.4 -65.0 -40.8 15.5 11.5 -3.0 301 308 A L H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.816 105.8 54.5 -63.2 -29.8 12.4 13.2 -1.7 302 309 A A T 3< S+ 0 0 48 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.415 82.2 119.4 -84.9 0.9 12.8 15.9 -4.4 303 310 A H S X S- 0 0 16 -3,-1.5 3,-1.5 -4,-0.2 7,-0.2 -0.378 75.6-116.7 -67.7 145.9 13.1 13.3 -7.3 304 311 A P G > S+ 0 0 71 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.780 111.5 65.5 -52.7 -34.4 10.4 13.5 -10.1 305 312 A Y G 3 S+ 0 0 8 -27,-0.3 3,-0.3 1,-0.3 -26,-0.1 0.847 108.5 40.3 -60.3 -31.7 9.0 10.1 -9.2 306 313 A L G X> S+ 0 0 0 -3,-1.5 4,-2.3 -6,-0.2 3,-1.6 0.229 80.0 113.3-101.8 13.4 7.9 11.5 -5.9 307 314 A E T <4 + 0 0 148 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.751 66.9 66.0 -58.3 -27.0 6.7 14.9 -7.1 308 315 A Q T 34 S+ 0 0 150 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.791 117.8 24.5 -67.1 -24.4 3.0 14.2 -6.3 309 316 A Y T <4 S+ 0 0 86 -3,-1.6 -2,-0.2 -8,-0.1 -1,-0.2 0.677 90.7 119.9-110.0 -26.7 3.9 14.1 -2.6 310 317 A Y < + 0 0 75 -4,-2.3 -8,-0.1 -7,-0.2 5,-0.0 -0.133 21.8 144.1 -50.5 131.1 7.0 16.2 -2.3 311 318 A D > - 0 0 67 1,-0.0 3,-2.2 3,-0.0 -1,-0.0 -0.534 32.3-160.5-172.0 92.6 6.7 19.3 -0.1 312 319 A P G > S+ 0 0 62 0, 0.0 3,-1.6 0, 0.0 -1,-0.0 0.814 92.4 56.5 -46.9 -43.7 9.7 20.3 2.1 313 320 A S G 3 S+ 0 0 109 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.613 107.8 49.5 -69.0 -13.5 7.7 22.4 4.5 314 321 A D G < S+ 0 0 84 -3,-2.2 -1,-0.3 1,-0.2 -3,-0.0 -0.013 94.4 80.1-111.6 23.8 5.6 19.3 5.3 315 322 A E S < S- 0 0 3 -3,-1.6 -1,-0.2 -184,-0.0 -5,-0.0 -0.629 76.6-156.7-131.3 73.0 8.6 17.1 5.8 316 323 A P - 0 0 59 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.045 4.7-151.4 -51.5 151.1 9.7 17.9 9.4 317 324 A I - 0 0 103 -182,-0.1 -185,-0.1 -183,-0.1 2,-0.1 -0.760 36.0 -77.9-118.6 168.8 13.2 17.5 10.8 318 325 A A - 0 0 13 -186,-0.5 -247,-0.1 -2,-0.3 -1,-0.1 -0.416 28.2-135.5 -72.1 142.9 14.2 16.8 14.4 319 326 A E S S+ 0 0 201 1,-0.2 -1,-0.1 -2,-0.1 -183,-0.0 0.852 89.6 13.4 -63.9 -35.2 14.2 19.7 16.8 320 327 A A S S- 0 0 58 -184,-0.0 -1,-0.2 0, 0.0 -185,-0.0 -0.999 84.3-104.1-147.2 143.3 17.6 18.5 18.2 321 328 A P - 0 0 90 0, 0.0 2,-0.3 0, 0.0 -184,-0.2 -0.208 42.0-107.9 -61.8 151.6 20.3 16.1 17.2 322 329 A F - 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