==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-DEC-11 3V6S . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 10; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.PARK,J.D.LAUGHLIN,P.V.LOGRASSO . 689 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31422.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 430 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 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 . 46 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 210 30.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 7 4 0 0 0 2 0 0 2 2 0 2 3 1 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 2 4 1 2 3 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 . 2 0 2 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 45 A D 0 0 113 0, 0.0 5,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 96.4 -0.4 -11.5 -41.7 2 46 A N + 0 0 150 3,-0.1 16,-0.0 0, 0.0 0, 0.0 0.720 360.0 28.2-111.5 -53.6 -0.6 -7.7 -41.8 3 47 A Q S S+ 0 0 144 85,-0.1 15,-2.9 14,-0.1 2,-0.3 0.452 120.3 75.4 -86.8 -5.0 1.8 -6.6 -39.0 4 48 A F E +A 17 0A 36 13,-0.3 2,-0.3 14,-0.1 13,-0.2 -0.784 54.1 178.7-111.4 156.3 3.7 -9.9 -39.7 5 49 A Y E -A 16 0A 73 11,-2.3 11,-2.0 -2,-0.3 2,-0.3 -0.961 23.6-123.1-147.3 152.6 6.1 -11.1 -42.4 6 50 A S E +A 15 0A 75 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.747 26.9 170.0-105.0 151.6 8.0 -14.4 -42.9 7 51 A V E -A 14 0A 44 7,-1.3 7,-2.9 -2,-0.3 2,-0.6 -0.928 32.0-126.5-158.7 130.5 11.8 -15.0 -43.3 8 52 A E E +A 13 0A 131 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.749 33.0 178.9 -82.2 115.8 13.9 -18.3 -43.4 9 53 A V E > -A 12 0A 11 3,-3.4 3,-0.9 -2,-0.6 15,-0.1 -0.985 65.2 -19.5-124.5 120.0 16.7 -18.0 -40.8 10 54 A G T 3 S- 0 0 54 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.878 128.5 -47.6 50.5 48.8 19.1 -20.9 -40.2 11 55 A D T 3 S+ 0 0 175 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.638 121.4 105.1 67.1 27.2 16.8 -23.6 -41.7 12 56 A S E < S-A 9 0A 17 -3,-0.9 -3,-3.4 -5,-0.0 2,-0.5 -0.997 71.9-122.5-140.2 136.6 13.8 -22.3 -39.7 13 57 A T E -A 8 0A 58 -2,-0.3 2,-0.7 -5,-0.2 -5,-0.2 -0.679 24.7-164.9 -81.0 117.5 10.7 -20.2 -40.7 14 58 A F E -A 7 0A 3 -7,-2.9 -7,-1.3 -2,-0.5 2,-0.9 -0.914 8.7-174.2-107.7 108.0 10.4 -17.0 -38.7 15 59 A T E +A 6 0A 27 -2,-0.7 2,-0.2 -9,-0.2 -9,-0.2 -0.904 30.2 159.3-101.1 97.5 7.0 -15.3 -38.9 16 60 A V E -A 5 0A 0 -11,-2.0 -11,-2.3 -2,-0.9 2,-0.1 -0.791 45.8 -81.2-120.2 166.0 7.8 -12.1 -37.0 17 61 A L E > -A 4 0A 23 -2,-0.2 3,-2.2 -13,-0.2 -13,-0.3 -0.355 42.4-116.1 -63.9 144.5 6.4 -8.5 -36.5 18 62 A K T 3 S+ 0 0 123 -15,-2.9 -1,-0.1 1,-0.3 -14,-0.1 0.611 111.1 73.2 -60.8 -12.7 7.4 -6.0 -39.3 19 63 A R T 3 S+ 0 0 64 -16,-0.3 21,-3.0 1,-0.1 2,-0.7 0.703 83.5 75.6 -73.3 -23.4 9.3 -4.0 -36.5 20 64 A Y E < +B 39 0B 1 -3,-2.2 19,-0.2 19,-0.2 2,-0.2 -0.856 68.2 163.3 -98.2 110.8 12.0 -6.8 -36.4 21 65 A Q E +B 38 0B 75 17,-2.6 17,-2.9 -2,-0.7 -2,-0.0 -0.641 44.1 37.3-119.7 175.7 14.3 -6.4 -39.4 22 66 A N E S- 0 0 102 15,-0.2 -1,-0.2 -2,-0.2 14,-0.1 0.825 74.5-164.1 47.1 43.3 17.8 -7.6 -40.7 23 67 A L E - 0 0 27 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.327 10.0-177.0 -59.8 131.1 17.3 -11.0 -39.0 24 68 A K E -B 36 0B 128 12,-3.0 12,-3.8 -15,-0.1 -15,-0.1 -0.999 28.0-111.3-130.7 136.2 20.6 -12.9 -38.6 25 69 A P E -B 35 0B 81 0, 0.0 2,-0.5 0, 0.0 10,-0.2 -0.402 17.3-155.8 -70.8 143.8 21.1 -16.5 -37.2 26 70 A I - 0 0 79 8,-1.5 8,-0.2 -2,-0.1 2,-0.1 -0.758 32.1-134.1-125.0 86.0 23.0 -16.8 -33.9 27 71 A G + 0 0 74 -2,-0.5 2,-0.1 1,-0.1 6,-0.1 -0.200 58.2 77.4 -61.4 117.5 24.3 -20.3 -34.2 28 72 A S - 0 0 124 4,-0.2 2,-0.3 -2,-0.1 -1,-0.1 -0.458 51.1-155.0-168.7-117.8 24.3 -23.2 -31.7 29 73 A G + 0 0 38 2,-0.2 2,-3.0 -2,-0.1 4,-0.0 -0.980 59.5 90.5 152.8-161.5 21.4 -25.5 -30.7 30 74 A A S S+ 0 0 96 -2,-0.3 2,-0.2 1,-0.1 3,-0.1 -0.243 109.6 41.6 64.2 -45.3 20.0 -27.7 -27.9 31 75 A Q S S+ 0 0 105 -2,-3.0 -2,-0.2 1,-0.3 -1,-0.1 -0.661 111.6 29.9-161.9 96.0 18.2 -24.5 -26.6 32 76 A G - 0 0 21 18,-0.2 2,-1.2 -2,-0.2 -1,-0.3 0.403 35.1-157.3-157.8-137.7 17.2 -23.1 -29.1 33 77 A I E + C 0 50B 58 17,-0.8 17,-3.0 -3,-0.1 2,-0.4 -0.799 62.4 157.3 -91.3 83.7 15.9 -21.7 -32.5 34 78 A V E + C 0 49B 41 -2,-1.2 -8,-1.5 15,-0.2 2,-0.3 -0.940 19.3 169.9-121.8 143.7 17.4 -18.2 -31.9 35 79 A C E -BC 25 48B 0 13,-1.9 13,-2.6 -2,-0.4 2,-0.3 -0.919 30.3-114.9-142.7 164.2 18.4 -15.3 -34.3 36 80 A A E +BC 24 47B 9 -12,-3.8 -12,-3.0 -2,-0.3 2,-0.3 -0.791 37.0 169.3-101.9 145.8 19.5 -11.7 -34.0 37 81 A A E - C 0 46B 3 9,-2.5 9,-3.3 -2,-0.3 2,-0.5 -0.984 34.5-113.6-152.2 161.3 17.4 -8.8 -35.3 38 82 A Y E -BC 21 45B 59 -17,-2.9 -17,-2.6 -2,-0.3 2,-0.7 -0.885 23.9-143.3-101.5 124.6 17.0 -5.0 -35.3 39 83 A D E >> -BC 20 44B 0 5,-3.3 5,-1.3 -2,-0.5 4,-1.3 -0.813 11.9-169.7 -86.7 114.8 13.9 -3.5 -33.6 40 84 A A T 45S+ 0 0 40 -21,-3.0 -1,-0.2 -2,-0.7 -20,-0.1 0.851 85.2 53.8 -72.3 -37.4 12.9 -0.5 -35.6 41 85 A V T 45S+ 0 0 103 -22,-0.2 -1,-0.2 1,-0.2 -21,-0.1 0.896 122.0 29.1 -63.8 -44.7 10.3 0.7 -32.9 42 86 A L T 45S- 0 0 100 2,-0.2 -1,-0.2 -23,-0.1 -2,-0.2 0.575 99.2-132.3 -93.8 -11.8 13.0 0.7 -30.1 43 87 A D T <5S+ 0 0 122 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.913 70.2 109.5 56.6 47.7 16.1 1.5 -32.4 44 88 A R E - 0 0 44 -2,-0.6 3,-1.3 1,-0.1 4,-0.3 0.871 69.1-176.4 37.2 70.3 7.8 -27.7 -30.8 54 98 A P T 3 S+ 0 0 6 0, 0.0 10,-0.2 0, 0.0 3,-0.2 0.727 82.1 42.2 -66.4 -20.0 6.3 -26.3 -27.4 55 99 A F T 3 S+ 0 0 40 41,-0.2 3,-0.1 1,-0.1 -2,-0.1 0.054 79.2 105.0-114.1 23.2 3.3 -28.7 -27.6 56 100 A Q S < S- 0 0 77 -3,-1.3 2,-0.2 1,-0.2 -1,-0.1 0.890 99.8 -18.1 -66.7 -39.3 5.3 -31.9 -28.7 57 101 A N S > S- 0 0 5 -4,-0.3 4,-1.7 -3,-0.2 -1,-0.2 -0.900 73.3 -93.5-155.7 175.3 4.9 -33.1 -25.1 58 102 A Q H > S+ 0 0 20 599,-0.3 4,-2.6 601,-0.3 5,-0.2 0.751 119.7 58.0 -70.2 -27.9 4.1 -32.0 -21.5 59 103 A T H > S+ 0 0 65 598,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.923 108.9 45.3 -70.4 -39.9 7.8 -31.5 -20.6 60 104 A H H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.887 117.0 45.3 -64.4 -43.7 8.2 -29.0 -23.5 61 105 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.875 113.8 47.8 -71.2 -40.3 4.9 -27.2 -22.5 62 106 A K H X S+ 0 0 34 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.930 114.9 46.7 -64.7 -45.0 5.7 -27.1 -18.8 63 107 A R H X S+ 0 0 44 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.844 114.1 48.5 -63.9 -38.0 9.3 -25.8 -19.6 64 108 A A H X S+ 0 0 9 -4,-2.0 4,-2.1 -10,-0.2 -2,-0.2 0.898 113.7 45.1 -69.8 -44.2 7.8 -23.2 -22.1 65 109 A Y H X S+ 0 0 9 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.936 115.1 49.0 -63.6 -47.9 5.1 -22.0 -19.5 66 110 A R H X S+ 0 0 27 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.891 113.7 45.3 -55.0 -52.1 7.8 -21.9 -16.7 67 111 A E H X S+ 0 0 8 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.861 114.4 48.1 -62.9 -43.9 10.3 -19.9 -18.9 68 112 A L H X S+ 0 0 7 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.897 115.7 44.1 -66.7 -41.3 7.6 -17.4 -20.2 69 113 A V H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.918 117.7 44.2 -70.2 -45.6 6.2 -16.8 -16.6 70 114 A L H X S+ 0 0 5 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.910 110.2 53.3 -71.0 -40.4 9.7 -16.4 -15.0 71 115 A M H < S+ 0 0 4 -4,-2.6 11,-1.1 1,-0.2 -1,-0.2 0.815 114.8 44.5 -61.9 -30.4 11.2 -14.2 -17.7 72 116 A K H < S+ 0 0 50 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.924 118.0 40.8 -77.7 -48.7 8.2 -11.9 -17.3 73 117 A C H < S+ 0 0 39 -4,-2.4 2,-0.3 -5,-0.1 -2,-0.2 0.845 101.2 78.7 -71.0 -40.1 8.1 -11.8 -13.4 74 118 A V < + 0 0 3 -4,-2.8 2,-0.2 -5,-0.2 62,-0.0 -0.575 51.3 177.0 -76.2 133.8 12.0 -11.6 -12.8 75 119 A N + 0 0 136 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.659 28.0 132.8-137.5 75.7 13.5 -8.1 -13.3 76 120 A H > - 0 0 18 3,-0.3 3,-1.8 -2,-0.2 243,-0.0 -0.978 59.1-129.0-128.5 140.6 17.3 -8.5 -12.4 77 121 A K T 3 S+ 0 0 108 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.621 109.9 51.9 -63.9 -15.4 20.3 -7.2 -14.5 78 122 A N T 3 S+ 0 0 2 82,-0.1 83,-2.5 53,-0.1 2,-0.4 0.268 100.8 69.7-108.1 13.9 21.9 -10.6 -14.3 79 123 A I B < S-f 161 0C 1 -3,-1.8 -3,-0.3 81,-0.3 83,-0.2 -0.996 94.5-106.2-129.1 129.6 18.9 -12.5 -15.7 80 124 A I - 0 0 3 81,-2.3 2,-0.3 -2,-0.4 -6,-0.1 -0.306 39.0-142.5 -56.7 131.6 17.8 -12.1 -19.3 81 125 A S - 0 0 37 -4,-0.1 2,-0.8 -6,-0.1 22,-0.7 -0.802 11.5-117.8-103.5 147.9 14.6 -10.0 -19.5 82 126 A L E +E 102 0B 37 -11,-1.1 20,-0.2 -2,-0.3 3,-0.1 -0.730 28.9 177.2 -84.0 107.5 11.6 -10.4 -21.8 83 127 A L E - 0 0 83 18,-2.1 2,-0.3 -2,-0.8 19,-0.2 0.913 70.0 -11.9 -73.4 -44.3 11.3 -7.3 -24.0 84 128 A N E -E 101 0B 41 17,-1.8 17,-3.2 2,-0.0 2,-0.3 -0.967 54.1-160.9-153.9 161.3 8.3 -8.7 -26.0 85 129 A V E +E 100 0B 9 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.975 23.1 157.9-147.1 134.3 6.3 -11.9 -26.7 86 130 A F E -E 99 0B 15 13,-1.5 13,-2.1 -2,-0.3 263,-0.1 -0.981 28.7-148.2-154.5 164.1 4.0 -12.7 -29.7 87 131 A T - 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0 0 0 -2,-0.3 -47,-2.4 -47,-0.3 2,-0.5 -0.993 5.5-164.0-127.8 130.9 5.7 -18.6 -29.5 99 143 A Y E -DE 50 86B 0 -13,-2.1 -13,-1.5 -2,-0.4 2,-0.5 -0.971 4.1-161.2-119.0 116.5 8.4 -15.9 -30.1 100 144 A L E -DE 49 85B 1 -51,-2.7 -51,-2.8 -2,-0.5 2,-0.5 -0.857 5.6-158.1 -98.4 126.6 10.3 -14.5 -27.1 101 145 A V E +DE 48 84B 0 -17,-3.2 -18,-2.1 -2,-0.5 -17,-1.8 -0.945 23.3 160.6-108.8 120.2 12.1 -11.1 -27.8 102 146 A M E -DE 47 82B 16 -55,-2.7 -55,-3.2 -2,-0.5 -20,-0.1 -0.827 46.2 -71.3-133.0 169.9 15.0 -10.3 -25.4 103 147 A E E -D 46 0B 64 -22,-0.7 2,-0.5 -2,-0.3 -57,-0.2 -0.354 52.8-115.5 -61.1 139.5 18.0 -8.0 -25.3 104 148 A L - 0 0 34 -59,-1.2 2,-0.3 -67,-0.1 -59,-0.1 -0.729 29.8-162.3 -85.1 124.2 20.8 -9.1 -27.7 105 149 A M - 0 0 20 -2,-0.5 49,-0.2 1,-0.1 3,-0.1 -0.682 18.9-130.7-100.1 156.3 24.0 -10.1 -26.0 106 150 A D S S+ 0 0 97 47,-0.9 2,-0.3 -2,-0.3 48,-0.2 0.896 77.0 3.0 -77.5 -42.4 27.4 -10.3 -27.9 107 151 A A E -G 153 0C 22 46,-2.3 46,-3.5 4,-0.0 2,-0.2 -0.947 65.1-114.5-145.6 162.2 28.6 -13.8 -26.9 108 152 A N E >> -G 152 0C 28 -2,-0.3 3,-1.9 44,-0.3 4,-1.6 -0.662 36.2-113.9 -91.7 150.6 27.8 -16.9 -25.0 109 153 A L H 3> S+ 0 0 0 42,-3.1 4,-3.4 39,-0.9 5,-0.2 0.811 112.9 72.0 -58.2 -26.7 29.9 -17.9 -21.9 110 154 A C H 34 S+ 0 0 56 38,-0.5 -1,-0.3 41,-0.3 4,-0.1 0.711 106.5 35.2 -58.7 -26.0 31.2 -20.9 -24.0 111 155 A Q H X4 S+ 0 0 107 -3,-1.9 3,-0.8 37,-0.1 -1,-0.2 0.813 117.7 50.3 -96.5 -40.7 33.2 -18.6 -26.2 112 156 A V H >< S+ 0 0 16 -4,-1.6 3,-2.2 1,-0.2 -2,-0.2 0.905 102.9 62.4 -63.4 -40.9 34.2 -16.1 -23.4 113 157 A I T 3< S+ 0 0 1 -4,-3.4 -1,-0.2 1,-0.3 98,-0.2 0.738 99.7 56.0 -53.5 -29.5 35.4 -19.0 -21.2 114 158 A Q T < S+ 0 0 140 -3,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.440 90.3 97.4 -85.6 -6.5 38.0 -19.8 -23.9 115 159 A M S < S- 0 0 102 -3,-2.2 2,-0.6 -4,-0.2 96,-0.1 -0.511 90.0-100.7 -81.7 153.6 39.5 -16.2 -23.7 116 160 A E - 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0 0 61 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.383 30.7-146.9 -58.1 124.7 9.6 -60.0 -5.3 558 262 B L S S+ 0 0 4 -11,-0.3 -1,-0.1 1,-0.2 -33,-0.1 0.922 88.9 23.8 -59.5 -52.8 5.7 -59.9 -5.4 559 263 B F S S+ 0 0 3 -35,-0.2 -1,-0.2 2,-0.0 12,-0.1 -0.618 79.5 167.3-122.0 71.3 5.1 -63.5 -6.3 560 264 B P + 0 0 48 0, 0.0 10,-0.3 0, 0.0 2,-0.2 -0.183 10.8 140.0 -76.3 176.0 8.1 -65.7 -5.2 561 265 B G - 0 0 10 1,-0.1 -2,-0.0 8,-0.1 6,-0.0 -0.592 60.4-111.8 152.3 147.0 8.0 -69.5 -5.0 562 266 B R S S- 0 0 76 -2,-0.2 2,-0.2 1,-0.0 -1,-0.1 0.786 101.3 -7.5 -63.7 -32.4 9.8 -72.8 -5.6 563 267 B D S > S- 0 0 79 -3,-0.1 4,-2.4 -40,-0.0 3,-0.1 -0.878 85.1 -82.4-153.1 179.5 7.4 -73.6 -8.4 564 268 B Y H > S+ 0 0 70 -2,-0.2 4,-3.2 2,-0.2 5,-0.2 0.814 123.7 57.2 -61.7 -36.9 4.2 -72.4 -10.2 565 269 B I H > S+ 0 0 90 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.928 112.7 40.5 -61.0 -45.4 1.9 -74.1 -7.6 566 270 B D H > S+ 0 0 48 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.889 115.6 52.9 -68.4 -40.5 3.7 -72.0 -4.8 567 271 B Q H X S+ 0 0 1 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.891 105.0 53.1 -61.3 -47.5 3.7 -68.9 -7.1 568 272 B W H X S+ 0 0 7 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.850 105.5 55.4 -60.1 -36.7 -0.1 -69.2 -7.8 569 273 B N H X S+ 0 0 27 -4,-1.3 4,-3.0 1,-0.2 5,-0.2 0.934 105.9 51.3 -59.6 -46.0 -0.7 -69.2 -4.0 570 274 B K H X S+ 0 0 54 -4,-1.6 4,-1.0 -10,-0.3 -1,-0.2 0.783 111.2 49.7 -60.8 -30.6 1.2 -65.9 -3.6 571 275 B V H X S+ 0 0 2 -4,-1.3 4,-2.9 2,-0.2 5,-0.5 0.947 115.5 39.7 -73.9 -52.0 -1.0 -64.4 -6.4 572 276 B I H X S+ 0 0 2 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.858 111.7 57.6 -70.7 -34.5 -4.3 -65.5 -4.9 573 277 B E H < S+ 0 0 76 -4,-3.0 30,-0.4 -5,-0.2 29,-0.3 0.881 120.9 28.4 -61.1 -36.8 -3.2 -64.6 -1.3 574 278 B Q H < S+ 0 0 20 -4,-1.0 29,-0.9 -5,-0.2 -2,-0.2 0.871 133.6 27.8 -93.2 -46.5 -2.5 -61.0 -2.3 575 279 B L H < S- 0 0 34 -4,-2.9 -3,-0.2 27,-0.2 -2,-0.1 0.619 108.4-117.9 -95.5 -16.3 -4.8 -60.2 -5.2 576 280 B G < - 0 0 5 -4,-1.4 25,-0.2 -5,-0.5 -1,-0.2 -0.078 40.7 -51.0 95.7 161.4 -7.7 -62.6 -4.3 577 281 B T - 0 0 36 23,-2.7 22,-0.1 1,-0.1 18,-0.0 -0.501 66.0-111.6 -67.2 131.2 -9.3 -65.6 -6.0 578 282 B P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 22,-0.1 -0.207 40.7 -85.1 -66.8 159.5 -10.3 -64.8 -9.7 579 283 B C >> - 0 0 40 1,-0.1 4,-1.8 3,-0.0 3,-0.7 -0.192 34.7-112.7 -60.5 152.4 -14.0 -64.6 -10.7 580 284 B P H 3> S+ 0 0 99 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.848 118.4 62.6 -56.4 -32.9 -15.9 -67.8 -11.7 581 285 B E H 3> S+ 0 0 68 1,-0.2 4,-1.2 2,-0.2 -2,-0.0 0.888 106.0 44.4 -55.8 -45.3 -16.1 -66.4 -15.3 582 286 B F H <4 S+ 0 0 5 -3,-0.7 3,-0.3 1,-0.2 -1,-0.2 0.896 113.1 49.6 -65.4 -46.7 -12.2 -66.6 -15.4 583 287 B M H >< S+ 0 0 12 -4,-1.8 3,-0.6 1,-0.2 -2,-0.2 0.728 105.9 58.3 -69.8 -19.6 -12.1 -70.0 -13.8 584 288 B K H 3< S+ 0 0 157 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.867 98.3 59.2 -73.4 -37.8 -14.7 -71.2 -16.4 585 289 B K T 3< S+ 0 0 72 -4,-1.2 2,-0.3 -3,-0.3 -1,-0.2 0.498 91.7 98.3 -69.2 -4.0 -12.3 -70.1 -19.2 586 290 B L S < S- 0 0 5 -3,-0.6 -53,-0.1 -4,-0.2 -52,-0.1 -0.638 87.1-104.0 -90.4 144.1 -9.8 -72.7 -17.7 587 291 B Q >> - 0 0 81 -55,-0.3 4,-2.4 -2,-0.3 3,-0.9 -0.382 38.4-110.9 -63.1 137.3 -9.3 -76.3 -19.1 588 292 B P H 3> S+ 0 0 94 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.728 112.5 58.2 -43.6 -33.2 -11.1 -78.8 -16.7 589 293 B T H 3> S+ 0 0 121 2,-0.2 4,-0.7 1,-0.2 -3,-0.0 0.881 116.7 28.7 -66.9 -49.8 -7.7 -80.3 -15.5 590 294 B V H <> S+ 0 0 47 -3,-0.9 4,-2.5 2,-0.2 3,-0.2 0.809 115.8 64.0 -83.5 -29.8 -6.1 -77.1 -14.1 591 295 B R H X S+ 0 0 84 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.840 97.2 57.8 -56.4 -40.9 -9.6 -75.6 -13.3 592 296 B N H X S+ 0 0 99 -4,-1.4 4,-1.1 -5,-0.3 -1,-0.2 0.920 111.9 39.5 -58.6 -47.5 -10.1 -78.5 -10.8 593 297 B Y H X S+ 0 0 77 -4,-0.7 4,-0.6 2,-0.2 -2,-0.2 0.912 116.8 49.0 -69.6 -48.9 -7.0 -77.5 -8.8 594 298 B V H >< S+ 0 0 4 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.918 114.3 45.4 -58.9 -48.2 -7.6 -73.7 -9.1 595 299 B E H 3< S+ 0 0 77 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.724 108.7 57.5 -69.7 -24.2 -11.3 -74.0 -7.9 596 300 B N H 3< S+ 0 0 115 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.572 85.1 104.5 -84.1 -8.7 -10.3 -76.4 -5.1 597 301 B R S << S- 0 0 71 -3,-1.0 2,-0.1 -4,-0.6 3,-0.0 -0.311 89.9 -90.3 -65.6 151.5 -7.9 -73.7 -3.6 598 302 B P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.427 49.7-107.7 -63.9 138.2 -9.1 -71.9 -0.5 599 303 B K - 0 0 165 -3,-0.1 2,-0.4 -2,-0.1 -4,-0.0 -0.549 36.8-165.8 -70.4 128.9 -11.0 -68.7 -1.5 600 304 B Y - 0 0 82 -2,-0.3 -23,-2.7 1,-0.1 -26,-0.1 -0.958 21.2-157.0-118.0 139.1 -9.1 -65.4 -0.8 601 305 B A - 0 0 106 -2,-0.4 -1,-0.1 -25,-0.2 -28,-0.1 0.848 45.6-133.0 -78.8 -35.9 -10.6 -61.9 -0.8 602 306 B G - 0 0 23 -29,-0.3 -27,-0.2 -26,-0.1 -28,-0.2 0.357 17.1 -82.7 88.4 135.8 -7.2 -60.4 -1.5 603 307 B L - 0 0 73 -29,-0.9 -3,-0.0 -30,-0.4 2,-0.0 -0.434 51.0-111.9 -66.9 138.5 -5.5 -57.5 0.1 604 308 B T > - 0 0 75 -2,-0.1 4,-2.5 1,-0.1 3,-0.5 -0.297 25.5-110.8 -68.9 161.5 -6.5 -54.1 -1.3 605 309 B F H > S+ 0 0 39 1,-0.2 4,-3.4 2,-0.2 -1,-0.1 0.922 117.7 61.2 -65.5 -34.1 -3.9 -52.1 -3.4 606 310 B P H 4 S+ 0 0 75 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.857 113.8 36.1 -57.0 -35.1 -3.7 -49.4 -0.5 607 311 B K H 4 S+ 0 0 118 -3,-0.5 -2,-0.2 1,-0.1 -4,-0.1 0.820 116.5 53.1 -87.2 -28.3 -2.5 -52.2 1.9 608 312 B L H < S+ 0 0 5 -4,-2.5 -3,-0.2 1,-0.3 -1,-0.1 0.897 130.3 17.1 -66.1 -40.3 -0.5 -54.0 -0.8 609 313 B F S < S- 0 0 0 -4,-3.4 -1,-0.3 -5,-0.2 -2,-0.1 -0.681 87.2-169.5-133.9 77.6 1.3 -50.7 -1.6 610 314 B P > - 0 0 43 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.263 38.9-106.0 -69.7 160.4 0.8 -48.2 1.3 611 315 B D G > S+ 0 0 98 1,-0.3 3,-1.4 2,-0.2 -4,-0.1 0.698 115.6 73.4 -55.5 -23.3 1.7 -44.4 1.1 612 316 B S G 3 S+ 0 0 103 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.768 91.9 54.3 -61.8 -31.1 4.8 -45.3 3.3 613 317 B L G < S+ 0 0 56 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.476 106.1 68.4 -81.7 -6.2 6.5 -47.0 0.3 614 318 B F S < S- 0 0 15 -3,-1.4 -144,-0.1 -4,-0.2 11,-0.1 -0.859 94.2 -87.3-116.8 152.5 6.1 -43.8 -1.7 615 319 B P - 0 0 43 0, 0.0 2,-0.2 0, 0.0 10,-0.2 -0.199 57.4-154.0 -57.5 146.4 7.6 -40.2 -1.6 616 320 B A + 0 0 75 -4,-0.1 3,-0.1 1,-0.0 2,-0.0 -0.734 46.3 43.7-137.6 173.6 5.9 -37.6 0.7 617 321 B D S S+ 0 0 162 -2,-0.2 5,-0.1 1,-0.1 -1,-0.0 -0.987 78.6 97.7-100.7 -12.2 4.9 -34.8 2.0 618 322 B S S > S- 0 0 48 1,-0.1 4,-2.0 3,-0.1 5,-0.1 0.165 71.3-128.8 -43.5 151.6 3.8 -32.8 -1.1 619 323 B E H > S+ 0 0 177 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.881 117.9 48.9 -65.4 -36.6 0.2 -32.5 -2.5 620 324 B H H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 111.0 46.5 -67.4 -48.2 1.9 -33.6 -5.8 621 325 B N H > S+ 0 0 29 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.800 112.8 50.3 -69.4 -30.6 3.8 -36.6 -4.2 622 326 B K H X S+ 0 0 51 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.927 113.9 45.2 -69.9 -43.9 0.6 -37.8 -2.4 623 327 B L H X S+ 0 0 96 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.866 111.5 53.9 -63.7 -39.4 -1.4 -37.5 -5.7 624 328 B K H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.799 108.0 49.0 -66.7 -33.9 1.5 -39.3 -7.6 625 329 B A H X S+ 0 0 1 -4,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.894 110.2 50.9 -71.4 -40.7 1.4 -42.2 -5.1 626 330 B S H X S+ 0 0 68 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.829 114.1 46.1 -62.4 -34.6 -2.4 -42.4 -5.6 627 331 B Q H X S+ 0 0 30 -4,-1.6 4,-1.8 2,-0.2 27,-0.2 0.900 111.7 49.2 -73.6 -47.6 -1.7 -42.5 -9.4 628 332 B A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.915 113.0 48.1 -58.4 -46.4 1.1 -45.1 -9.2 629 333 B R H X S+ 0 0 26 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.857 109.8 53.5 -61.6 -39.8 -1.2 -47.4 -7.0 630 334 B D H X S+ 0 0 60 -4,-1.3 4,-0.6 2,-0.2 -1,-0.2 0.834 108.9 47.9 -64.7 -38.4 -4.0 -46.9 -9.5 631 335 B L H >X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 3,-0.7 0.888 111.7 50.7 -71.6 -37.3 -1.8 -48.0 -12.4 632 336 B L H 3X S+ 0 0 0 -4,-2.1 4,-3.2 1,-0.2 3,-0.3 0.914 106.0 55.1 -64.4 -40.5 -0.7 -51.0 -10.3 633 337 B S H 3< S+ 0 0 41 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.664 113.5 43.1 -65.3 -17.9 -4.4 -51.9 -9.6 634 338 B K H << S+ 0 0 86 -3,-0.7 10,-2.2 -4,-0.6 -1,-0.2 0.661 119.9 39.9 -99.3 -25.6 -4.9 -51.9 -13.5 635 339 B M H < S+ 0 0 1 -4,-1.6 2,-1.7 -3,-0.3 -89,-0.2 0.849 106.3 62.6 -92.0 -43.7 -1.7 -53.9 -14.4 636 340 B L S < S+ 0 0 4 -4,-3.2 2,-0.4 -5,-0.2 -1,-0.2 -0.550 74.5 130.8 -85.3 70.9 -1.7 -56.4 -11.6 637 341 B V - 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