==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 02-DEC-10 3PTG . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 10; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.BOWERS,A.P.TRUONG,J.NEITZ,M.NEITZEL,G.D.PROBST,R.K.HOM,A.W . 350 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16995.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 58.9 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 . 41 11.7 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 . 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 . 35 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 27.7 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 4 2 2 0 0 0 0 2 1 0 1 1 0 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 1 2 2 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 46 A N 0 0 167 0, 0.0 2,-0.2 0, 0.0 15,-0.0 0.000 360.0 360.0 360.0 -43.0 -25.6 0.2 32.5 2 47 A Q - 0 0 125 2,-0.0 15,-2.1 0, 0.0 2,-0.3 -0.854 360.0-167.1-159.5 139.6 -24.5 3.8 33.5 3 48 A F E -A 16 0A 34 -2,-0.2 2,-0.3 13,-0.2 13,-0.2 -0.780 6.8-167.9-122.9 157.3 -21.6 5.9 32.2 4 49 A Y E -A 15 0A 66 11,-1.8 11,-2.1 -2,-0.3 2,-0.3 -0.983 21.6-117.4-142.1 156.1 -19.7 9.1 33.1 5 50 A S E +A 14 0A 68 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.724 22.7 176.1 -97.3 140.0 -17.2 11.3 31.3 6 51 A V E -A 13 0A 38 7,-2.3 7,-2.6 -2,-0.3 -2,-0.0 -0.989 25.0-139.0-133.7 130.4 -13.6 12.2 32.1 7 52 A E - 0 0 106 -2,-0.4 -1,-0.2 5,-0.2 6,-0.1 0.979 19.2-176.9 -58.6 -71.7 -11.6 14.4 29.7 8 53 A V > - 0 0 21 4,-0.1 3,-1.5 14,-0.1 2,-0.2 0.993 64.9 -50.2 68.2 70.0 -8.0 13.0 29.4 9 54 A G T 3 S- 0 0 70 1,-0.2 -1,-0.0 15,-0.0 0, 0.0 -0.512 118.3 -23.1 69.6-135.5 -6.2 15.5 27.1 10 55 A D T 3 S+ 0 0 181 -2,-0.2 -1,-0.2 2,-0.0 2,-0.2 0.487 125.4 87.1 -86.6 -5.0 -8.1 16.3 23.9 11 56 A S < - 0 0 29 -3,-1.5 2,-0.5 -4,-0.1 0, 0.0 -0.624 68.9-142.7 -96.2 150.4 -9.9 13.0 24.2 12 57 A T - 0 0 54 -2,-0.2 2,-0.7 2,-0.0 -5,-0.2 -0.978 9.1-159.3-115.6 123.7 -13.1 12.2 26.1 13 58 A F E -A 6 0A 0 -7,-2.6 -7,-2.3 -2,-0.5 2,-0.6 -0.925 7.1-173.9-102.5 108.5 -13.3 8.9 27.9 14 59 A T E +A 5 0A 33 -2,-0.7 2,-0.3 -9,-0.2 -9,-0.2 -0.960 24.3 165.9-100.4 110.4 -17.0 7.9 28.6 15 60 A V E -A 4 0A 0 -11,-2.1 -11,-1.8 -2,-0.6 -2,-0.0 -0.837 44.0 -80.6-130.9 159.0 -16.8 4.7 30.7 16 61 A L E > -A 3 0A 15 -2,-0.3 3,-1.6 -13,-0.2 -13,-0.2 -0.348 50.4-113.9 -56.2 143.4 -18.9 2.4 33.0 17 62 A K T 3 S+ 0 0 98 -15,-2.1 -1,-0.1 1,-0.3 -14,-0.1 0.649 108.7 75.1 -57.6 -24.6 -19.1 4.0 36.4 18 63 A R T 3 S+ 0 0 72 20,-0.1 21,-4.1 21,-0.1 2,-0.5 0.525 82.9 79.9 -63.2 -14.2 -17.0 1.1 38.1 19 64 A Y E < +B 38 0B 1 -3,-1.6 2,-0.3 19,-0.2 19,-0.2 -0.919 64.3 163.7-106.3 120.7 -13.9 2.6 36.5 20 65 A Q E +B 37 0B 75 17,-1.9 17,-2.7 -2,-0.5 -2,-0.0 -0.841 43.9 36.0-142.3 160.2 -12.6 5.6 38.4 21 66 A N E S- 0 0 128 -2,-0.3 2,-0.2 15,-0.2 -1,-0.2 0.835 71.0-171.6 55.7 42.1 -9.5 7.7 38.8 22 67 A L E + 0 0 21 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.407 11.8 166.8 -64.1 128.1 -8.6 7.5 35.1 23 68 A K E -B 35 0B 125 12,-1.5 12,-2.4 -2,-0.2 2,-0.1 -0.976 40.1-100.3-144.7 144.2 -5.1 8.9 34.1 24 69 A P E +B 34 0B 75 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.321 37.7 168.0 -68.1 126.7 -3.2 8.6 30.9 25 70 A I E - 0 0 92 8,-2.6 2,-0.3 1,-0.4 9,-0.2 0.554 66.0 -14.2-113.0 -10.9 -0.4 6.0 30.8 26 71 A G E -B 33 0B 33 7,-1.5 7,-2.4 2,-0.0 -1,-0.4 -0.927 55.4-170.6-179.3 155.3 0.3 5.8 27.1 27 72 A S + 0 0 93 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.940 21.5 119.6-147.0 173.6 -0.9 6.7 23.7 28 73 A G S S- 0 0 46 -2,-0.3 -2,-0.0 1,-0.0 0, 0.0 -0.948 73.4 -38.4 165.8-141.3 -0.3 6.2 20.0 29 74 A A S S+ 0 0 91 -2,-0.3 22,-0.2 1,-0.2 3,-0.1 0.772 124.8 58.4 -91.9 -33.1 -1.9 4.9 16.8 30 75 A Q S S- 0 0 67 1,-0.3 21,-1.8 20,-0.1 2,-0.2 0.858 121.5 -87.0 -58.1 -40.2 -3.7 2.0 18.3 31 76 A G E - C 0 50B 1 19,-0.2 2,-0.3 2,-0.0 -1,-0.3 -0.807 49.6 -58.0 146.6 169.9 -5.6 4.3 20.7 32 77 A I E - C 0 49B 43 17,-1.1 17,-3.0 -2,-0.2 2,-0.4 -0.633 44.9-158.7 -91.3 141.7 -5.3 6.1 24.1 33 78 A V E -BC 26 48B 26 -7,-2.4 -8,-2.6 -2,-0.3 -7,-1.5 -0.967 8.9-176.0-126.3 130.6 -4.8 4.1 27.3 34 79 A C E -BC 24 47B 0 13,-2.5 13,-2.6 -2,-0.4 2,-0.2 -0.936 25.5-126.8-118.9 145.0 -5.5 5.1 30.9 35 80 A A E +BC 23 46B 15 -12,-2.4 -12,-1.5 -2,-0.4 2,-0.3 -0.633 40.2 176.6 -75.4 150.7 -4.9 3.3 34.2 36 81 A A E - C 0 45B 2 9,-2.1 9,-2.8 -2,-0.2 2,-0.5 -0.992 34.7-114.3-156.5 148.5 -8.1 3.0 36.3 37 82 A Y E -BC 20 44B 64 -17,-2.7 -17,-1.9 -2,-0.3 2,-0.9 -0.790 25.1-146.1 -80.8 124.5 -9.4 1.6 39.4 38 83 A D E >>> -BC 19 43B 7 5,-3.5 4,-2.2 -2,-0.5 3,-1.6 -0.819 9.1-166.8 -91.6 101.7 -12.1 -1.1 38.8 39 84 A A T 345S+ 0 0 41 -21,-4.1 -1,-0.2 -2,-0.9 -20,-0.1 0.803 86.0 55.7 -54.5 -36.9 -14.6 -0.8 41.8 40 85 A V T 345S+ 0 0 102 -22,-0.2 -1,-0.3 1,-0.2 -21,-0.1 0.559 121.2 26.7 -74.5 -19.4 -16.3 -4.1 40.9 41 86 A L T <45S- 0 0 99 -3,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.467 97.2-131.9-111.6 -11.5 -13.0 -6.1 41.1 42 87 A D T <5S+ 0 0 114 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.987 71.9 110.2 49.5 60.9 -11.2 -3.8 43.5 43 88 A R E S- 0 0 167 -2,-0.7 3,-1.5 1,-0.1 4,-0.3 0.895 70.5-169.5 40.1 66.6 -11.3 5.9 15.2 53 98 A P T 3 S+ 0 0 9 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 0.743 82.2 33.0 -57.3 -21.2 -12.3 2.2 14.9 54 99 A F T 3 S+ 0 0 29 41,-0.2 3,-0.1 5,-0.1 -2,-0.1 -0.215 77.0 116.5-128.5 31.0 -14.6 2.9 11.9 55 100 A Q S < S- 0 0 98 -3,-1.5 2,-0.3 1,-0.2 -1,-0.1 0.849 94.9 -26.9 -67.6 -34.6 -12.7 5.7 10.0 56 101 A N S > S- 0 0 63 -4,-0.3 4,-1.7 -3,-0.1 -1,-0.2 -0.885 81.7 -75.3-167.1 178.0 -12.2 3.3 7.1 57 102 A Q H > S+ 0 0 82 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.693 123.7 50.1 -68.1 -27.8 -12.0 -0.5 6.4 58 103 A T H > S+ 0 0 73 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.865 109.9 51.4 -79.1 -37.2 -8.4 -1.1 7.7 59 104 A H H > S+ 0 0 60 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.905 114.6 44.7 -58.4 -44.2 -9.2 0.7 11.0 60 105 A A H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 3,-0.4 0.912 111.9 49.5 -70.8 -45.8 -12.3 -1.5 11.4 61 106 A K H X S+ 0 0 31 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.846 110.1 54.1 -58.0 -38.3 -10.5 -4.8 10.4 62 107 A R H X S+ 0 0 171 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.782 107.5 49.5 -67.6 -28.5 -7.8 -4.0 12.9 63 108 A A H X S+ 0 0 3 -4,-1.0 4,-1.6 -3,-0.4 -2,-0.2 0.863 111.8 46.6 -81.7 -35.3 -10.3 -3.6 15.7 64 109 A Y H X S+ 0 0 59 -4,-1.8 4,-3.0 2,-0.2 5,-0.3 0.915 111.4 52.1 -74.5 -42.8 -12.1 -6.8 15.1 65 110 A R H X S+ 0 0 75 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.939 103.8 57.7 -52.3 -52.4 -8.7 -8.7 14.8 66 111 A E H X S+ 0 0 24 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.934 115.3 40.1 -36.5 -53.5 -7.7 -7.1 18.3 67 112 A L H X S+ 0 0 0 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.874 115.3 45.5 -73.5 -46.2 -10.8 -8.8 19.6 68 113 A V H < S+ 0 0 41 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.802 114.5 52.0 -69.6 -25.7 -10.8 -12.2 17.8 69 114 A L H >< S+ 0 0 12 -4,-2.9 3,-1.4 -5,-0.3 4,-0.2 0.888 106.6 53.5 -72.7 -38.9 -7.1 -12.5 18.6 70 115 A M H >< S+ 0 0 13 -4,-1.6 3,-1.3 -5,-0.3 -2,-0.2 0.834 104.8 53.9 -62.4 -37.3 -7.7 -11.9 22.3 71 116 A K T 3< S+ 0 0 79 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.1 -0.005 99.4 63.0 -99.8 25.7 -10.3 -14.6 22.5 72 117 A C T < S+ 0 0 2 -3,-1.4 243,-1.1 242,-0.1 2,-0.3 0.343 100.7 66.4-107.6 -8.4 -7.8 -17.1 21.1 73 118 A V < + 0 0 14 -3,-1.3 2,-0.2 -4,-0.2 62,-0.1 -0.904 42.5 162.8-127.6 144.6 -5.5 -16.7 24.1 74 119 A N + 0 0 118 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.649 30.3 130.9-157.8 93.8 -5.5 -17.4 27.8 75 120 A H > - 0 0 18 3,-0.3 3,-2.0 -2,-0.2 233,-0.1 -0.999 60.2-123.5-154.8 144.2 -2.2 -17.4 29.6 76 121 A K T 3 S+ 0 0 106 -2,-0.3 82,-0.2 1,-0.3 55,-0.1 0.644 112.8 51.1 -63.2 -16.0 -0.5 -16.0 32.7 77 122 A N T 3 S+ 0 0 2 231,-0.1 83,-1.6 82,-0.1 2,-0.4 0.172 99.9 73.8-108.3 18.2 2.3 -14.4 30.5 78 123 A I B < S-f 160 0C 3 -3,-2.0 2,-0.4 81,-0.3 -3,-0.3 -0.994 88.8-113.5-130.7 129.3 -0.1 -12.6 28.1 79 124 A I - 0 0 2 81,-2.5 2,-0.3 -2,-0.4 -2,-0.1 -0.547 39.9-146.6 -59.4 118.5 -2.1 -9.5 29.0 80 125 A S - 0 0 28 -2,-0.4 22,-1.5 -4,-0.1 2,-0.4 -0.664 12.2-116.6 -97.1 151.8 -5.8 -10.6 29.0 81 126 A L E -E 101 0B 33 -2,-0.3 20,-0.3 20,-0.2 3,-0.1 -0.671 29.6-178.1 -78.7 130.4 -8.9 -8.6 28.0 82 127 A L E - 0 0 69 18,-4.6 2,-0.3 1,-0.4 19,-0.2 0.825 61.0 -14.0-101.4 -38.9 -11.1 -8.3 31.0 83 128 A N E -E 100 0B 37 17,-1.3 17,-2.6 2,-0.0 -1,-0.4 -0.927 50.9-159.3-152.3 161.4 -14.1 -6.4 29.6 84 129 A V E +E 99 0B 11 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.939 22.3 163.7-144.4 143.5 -15.1 -4.3 26.6 85 130 A F E -E 98 0B 9 13,-1.2 13,-1.7 -2,-0.3 255,-0.1 -0.883 23.6-148.7-146.8 174.7 -18.0 -1.9 26.5 86 131 A T - 0 0 2 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.982 17.4-140.7-145.3 137.3 -19.4 1.1 24.5 87 132 A P S S+ 0 0 19 0, 0.0 2,-0.2 0, 0.0 -84,-0.1 0.702 78.6 94.3 -74.3 -9.0 -21.4 4.1 25.7 88 133 A Q - 0 0 33 8,-0.3 -2,-0.1 1,-0.1 6,-0.1 -0.570 61.5-156.5 -87.5 143.8 -23.7 3.9 22.7 89 134 A K + 0 0 131 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.464 69.1 41.4-105.6 -2.9 -27.0 2.0 23.1 90 135 A T S >> S- 0 0 46 1,-0.1 4,-1.2 0, 0.0 3,-1.1 -0.988 80.3-113.4-148.1 151.8 -27.8 1.1 19.5 91 136 A L T 34 S+ 0 0 50 -2,-0.3 3,-0.4 1,-0.2 -1,-0.1 0.842 111.4 52.8 -50.6 -46.4 -26.0 -0.1 16.5 92 137 A E T 34 S+ 0 0 136 1,-0.2 -1,-0.2 -3,-0.1 240,-0.0 0.664 114.0 40.6 -73.7 -20.3 -26.6 3.0 14.4 93 138 A E T <4 S+ 0 0 101 -3,-1.1 -1,-0.2 2,-0.0 -2,-0.2 0.523 88.9 119.6-100.8 -6.2 -25.2 5.5 17.0 94 139 A F < + 0 0 0 -4,-1.2 3,-0.1 -3,-0.4 242,-0.1 -0.318 18.4 130.9 -60.0 129.7 -22.3 3.2 18.0 95 140 A Q + 0 0 104 1,-0.3 2,-0.3 -2,-0.1 -41,-0.2 0.433 47.8 74.2-142.8 -46.8 -18.7 4.6 17.4 96 141 A D - 0 0 39 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.654 50.8-170.7 -92.3 140.9 -16.5 4.2 20.5 97 142 A V - 0 0 0 -2,-0.3 -47,-2.4 -47,-0.3 2,-0.4 -0.989 2.6-166.5-133.0 128.6 -14.9 1.0 21.6 98 143 A Y E -DE 49 85B 0 -13,-1.7 -13,-1.2 -2,-0.4 2,-0.4 -0.961 4.1-159.4-117.2 130.3 -13.1 0.5 25.0 99 144 A L E -DE 48 84B 2 -51,-2.7 -51,-2.8 -2,-0.4 2,-0.5 -0.954 5.4-157.1-107.7 135.3 -10.9 -2.4 25.8 100 145 A V E +DE 47 83B 0 -17,-2.6 -18,-4.6 -2,-0.4 -17,-1.3 -0.958 21.8 169.2-116.1 124.3 -10.2 -3.2 29.5 101 146 A M E -DE 46 81B 16 -55,-2.5 -55,-2.2 -2,-0.5 -20,-0.2 -0.729 39.8 -76.9-126.7 170.0 -7.1 -5.2 30.2 102 147 A E E -D 45 0B 30 -22,-1.5 2,-0.3 -2,-0.2 -57,-0.2 -0.389 46.1-138.0 -61.7 146.6 -4.9 -6.3 33.1 103 148 A L - 0 0 31 -59,-0.7 2,-0.2 -58,-0.1 -59,-0.1 -0.877 19.2-174.9-113.5 148.3 -2.6 -3.7 34.5 104 149 A M - 0 0 19 -2,-0.3 49,-0.2 49,-0.0 3,-0.1 -0.604 34.2-109.3-126.7-176.8 1.0 -4.2 35.6 105 150 A D S S- 0 0 96 47,-1.8 2,-0.3 1,-0.3 48,-0.2 0.854 82.0 -17.3 -88.2 -40.2 3.5 -1.8 37.2 106 151 A A E -G 152 0C 16 46,-1.8 46,-3.6 -3,-0.0 -1,-0.3 -0.980 59.7-104.7-162.4 155.6 6.0 -1.0 34.4 107 152 A N E > -G 151 0C 53 -2,-0.3 3,-0.7 44,-0.3 4,-0.5 -0.275 49.6 -96.6 -78.0 176.9 7.4 -2.0 31.0 108 153 A L T 3> S+ 0 0 0 39,-2.5 4,-2.0 42,-1.4 5,-0.2 0.552 106.3 91.3 -77.1 -7.6 10.9 -3.7 30.7 109 154 A C H 3> S+ 0 0 67 38,-0.5 4,-0.6 41,-0.2 -1,-0.2 0.904 90.1 47.2 -51.0 -42.6 12.6 -0.3 30.0 110 155 A Q H X> S+ 0 0 95 -3,-0.7 3,-0.9 1,-0.2 4,-0.9 0.956 112.4 48.8 -51.5 -56.4 13.2 0.0 33.8 111 156 A V H 34 S+ 0 0 2 -4,-0.5 -2,-0.2 1,-0.3 -1,-0.2 0.714 100.4 61.2 -70.7 -31.5 14.5 -3.5 34.3 112 157 A I H 3< S+ 0 0 3 -4,-2.0 -1,-0.3 1,-0.2 90,-0.2 0.798 106.3 49.8 -64.3 -29.7 17.0 -3.5 31.5 113 158 A Q H << S+ 0 0 124 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.758 100.8 72.1 -86.4 -27.7 18.9 -0.7 33.2 114 159 A M S < S- 0 0 53 -4,-0.9 2,-0.4 1,-0.1 -3,-0.0 0.235 90.6-107.6 -69.1-157.6 19.0 -2.3 36.6 115 160 A E - 0 0 163 87,-0.0 2,-0.3 147,-0.0 85,-0.1 -0.866 34.7-162.3-146.6 103.6 21.3 -5.2 37.3 116 161 A L - 0 0 15 -2,-0.4 2,-0.1 83,-0.3 -4,-0.0 -0.652 15.0-131.4 -98.0 143.6 19.8 -8.6 37.8 117 162 A D > - 0 0 44 -2,-0.3 4,-2.0 144,-0.1 3,-0.3 -0.312 44.1 -93.7 -67.6 169.9 21.0 -11.9 39.3 118 163 A H H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.773 119.3 55.3 -66.5 -32.8 20.6 -15.1 37.3 119 164 A E H > S+ 0 0 101 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.888 111.7 42.8 -73.8 -36.4 17.3 -16.2 38.7 120 165 A R H > S+ 0 0 59 -3,-0.3 4,-3.1 2,-0.2 5,-0.2 0.953 119.4 43.4 -69.9 -51.4 15.4 -13.0 37.9 121 166 A M H X S+ 0 0 11 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.946 119.4 43.0 -48.6 -60.1 17.0 -12.7 34.4 122 167 A S H X S+ 0 0 4 -4,-2.5 4,-1.7 -5,-0.2 -1,-0.2 0.808 115.6 50.3 -59.3 -37.4 16.5 -16.3 33.7 123 168 A Y H X S+ 0 0 17 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.897 110.1 47.6 -76.8 -41.7 12.9 -16.2 35.2 124 169 A L H X S+ 0 0 0 -4,-3.1 4,-2.8 2,-0.2 -2,-0.2 0.929 114.3 48.5 -54.6 -50.0 11.8 -13.1 33.2 125 170 A L H X S+ 0 0 1 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.852 109.4 53.2 -60.6 -39.9 13.1 -14.7 30.0 126 171 A Y H X S+ 0 0 3 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.881 111.4 45.0 -59.9 -46.3 11.4 -18.0 30.9 127 172 A Q H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.887 110.3 54.5 -67.6 -40.7 8.0 -16.2 31.3 128 173 A M H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.935 111.0 47.5 -50.8 -49.7 8.6 -14.2 28.0 129 174 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.787 108.8 51.5 -66.3 -32.8 9.1 -17.6 26.3 130 175 A C H X S+ 0 0 1 -4,-1.5 4,-1.1 2,-0.2 -1,-0.2 0.891 113.6 46.1 -72.5 -40.9 6.0 -19.2 27.8 131 176 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 3,-0.3 0.924 113.5 48.3 -59.7 -48.6 3.9 -16.3 26.6 132 177 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.907 111.0 51.0 -58.9 -45.7 5.6 -16.3 23.1 133 178 A K H X S+ 0 0 34 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.784 108.7 51.3 -63.1 -29.8 5.0 -20.1 22.8 134 179 A H H X S+ 0 0 5 -4,-1.1 4,-1.2 -3,-0.3 -2,-0.2 0.912 109.1 50.5 -78.2 -42.1 1.3 -19.7 23.7 135 180 A L H ><>S+ 0 0 1 -4,-2.2 5,-2.8 2,-0.2 3,-0.6 0.950 111.2 49.5 -50.6 -51.9 0.9 -16.9 21.1 136 181 A H H ><5S+ 0 0 20 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.900 107.1 53.3 -61.0 -45.5 2.5 -19.3 18.4 137 182 A S H 3<5S+ 0 0 49 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.764 106.6 54.5 -57.5 -30.4 0.3 -22.3 19.3 138 183 A A T <<5S- 0 0 0 -4,-1.2 179,-3.2 -3,-0.6 -1,-0.3 0.278 127.2-101.9 -83.5 5.4 -2.7 -20.0 18.8 139 184 A G T < 5S+ 0 0 38 -3,-1.9 2,-0.6 177,-0.2 -3,-0.2 0.661 81.2 134.4 79.1 15.6 -1.4 -19.1 15.3 140 185 A I < - 0 0 6 -5,-2.8 2,-0.5 -6,-0.2 -1,-0.2 -0.880 32.3-176.7-106.1 110.8 -0.1 -15.7 16.4 141 186 A I - 0 0 39 -2,-0.6 24,-0.1 1,-0.1 44,-0.1 -0.937 11.8-160.6-100.9 125.6 3.5 -14.6 15.4 142 187 A H + 0 0 0 -2,-0.5 22,-0.4 43,-0.2 23,-0.3 0.903 12.7 178.6 -82.4 -47.4 4.2 -11.3 17.0 143 188 A R + 0 0 65 42,-0.2 31,-0.2 1,-0.2 -1,-0.1 0.225 68.6 70.1 67.2 -16.6 7.0 -9.9 15.0 144 189 A D + 0 0 19 -2,-0.3 -1,-0.2 29,-0.1 5,-0.1 0.113 61.0 150.0-125.1 24.8 7.1 -6.7 17.1 145 190 A L + 0 0 1 27,-0.1 27,-0.1 3,-0.1 20,-0.1 -0.251 13.9 139.0 -54.0 138.9 8.5 -7.7 20.5 146 191 A K > - 0 0 33 25,-0.1 3,-1.4 48,-0.0 -38,-0.1 -0.923 64.5 -85.7-170.4 169.0 10.5 -5.1 22.5 147 192 A P G > S+ 0 0 6 0, 0.0 -39,-2.5 0, 0.0 3,-0.7 0.678 118.1 61.3 -53.8 -28.8 10.9 -3.7 26.1 148 193 A S G 3 S+ 0 0 52 1,-0.2 -3,-0.1 -41,-0.2 -41,-0.0 0.675 106.3 42.6 -81.1 -19.8 7.9 -1.3 25.9 149 194 A N G < S+ 0 0 5 -3,-1.4 12,-3.1 -5,-0.1 2,-0.5 0.062 98.6 82.5-113.0 18.5 5.2 -4.0 25.2 150 195 A I E < - H 0 160C 0 -3,-0.7 -42,-1.4 10,-0.2 2,-0.3 -0.999 68.8-167.3-121.0 120.4 6.6 -6.4 27.8 151 196 A V E -GH 107 159C 18 8,-3.0 8,-2.5 -2,-0.5 2,-0.3 -0.846 5.5-165.0-122.9 153.6 5.3 -5.4 31.2 152 197 A V E -GH 106 158C 0 -46,-3.6 -46,-1.8 -2,-0.3 -47,-1.8 -0.888 12.7-139.6-139.6 159.4 6.2 -6.5 34.7 153 198 A K > - 0 0 65 4,-2.1 3,-2.5 -2,-0.3 4,-0.2 -0.902 33.0-114.0-120.6 152.2 5.1 -6.4 38.3 154 199 A S T 3 S+ 0 0 65 -2,-0.3 196,-3.1 1,-0.3 199,-0.1 0.654 116.2 66.8 -61.1 -16.3 7.2 -5.9 41.4 155 200 A D T 3 S- 0 0 71 194,-0.3 -1,-0.3 2,-0.1 194,-0.1 0.223 120.8-109.6 -80.4 10.3 6.4 -9.6 42.3 156 201 A C S < S+ 0 0 0 -3,-2.5 2,-0.2 1,-0.2 -2,-0.2 0.588 74.7 136.4 73.0 8.3 8.6 -10.5 39.2 157 202 A T - 0 0 40 -4,-0.2 -4,-2.1 191,-0.1 2,-0.3 -0.481 35.7-160.4 -75.7 161.5 5.6 -11.7 37.1 158 203 A L E - H 0 152C 0 -6,-0.2 2,-0.3 -82,-0.2 -6,-0.2 -0.999 13.6-172.0-153.8 141.2 5.5 -10.6 33.4 159 204 A K E - H 0 151C 30 -8,-2.5 -8,-3.0 -2,-0.3 2,-0.4 -0.942 22.5-129.3-135.8 150.7 3.1 -10.3 30.6 160 205 A I E -fH 78 150C 1 -83,-1.6 -81,-2.5 -2,-0.3 -10,-0.2 -0.873 24.6-147.3-100.4 135.1 3.3 -9.6 26.9 161 206 A L - 0 0 48 -12,-3.1 -82,-0.3 -2,-0.4 -1,-0.2 0.941 58.1 -3.7 -76.5 -95.7 1.0 -6.8 25.7 162 207 A D S S- 0 0 29 2,-0.2 3,-0.2 -13,-0.1 -83,-0.1 0.238 77.5 -96.7 -85.6-153.0 -0.5 -7.0 22.2 163 208 A F S S- 0 0 9 -21,-0.1 2,-0.2 -22,-0.1 -22,-0.1 -0.301 71.3 -70.0-174.6 83.6 0.2 -9.5 19.4 164 209 A G S S+ 0 0 1 -22,-0.4 2,-0.3 -24,-0.1 -2,-0.2 -0.412 113.0 30.5 -80.3 -76.0 2.1 -8.3 17.7 165 210 A L 0 0 66 -23,-0.3 -24,-0.1 1,-0.3 -20,-0.0 -0.574 360.0 360.0 68.8 57.5 1.5 -5.9 15.9 166 211 A A 0 0 77 -2,-0.3 -1,-0.3 -22,-0.1 -100,-0.1 0.192 360.0 360.0 176.8 360.0 -0.6 -4.1 17.2 167 ! 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 0.0 168 225 A V 0 0 152 0, 0.0 41,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -33.7 10.1 3.8 16.0 169 226 A T > + 0 0 19 4,-0.0 3,-0.9 -23,-0.0 4,-0.1 0.170 360.0 118.8 167.4 -0.4 10.5 0.1 17.1 170 227 A R G > + 0 0 42 1,-0.2 3,-2.6 2,-0.1 8,-0.1 0.816 51.9 78.3 -62.9 -39.2 13.2 -1.1 14.7 171 228 A Y G 3 S+ 0 0 72 1,-0.3 35,-0.3 23,-0.0 -1,-0.2 0.621 99.8 40.8 -48.9 -26.1 16.0 -2.1 17.1 172 229 A Y G < S+ 0 0 16 -3,-0.9 -1,-0.3 -27,-0.1 2,-0.3 0.285 86.9 118.8-109.7 1.6 14.5 -5.4 18.0 173 230 A R < - 0 0 48 -3,-2.6 -29,-0.1 -4,-0.1 15,-0.1 -0.568 67.4-110.1 -84.5 138.2 13.2 -6.5 14.6 174 231 A A > - 0 0 1 -2,-0.3 4,-2.7 -31,-0.2 3,-0.3 -0.164 19.8-119.5 -63.5 151.0 14.6 -9.7 13.0 175 232 A P H > S+ 0 0 3 0, 0.0 4,-1.2 0, 0.0 6,-0.3 0.883 115.2 57.6 -59.3 -42.2 16.9 -9.6 10.0 176 233 A E H 4>S+ 0 0 0 107,-0.3 5,-2.1 2,-0.2 3,-0.0 0.877 112.7 42.8 -55.9 -36.0 14.4 -11.6 7.9 177 234 A V H >45S+ 0 0 35 -3,-0.3 3,-2.7 3,-0.2 -1,-0.2 0.983 114.1 47.6 -68.6 -62.3 11.9 -8.8 8.6 178 235 A I H 3<5S+ 0 0 19 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.488 117.8 43.9 -65.4 -3.8 14.3 -5.9 8.1 179 236 A L T 3<5S- 0 0 13 -4,-1.2 55,-0.3 -5,-0.2 -1,-0.3 0.075 113.3-117.4-120.3 17.3 15.5 -7.5 4.8 180 237 A G T < 5 + 0 0 44 -3,-2.7 -3,-0.2 1,-0.1 -4,-0.1 0.665 66.9 137.3 54.5 23.4 12.0 -8.4 3.6 181 238 A M < - 0 0 39 -5,-2.1 -1,-0.1 -6,-0.3 2,-0.1 -0.217 63.0 -93.9 -70.8-179.6 12.5 -12.2 3.5 182 239 A G - 0 0 56 -3,-0.1 2,-0.3 -2,-0.0 -1,-0.2 -0.173 43.4-151.3 -80.0-165.6 9.6 -14.2 5.0 183 240 A Y - 0 0 106 -3,-0.1 2,-0.2 -2,-0.1 -1,-0.0 -0.973 13.1-170.0-158.8 156.3 9.5 -15.3 8.6 184 241 A K > - 0 0 141 -2,-0.3 3,-1.6 0, 0.0 4,-0.3 -0.635 56.1 -51.0-132.5-152.4 8.2 -18.0 10.9 185 242 A E T > S+ 0 0 97 1,-0.3 3,-1.8 -2,-0.2 4,-0.3 0.894 124.5 59.6 -49.8 -51.2 7.9 -18.7 14.6 186 243 A N T 3> S+ 0 0 24 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.418 77.1 89.9 -69.6 3.3 11.6 -18.0 15.5 187 244 A V H <> S+ 0 0 2 -3,-1.6 4,-0.8 1,-0.2 -1,-0.3 0.827 88.2 52.9 -58.6 -32.8 11.4 -14.4 14.3 188 245 A D H <> S+ 0 0 0 -3,-1.8 4,-1.5 -4,-0.3 -1,-0.2 0.786 98.2 65.2 -76.5 -27.2 10.3 -13.7 17.9 189 246 A I H > S+ 0 0 0 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.892 95.7 57.0 -57.8 -39.4 13.4 -15.5 19.1 190 247 A W H X S+ 0 0 0 -4,-1.2 4,-1.4 1,-0.2 3,-0.2 0.912 107.2 48.4 -55.9 -46.7 15.6 -12.8 17.5 191 248 A S H X S+ 0 0 2 -4,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.783 104.6 57.1 -67.6 -33.2 13.8 -10.2 19.6 192 249 A V H X S+ 0 0 0 -4,-1.5 4,-3.1 2,-0.2 -1,-0.2 0.820 107.8 50.3 -65.9 -33.8 14.2 -12.1 22.8 193 250 A G H X S+ 0 0 0 -4,-1.5 4,-2.5 -3,-0.2 -2,-0.2 0.810 107.9 52.0 -73.3 -35.4 18.0 -12.0 22.2 194 251 A C H X S+ 0 0 2 -4,-1.4 4,-1.6 2,-0.2 11,-0.3 0.915 115.6 41.8 -62.8 -45.0 17.9 -8.3 21.6 195 252 A I H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.964 119.3 43.9 -64.7 -53.7 16.1 -7.8 24.9 196 253 A M H X S+ 0 0 0 -4,-3.1 4,-1.6 2,-0.2 -2,-0.2 0.866 113.9 49.4 -60.4 -44.2 18.3 -10.4 26.8 197 254 A G H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.876 114.1 46.4 -62.8 -39.1 21.5 -9.1 25.3 198 255 A E H X S+ 0 0 13 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.702 105.9 59.2 -72.8 -26.8 20.5 -5.6 26.2 199 256 A M H < S+ 0 0 6 -4,-1.6 -83,-0.3 2,-0.2 -2,-0.2 0.853 112.7 40.2 -67.5 -40.0 19.5 -6.7 29.7 200 257 A V H < S+ 0 0 2 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.823 125.7 35.1 -73.4 -37.0 23.1 -7.9 30.2 201 258 A R H < S- 0 0 57 -4,-1.7 -2,-0.2 2,-0.2 -3,-0.2 0.636 94.2-135.6-100.0 -20.0 24.8 -4.9 28.5 202 259 A H S < S+ 0 0 50 -4,-2.1 2,-0.3 1,-0.2 -3,-0.1 0.504 75.0 84.3 73.3 10.0 22.4 -2.1 29.5 203 260 A K S S- 0 0 91 -6,-0.2 -2,-0.2 -5,-0.1 -1,-0.2 -0.974 92.6 -86.8-134.6 156.1 22.4 -0.7 26.0 204 261 A I - 0 0 54 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.355 33.2-146.6 -51.2 120.8 20.5 -1.3 22.8 205 262 A L S S+ 0 0 5 -11,-0.3 -1,-0.1 1,-0.3 -33,-0.1 0.931 89.4 25.5 -60.2 -48.2 22.4 -4.0 20.9 206 263 A F S S+ 0 0 2 -35,-0.3 -1,-0.3 -12,-0.0 12,-0.1 -0.765 78.5 175.3-127.2 79.2 21.6 -2.6 17.4 207 264 A P + 0 0 47 0, 0.0 10,-0.2 0, 0.0 -2,-0.0 0.284 18.0 116.9 -62.5-160.5 20.9 1.2 17.4 208 265 A G - 0 0 7 8,-0.1 2,-0.2 9,-0.1 9,-0.0 0.689 56.6-121.2 66.3 124.0 20.2 3.5 14.2 209 266 A R S S+ 0 0 172 -39,-0.1 4,-0.4 4,-0.1 5,-0.0 -0.193 90.6 33.4 62.2 86.3 18.0 5.3 12.9 210 267 A D S >> S- 0 0 50 -2,-0.2 4,-1.3 2,-0.1 3,-0.7 0.575 86.6-108.0 62.7 139.7 17.2 3.9 9.5 211 268 A Y H 3> S+ 0 0 82 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.867 116.9 69.5 -56.6 -38.0 17.4 0.1 8.8 212 269 A I H 3> S+ 0 0 99 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.854 106.0 37.0 -42.4 -50.4 20.6 0.9 6.8 213 270 A D H <> S+ 0 0 36 -3,-0.7 4,-1.7 -4,-0.4 -1,-0.3 0.696 111.3 61.4 -82.3 -24.5 22.5 1.7 10.0 214 271 A Q H X S+ 0 0 1 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.936 103.2 49.6 -68.7 -47.4 20.6 -1.1 11.9 215 272 A W H X S+ 0 0 5 -4,-3.2 4,-2.2 1,-0.2 5,-0.3 0.876 106.2 59.5 -54.0 -40.7 22.1 -3.7 9.5 216 273 A N H X S+ 0 0 36 -4,-1.0 4,-2.9 -5,-0.3 -2,-0.2 0.944 105.8 45.3 -56.0 -47.4 25.6 -2.1 10.1 217 274 A K H X S+ 0 0 43 -4,-1.7 4,-0.9 -10,-0.2 -1,-0.2 0.784 110.2 56.3 -72.3 -24.5 25.4 -2.7 13.8 218 275 A V H >X S+ 0 0 1 -4,-1.5 4,-3.3 2,-0.2 3,-1.2 1.000 115.1 35.5 -63.8 -64.1 24.2 -6.2 13.2 219 276 A I H 3X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.3 -2,-0.2 0.822 111.2 62.3 -59.0 -38.7 27.2 -7.2 11.0 220 277 A E H 3< S+ 0 0 83 -4,-2.9 -1,-0.3 -5,-0.3 29,-0.2 0.810 121.3 24.1 -53.8 -31.2 29.7 -5.1 13.1 221 278 A Q H << S+ 0 0 20 -3,-1.2 29,-2.6 -4,-0.9 30,-0.6 0.779 133.3 34.2-107.2 -38.4 28.9 -7.3 16.0 222 279 A L H < S- 0 0 36 -4,-3.3 -3,-0.2 27,-0.2 -2,-0.2 0.402 104.8-123.1-101.0 -1.8 27.7 -10.6 14.6 223 280 A G < - 0 0 2 -4,-1.9 25,-0.2 -5,-0.3 -1,-0.2 0.192 44.4 -52.2 71.8 162.2 29.9 -10.6 11.5 224 281 A T - 0 0 29 23,-2.3 22,-0.1 1,-0.1 18,-0.0 -0.492 67.0-114.4 -68.6 135.9 28.7 -10.9 7.9 225 282 A P - 0 0 24 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.089 43.1 -73.0 -56.7 176.5 26.3 -13.9 7.4 226 283 A C > - 0 0 75 1,-0.1 4,-1.1 0, 0.0 3,-0.2 -0.551 39.4-117.8 -76.8 144.8 27.1 -16.9 5.2 227 284 A P H > S+ 0 0 86 0, 0.0 4,-0.5 0, 0.0 3,-0.2 0.809 113.7 57.1 -46.6 -40.2 27.1 -16.6 1.4 228 285 A E H >> S+ 0 0 156 1,-0.2 3,-2.2 2,-0.2 4,-1.2 0.968 102.3 54.0 -61.7 -49.2 24.3 -19.1 1.0 229 286 A F H 34 S+ 0 0 3 1,-0.3 4,-0.3 -3,-0.2 -1,-0.2 0.817 104.9 57.6 -46.3 -37.0 22.0 -17.0 3.3 230 287 A M H 3< S+ 0 0 6 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.500 97.7 59.1 -82.1 -10.1 22.7 -14.0 1.0 231 288 A K H << S+ 0 0 108 -3,-2.2 -1,-0.2 -4,-0.5 -2,-0.2 0.869 95.9 62.2 -76.4 -45.9 21.3 -15.9 -2.1 232 289 A K S < S+ 0 0 106 -4,-1.2 2,-0.2 2,-0.1 -2,-0.2 0.691 89.0 94.2 -48.1 -24.8 17.9 -16.3 -0.4 233 290 A L S S- 0 0 2 -4,-0.3 3,-0.1 1,-0.1 -53,-0.1 -0.542 92.7 -97.3 -77.5 139.3 17.7 -12.5 -0.4 234 291 A Q >> - 0 0 109 -55,-0.3 4,-2.2 -2,-0.2 2,-1.1 -0.217 44.9-100.1 -49.4 133.4 15.9 -10.7 -3.3 235 292 A P T 34 S+ 0 0 103 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 -0.599 119.6 45.1 -54.8 98.8 18.4 -9.5 -5.9 236 293 A T T 3> S+ 0 0 96 -2,-1.1 4,-1.4 -3,-0.1 5,-0.1 -0.444 110.7 49.2 155.4 -55.0 18.4 -5.9 -4.7 237 294 A V H <> S+ 0 0 36 -3,-0.8 4,-2.7 2,-0.2 5,-0.2 0.918 114.3 50.4 -64.4 -41.3 18.7 -6.5 -0.9 238 295 A R H X S+ 0 0 56 -4,-2.2 4,-4.4 2,-0.2 5,-0.4 0.937 103.1 54.9 -63.4 -57.8 21.6 -8.8 -1.7 239 296 A N H > S+ 0 0 83 1,-0.2 4,-0.9 -5,-0.2 -1,-0.2 0.891 115.5 42.5 -38.9 -53.3 23.6 -6.5 -4.0 240 297 A Y H >< S+ 0 0 90 -4,-1.4 3,-0.5 2,-0.2 -2,-0.2 0.955 119.5 41.6 -55.8 -59.4 23.5 -4.0 -1.1 241 298 A V H >< S+ 0 0 2 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.889 112.4 54.3 -61.0 -46.0 24.2 -6.5 1.7 242 299 A E H 3< S+ 0 0 64 -4,-4.4 -1,-0.2 1,-0.2 -2,-0.2 0.762 106.9 53.0 -61.0 -26.7 26.9 -8.5 -0.3 243 300 A N T << S+ 0 0 122 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.134 85.4 102.1-105.0 18.7 28.9 -5.2 -0.9 244 301 A R S < S- 0 0 69 -3,-1.3 -3,-0.0 1,-0.2 -20,-0.0 -0.511 90.5 -71.8 -84.4 161.6 29.2 -4.0 2.7 245 302 A P - 0 0 63 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 -0.277 51.1-118.2 -52.1 146.3 32.5 -4.5 4.6 246 303 A K - 0 0 130 -3,-0.1 2,-0.3 -23,-0.1 -4,-0.0 -0.774 34.6-173.7-101.3 98.0 33.1 -8.1 5.6 247 304 A Y - 0 0 90 -2,-0.9 -23,-2.3 1,-0.1 -26,-0.1 -0.653 26.2-151.7 -94.0 148.5 33.3 -8.6 9.3 248 305 A A - 0 0 108 -2,-0.3 -1,-0.1 -25,-0.2 2,-0.1 0.708 52.5-115.6 -80.4 -22.0 34.2 -11.8 11.2 249 306 A G - 0 0 21 -29,-0.2 -27,-0.2 -30,-0.1 -1,-0.2 -0.044 14.9-100.0 93.1 156.9 32.0 -10.8 14.1 250 307 A L - 0 0 73 -29,-2.6 4,-0.3 1,-0.1 -28,-0.1 0.734 55.6-128.1 -86.4 -19.0 33.1 -10.0 17.6 251 308 A T > - 0 0 90 -30,-0.6 4,-2.5 3,-0.1 5,-0.1 0.161 20.6 -92.6 78.2 155.8 32.2 -13.3 19.2 252 309 A F H > S+ 0 0 36 2,-0.2 4,-2.8 1,-0.2 -1,-0.1 0.830 120.3 54.8 -79.0 -38.6 30.0 -13.9 22.3 253 310 A P H 4 S+ 0 0 72 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.922 115.7 42.8 -54.2 -42.3 32.7 -14.0 25.0 254 311 A K H 4 S+ 0 0 130 -4,-0.3 -2,-0.2 1,-0.2 -3,-0.1 0.931 117.4 45.0 -68.4 -51.2 33.8 -10.6 23.7 255 312 A L H < S+ 0 0 5 -4,-2.5 -1,-0.2 1,-0.3 -3,-0.2 0.864 132.9 20.2 -55.8 -43.7 30.3 -9.2 23.3 256 313 A F S < S+ 0 0 2 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.1 -0.690 84.4 179.7-133.0 77.0 29.2 -10.5 26.7 257 314 A P > - 0 0 43 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.229 45.1-101.8 -79.6 169.9 32.2 -11.2 28.9 258 315 A D G > S+ 0 0 76 1,-0.3 3,-2.8 2,-0.2 5,-0.2 0.866 116.1 74.1 -55.1 -37.1 32.1 -12.6 32.5 259 316 A S G 3 S+ 0 0 108 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.625 93.6 56.0 -49.0 -17.5 32.7 -9.0 33.8 260 317 A L G < S+ 0 0 63 -3,-1.9 -1,-0.3 3,-0.1 -2,-0.2 0.444 99.3 71.3 -99.2 -5.1 29.1 -8.3 32.8 261 318 A F S < S- 0 0 17 -3,-2.8 -144,-0.1 2,-0.5 9,-0.1 -0.737 101.7 -88.9-116.5 156.7 27.4 -11.1 34.8 262 319 A P 0 0 59 0, 0.0 -145,-0.1 0, 0.0 -3,-0.1 0.593 360.0 360.0 -33.6 -24.2 26.6 -11.9 38.5 263 320 A A 0 0 39 3,-0.3 -2,-0.5 -5,-0.2 -3,-0.1 -0.910 360.0 360.0-171.1 360.0 30.0 -13.5 38.2 264 ! 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 0.0 265 324 A H 0 0 196 0, 0.0 -2,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 78.0 30.8 -18.8 40.2 266 325 A N + 0 0 60 2,-0.1 4,-0.4 1,-0.1 -3,-0.3 -0.924 360.0 117.7 54.6 17.4 28.3 -18.1 38.6 267 326 A K + 0 0 46 2,-0.2 2,-0.2 3,-0.1 -1,-0.1 -0.222 66.6 54.3 173.6 79.1 30.7 -19.6 36.1 268 327 A L S S+ 0 0 61 0, 0.0 3,-0.4 0, 0.0 2,-0.1 0.503 114.5 43.3 20.8-141.2 29.0 -22.1 35.3 269 328 A K S > S+ 0 0 52 1,-0.4 4,-1.5 2,-0.2 -2,-0.2 -0.452 92.8 63.2 154.7 -57.2 26.5 -20.0 34.5 270 329 A A H > S+ 0 0 0 -4,-0.4 4,-2.3 2,-0.2 -1,-0.4 0.744 105.8 58.7 -59.5 -33.7 27.3 -16.9 32.6 271 330 A S H > S+ 0 0 55 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.781 101.1 54.3 -71.1 -28.8 28.4 -19.3 29.9 272 331 A Q H > S+ 0 0 56 2,-0.2 4,-2.3 3,-0.2 27,-0.2 0.947 112.5 42.6 -62.9 -51.1 24.9 -20.7 29.9 273 332 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.842 116.0 49.3 -58.3 -42.2 23.5 -17.2 29.3 274 333 A R H X S+ 0 0 34 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.897 110.3 52.2 -64.0 -44.1 26.3 -16.5 26.7 275 334 A D H X S+ 0 0 59 -4,-2.2 4,-1.1 2,-0.2 3,-0.4 0.932 109.0 47.3 -60.4 -51.8 25.4 -19.8 25.1 276 335 A L H >X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.3 3,-0.8 0.917 112.6 50.2 -55.9 -49.3 21.7 -19.1 24.7 277 336 A L H 3X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.3 0.768 104.9 57.7 -57.8 -29.8 22.5 -15.6 23.3 278 337 A S H 3< S+ 0 0 32 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.792 114.8 38.4 -74.4 -24.0 24.9 -17.2 20.8 279 338 A K H << S+ 0 0 79 -4,-1.1 10,-2.3 -3,-0.8 3,-0.3 0.683 116.8 48.6 -92.4 -31.1 21.9 -19.3 19.6 280 339 A M H < S+ 0 0 1 -4,-2.4 2,-1.3 1,-0.2 -87,-0.2 0.871 105.2 59.0 -76.4 -39.8 19.2 -16.6 19.8 281 340 A L S < S+ 0 0 4 -4,-1.8 2,-0.5 -5,-0.2 -1,-0.2 -0.511 72.4 134.7 -95.1 69.1 21.2 -13.9 18.0 282 341 A V - 0 0 20 -2,-1.3 6,-0.2 -3,-0.3 5,-0.1 -0.974 50.6-146.8-123.1 114.4 21.7 -15.8 14.8 283 342 A I S S+ 0 0 13 -2,-0.5 -107,-0.3 -61,-0.1 -1,-0.1 0.888 85.4 69.1 -53.2 -43.3 21.1 -13.8 11.6 284 343 A D S >> S- 0 0 22 1,-0.2 3,-2.1 -109,-0.1 4,-0.9 -0.670 72.6-152.9 -81.1 116.8 19.8 -16.8 9.7 285 344 A P G >4 S+ 0 0 19 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.824 96.5 61.5 -61.5 -31.4 16.5 -18.0 11.0 286 345 A A G 34 S+ 0 0 85 1,-0.2 -3,-0.1 -3,-0.0 -2,-0.1 0.622 110.2 40.3 -67.5 -15.9 17.3 -21.5 9.8 287 346 A K G <4 S+ 0 0 138 -3,-2.1 -1,-0.2 -5,-0.1 2,-0.1 0.535 98.1 102.5-104.0 -4.7 20.3 -21.5 12.2 288 347 A R S << S- 0 0 14 -4,-0.9 -8,-0.2 -3,-0.5 -102,-0.1 -0.403 80.2-100.6 -82.7 149.0 18.5 -19.8 15.1 289 348 A I - 0 0 17 -10,-2.3 -1,-0.1 -13,-0.2 -100,-0.1 -0.336 37.3-131.8 -61.0 144.4 17.2 -21.5 18.2 290 349 A S > - 0 0 45 1,-0.1 4,-1.8 -101,-0.1 5,-0.1 -0.337 26.0-101.5 -85.5 178.1 13.4 -22.3 18.3 291 350 A V H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.953 121.2 51.3 -65.3 -44.7 11.0 -21.5 21.1 292 351 A D H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.888 111.8 43.2 -59.1 -47.8 11.1 -25.1 22.2 293 352 A D H > S+ 0 0 92 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.828 110.9 55.6 -71.8 -36.3 14.9 -25.5 22.4 294 353 A A H < S+ 0 0 0 -4,-1.8 6,-0.3 2,-0.2 -1,-0.2 0.863 112.0 45.1 -58.5 -37.6 15.3 -22.1 24.1 295 354 A L H < S+ 0 0 4 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.804 113.2 48.1 -76.2 -35.1 12.8 -23.4 26.7 296 355 A Q H < S+ 0 0 112 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.539 90.1 116.2 -72.9 -11.8 14.6 -26.8 27.0 297 356 A H S >X S- 0 0 11 -4,-0.6 4,-3.8 -3,-0.2 3,-1.5 -0.426 76.9-121.1 -67.0 135.6 17.9 -24.8 27.2 298 357 A P H 3> S+ 0 0 77 0, 0.0 4,-0.6 0, 0.0 -1,-0.1 0.760 111.4 54.9 -45.5 -38.9 19.8 -25.2 30.6 299 358 A Y H 34 S+ 0 0 0 -27,-0.2 -26,-0.1 1,-0.1 -4,-0.1 0.856 124.6 23.7 -65.4 -34.4 19.7 -21.5 31.4 300 359 A I H X4 S+ 0 0 0 -3,-1.5 3,-2.2 -6,-0.3 4,-0.2 0.790 107.3 75.4 -95.5 -40.4 15.8 -21.4 31.0 301 360 A N H >< S+ 0 0 66 -4,-3.8 3,-1.4 1,-0.3 -2,-0.1 0.597 74.7 80.8 -58.6 -16.1 14.9 -25.0 31.7 302 361 A V T 3< S+ 0 0 68 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.1 0.838 95.1 49.1 -51.5 -34.2 15.4 -24.7 35.5 303 362 A W T < S+ 0 0 15 -3,-2.2 -1,-0.2 -181,-0.1 -2,-0.2 0.474 80.9 146.1 -90.6 -2.1 11.9 -23.1 35.6 304 363 A Y < + 0 0 101 -3,-1.4 3,-0.1 -4,-0.2 -3,-0.0 -0.025 16.5 169.5 -51.4 125.3 10.1 -25.7 33.6 305 364 A D > - 0 0 57 1,-0.1 4,-1.9 0, 0.0 3,-0.4 -0.994 32.0-143.0-130.6 127.6 6.5 -26.4 34.6 306 365 A P H > S+ 0 0 77 0, 0.0 4,-1.9 0, 0.0 5,-0.4 0.809 100.0 58.6 -54.0 -33.1 4.3 -28.5 32.3 307 366 A A H 4 S+ 0 0 72 1,-0.2 4,-0.4 2,-0.2 -3,-0.0 0.864 112.2 37.1 -67.8 -42.0 1.2 -26.3 33.1 308 367 A E H 4 S+ 0 0 13 -3,-0.4 -1,-0.2 2,-0.1 -231,-0.1 0.791 124.6 39.3 -79.6 -31.8 2.9 -23.1 31.9 309 368 A V H < S+ 0 0 8 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.1 0.922 120.5 36.3 -85.7 -53.2 4.7 -24.6 28.9 310 369 A E S < S+ 0 0 108 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.1 0.521 79.0 133.8 -85.1 -10.1 2.4 -27.2 27.3 311 370 A A - 0 0 33 -4,-0.4 -4,-0.1 -5,-0.4 -3,-0.0 -0.197 51.0-139.7 -38.9 111.2 -0.9 -25.3 27.9 312 371 A P - 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -178,-0.1 -0.536 22.5-106.5 -78.4 150.2 -2.9 -25.4 24.6 313 372 A P - 0 0 25 0, 0.0 -240,-0.2 0, 0.0 3,-0.2 -0.337 21.8-115.5 -76.7 156.3 -4.8 -22.2 23.5 314 373 A P S S- 0 0 80 0, 0.0 2,-0.3 0, 0.0 -241,-0.1 0.829 100.6 -0.9 -60.8 -31.1 -8.6 -21.8 23.8 315 374 A Q S S- 0 0 124 -243,-1.1 2,-0.5 3,-0.0 3,-0.0 -0.968 70.6-122.3-152.1 143.6 -8.6 -21.6 20.0 316 375 A I - 0 0 106 -2,-0.3 -177,-0.2 -3,-0.2 -178,-0.2 -0.809 50.8-103.9 -79.7 126.6 -6.0 -21.7 17.2 317 376 A Y - 0 0 24 -179,-3.2 2,-0.9 -2,-0.5 -248,-0.1 -0.267 36.3 -98.6 -58.9 131.7 -6.5 -18.4 15.3 318 377 A D - 0 0 77 1,-0.2 3,-0.2 -2,-0.0 -1,-0.2 -0.378 27.6-149.7 -57.8 94.4 -8.3 -18.6 12.0 319 378 A K S S+ 0 0 136 -2,-0.9 2,-0.2 1,-0.2 -1,-0.2 0.813 82.7 25.1 -27.4 -45.5 -5.3 -18.6 9.6 320 379 A Q + 0 0 93 2,-0.1 -1,-0.2 -3,-0.0 2,-0.2 -0.843 67.1 95.9-168.0 136.7 -7.9 -16.9 7.3 321 380 A L S S+ 0 0 95 2,-0.4 3,-0.2 -2,-0.2 4,-0.0 0.053 75.8 102.7 -25.4 121.6 -10.5 -15.2 7.5 322 381 A D S S+ 0 0 53 -2,-0.2 2,-0.2 1,-0.1 -2,-0.1 0.372 81.3 59.0-177.9 -17.3 -7.6 -12.6 7.2 323 382 A E S S+ 0 0 122 2,-0.0 -2,-0.4 0, 0.0 -1,-0.1 0.130 81.0 91.4 65.3 124.7 -8.8 -12.6 4.2 324 383 A R - 0 0 139 -3,-0.2 2,-0.3 -2,-0.2 -3,-0.0 0.607 52.1-150.8 89.1 118.9 -12.6 -11.6 4.1 325 384 A E - 0 0 77 -4,-0.0 2,-0.3 -3,-0.0 -2,-0.0 -0.851 12.1-176.6-114.5 155.0 -13.9 -8.0 3.8 326 385 A H - 0 0 36 -2,-0.3 2,-0.1 -269,-0.1 -265,-0.1 -0.908 32.2 -98.3-136.4 168.9 -17.1 -6.4 5.1 327 386 A T > - 0 0 62 -2,-0.3 4,-1.0 1,-0.1 5,-0.2 -0.381 39.3-108.5 -77.1 168.3 -18.8 -3.1 4.7 328 387 A I H > S+ 0 0 64 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.840 125.8 53.4 -71.5 -28.1 -18.4 -0.5 7.5 329 388 A E H > S+ 0 0 164 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.902 111.6 46.2 -62.8 -40.0 -22.0 -1.2 8.5 330 389 A E H > S+ 0 0 99 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.564 111.3 50.5 -81.9 -11.8 -21.1 -4.9 8.6 331 390 A W H X S+ 0 0 10 -4,-1.0 4,-2.5 2,-0.2 5,-0.2 0.857 108.0 53.9 -89.6 -43.1 -17.9 -4.4 10.6 332 391 A K H X S+ 0 0 37 -4,-1.9 4,-3.4 1,-0.2 5,-0.3 0.911 108.1 50.7 -47.1 -50.8 -19.9 -2.3 13.1 333 392 A E H X S+ 0 0 97 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.894 111.7 46.2 -62.0 -43.7 -22.4 -5.2 13.5 334 393 A L H X S+ 0 0 41 -4,-0.9 4,-0.8 2,-0.2 -1,-0.2 0.876 118.1 42.4 -65.8 -40.0 -19.6 -7.7 14.2 335 394 A I H >X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 3,-0.6 0.899 111.7 52.3 -77.0 -45.8 -17.8 -5.4 16.7 336 395 A Y H 3< S+ 0 0 43 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.894 105.1 60.1 -53.3 -41.6 -21.0 -4.2 18.5 337 396 A K H 3< S+ 0 0 121 -4,-1.7 3,-0.3 -5,-0.3 -1,-0.2 0.845 112.6 36.1 -51.9 -43.8 -21.8 -7.9 18.9 338 397 A E H X< S+ 0 0 33 -4,-0.8 3,-2.3 -3,-0.6 2,-1.1 0.831 105.3 71.2 -74.6 -37.0 -18.6 -8.3 20.8 339 398 A V T 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -253,-0.2 -0.065 118.9 17.8 -86.8 38.0 -18.8 -4.9 22.6 340 399 A M T 3 S+ 0 0 90 -2,-1.1 2,-1.9 -3,-0.3 -1,-0.3 0.069 83.7 142.1 175.1 20.0 -21.7 -6.0 24.8 341 400 A N < 0 0 78 -3,-2.3 -2,-0.1 1,-0.2 -3,-0.1 0.035 360.0 360.0 -68.5 33.9 -21.1 -9.8 24.2 342 401 A S 0 0 165 -2,-1.9 -1,-0.2 0, 0.0 -3,-0.1 0.850 360.0 360.0 65.4 360.0 -22.1 -10.4 27.9 343 !* 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 0.0 344 154 J P 0 0 147 0, 0.0 2,-0.8 0, 0.0 -41,-0.0 0.000 360.0 360.0 360.0 1.7 12.6 -24.7 41.4 345 155 J K - 0 0 175 3,-0.0 3,-0.1 0, 0.0 -42,-0.0 -0.822 360.0-154.5 -93.1 108.6 11.9 -21.7 43.8 346 156 J R - 0 0 57 -2,-0.8 2,-0.1 1,-0.1 -226,-0.1 -0.261 25.3 -89.9 -75.5 158.3 11.3 -18.6 41.6 347 157 J P - 0 0 16 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.430 29.6-167.3 -64.3 151.6 11.8 -15.0 42.6 348 158 J T + 0 0 104 -2,-0.1 2,-0.3 1,-0.1 -191,-0.1 0.324 66.7 56.5-118.7 -3.2 8.9 -13.3 44.3 349 159 J T - 0 0 80 -194,-0.1 2,-0.3 -193,-0.1 -194,-0.3 -0.976 51.2-175.3-138.8 148.6 10.2 -9.7 44.1 350 160 J L - 0 0 3 -196,-3.1 2,-1.7 -2,-0.3 -194,-0.2 -0.923 30.4-127.0-148.2 114.6 11.4 -7.3 41.4 351 161 J N + 0 0 109 -2,-0.3 -196,-0.1 1,-0.2 -197,-0.0 -0.399 42.1 156.8 -75.5 87.3 12.8 -3.9 42.3 352 162 J L 0 0 28 -2,-1.7 -1,-0.2 -238,-0.0 -198,-0.0 0.417 360.0 360.0 -86.3 3.3 10.8 -1.5 40.1 353 163 J F 0 0 244 -199,-0.1 -2,-0.0 -3,-0.1 0, 0.0 -0.624 360.0 360.0 -82.5 360.0 11.6 1.1 42.7