==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-APR-07 2PE1 . COMPND 2 MOLECULE: 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.WHITLOW,M.ADLER . 276 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14122.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 0 1 1 1 0 1 1 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 0 1 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 74 A P 0 0 177 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 109.9 -31.2 46.3 48.2 2 75 A R - 0 0 93 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.116 360.0 -98.1 -52.5 141.3 -30.6 48.2 51.5 3 76 A K - 0 0 145 1,-0.1 2,-0.1 71,-0.0 -1,-0.1 -0.297 40.0-123.6 -61.8 143.0 -27.2 49.9 51.7 4 77 A K - 0 0 57 71,-0.3 73,-0.2 -3,-0.1 -1,-0.1 -0.473 22.1-154.1 -88.0 160.5 -24.5 48.0 53.5 5 78 A R > - 0 0 127 -2,-0.1 3,-1.5 71,-0.1 4,-0.1 -0.792 33.8-101.8-126.8 168.8 -22.4 49.2 56.5 6 79 A P G > S+ 0 0 29 0, 0.0 3,-1.3 0, 0.0 5,-0.1 0.835 120.0 61.2 -56.9 -32.5 -19.0 48.5 58.0 7 80 A E G 3 S+ 0 0 118 1,-0.3 22,-0.0 3,-0.1 -3,-0.0 0.572 88.1 71.3 -75.8 -10.4 -20.7 46.3 60.6 8 81 A D G < S+ 0 0 46 -3,-1.5 21,-2.3 20,-0.1 22,-0.4 0.497 97.6 64.2 -77.7 -3.7 -22.1 44.0 57.9 9 82 A F E < -A 28 0A 13 -3,-1.3 2,-0.7 19,-0.2 19,-0.2 -0.874 68.8-140.7-128.2 147.1 -18.6 42.6 57.4 10 83 A K E -A 27 0A 126 17,-2.7 17,-2.6 -2,-0.3 2,-0.2 -0.944 35.0-148.9 -99.2 110.3 -15.8 40.8 59.0 11 84 A F E +A 26 0A 75 -2,-0.7 15,-0.2 15,-0.2 2,-0.1 -0.504 22.8 169.3 -80.4 147.1 -12.6 42.6 57.8 12 85 A G E - 0 0 50 13,-3.0 -1,-0.1 1,-0.3 14,-0.1 -0.012 37.0 -9.1-127.3-130.1 -9.4 40.7 57.4 13 86 A K E - 0 0 123 1,-0.1 12,-2.3 11,-0.1 2,-0.3 -0.334 66.1 -99.2 -84.2 157.0 -5.9 41.3 55.8 14 87 A I E -A 24 0A 85 10,-0.2 10,-0.2 1,-0.2 -1,-0.1 -0.571 33.5-177.2 -70.2 127.4 -4.6 44.1 53.7 15 88 A L E - 0 0 59 8,-3.3 2,-0.3 1,-0.3 9,-0.2 0.758 63.0 -10.8 -94.6 -32.8 -4.6 43.0 50.0 16 89 A G E -A 23 0A 23 7,-1.4 7,-2.2 2,-0.0 2,-0.4 -0.989 55.7-148.7-165.3 161.7 -3.0 46.1 48.4 17 90 A E E +A 22 0A 155 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.965 15.9 166.1-148.7 125.8 -2.0 49.7 49.1 18 91 A G - 0 0 50 3,-2.6 -2,-0.0 -2,-0.4 5,-0.0 -0.510 53.6 -86.9-119.6-166.2 -1.7 52.9 47.0 19 92 A S S S+ 0 0 98 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.638 124.7 19.0 -79.1 -15.2 -1.3 56.6 47.8 20 93 A F S S+ 0 0 70 1,-0.2 21,-0.5 20,-0.0 2,-0.3 0.492 122.3 46.7-132.5 -12.4 -5.0 57.2 48.2 21 94 A S E - B 0 40A 22 19,-0.1 -3,-2.6 2,-0.0 2,-0.4 -0.934 50.7-157.4-135.2 156.9 -6.6 53.8 48.8 22 95 A T E -AB 17 39A 45 17,-1.5 17,-3.5 -2,-0.3 2,-0.6 -0.998 16.5-148.8-126.5 129.5 -6.2 50.6 50.9 23 96 A V E -AB 16 38A 28 -7,-2.2 -8,-3.3 -2,-0.4 -7,-1.4 -0.886 20.4-175.1-100.0 118.8 -7.8 47.4 49.6 24 97 A V E -AB 14 37A 12 13,-2.8 13,-2.7 -2,-0.6 2,-0.3 -0.897 25.7-119.5-115.7 143.8 -8.9 45.0 52.4 25 98 A L E - B 0 36A 21 -12,-2.3 -13,-3.0 -2,-0.4 2,-0.4 -0.590 37.8-178.3 -77.6 135.0 -10.4 41.5 52.3 26 99 A A E -AB 11 35A 1 9,-2.6 9,-2.7 -2,-0.3 2,-0.6 -0.996 23.5-147.0-140.1 141.3 -13.8 41.2 53.9 27 100 A R E -AB 10 34A 90 -17,-2.6 -17,-2.7 -2,-0.4 2,-0.3 -0.923 21.3-134.0-105.8 122.3 -16.4 38.5 54.5 28 101 A E E > -A 9 0A 15 5,-3.0 4,-2.0 -2,-0.6 3,-0.5 -0.605 15.5-148.2 -69.8 129.9 -20.0 39.5 54.3 29 102 A L T 4 S+ 0 0 114 -21,-2.3 -1,-0.1 -2,-0.3 -20,-0.1 0.811 90.2 52.8 -73.7 -32.4 -21.6 37.9 57.5 30 103 A A T 4 S+ 0 0 96 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.621 129.0 16.8 -81.9 -13.0 -25.1 37.3 56.1 31 104 A T T 4 S- 0 0 55 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.2 0.493 91.6-128.7-131.4 -17.2 -23.8 35.4 53.0 32 105 A S < + 0 0 72 -4,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.597 56.1 153.2 60.1 17.9 -20.2 34.5 53.9 33 106 A R - 0 0 149 -5,-0.2 -5,-3.0 -6,-0.1 2,-0.4 -0.495 40.6-133.0 -70.3 140.5 -19.2 36.0 50.5 34 107 A E E +B 27 0A 63 -7,-0.2 54,-0.5 -2,-0.2 2,-0.3 -0.824 27.8 176.7 -95.6 135.2 -15.7 37.4 50.2 35 108 A Y E -B 26 0A 17 -9,-2.7 -9,-2.6 -2,-0.4 2,-0.8 -0.947 33.9-127.0-131.1 154.6 -15.1 40.8 48.7 36 109 A A E -BC 25 86A 7 50,-2.4 50,-2.6 -2,-0.3 2,-0.6 -0.900 33.3-162.0 -96.1 103.7 -12.1 43.1 48.1 37 110 A I E -BC 24 85A 0 -13,-2.7 -13,-2.8 -2,-0.8 2,-0.6 -0.802 5.5-150.6 -95.1 119.8 -13.3 46.4 49.7 38 111 A K E -BC 23 84A 13 46,-2.7 46,-2.0 -2,-0.6 2,-0.5 -0.781 13.3-157.4 -90.3 121.6 -11.3 49.5 48.7 39 112 A I E -BC 22 83A 28 -17,-3.5 -17,-1.5 -2,-0.6 2,-0.4 -0.860 9.9-173.9-108.6 129.9 -11.2 52.1 51.4 40 113 A L E -BC 21 82A 6 42,-2.0 42,-2.6 -2,-0.5 2,-0.6 -0.972 23.3-131.5-125.1 131.2 -10.6 55.8 50.8 41 114 A E E > - C 0 81A 65 -21,-0.5 4,-2.2 -2,-0.4 40,-0.2 -0.685 14.1-151.1 -82.1 116.5 -10.2 58.6 53.4 42 115 A K H > S+ 0 0 54 38,-2.4 4,-2.0 -2,-0.6 -1,-0.2 0.833 92.8 51.3 -58.7 -36.7 -12.4 61.5 52.4 43 116 A R H > S+ 0 0 188 37,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.889 111.3 46.1 -71.4 -40.9 -10.2 64.2 54.0 44 117 A H H > S+ 0 0 54 -3,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.863 111.7 53.1 -69.0 -35.3 -7.1 63.0 52.3 45 118 A I H <>S+ 0 0 8 -4,-2.2 5,-2.5 1,-0.2 6,-0.4 0.907 113.0 44.1 -64.7 -43.1 -8.9 62.8 49.0 46 119 A I H ><5S+ 0 0 106 -4,-2.0 3,-2.0 3,-0.2 -2,-0.2 0.922 109.4 52.5 -68.1 -48.2 -10.1 66.4 49.3 47 120 A K H 3<5S+ 0 0 117 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.759 113.4 47.1 -66.4 -20.1 -6.9 68.0 50.5 48 121 A E T 3<5S- 0 0 84 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.312 112.3-119.6-100.6 6.7 -5.2 66.4 47.5 49 122 A N T < 5 + 0 0 131 -3,-2.0 -3,-0.2 1,-0.1 -2,-0.1 0.962 70.0 134.0 53.5 58.7 -7.9 67.5 45.0 50 123 A K >>< + 0 0 54 -5,-2.5 4,-1.9 2,-0.1 3,-1.6 0.383 27.1 108.1-114.9 -1.4 -8.7 63.9 44.0 51 124 A V H 3> S+ 0 0 74 -6,-0.4 4,-2.3 1,-0.3 5,-0.2 0.878 80.0 53.7 -47.2 -42.3 -12.5 64.0 44.1 52 125 A P H 3> S+ 0 0 68 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.796 107.7 50.1 -65.2 -27.8 -12.7 63.9 40.2 53 126 A Y H <> S+ 0 0 49 -3,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.852 111.3 48.6 -77.5 -35.3 -10.5 60.8 40.1 54 127 A V H X S+ 0 0 15 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.867 112.4 46.9 -72.5 -37.5 -12.7 59.0 42.7 55 128 A T H X S+ 0 0 67 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.872 111.7 52.4 -73.9 -32.1 -15.9 59.9 40.9 56 129 A R H X S+ 0 0 36 -4,-1.4 4,-3.0 -5,-0.2 5,-0.3 0.914 106.6 51.9 -68.0 -43.4 -14.5 58.8 37.6 57 130 A E H X S+ 0 0 8 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.934 112.7 45.8 -56.8 -47.7 -13.4 55.4 38.9 58 131 A R H X S+ 0 0 105 -4,-1.6 4,-1.0 1,-0.2 -1,-0.2 0.905 114.5 47.8 -61.8 -42.7 -16.9 54.8 40.3 59 132 A D H X S+ 0 0 94 -4,-2.1 4,-0.6 2,-0.2 -2,-0.2 0.893 114.5 45.1 -70.3 -40.8 -18.6 56.0 37.1 60 133 A V H >X S+ 0 0 2 -4,-3.0 3,-1.6 1,-0.2 4,-0.9 0.940 111.3 51.5 -65.5 -49.5 -16.4 53.9 34.7 61 134 A M H 3< S+ 0 0 11 -4,-2.5 11,-0.5 1,-0.3 -1,-0.2 0.730 104.4 60.5 -63.8 -20.1 -16.6 50.7 36.8 62 135 A S H 3< S+ 0 0 80 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.757 104.8 48.4 -72.9 -25.0 -20.4 51.2 36.7 63 136 A R H << S+ 0 0 117 -3,-1.6 2,-0.3 -4,-0.6 -2,-0.2 0.619 89.4 97.7 -93.6 -13.3 -20.3 51.0 32.9 64 137 A L < + 0 0 22 -4,-0.9 8,-0.2 -3,-0.1 59,-0.0 -0.589 35.7 164.5 -84.0 136.6 -18.2 47.8 32.6 65 138 A D + 0 0 137 -2,-0.3 -1,-0.1 6,-0.1 6,-0.1 -0.477 36.2 107.9-148.5 68.1 -19.9 44.5 32.0 66 139 A H S > S- 0 0 51 3,-0.1 3,-1.1 4,-0.1 -2,-0.0 -0.988 70.2-120.6-149.3 144.7 -17.3 42.0 30.8 67 140 A P T 3 S+ 0 0 60 0, 0.0 4,-0.1 0, 0.0 78,-0.1 0.625 105.1 66.0 -66.8 -16.1 -15.6 39.0 32.5 68 141 A F T 3 S+ 0 0 7 79,-0.1 80,-2.4 2,-0.1 2,-0.4 0.086 92.8 76.1 -93.2 22.1 -12.0 40.4 32.2 69 142 A F B < S-e 148 0B 8 -3,-1.1 80,-0.2 78,-0.3 -3,-0.1 -0.998 86.8-110.4-135.2 136.1 -12.7 43.3 34.5 70 143 A V - 0 0 6 78,-2.0 2,-0.3 -2,-0.4 -4,-0.1 -0.350 43.7-131.2 -52.6 144.0 -12.9 43.6 38.3 71 144 A K - 0 0 111 -4,-0.1 16,-1.0 -6,-0.1 2,-0.7 -0.832 3.2-135.1-109.0 144.2 -16.6 44.3 39.1 72 145 A L E +D 86 0A 27 -11,-0.5 14,-0.2 -2,-0.3 3,-0.1 -0.866 27.4 170.6 -96.0 109.4 -18.1 46.9 41.4 73 146 A Y E - 0 0 112 12,-2.5 2,-0.3 -2,-0.7 -1,-0.2 0.890 59.6 -16.5 -85.8 -44.1 -20.8 45.3 43.5 74 147 A F E -D 85 0A 27 11,-1.0 11,-2.8 2,-0.0 2,-0.3 -0.980 49.9-155.9-156.8 160.4 -21.7 48.0 46.1 75 148 A T E +D 84 0A 15 -2,-0.3 -71,-0.3 9,-0.2 2,-0.3 -0.975 19.1 156.5-135.3 152.2 -20.5 51.3 47.6 76 149 A F E -D 83 0A 10 7,-1.7 7,-2.4 -2,-0.3 2,-0.3 -0.937 20.2-144.0-153.0 179.9 -21.3 53.0 51.0 77 150 A Q E -D 82 0A 117 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.998 7.9-167.8-148.9 152.9 -19.8 55.5 53.3 78 151 A D - 0 0 47 3,-1.9 5,-0.0 -2,-0.3 -73,-0.0 -0.293 56.8 -69.2-112.1-153.6 -19.4 56.4 57.0 79 152 A D S S+ 0 0 148 1,-0.2 3,-0.0 -2,-0.1 -2,-0.0 0.893 127.3 18.7 -71.0 -39.6 -18.1 59.6 58.5 80 153 A E S S+ 0 0 105 1,-0.1 -38,-2.4 -38,-0.1 -37,-0.5 0.658 118.8 49.5-105.6 -20.3 -14.5 59.5 57.5 81 154 A K E -C 41 0A 85 -40,-0.2 -3,-1.9 -39,-0.1 2,-0.3 -0.892 56.1-140.7-133.0 151.2 -14.3 56.9 54.6 82 155 A L E -CD 40 77A 28 -42,-2.6 -42,-2.0 -2,-0.3 2,-0.4 -0.812 24.0-154.7 -96.2 148.7 -15.7 55.7 51.3 83 156 A Y E -CD 39 76A 15 -7,-2.4 -7,-1.7 -2,-0.3 2,-0.5 -0.992 9.6-170.9-129.0 125.2 -16.0 52.0 50.7 84 157 A F E -CD 38 75A 8 -46,-2.0 -46,-2.7 -2,-0.4 2,-0.8 -0.951 14.7-148.7-114.7 113.1 -16.0 50.2 47.3 85 158 A G E +CD 37 74A 0 -11,-2.8 -12,-2.5 -2,-0.5 -11,-1.0 -0.690 30.9 169.7 -83.8 110.7 -16.9 46.5 47.3 86 159 A L E -CD 36 72A 6 -50,-2.6 -50,-2.4 -2,-0.8 -14,-0.2 -0.599 39.5 -70.4-116.6 173.4 -15.0 44.9 44.5 87 160 A S - 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0 0 1 -2,-0.5 -1,-0.2 24,-0.2 23,-0.1 0.970 12.4-170.6 -69.7 -57.0 -7.0 53.0 31.0 131 204 A R S S+ 0 0 25 47,-0.1 -1,-0.1 23,-0.1 32,-0.1 0.435 74.4 56.1 81.1 2.4 -3.8 55.0 31.0 132 205 A D + 0 0 18 30,-0.2 2,-0.4 18,-0.1 5,-0.1 -0.096 67.0 161.1-153.7 43.0 -2.0 52.9 33.6 133 206 A L + 0 0 2 33,-0.1 30,-0.1 3,-0.1 56,-0.1 -0.541 20.2 133.9 -70.8 124.4 -2.1 49.4 32.2 134 207 A K > - 0 0 24 -2,-0.4 3,-1.8 1,-0.1 4,-0.4 -0.988 68.4 -90.8-166.5 163.4 0.6 47.2 33.9 135 208 A P G > S+ 0 0 2 0, 0.0 3,-1.1 0, 0.0 -41,-0.9 0.814 122.1 56.2 -52.1 -36.3 1.2 43.7 35.5 136 209 A E G 3 S+ 0 0 91 1,-0.2 -3,-0.1 -42,-0.2 -40,-0.0 0.764 107.8 49.4 -67.3 -26.3 0.3 45.1 39.0 137 210 A N G < S+ 0 0 6 -3,-1.8 12,-2.2 -5,-0.1 2,-0.6 0.337 95.5 81.7 -95.3 2.6 -3.1 46.2 37.6 138 211 A I E < - G 0 148B 0 -3,-1.1 -44,-2.8 -4,-0.4 -43,-0.3 -0.932 67.1-170.4-111.4 108.2 -3.8 42.8 36.0 139 212 A L E -FG 93 147B 28 8,-2.3 8,-2.1 -2,-0.6 2,-0.4 -0.511 15.4-134.7 -95.3 162.5 -5.2 40.3 38.5 140 213 A L E - G 0 146B 0 -48,-3.3 -49,-1.2 -51,-0.3 -48,-0.3 -0.974 15.6-145.3-119.7 129.7 -5.8 36.6 38.4 141 214 A N > - 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0 0 0 -3,-1.4 2,-0.5 -101,-0.2 -24,-0.2 -0.383 55.2-133.0 -83.3 165.0 -8.8 56.5 33.2 155 228 A K E -H 129 0C 89 -26,-2.6 -26,-2.7 -2,-0.1 2,-0.7 -0.986 11.1-158.9-119.8 125.4 -10.0 58.8 30.5 156 229 A V E H 128 0C 62 -2,-0.5 -28,-0.2 -28,-0.2 -29,-0.1 -0.910 360.0 360.0-105.1 112.6 -13.5 58.6 29.1 157 230 A L 0 0 139 -30,-2.4 -29,-0.1 -2,-0.7 -1,-0.1 0.503 360.0 360.0 -64.1 360.0 -13.8 60.2 25.7 158 ! 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 0.0 159 241 A X 0 0 113 0, 0.0 2,-0.4 0, 0.0 17,-0.1 0.000 360.0 360.0 360.0 -55.2 -3.2 65.6 32.4 160 242 A F - 0 0 44 -7,-0.1 2,-0.4 15,-0.0 -7,-0.0 -0.793 360.0-159.7-106.0 141.2 -2.1 62.3 34.0 161 243 A V - 0 0 63 -2,-0.4 3,-0.1 1,-0.2 -29,-0.1 -0.943 15.6-144.1-114.8 143.1 0.9 60.2 33.2 162 244 A G - 0 0 25 -2,-0.4 2,-0.4 1,-0.2 -1,-0.2 0.559 51.0 -29.7 -79.5-134.7 1.0 56.5 34.3 163 245 A T >> - 0 0 41 1,-0.1 3,-2.5 -30,-0.1 4,-1.1 -0.744 60.2-120.5 -90.7 136.0 3.9 54.4 35.5 164 246 A A G >4 S+ 0 0 18 -2,-0.4 3,-0.8 1,-0.3 -1,-0.1 0.817 108.6 50.6 -43.7 -52.3 7.4 55.3 34.3 165 247 A Q G 34 S+ 0 0 51 1,-0.2 35,-0.3 -3,-0.0 -1,-0.3 0.614 118.7 38.5 -68.9 -11.4 8.3 52.0 32.6 166 248 A Y G <4 S+ 0 0 19 -3,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.478 81.9 118.0-117.2 -5.6 5.0 52.0 30.6 167 249 A V << - 0 0 7 -4,-1.1 -6,-0.0 -3,-0.8 -35,-0.0 -0.381 62.0-123.1 -68.6 141.8 4.3 55.6 29.6 168 250 A S >> - 0 0 3 1,-0.1 3,-1.0 -2,-0.1 4,-0.7 -0.405 19.2-112.0 -82.0 160.2 4.2 56.2 25.9 169 251 A P T 34 S+ 0 0 11 0, 0.0 4,-0.3 0, 0.0 6,-0.2 0.737 113.8 64.0 -64.6 -23.2 6.5 58.8 24.0 170 252 A E T >4>S+ 0 0 16 1,-0.2 5,-1.3 2,-0.2 6,-1.0 0.794 98.8 55.9 -72.3 -24.8 3.6 61.1 23.2 171 253 A L T <45S+ 0 0 20 -3,-1.0 -1,-0.2 4,-0.3 6,-0.1 0.804 101.8 56.4 -69.5 -30.5 3.1 61.6 26.9 172 254 A L T 3<5S+ 0 0 49 -4,-0.7 -1,-0.2 -3,-0.2 -2,-0.2 0.500 121.0 26.7 -84.8 -3.0 6.7 62.8 27.2 173 255 A T T < 5S+ 0 0 90 -3,-0.6 -3,-0.1 -4,-0.3 -2,-0.1 0.377 135.7 11.4-115.9-103.8 6.1 65.5 24.6 174 256 A E T 5S- 0 0 143 1,-0.1 -3,-0.2 2,-0.1 3,-0.1 0.602 92.9-128.9 -57.4 -10.7 2.7 67.0 23.9 175 257 A K < + 0 0 139 -5,-1.3 -4,-0.3 1,-0.2 2,-0.2 0.700 61.9 138.8 70.3 20.4 1.6 65.3 27.2 176 258 A S - 0 0 48 -6,-1.0 2,-0.3 -17,-0.1 -1,-0.2 -0.601 34.7-163.1 -96.7 156.5 -1.4 63.8 25.3 177 259 A A + 0 0 40 -2,-0.2 2,-0.3 -3,-0.1 -48,-0.0 -0.971 15.3 154.2-138.0 154.5 -2.9 60.3 25.6 178 260 A C >> - 0 0 53 -2,-0.3 3,-2.2 1,-0.0 4,-0.8 -0.883 62.1 -65.4-158.4-172.4 -5.2 58.1 23.5 179 261 A K H >> S+ 0 0 46 1,-0.3 4,-1.3 -2,-0.3 3,-0.7 0.854 126.5 64.0 -55.1 -36.2 -6.1 54.5 22.7 180 262 A S H 3> S+ 0 0 3 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.687 93.2 64.6 -61.0 -18.9 -2.7 54.1 21.1 181 263 A S H <> S+ 0 0 9 -3,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.887 99.6 48.8 -74.7 -39.9 -1.2 54.7 24.6 182 264 A D H S- 0 0 85 1,-0.1 4,-1.4 -3,-0.0 3,-0.4 -0.967 80.1-100.6-151.5 172.5 16.2 56.6 37.7 205 287 A E H > S+ 0 0 122 -2,-0.3 4,-2.1 1,-0.3 5,-0.2 0.811 116.1 53.7 -65.3 -38.0 13.0 57.9 36.1 206 288 A Y H > S+ 0 0 157 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.867 107.7 52.5 -64.0 -36.9 14.6 60.6 34.0 207 289 A L H > S+ 0 0 65 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.821 108.5 50.9 -69.5 -33.0 16.9 58.0 32.4 208 290 A I H X S+ 0 0 14 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.908 108.5 50.3 -66.3 -45.4 13.9 55.8 31.6 209 291 A F H X S+ 0 0 46 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.881 108.7 54.1 -64.6 -35.8 12.1 58.7 29.9 210 292 A Q H X S+ 0 0 72 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.925 108.4 48.1 -61.9 -46.1 15.3 59.4 27.9 211 293 A K H <>S+ 0 0 53 -4,-1.7 5,-3.3 1,-0.2 4,-0.5 0.848 107.8 56.4 -63.7 -36.6 15.4 55.8 26.6 212 294 A I H ><5S+ 0 0 0 -4,-1.9 3,-0.6 3,-0.2 -1,-0.2 0.903 106.9 46.3 -66.7 -43.6 11.7 55.8 25.7 213 295 A I H 3<5S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.862 116.3 45.9 -69.6 -32.2 11.9 58.8 23.3 214 296 A K T 3<5S- 0 0 130 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.536 108.5-129.0 -82.6 -6.6 15.0 57.4 21.7 215 297 A L T < 5 + 0 0 57 -3,-0.6 2,-1.1 -4,-0.5 -3,-0.2 0.937 44.4 173.4 55.7 48.7 13.3 54.0 21.5 216 298 A E < + 0 0 80 -5,-3.3 2,-0.3 -6,-0.1 -1,-0.2 -0.742 21.8 108.1 -97.4 95.1 16.4 52.5 23.2 217 299 A Y - 0 0 36 -2,-1.1 2,-0.3 -3,-0.2 -17,-0.1 -0.964 46.1-142.8-156.8 169.2 15.9 48.9 24.0 218 300 A D - 0 0 131 -19,-0.3 -2,-0.0 -2,-0.3 0, 0.0 -0.953 13.3-124.5-138.3 153.8 16.9 45.4 22.9 219 301 A F - 0 0 34 -2,-0.3 2,-0.1 4,-0.0 9,-0.0 -0.811 27.6-120.7 -96.7 140.2 15.5 41.9 22.5 220 302 A P > - 0 0 52 0, 0.0 3,-1.0 0, 0.0 -1,-0.0 -0.350 24.4-118.0 -63.9 158.3 17.0 38.8 24.1 221 303 A E T 3 S+ 0 0 204 1,-0.2 -2,-0.0 -2,-0.1 0, 0.0 0.794 112.3 60.2 -69.6 -27.9 18.1 36.0 21.8 222 304 A K T 3 S+ 0 0 197 2,-0.1 2,-0.4 -27,-0.0 -1,-0.2 0.247 77.0 125.8 -85.8 15.6 15.6 33.6 23.3 223 305 A F S < S- 0 0 11 -3,-1.0 5,-0.1 1,-0.1 -28,-0.0 -0.625 72.0-108.1 -85.7 124.9 12.6 35.8 22.4 224 306 A F > - 0 0 40 -2,-0.4 4,-2.0 1,-0.1 3,-0.3 -0.249 28.6-136.4 -53.6 127.9 9.9 34.0 20.3 225 307 A P H > S+ 0 0 102 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.892 99.7 44.6 -58.2 -52.2 10.1 35.4 16.8 226 308 A K H > S+ 0 0 101 1,-0.2 4,-1.2 2,-0.2 33,-0.3 0.773 115.9 51.6 -65.3 -23.2 6.5 36.0 15.9 227 309 A A H > S+ 0 0 0 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.801 108.4 50.2 -84.4 -28.6 6.2 37.6 19.4 228 310 A R H X S+ 0 0 105 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.922 108.3 52.8 -69.9 -43.2 9.1 39.8 18.7 229 311 A D H X S+ 0 0 56 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.854 109.9 49.2 -59.6 -35.5 7.6 40.9 15.4 230 312 A L H >X S+ 0 0 1 -4,-1.2 3,-0.7 2,-0.2 4,-0.5 0.898 108.0 52.5 -68.5 -43.4 4.4 41.8 17.2 231 313 A V H >X S+ 0 0 0 -4,-1.7 4,-3.1 1,-0.3 3,-0.7 0.848 107.1 54.3 -61.9 -34.1 6.2 43.8 19.9 232 314 A E H 3< S+ 0 0 81 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.718 106.1 51.1 -72.7 -21.9 7.9 45.8 17.1 233 315 A K H << S+ 0 0 89 -3,-0.7 10,-2.3 -4,-0.7 -1,-0.2 0.494 117.4 41.5 -92.0 -3.7 4.6 46.7 15.6 234 316 A L H << S+ 0 0 0 -3,-0.7 2,-2.1 -4,-0.5 -2,-0.2 0.764 103.1 62.4-104.4 -49.0 3.4 47.9 19.0 235 317 A L S < S+ 0 0 3 -4,-3.1 2,-0.4 -5,-0.1 -1,-0.2 -0.524 74.6 139.8 -82.3 74.0 6.5 49.7 20.4 236 318 A V - 0 0 37 -2,-2.1 6,-0.1 -3,-0.2 5,-0.1 -0.956 53.3-139.7-117.6 138.0 6.4 52.4 17.6 237 319 A L S S+ 0 0 72 -2,-0.4 2,-0.7 4,-0.1 -1,-0.1 0.919 89.9 71.9 -66.4 -45.8 7.2 56.1 18.3 238 320 A D S > S- 0 0 69 1,-0.2 3,-1.5 3,-0.1 4,-0.1 -0.622 74.4-155.6 -70.7 113.4 4.4 57.4 15.9 239 321 A A G > S+ 0 0 21 -2,-0.7 3,-1.4 1,-0.3 -1,-0.2 0.825 89.2 61.5 -65.0 -30.8 1.2 56.5 17.8 240 322 A T G 3 S+ 0 0 53 1,-0.3 -1,-0.3 7,-0.1 -2,-0.1 0.607 99.3 58.7 -72.3 -9.3 -0.8 56.5 14.6 241 323 A K G < S+ 0 0 115 -3,-1.5 2,-0.3 -5,-0.1 -1,-0.3 0.313 78.2 117.5-102.3 7.3 1.3 53.6 13.3 242 324 A R S X S- 0 0 0 -3,-1.4 3,-2.0 -4,-0.1 6,-0.2 -0.591 73.5-107.6 -81.6 134.9 0.6 51.1 16.1 243 325 A L T 3 S+ 0 0 17 -10,-2.3 -1,-0.1 -2,-0.3 3,-0.1 -0.370 105.4 27.4 -58.4 124.8 -1.1 47.8 15.4 244 326 A G T 3 S+ 0 0 2 6,-0.4 -1,-0.3 1,-0.4 7,-0.1 0.243 91.5 117.9 107.7 -14.0 -4.6 48.0 16.7 245 327 A C S X >S- 0 0 3 -3,-2.0 5,-3.1 5,-0.2 3,-0.9 -0.369 76.4-108.0 -84.6 167.2 -5.2 51.8 16.5 246 328 A E G > 5S+ 0 0 119 1,-0.3 3,-2.4 3,-0.2 -1,-0.1 0.896 118.5 55.2 -62.7 -43.7 -7.9 53.4 14.4 247 329 A E G 3 5S+ 0 0 118 1,-0.3 -1,-0.3 2,-0.1 -7,-0.1 0.691 109.5 49.4 -65.9 -17.0 -5.5 54.8 11.8 248 330 A M G < 5S- 0 0 67 -3,-0.9 -1,-0.3 -6,-0.2 -4,-0.3 0.139 129.4-100.3-103.6 15.4 -4.3 51.2 11.4 249 331 A E T < 5 - 0 0 150 -3,-2.4 3,-0.4 -6,-0.1 -3,-0.2 0.641 59.6 -99.9 74.5 19.3 -7.9 50.0 11.0 250 332 A G >< - 0 0 9 -5,-3.1 4,-0.8 1,-0.2 -6,-0.4 -0.277 66.9 -24.2 90.4-158.6 -8.4 48.7 14.5 251 333 A Y H > S+ 0 0 20 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.723 113.4 79.0 -78.0 -22.4 -8.4 45.3 16.3 252 334 A G H > S+ 0 0 55 -3,-0.4 4,-1.2 1,-0.2 3,-0.2 0.959 100.0 38.8 -45.6 -63.0 -9.1 43.3 13.2 253 335 A P H 4 S+ 0 0 57 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.809 114.3 56.1 -60.6 -33.2 -5.5 43.4 12.0 254 336 A L H >< S+ 0 0 0 -4,-0.8 3,-0.8 1,-0.2 -2,-0.2 0.881 108.6 44.8 -65.5 -42.5 -4.1 43.1 15.5 255 337 A K H 3< S+ 0 0 48 -4,-2.4 -1,-0.2 -3,-0.2 8,-0.2 0.730 107.5 61.7 -76.4 -20.9 -5.9 39.8 16.3 256 338 A A T 3< S+ 0 0 77 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.559 75.9 124.5 -81.4 -10.0 -4.9 38.5 12.9 257 339 A H S X S- 0 0 11 -3,-0.8 3,-2.0 -4,-0.3 -3,-0.1 -0.189 74.4-116.1 -51.9 143.3 -1.2 38.7 13.7 258 340 A P G > S+ 0 0 63 0, 0.0 3,-1.3 0, 0.0 4,-0.2 0.665 111.1 68.3 -55.3 -24.0 0.7 35.4 13.2 259 341 A F G 3 S+ 0 0 2 -33,-0.3 3,-0.2 1,-0.3 -32,-0.1 0.751 103.5 45.9 -69.1 -22.7 1.5 35.2 16.9 260 342 A F G X S+ 0 0 4 -3,-2.0 3,-2.7 1,-0.2 -1,-0.3 0.217 76.9 128.1-101.4 13.0 -2.2 34.6 17.5 261 343 A E T < S+ 0 0 155 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.800 76.9 36.0 -39.1 -48.6 -2.5 32.0 14.7 262 344 A S T 3 S+ 0 0 94 -3,-0.2 2,-0.3 -4,-0.2 -1,-0.3 0.215 89.9 118.9 -98.8 14.6 -4.1 29.4 16.8 263 345 A V < - 0 0 24 -3,-2.7 2,-0.7 -8,-0.2 -3,-0.1 -0.634 52.0-150.2 -87.1 135.1 -6.3 31.5 19.1 264 346 A T > - 0 0 72 -2,-0.3 3,-0.6 1,-0.1 -2,-0.1 -0.922 15.7-171.6 -96.7 113.3 -10.1 31.2 19.3 265 347 A W T 3 + 0 0 35 -2,-0.7 3,-0.5 1,-0.2 -1,-0.1 0.608 65.8 73.5 -81.4 -12.8 -11.0 34.8 20.2 266 348 A E T 3 S+ 0 0 163 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.648 108.9 16.8 -87.7 -18.0 -14.7 34.2 20.9 267 349 A N X> + 0 0 68 -3,-0.6 3,-2.3 1,-0.1 4,-0.8 -0.069 69.9 144.3-147.7 35.9 -14.8 32.3 24.2 268 350 A L G >4 S+ 0 0 5 -3,-0.5 3,-0.7 1,-0.3 -2,-0.1 0.795 74.6 54.2 -54.4 -35.7 -11.4 32.7 25.9 269 351 A H G 34 S+ 0 0 81 1,-0.2 -1,-0.3 -3,-0.1 -124,-0.1 0.574 104.2 56.8 -81.9 -5.4 -12.8 32.9 29.4 270 352 A Q G <4 S+ 0 0 134 -3,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.611 94.7 88.7 -89.0 -19.7 -14.6 29.6 28.7 271 353 A Q S << S- 0 0 57 -4,-0.8 -3,-0.0 -3,-0.7 0, 0.0 -0.399 86.3-109.9 -81.0 156.1 -11.3 28.0 27.9 272 354 A T - 0 0 119 -2,-0.1 -1,-0.1 1,-0.0 -128,-0.1 -0.754 35.9-125.1 -85.9 123.7 -8.9 26.3 30.4 273 355 A P - 0 0 15 0, 0.0 2,-0.1 0, 0.0 -165,-0.1 -0.385 25.8-107.2 -67.3 145.4 -5.8 28.3 30.9 274 356 A P - 0 0 32 0, 0.0 2,-0.1 0, 0.0 0, 0.0 -0.429 43.7 -97.7 -64.9 145.7 -2.4 26.6 30.3 275 357 A K - 0 0 162 -2,-0.1 2,-0.5 1,-0.1 -167,-0.1 -0.410 36.3-118.2 -70.8 143.2 -0.4 25.9 33.6 276 358 A L 0 0 30 -2,-0.1 -1,-0.1 -3,-0.1 -172,-0.1 -0.714 360.0 360.0 -87.7 121.6 2.3 28.4 34.5 277 359 A T 0 0 127 -2,-0.5 -172,-0.5 -174,-0.1 -169,-0.1 -0.970 360.0 360.0-160.9 360.0 5.8 27.1 34.7