==== 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 09-NOV-09 2WXR . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR A.BERNDT,S.MILLER,O.WILLIAMS,D.D.LEE,B.T.HOUSEMAN,J.I.PACOLD . 822 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 585 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 40 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 302 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 2 1 2 2 1 2 2 3 3 2 1 1 0 1 1 1 1 0 2 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 7 4 2 2 1 2 1 1 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 1 1 2 0 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 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 1 109 A V > 0 0 141 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -46.0 -7.3 7.6 5.1 2 110 A K H > + 0 0 104 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.776 360.0 55.8 -61.8 -26.4 -10.9 7.8 6.5 3 111 A K H > S+ 0 0 169 2,-0.2 4,-2.4 3,-0.1 -1,-0.2 0.948 104.8 49.1 -61.4 -57.2 -11.4 5.4 3.5 4 112 A L H > S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.904 111.4 50.3 -50.9 -47.2 -8.7 3.0 4.8 5 113 A I H X S+ 0 0 43 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.930 110.3 48.0 -59.2 -53.5 -10.3 2.9 8.2 6 114 A N H X S+ 0 0 39 -4,-1.6 4,-2.6 1,-0.2 11,-0.2 0.898 111.3 50.9 -55.3 -44.3 -13.8 2.2 7.0 7 115 A S H X S+ 0 0 63 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.857 110.7 49.2 -65.2 -34.9 -12.5 -0.6 4.7 8 116 A Q H X S+ 0 0 47 -4,-1.9 4,-2.9 -5,-0.2 -2,-0.2 0.903 108.6 52.6 -72.9 -39.1 -10.7 -2.1 7.6 9 117 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.987 109.8 49.2 -55.7 -55.7 -13.8 -1.9 9.9 10 118 A S H X>S+ 0 0 29 -4,-2.6 5,-1.0 1,-0.2 4,-0.7 0.886 112.3 48.4 -48.9 -45.6 -15.8 -3.7 7.2 11 119 A L H ><5S+ 0 0 111 -4,-1.9 3,-0.5 1,-0.2 -1,-0.2 0.933 115.0 45.8 -60.0 -48.1 -13.1 -6.3 7.0 12 120 A L H 3<5S+ 0 0 10 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.916 114.0 43.4 -65.4 -48.4 -13.0 -6.8 10.7 13 121 A I H 3<5S- 0 0 0 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.461 106.4-121.5 -83.1 -1.3 -16.7 -7.0 11.6 14 122 A G T <<5S+ 0 0 45 -4,-0.7 2,-0.3 -3,-0.5 -3,-0.2 0.698 82.9 87.9 70.3 20.9 -17.4 -9.3 8.7 15 123 A K S - 0 0 10 -2,-0.3 3,-1.8 1,-0.1 4,-0.4 -0.571 15.3-137.6 -82.3 132.3 -19.6 -4.0 4.7 17 125 A L T >> S+ 0 0 13 -2,-0.3 3,-1.4 1,-0.3 4,-1.2 0.786 101.9 70.9 -55.5 -27.0 -20.5 -0.5 6.0 18 126 A H H 3> S+ 0 0 127 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.814 86.9 65.5 -62.9 -27.8 -22.3 0.1 2.7 19 127 A E H <4 S+ 0 0 76 -3,-1.8 4,-0.5 1,-0.2 -1,-0.3 0.806 97.1 53.7 -69.3 -27.6 -24.9 -2.4 3.9 20 128 A F H X4 S+ 0 0 0 -3,-1.4 3,-1.2 -4,-0.4 5,-0.4 0.969 110.5 45.2 -67.4 -51.8 -26.0 -0.0 6.7 21 129 A D H >< S+ 0 0 83 -4,-1.2 3,-3.8 1,-0.2 -2,-0.2 0.946 102.4 64.2 -53.6 -56.5 -26.6 3.0 4.3 22 130 A S T 3< S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.683 91.6 67.7 -42.3 -26.8 -28.5 0.9 1.7 23 131 A L T < S- 0 0 90 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.584 89.9-151.1 -70.7 -12.6 -31.1 0.4 4.4 24 132 A R < + 0 0 216 -3,-3.8 -2,-0.1 -4,-0.2 -3,-0.1 0.881 38.5 159.0 36.2 57.4 -32.0 4.1 4.3 25 133 A D > - 0 0 43 -5,-0.4 4,-2.8 -4,-0.2 5,-0.2 -0.939 44.0-156.6-118.5 116.3 -33.0 3.8 8.0 26 134 A P H > S+ 0 0 70 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.903 97.4 54.4 -49.3 -46.6 -33.3 6.8 10.4 27 135 A E H > S+ 0 0 15 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.951 111.2 41.4 -56.9 -60.7 -32.8 4.4 13.4 28 136 A V H > S+ 0 0 0 1,-0.2 4,-3.5 2,-0.2 -1,-0.2 0.929 115.1 55.1 -46.4 -53.9 -29.6 2.9 12.1 29 137 A N H X S+ 0 0 70 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.862 112.1 41.0 -45.6 -49.4 -28.5 6.5 11.1 30 138 A D H X S+ 0 0 73 -4,-2.7 4,-3.6 2,-0.2 5,-0.4 0.959 114.2 51.4 -75.1 -48.5 -29.0 7.9 14.5 31 139 A F H X S+ 0 0 6 -4,-2.9 4,-1.9 1,-0.2 5,-0.3 0.919 113.7 47.5 -47.2 -50.2 -27.5 4.9 16.3 32 140 A R H X S+ 0 0 39 -4,-3.5 4,-1.1 -5,-0.2 -1,-0.2 0.888 117.5 40.1 -62.3 -40.3 -24.5 5.2 14.0 33 141 A T H X S+ 0 0 97 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.926 119.2 43.1 -79.5 -42.2 -24.1 9.0 14.5 34 142 A K H X S+ 0 0 115 -4,-3.6 4,-2.4 2,-0.2 -3,-0.2 0.956 117.3 45.2 -67.1 -50.1 -24.8 9.2 18.3 35 143 A M H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.4 -1,-0.2 0.804 108.8 57.6 -64.6 -32.7 -22.8 6.2 19.2 36 144 A R H X S+ 0 0 73 -4,-1.1 4,-2.2 -5,-0.3 -1,-0.2 0.943 110.4 44.3 -58.2 -47.5 -19.9 7.3 17.0 37 145 A Q H X S+ 0 0 114 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.904 112.7 51.7 -62.3 -46.6 -19.8 10.6 19.0 38 146 A F H X S+ 0 0 50 -4,-2.4 4,-1.7 1,-0.2 3,-0.3 0.960 113.0 43.9 -56.7 -54.6 -20.1 8.8 22.3 39 147 A C H X S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.806 109.6 57.0 -60.7 -35.1 -17.2 6.4 21.4 40 148 A E H X S+ 0 0 80 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.869 105.5 49.6 -64.4 -38.0 -15.0 9.3 20.1 41 149 A E H X S+ 0 0 113 -4,-1.9 4,-2.2 -3,-0.3 -2,-0.2 0.867 106.8 56.6 -71.9 -37.3 -15.2 11.3 23.3 42 150 A A H X S+ 0 0 33 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.868 106.5 50.3 -56.4 -38.1 -14.2 8.2 25.2 43 151 A A H X S+ 0 0 4 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.849 107.6 51.7 -74.8 -30.5 -11.1 7.9 23.1 44 152 A A H X S+ 0 0 56 -4,-1.4 4,-0.8 2,-0.2 -1,-0.2 0.912 108.1 53.3 -67.7 -42.3 -10.1 11.5 23.7 45 153 A H H >< S+ 0 0 119 -4,-2.2 3,-0.8 1,-0.2 4,-0.4 0.885 106.9 54.0 -51.4 -43.8 -10.5 10.9 27.4 46 154 A R H >< S+ 0 0 6 -4,-1.5 3,-0.9 1,-0.2 -1,-0.2 0.843 100.4 58.7 -64.0 -40.0 -8.1 7.9 26.8 47 155 A Q H 3< S+ 0 0 49 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.688 107.8 45.6 -67.8 -19.2 -5.4 10.0 25.2 48 156 A Q T << S+ 0 0 146 -4,-0.8 -1,-0.2 -3,-0.8 -2,-0.2 0.425 84.4 123.4-108.6 1.1 -5.0 12.3 28.2 49 157 A L < - 0 0 34 -3,-0.9 2,-0.1 -4,-0.4 -3,-0.0 -0.124 69.2-100.1 -55.4 151.3 -4.9 9.7 31.0 50 158 A G > - 0 0 32 1,-0.1 4,-1.9 4,-0.0 5,-0.2 -0.396 37.9-109.1 -67.7 156.2 -2.1 9.4 33.5 51 159 A W H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.885 120.4 48.9 -64.4 -37.5 0.3 6.6 32.7 52 160 A V H > S+ 0 0 55 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.971 110.7 51.7 -62.6 -44.8 -0.9 4.5 35.6 53 161 A E H > S+ 0 0 100 1,-0.3 4,-1.3 2,-0.2 -2,-0.2 0.789 107.8 53.3 -63.3 -28.1 -4.5 5.1 34.6 54 162 A W H X S+ 0 0 0 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.872 105.1 52.9 -70.2 -41.4 -3.5 4.0 31.1 55 163 A L H X S+ 0 0 1 -4,-2.0 4,-3.0 -3,-0.3 -2,-0.2 0.948 105.6 54.5 -59.7 -47.4 -2.0 0.8 32.5 56 164 A Q H < S+ 0 0 104 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.871 114.4 43.0 -49.9 -42.7 -5.4 0.2 34.2 57 165 A Y H < S+ 0 0 7 -4,-1.3 397,-2.3 -5,-0.2 398,-0.4 0.927 124.0 32.0 -66.3 -53.7 -7.0 0.6 30.7 58 166 A S H < S+ 0 0 2 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.920 135.7 19.6 -78.9 -44.7 -4.5 -1.5 28.6 59 167 A F S < S- 0 0 9 -4,-3.0 -1,-0.2 -5,-0.3 67,-0.2 -0.636 77.6-164.0-127.1 74.1 -3.4 -4.1 31.1 60 168 A P - 0 0 24 0, 0.0 66,-0.1 0, 0.0 -4,-0.1 -0.325 37.6 -91.8 -61.3 138.2 -6.0 -4.3 34.0 61 169 A L - 0 0 27 1,-0.1 2,-0.8 64,-0.1 66,-0.1 -0.060 25.7-142.8 -55.9 146.3 -4.6 -6.2 37.0 62 170 A Q + 0 0 29 64,-0.3 75,-2.8 -3,-0.1 76,-0.4 -0.842 34.4 173.7-114.8 89.8 -5.0 -9.9 37.3 63 171 A L B -A 136 0A 43 -2,-0.8 73,-0.2 73,-0.3 72,-0.1 -0.609 36.5-100.7-100.8 156.6 -5.5 -10.4 41.0 64 172 A E 0 0 72 71,-3.5 -1,-0.1 -2,-0.2 71,-0.0 -0.613 360.0 360.0 -76.2 135.1 -6.5 -13.4 43.1 65 173 A P 0 0 88 0, 0.0 -1,-0.1 0, 0.0 548,-0.0 0.093 360.0 360.0 -34.5 360.0 -10.2 -13.6 44.2 66 ! 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 67 187 A N 0 0 171 0, 0.0 2,-0.4 0, 0.0 21,-0.0 0.000 360.0 360.0 360.0 -82.7 5.4 -14.7 55.6 68 188 A R - 0 0 135 19,-0.0 21,-3.5 0, 0.0 22,-0.2 -0.979 360.0-132.3-130.4 139.9 7.5 -16.5 53.0 69 189 A A E -B 88 0B 39 -2,-0.4 2,-0.3 19,-0.3 19,-0.3 -0.474 23.6-171.9 -81.6 153.4 10.4 -15.5 50.7 70 190 A L E -B 87 0B 13 17,-2.9 17,-2.1 -2,-0.1 2,-0.4 -0.946 23.5-111.4-141.1 170.1 10.5 -16.2 47.0 71 191 A L E +B 86 0B 91 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.850 35.3 176.4-108.7 130.5 13.0 -15.9 44.1 72 192 A V E -B 85 0B 1 13,-2.0 13,-2.5 -2,-0.4 2,-0.5 -0.994 23.4-144.0-139.6 137.5 12.4 -13.5 41.3 73 193 A N E +Bc 84 150B 12 76,-2.7 78,-2.9 -2,-0.4 2,-0.3 -0.925 24.8 177.7-102.2 121.5 14.3 -12.3 38.2 74 194 A V E +Bc 83 151B 0 9,-1.8 9,-2.0 -2,-0.5 2,-0.3 -0.747 4.8 162.6-117.7 164.2 14.0 -8.6 37.2 75 195 A K E -Bc 82 152B 25 76,-0.7 78,-3.2 -2,-0.3 2,-0.2 -0.948 32.0-111.3-173.9 160.3 15.7 -6.6 34.4 76 196 A F E - c 0 153B 23 5,-0.6 78,-0.1 -2,-0.3 5,-0.1 -0.613 32.1-107.8-105.3 167.9 15.3 -3.4 32.6 77 197 A E S S+ 0 0 108 76,-0.9 -1,-0.1 -2,-0.2 77,-0.1 0.931 105.5 53.5 -59.5 -55.0 14.2 -2.8 29.0 78 198 A G S S+ 0 0 75 2,-0.1 -1,-0.0 -3,-0.0 -3,-0.0 0.925 109.6 28.8 -45.5 -96.0 17.6 -1.8 27.4 79 199 A S S S- 0 0 47 1,-0.1 -3,-0.1 2,-0.0 0, 0.0 -0.098 71.3-130.5 -64.7 165.0 20.2 -4.4 28.3 80 200 A E + 0 0 158 -5,-0.1 2,-0.5 2,-0.1 -1,-0.1 0.020 66.4 127.1-102.4 23.0 19.5 -8.1 28.9 81 201 A E - 0 0 118 -5,-0.1 -5,-0.6 0, 0.0 2,-0.3 -0.710 42.6-169.3 -75.9 128.9 21.4 -8.1 32.1 82 202 A S E -B 75 0B 61 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.940 14.3-154.0-125.0 147.2 19.2 -9.5 34.8 83 203 A F E -B 74 0B 34 -9,-2.0 -9,-1.8 -2,-0.3 2,-0.5 -0.771 11.4-140.2-111.2 160.4 19.4 -9.7 38.6 84 204 A T E -B 73 0B 77 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.2 -0.969 21.5-169.7-128.4 118.9 17.8 -12.2 40.9 85 205 A F E -B 72 0B 22 -13,-2.5 -13,-2.0 -2,-0.5 2,-0.5 -0.554 18.4-141.3-102.5 164.9 16.3 -11.1 44.2 86 206 A Q E +B 71 0B 147 -15,-0.2 2,-0.3 -2,-0.2 -15,-0.2 -0.985 37.8 149.6-126.0 118.6 14.9 -12.8 47.2 87 207 A V E -B 70 0B 21 -17,-2.1 -17,-2.9 -2,-0.5 2,-0.0 -0.977 46.2 -86.1-146.8 159.6 11.8 -11.2 48.8 88 208 A S E > -B 69 0B 18 -2,-0.3 3,-1.6 -19,-0.3 -19,-0.3 -0.309 29.6-128.1 -61.7 140.3 8.6 -11.9 50.8 89 209 A T T 3 S+ 0 0 14 -21,-3.5 45,-2.1 1,-0.2 46,-0.3 0.773 110.7 60.3 -53.2 -27.4 5.5 -13.0 49.1 90 210 A K T 3 S+ 0 0 109 -22,-0.2 -1,-0.2 42,-0.2 2,-0.2 0.458 79.1 116.0 -88.7 0.8 3.8 -10.2 51.1 91 211 A D < - 0 0 39 -3,-1.6 42,-1.8 41,-0.1 43,-0.1 -0.460 69.8-116.0 -72.1 137.5 6.0 -7.4 49.6 92 212 A M >> - 0 0 60 40,-0.2 4,-1.3 -2,-0.2 3,-0.9 -0.422 27.2-113.8 -61.5 147.4 4.4 -4.6 47.5 93 213 A P H 3> S+ 0 0 1 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.816 118.9 60.4 -52.8 -32.8 5.5 -4.5 43.9 94 214 A L H 3> S+ 0 0 69 35,-0.3 4,-2.2 2,-0.2 5,-0.1 0.851 97.7 56.3 -62.9 -39.9 7.1 -1.1 44.8 95 215 A A H <> S+ 0 0 45 -3,-0.9 4,-1.1 1,-0.2 -1,-0.2 0.896 109.8 46.6 -57.4 -43.2 9.3 -2.7 47.4 96 216 A L H X S+ 0 0 1 -4,-1.3 4,-1.9 2,-0.2 3,-0.3 0.874 108.0 55.0 -68.2 -39.7 10.7 -5.0 44.7 97 217 A M H X S+ 0 0 7 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.913 102.7 57.6 -59.9 -39.5 11.2 -2.1 42.3 98 218 A A H X S+ 0 0 23 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.821 105.7 51.3 -60.8 -34.9 13.3 -0.4 45.0 99 219 A C H X S+ 0 0 22 -4,-1.1 4,-2.4 -3,-0.3 3,-0.4 0.968 106.2 52.8 -58.6 -59.8 15.6 -3.4 45.0 100 220 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.3 -2,-0.2 0.888 109.4 48.5 -46.1 -50.9 16.1 -3.5 41.3 101 221 A L H X S+ 0 0 31 -4,-2.0 4,-3.2 1,-0.2 -1,-0.3 0.833 108.0 54.2 -66.3 -35.0 17.1 0.2 41.2 102 222 A R H X S+ 0 0 159 -4,-1.3 4,-1.4 -3,-0.4 -1,-0.2 0.907 110.6 47.9 -62.3 -41.1 19.6 -0.4 44.0 103 223 A K H X S+ 0 0 95 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.942 115.0 44.1 -62.5 -51.1 21.1 -3.2 42.0 104 224 A K H X S+ 0 0 65 -4,-2.6 4,-3.6 1,-0.2 6,-0.4 0.943 112.1 52.8 -57.8 -52.2 21.3 -1.1 38.8 105 225 A A H <>S+ 0 0 35 -4,-3.2 5,-0.6 2,-0.2 -1,-0.2 0.762 112.5 46.2 -59.0 -28.0 22.6 1.9 40.7 106 226 A T H ><5S+ 0 0 94 -4,-1.4 3,-1.8 -3,-0.2 -2,-0.2 0.973 117.2 40.4 -75.1 -59.1 25.4 -0.2 42.2 107 227 A V H 3<5S+ 0 0 89 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.903 120.0 46.9 -52.9 -46.7 26.5 -2.0 38.9 108 228 A F T 3<5S- 0 0 138 -4,-3.6 -1,-0.3 -5,-0.2 -3,-0.2 0.515 112.7-120.3 -70.4 -6.8 26.1 1.4 37.0 109 229 A R T < 5 0 0 228 -3,-1.8 -3,-0.2 -5,-0.2 -4,-0.1 0.642 360.0 360.0 65.0 16.7 28.0 3.2 39.8 110 230 A Q < 0 0 195 -5,-0.6 -1,-0.2 -6,-0.4 -5,-0.1 0.237 360.0 360.0 72.5 360.0 24.8 5.3 40.2 111 ! 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 0.0 112 235 A Q > 0 0 150 0, 0.0 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0 0 37 -3,-0.8 2,-1.4 -4,-0.2 -1,-0.3 0.740 92.6 98.8 -79.7 -25.0 -45.5 -15.6 51.1 332 516 A E < 0 0 33 -3,-1.6 -1,-0.1 -4,-0.3 -3,-0.0 -0.477 360.0 360.0 -85.0 79.3 -42.4 -13.4 50.3 333 517 A R 0 0 185 -2,-1.4 -1,-0.2 -3,-0.0 -3,-0.0 0.304 360.0 360.0-129.6 360.0 -39.2 -15.6 49.8 334 ! 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 0.0 335 522 A E 0 0 239 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 79.3 -45.6 -18.4 42.6 336 523 A L - 0 0 45 1,-0.1 5,-0.1 2,-0.0 -4,-0.0 -0.926 360.0-114.3-129.3 146.0 -48.3 -16.3 44.3 337 524 A Y > - 0 0 163 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 0.026 32.1-102.6 -72.0 171.6 -52.2 -16.4 44.5 338 525 A E H > S+ 0 0 130 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.927 123.3 40.0 -60.9 -50.3 -54.8 -13.9 43.2 339 526 A H H > S+ 0 0 118 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.894 110.3 61.8 -65.9 -36.7 -55.5 -12.4 46.6 340 527 A E H > S+ 0 0 37 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.922 101.9 50.0 -57.9 -45.4 -51.8 -12.5 47.4 341 528 A K H X S+ 0 0 64 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.907 106.4 58.0 -55.2 -43.3 -51.0 -10.2 44.5 342 529 A D H X S+ 0 0 95 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.865 103.4 50.8 -55.2 -43.5 -53.7 -7.8 45.7 343 530 A L H X S+ 0 0 58 -4,-1.7 4,-2.9 -3,-0.3 -1,-0.2 0.853 112.3 49.5 -66.0 -36.4 -52.1 -7.4 49.1 344 531 A V H X S+ 0 0 11 -4,-1.5 4,-0.6 2,-0.2 -2,-0.2 0.994 109.1 46.7 -64.3 -66.3 -48.8 -6.6 47.4 345 532 A W H < S+ 0 0 42 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.819 116.2 50.8 -49.7 -30.4 -50.0 -4.0 45.0 346 533 A K H >< S+ 0 0 154 -4,-1.6 3,-0.6 -5,-0.3 -2,-0.2 0.972 111.3 43.0 -71.8 -56.9 -51.8 -2.5 48.0 347 534 A M H >X S+ 0 0 58 -4,-2.9 3,-1.5 1,-0.2 4,-1.2 0.342 81.6 128.6 -64.2 6.8 -48.8 -2.4 50.4 348 535 A R H 3X + 0 0 36 -4,-0.6 4,-1.4 -3,-0.5 -1,-0.2 0.683 69.7 47.1 -47.3 -29.4 -46.9 -1.1 47.3 349 536 A H H <> S+ 0 0 83 -3,-0.6 4,-2.9 2,-0.2 -1,-0.3 0.880 107.1 55.5 -75.7 -37.9 -45.5 1.9 49.2 350 537 A E H <> S+ 0 0 86 -3,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.662 105.0 56.6 -70.6 -14.7 -44.4 -0.2 52.2 351 538 A V H X S+ 0 0 3 -4,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.928 109.9 41.5 -75.7 -54.3 -42.4 -2.3 49.7 352 539 A Q H < S+ 0 0 44 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.886 123.8 44.6 -53.8 -40.0 -40.5 0.8 48.5 353 540 A E H < S+ 0 0 111 -4,-2.9 -2,-0.2 2,-0.1 -3,-0.2 0.932 134.7 5.2 -72.0 -51.4 -40.3 1.7 52.2 354 541 A H H < S+ 0 0 121 -4,-3.0 -3,-0.2 -5,-0.1 -2,-0.2 0.405 131.1 39.1-125.5 3.6 -39.4 -1.6 53.8 355 542 A F >< + 0 0 51 -4,-2.5 3,-3.1 -5,-0.1 4,-0.2 -0.141 53.2 154.1-147.2 44.6 -38.7 -4.2 51.2 356 543 A P G > S+ 0 0 38 0, 0.0 3,-2.2 0, 0.0 4,-0.2 0.804 71.3 68.7 -50.8 -29.8 -36.9 -2.7 48.2 357 544 A E G 3 S+ 0 0 138 1,-0.3 3,-0.3 2,-0.1 4,-0.2 0.566 92.3 61.1 -68.1 -5.2 -35.3 -6.1 47.4 358 545 A A G <> + 0 0 11 -3,-3.1 4,-1.6 -7,-0.2 3,-0.5 0.329 66.1 118.3-104.1 8.9 -38.8 -7.3 46.4 359 546 A L H <> S+ 0 0 2 -3,-2.2 4,-1.7 1,-0.2 3,-0.3 0.850 74.6 52.2 -33.2 -55.5 -39.1 -4.6 43.6 360 547 A A H > S+ 0 0 7 -3,-0.3 4,-2.2 1,-0.2 3,-0.4 0.927 103.3 55.3 -58.2 -48.2 -39.4 -7.3 41.0 361 548 A R H 4 S+ 0 0 91 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.872 109.4 48.5 -54.4 -35.9 -42.2 -9.2 42.8 362 549 A L H >X S+ 0 0 0 -4,-1.6 4,-1.5 -3,-0.3 3,-0.7 0.848 108.4 54.8 -72.3 -33.7 -44.3 -6.1 42.8 363 550 A L H 3< S+ 0 0 1 -4,-1.7 -2,-0.2 -3,-0.4 -1,-0.2 0.857 105.4 51.8 -63.9 -42.1 -43.5 -5.5 39.1 364 551 A L T 3< S+ 0 0 92 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.397 112.1 48.4 -77.6 -0.1 -44.9 -9.0 38.2 365 552 A V T <4 S+ 0 0 18 -3,-0.7 -2,-0.2 -5,-0.2 -1,-0.2 0.660 89.7 106.1-101.2 -22.8 -48.0 -8.0 40.1 366 553 A T S < S- 0 0 8 -4,-1.5 2,-1.6 1,-0.1 3,-0.1 -0.175 79.6-112.0 -65.1 146.0 -48.5 -4.6 38.4 367 554 A K > + 0 0 87 1,-0.2 3,-1.6 3,-0.1 7,-0.5 -0.557 37.9 173.2 -79.5 84.9 -51.2 -4.1 35.9 368 555 A W T 3 S+ 0 0 38 -2,-1.6 -1,-0.2 1,-0.3 -162,-0.1 0.833 78.7 55.6 -63.4 -29.4 -49.2 -3.6 32.7 369 556 A N T 3 S+ 0 0 33 -3,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.252 98.4 70.4 -88.7 11.3 -52.5 -3.6 30.7 370 557 A K S X> S- 0 0 105 -3,-1.6 4,-1.6 1,-0.1 3,-0.5 -0.910 70.9-155.4-131.7 105.3 -54.0 -0.8 32.7 371 558 A H H 3> S+ 0 0 71 -2,-0.4 4,-1.5 1,-0.2 -1,-0.1 0.825 89.0 58.4 -47.0 -46.5 -52.3 2.6 32.2 372 559 A E H >> S+ 0 0 107 1,-0.2 4,-1.6 2,-0.2 3,-0.7 0.931 107.4 46.1 -50.4 -52.8 -53.3 4.0 35.6 373 560 A D H <> S+ 0 0 39 -3,-0.5 4,-2.1 1,-0.3 -1,-0.2 0.839 108.1 55.4 -68.5 -34.4 -51.5 1.3 37.6 374 561 A V H 3X S+ 0 0 12 -4,-1.6 4,-2.1 -7,-0.5 -1,-0.3 0.800 105.4 56.8 -62.6 -28.5 -48.4 1.5 35.4 375 562 A A H < S+ 0 0 5 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.951 110.2 53.6 -55.8 -53.2 -42.6 4.6 42.9 381 568 A L H >< S+ 0 0 12 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.814 93.7 72.6 -55.5 -31.6 -39.7 3.3 40.8 382 569 A C T 3< S+ 0 0 64 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.620 112.2 25.2 -65.4 -13.5 -38.4 6.9 40.2 383 570 A S T < S+ 0 0 84 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.079 89.2 132.5-134.8 19.4 -37.2 7.2 43.8 384 571 A W < - 0 0 5 -3,-1.6 2,-0.1 -4,-0.2 3,-0.1 -0.453 65.1-108.4 -65.3 139.4 -36.6 3.5 44.5 385 572 A P - 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.517 39.9 -92.4 -71.6 147.8 -33.2 3.0 46.0 386 573 A E - 0 0 109 -2,-0.1 23,-0.1 1,-0.1 22,-0.0 -0.282 47.1-138.2 -50.1 140.8 -30.6 1.4 43.9 387 574 A L - 0 0 7 21,-0.2 2,-0.1 1,-0.1 -1,-0.1 -0.580 22.3 -85.5-100.7 164.8 -30.5 -2.4 44.4 388 575 A P >> - 0 0 55 0, 0.0 4,-2.3 0, 0.0 3,-1.2 -0.440 44.0-107.0 -69.4 147.2 -27.6 -5.0 44.7 389 576 A V H 3> S+ 0 0 17 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.811 118.0 59.8 -41.4 -46.1 -26.1 -6.4 41.5 390 577 A L H 3> S+ 0 0 63 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.904 109.6 41.0 -53.4 -50.9 -27.8 -9.8 42.1 391 578 A S H X> S+ 0 0 11 -3,-1.2 4,-2.3 1,-0.2 3,-0.9 0.926 112.6 56.4 -63.7 -46.5 -31.3 -8.2 42.1 392 579 A A H 3X S+ 0 0 0 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.887 102.8 54.8 -47.7 -43.0 -30.2 -6.0 39.1 393 580 A L H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.785 107.9 50.2 -67.7 -25.9 -29.2 -9.1 37.1 394 581 A E H X< S+ 0 0 65 -4,-0.9 3,-2.0 -3,-0.9 -1,-0.2 0.909 103.8 58.6 -72.3 -45.3 -32.8 -10.4 37.8 395 582 A L H 3< S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.694 95.0 65.9 -55.9 -23.9 -34.2 -7.1 36.5 396 583 A L T 3< S+ 0 0 20 -4,-0.9 -1,-0.3 13,-0.1 -2,-0.1 0.378 80.6 111.2 -80.9 2.1 -32.5 -7.6 33.2 397 584 A D S X S- 0 0 32 -3,-2.0 3,-2.3 1,-0.1 388,-0.1 -0.350 85.8-107.1 -80.6 158.4 -34.6 -10.6 32.4 398 585 A F T 3 S+ 0 0 14 1,-0.3 -195,-0.2 386,-0.2 -1,-0.1 0.769 114.0 74.0 -56.0 -28.3 -37.4 -10.7 29.7 399 586 A S T 3 S+ 0 0 30 1,-0.3 -1,-0.3 -197,-0.2 3,-0.1 0.448 94.9 56.9 -59.4 -6.4 -40.1 -10.6 32.5 400 587 A F < + 0 0 20 -3,-2.3 -1,-0.3 1,-0.1 -198,-0.1 -0.588 60.5 152.0-129.7 71.8 -39.1 -7.0 32.8 401 588 A P + 0 0 33 0, 0.0 35,-0.1 0, 0.0 -1,-0.1 0.748 35.3 111.8 -72.3 -24.5 -39.6 -5.4 29.4 402 589 A D > - 0 0 4 1,-0.1 4,-2.2 -3,-0.1 5,-0.1 -0.252 62.4-143.9 -61.5 134.8 -40.3 -1.9 30.6 403 590 A C H > S+ 0 0 56 2,-0.2 4,-2.3 1,-0.2 -1,-0.1 0.692 100.3 56.0 -77.6 -18.6 -37.5 0.6 29.7 404 591 A Y H > S+ 0 0 84 2,-0.2 4,-1.5 3,-0.2 -1,-0.2 0.866 111.3 45.6 -74.1 -36.9 -37.7 2.6 32.9 405 592 A V H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.891 115.0 48.2 -63.7 -42.2 -37.2 -0.7 34.7 406 593 A G H X S+ 0 0 23 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.900 109.1 52.3 -69.0 -40.5 -34.3 -1.5 32.3 407 594 A S H X S+ 0 0 43 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.874 110.5 48.3 -61.3 -37.4 -32.8 1.9 32.8 408 595 A F H X S+ 0 0 12 -4,-1.5 4,-3.2 2,-0.2 5,-0.3 0.896 106.6 57.0 -69.1 -42.4 -32.9 1.3 36.6 409 596 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.925 108.7 46.0 -53.3 -48.3 -31.3 -2.1 36.2 410 597 A I H X S+ 0 0 3 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.922 110.3 54.7 -60.6 -46.7 -28.3 -0.5 34.4 411 598 A K H >< S+ 0 0 88 -4,-2.0 3,-0.9 1,-0.2 4,-0.3 0.955 111.6 42.9 -51.8 -55.5 -28.2 2.2 37.0 412 599 A S H >< S+ 0 0 0 -4,-3.2 3,-0.6 1,-0.3 -1,-0.2 0.806 114.9 52.6 -65.3 -26.2 -27.9 -0.4 39.8 413 600 A L H >< S+ 0 0 0 -4,-2.0 3,-2.3 -5,-0.3 -1,-0.3 0.710 82.7 87.0 -78.5 -21.6 -25.5 -2.4 37.6 414 601 A R T << S+ 0 0 111 -4,-1.8 -1,-0.2 -3,-0.9 -2,-0.2 0.768 81.6 63.9 -53.0 -22.2 -23.1 0.5 37.0 415 602 A K T < S+ 0 0 104 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.1 0.736 72.1 120.5 -80.4 -20.9 -21.4 -0.5 40.3 416 603 A L < - 0 0 4 -3,-2.3 2,-0.1 -4,-0.1 -3,-0.0 -0.094 65.7-124.1 -33.2 135.4 -20.2 -3.9 39.0 417 604 A T > - 0 0 71 1,-0.1 4,-3.1 4,-0.0 5,-0.2 -0.373 24.8-104.8 -76.8 167.0 -16.4 -4.1 39.1 418 605 A D H > S+ 0 0 56 2,-0.2 4,-3.6 1,-0.2 5,-0.2 0.924 121.8 48.8 -64.8 -42.5 -14.5 -4.9 35.9 419 606 A D H > S+ 0 0 78 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 114.5 46.1 -66.1 -39.0 -13.8 -8.5 37.0 420 607 A E H > S+ 0 0 64 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.967 113.0 48.7 -60.8 -54.8 -17.4 -9.0 37.9 421 608 A L H X S+ 0 0 0 -4,-3.1 4,-1.2 1,-0.2 3,-0.3 0.910 112.1 50.0 -52.2 -44.5 -18.5 -7.4 34.6 422 609 A F H >< S+ 0 0 50 -4,-3.6 3,-0.7 1,-0.2 4,-0.5 0.933 106.6 56.3 -57.7 -44.8 -16.0 -9.7 32.9 423 610 A Q H 3< S+ 0 0 31 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.848 118.9 31.3 -54.2 -37.9 -17.5 -12.6 34.8 424 611 A Y H >X S+ 0 0 15 -4,-1.9 4,-2.0 -3,-0.3 3,-0.9 0.406 85.2 107.1-107.4 0.0 -21.0 -11.9 33.4 425 612 A L H S+ 0 0 5 -4,-0.5 4,-1.3 1,-0.2 -1,-0.3 0.897 109.8 41.7 -54.4 -43.7 -21.4 -13.5 28.2 427 614 A Q H <> S+ 0 0 3 -3,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.884 111.0 54.5 -74.4 -38.1 -24.9 -13.1 29.6 428 615 A L H < S+ 0 0 0 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.814 107.2 51.6 -64.2 -32.2 -25.1 -9.3 29.2 429 616 A V H >< S+ 0 0 0 -4,-2.0 3,-1.3 -5,-0.2 4,-0.5 0.937 109.3 50.9 -66.6 -42.7 -24.3 -9.6 25.5 430 617 A Q H >< S+ 0 0 9 -4,-1.3 3,-1.9 1,-0.3 -2,-0.2 0.870 101.3 60.7 -65.5 -40.0 -27.0 -12.3 25.0 431 618 A V G >< S+ 0 0 2 -4,-2.0 3,-2.1 1,-0.3 4,-0.4 0.652 85.8 76.3 -61.3 -20.8 -29.6 -10.1 26.7 432 619 A L G X S+ 0 0 0 -3,-1.3 3,-2.5 -4,-0.5 -1,-0.3 0.907 83.7 68.4 -52.3 -38.3 -29.0 -7.6 23.9 433 620 A K G < S+ 0 0 40 -3,-1.9 -1,-0.3 -4,-0.5 -2,-0.2 0.528 94.7 54.7 -60.7 -8.1 -31.1 -10.0 22.0 434 621 A Y G < S+ 0 0 33 -3,-2.1 -1,-0.3 -144,-0.1 -2,-0.2 0.556 82.6 115.3 -94.0 -17.0 -34.1 -9.0 24.1 435 622 A E < - 0 0 48 -3,-2.5 -144,-0.3 -4,-0.4 5,-0.0 -0.188 55.2-153.5 -61.5 146.3 -33.7 -5.3 23.3 436 623 A S S S+ 0 0 19 -35,-0.1 2,-0.2 -146,-0.1 -175,-0.2 0.854 73.9 21.5 -90.2 -30.9 -36.5 -3.7 21.3 437 624 A Y S S- 0 0 30 2,-0.1 -145,-0.0 1,-0.1 -2,-0.0 -0.665 78.6-110.2-128.5 178.7 -34.5 -0.9 19.6 438 625 A L S S+ 0 0 2 -2,-0.2 2,-0.7 1,-0.1 5,-0.1 0.960 100.6 60.4 -82.9 -50.8 -30.9 -0.1 18.7 439 626 A D S S+ 0 0 83 4,-0.1 2,-0.3 3,-0.1 -1,-0.1 -0.702 75.2 150.2 -78.5 115.3 -30.0 2.8 21.1 440 627 A C >> - 0 0 18 -2,-0.7 4,-1.9 1,-0.1 3,-0.7 -0.989 59.1-111.7-149.4 152.3 -30.5 1.3 24.5 441 628 A E H 3> S+ 0 0 82 -2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.866 114.7 55.6 -51.3 -43.4 -29.0 1.7 27.9 442 629 A L H 3> S+ 0 0 5 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.863 106.7 50.3 -61.7 -37.5 -27.3 -1.7 27.9 443 630 A T H <> S+ 0 0 1 -3,-0.7 4,-2.9 2,-0.2 5,-0.3 0.960 112.4 44.8 -68.2 -50.5 -25.5 -0.9 24.6 444 631 A K H X S+ 0 0 80 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.917 114.6 51.7 -63.1 -39.9 -24.1 2.4 25.8 445 632 A F H X S+ 0 0 2 -4,-2.7 4,-3.2 -5,-0.3 5,-0.3 0.990 112.3 42.9 -55.5 -65.7 -23.2 0.7 29.1 446 633 A L H X S+ 0 0 4 -4,-3.0 4,-3.0 1,-0.2 -2,-0.2 0.893 117.4 47.9 -45.6 -48.0 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58.1 29.9-123.3 167.0 -12.9 -31.4 28.1 724 911 A D + 0 0 93 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.902 59.8 172.5 52.2 66.3 -15.6 -31.7 25.5 725 912 A F + 0 0 2 -3,-0.1 -1,-0.2 1,-0.1 -122,-0.1 -0.904 20.5 142.2 -98.0 124.4 -18.9 -30.9 27.1 726 913 A G + 0 0 31 -2,-0.6 2,-0.4 1,-0.1 -1,-0.1 0.225 60.1 71.1-135.7 8.3 -21.8 -30.5 24.8 727 914 A H + 0 0 94 -22,-0.2 -22,-0.3 -128,-0.0 2,-0.2 -0.992 60.2 141.1-130.0 123.4 -24.5 -32.1 27.1 728 915 A F > + 0 0 0 -2,-0.4 3,-2.7 3,-0.2 -25,-0.3 -0.902 46.0 45.2-154.3-178.7 -25.8 -30.5 30.3 729 916 A L T 3 S- 0 0 3 -27,-3.7 -26,-0.3 1,-0.3 -25,-0.1 0.853 128.1 -66.2 37.7 37.5 -28.8 -29.8 32.5 730 917 A G T 3 S+ 0 0 10 -27,-2.4 2,-2.0 -28,-0.2 -1,-0.3 0.250 88.3 154.7 82.7 -11.3 -29.4 -33.5 31.9 731 918 A N < 0 0 56 -3,-2.7 -3,-0.2 1,-0.2 -1,-0.2 -0.261 360.0 360.0 -62.5 80.5 -30.2 -33.2 28.2 732 919 A F 0 0 229 -2,-2.0 -1,-0.2 -5,-0.1 -3,-0.0 0.168 360.0 360.0 -76.2 360.0 -29.2 -36.7 27.1 733 ! 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 0.0 734 929 A R 0 0 118 0, 0.0 -4,-0.0 0, 0.0 68,-0.0 0.000 360.0 360.0 360.0 88.7 -31.6 -36.4 36.1 735 930 A V - 0 0 23 -35,-0.2 -32,-0.1 1,-0.1 -31,-0.1 -0.585 360.0-125.0 -74.5 124.4 -27.8 -37.3 35.9 736 931 A P - 0 0 93 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.325 29.1-101.0 -63.2 153.5 -26.5 -39.3 38.9 737 932 A F - 0 0 7 86,-0.1 2,-0.5 1,-0.0 -40,-0.1 -0.530 47.3-132.7 -65.5 144.4 -23.5 -38.0 40.9 738 933 A I + 0 0 84 -42,-0.3 2,-0.5 -2,-0.2 90,-0.1 -0.916 29.5 178.9-120.2 127.5 -20.5 -40.0 39.7 739 934 A L - 0 0 13 -2,-0.5 2,-0.5 88,-0.4 -2,-0.0 -0.919 18.6-154.5-121.3 105.1 -17.7 -41.7 41.6 740 935 A T >> - 0 0 54 -2,-0.5 4,-2.3 1,-0.1 3,-1.2 -0.655 14.1-137.8 -80.8 127.6 -15.2 -43.4 39.3 741 936 A Y H 3> S+ 0 0 79 -2,-0.5 4,-2.7 1,-0.3 -1,-0.1 0.798 100.9 55.5 -50.7 -36.7 -13.4 -46.3 40.9 742 937 A D H 3> S+ 0 0 22 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.757 109.0 45.9 -78.5 -21.3 -10.1 -45.3 39.4 743 938 A F H X> S+ 0 0 16 -3,-1.2 4,-2.9 2,-0.2 3,-0.5 0.925 112.1 51.9 -74.2 -56.3 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5,-0.2 0.888 74.1 57.8 -40.8 -42.2 -28.0 -20.6 43.8 777 972 A L H 3> S+ 0 0 84 -4,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.879 100.3 54.7 -62.7 -38.8 -29.7 -17.3 43.0 778 973 A L H <> S+ 0 0 12 -3,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.943 110.8 46.3 -58.0 -45.9 -26.7 -16.0 41.1 779 974 A F H X S+ 0 0 2 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.890 112.0 50.3 -64.5 -39.2 -26.7 -19.1 38.9 780 975 A L H X S+ 0 0 24 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.897 112.1 46.9 -67.4 -41.3 -30.5 -19.0 38.3 781 976 A H H X S+ 0 0 18 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.938 114.4 48.4 -64.9 -43.4 -30.4 -15.3 37.3 782 977 A L H X S+ 0 0 2 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.861 113.3 45.8 -63.3 -37.6 -27.4 -16.1 35.0 783 978 A F H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.816 108.1 58.5 -75.9 -27.1 -29.1 -19.0 33.4 784 979 A A H < S+ 0 0 22 -4,-1.8 3,-0.3 1,-0.2 -2,-0.2 0.897 108.0 45.2 -67.3 -43.6 -32.3 -17.0 33.0 785 980 A L H >< S+ 0 0 1 -4,-1.9 3,-1.7 1,-0.2 -1,-0.2 0.815 106.4 61.4 -66.7 -32.9 -30.4 -14.4 31.0 786 981 A M H >< S+ 0 0 5 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-30.0 41.7 807 1002 A L T <5S- 0 0 2 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.336 95.4-142.1 -94.3 5.4 -29.0 -27.1 44.2 808 1003 A A T > 5 + 0 0 11 -4,-0.4 3,-1.4 -5,-0.2 8,-0.2 0.834 34.9 170.3 37.5 50.5 -32.1 -28.1 46.3 809 1004 A L T 3 < + 0 0 65 -5,-1.2 -1,-0.1 1,-0.3 -4,-0.1 0.762 64.8 55.2 -70.8 -24.7 -32.6 -24.4 46.8 810 1005 A G T 3 S+ 0 0 87 -6,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.611 97.5 84.1 -80.9 -12.4 -36.1 -24.6 48.4 811 1006 A K S < S- 0 0 98 -3,-1.4 2,-0.2 1,-0.1 0, 0.0 -0.275 87.3 -97.2 -87.6 170.1 -34.8 -26.8 51.2 812 1007 A T > - 0 0 65 1,-0.1 4,-2.9 -2,-0.1 5,-0.3 -0.573 36.8-113.7 -77.3 150.7 -33.1 -26.2 54.4 813 1008 A E H > S+ 0 0 88 1,-0.2 4,-0.9 -2,-0.2 5,-0.1 0.729 121.5 54.1 -62.6 -20.9 -29.3 -26.6 54.4 814 1009 A E H > S+ 0 0 166 2,-0.1 4,-1.8 3,-0.1 5,-0.2 0.974 111.4 43.0 -67.0 -57.7 -29.9 -29.5 56.6 815 1010 A E H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.905 114.1 49.1 -55.3 -51.2 -32.3 -31.2 54.2 816 1011 A A H X S+ 0 0 0 -4,-2.9 4,-3.3 1,-0.2 -1,-0.2 0.850 109.9 51.0 -60.3 -40.5 -30.3 -30.5 51.0 817 1012 A L H X S+ 0 0 27 -4,-0.9 4,-1.6 -5,-0.3 -1,-0.2 0.876 111.9 46.4 -66.3 -40.6 -27.0 -31.8 52.4 818 1013 A K H X S+ 0 0 144 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.832 113.1 50.6 -70.8 -34.9 -28.6 -35.1 53.6 819 1014 A H H >X S+ 0 0 66 -4,-2.2 4,-1.7 -5,-0.2 3,-1.4 0.976 110.6 48.1 -64.0 -55.4 -30.3 -35.4 50.2 820 1015 A F H 3X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.3 -2,-0.2 0.821 105.6 62.4 -48.4 -35.6 -27.0 -34.8 48.6 821 1016 A R H 3X S+ 0 0 88 -4,-1.6 4,-2.1 2,-0.2 -1,-0.3 0.813 101.7 48.9 -68.1 -28.5 -25.6 -37.4 50.9 822 1017 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 3,-0.7 0.973 114.7 43.4 -62.7 -59.6 -23.2 -39.5 46.9 825 1020 A N H 3X S+ 0 0 60 -4,-2.1 4,-2.4 1,-0.3 5,-0.3 0.936 112.7 55.0 -47.6 -50.9 -23.5 -42.7 48.8 826 1021 A E H 3X S+ 0 0 87 -4,-4.2 4,-0.5 1,-0.2 -1,-0.3 0.859 109.2 49.3 -49.9 -36.5 -25.6 -44.0 46.0 827 1022 A A H XX S+ 0 0 6 -4,-1.9 4,-1.2 -3,-0.7 3,-0.8 0.905 107.1 52.1 -74.3 -42.6 -22.7 -43.0 43.7 828 1023 A L H >< S+ 0 0 51 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.947 103.5 57.4 -58.0 -45.6 -20.0 -44.8 45.8 829 1024 A R H 3< S+ 0 0 163 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.754 102.3 57.8 -59.7 -20.5 -22.0 -48.0 45.7 830 1025 A E H << S+ 0 0 154 -3,-0.8 2,-0.5 -4,-0.5 -1,-0.3 0.808 78.5 95.6 -77.8 -34.3 -21.8 -47.7 42.0 831 1026 A S << 0 0 24 -4,-1.2 -91,-0.1 -3,-1.2 -93,-0.0 -0.537 360.0 360.0 -52.6 110.1 -17.9 -47.6 42.3 832 1027 A W 0 0 262 -2,-0.5 -1,-0.1 0, 0.0 -3,-0.1 -0.053 360.0 360.0 23.4 360.0 -17.8 -51.4 41.5