==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM/PHOSPHOLIPID BINDING PROTEIN 28-NOV-96 1AII . COMPND 2 MOLECULE: ANNEXIN III; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.LEWIT-BENTLEY,B.PERRON . 322 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15222.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 232 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 6 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 57.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 0 5 0 3 4 2 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A A 0 0 157 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.8 2.0 -15.4 -8.2 2 4 A S > - 0 0 70 1,-0.1 3,-0.9 2,-0.1 0, 0.0 0.286 360.0-136.4 -36.8 145.6 5.0 -13.1 -7.5 3 5 A I T 3 S+ 0 0 48 1,-0.2 117,-0.2 119,-0.1 -1,-0.1 0.510 103.6 65.4 -81.8 -6.7 7.0 -12.7 -4.4 4 6 A W T 3 S+ 0 0 24 2,-0.1 2,-0.4 119,-0.0 -1,-0.2 0.364 88.5 77.1 -98.5 1.5 6.9 -8.9 -5.1 5 7 A V < - 0 0 81 -3,-0.9 276,-0.2 -4,-0.1 2,-0.2 -0.972 60.8-178.3-117.7 129.9 3.2 -8.6 -4.6 6 8 A G - 0 0 28 274,-3.0 3,-0.4 -2,-0.4 276,-0.1 -0.439 38.9-100.9-114.1-172.4 1.6 -8.6 -1.1 7 9 A H S S+ 0 0 190 1,-0.2 275,-0.1 -2,-0.2 274,-0.1 0.551 109.2 48.6 -91.2 -8.3 -1.9 -8.4 0.4 8 10 A R S S+ 0 0 108 273,-2.3 276,-2.5 272,-0.1 277,-0.6 -0.107 72.7 135.4-128.3 42.5 -2.0 -4.7 1.4 9 11 A G - 0 0 13 271,-0.4 271,-0.3 -3,-0.4 270,-0.1 -0.358 48.8-144.5 -82.7 164.3 -0.8 -2.6 -1.5 10 12 A T S S+ 0 0 28 269,-2.5 2,-0.5 268,-0.1 270,-0.2 0.545 86.3 66.8-101.8 -14.9 -2.4 0.6 -2.8 11 13 A V + 0 0 11 268,-1.7 2,-0.3 307,-0.0 38,-0.1 -0.938 65.4 169.3-112.0 124.0 -1.7 -0.2 -6.5 12 14 A R - 0 0 206 -2,-0.5 36,-0.1 36,-0.1 -2,-0.0 -0.820 43.1 -70.7-128.7 165.9 -3.5 -3.2 -8.1 13 15 A D - 0 0 110 -2,-0.3 34,-0.1 34,-0.2 3,-0.1 -0.326 44.6-127.6 -57.3 140.4 -4.0 -4.6 -11.6 14 16 A Y > - 0 0 86 1,-0.2 3,-1.5 34,-0.1 -1,-0.1 -0.838 13.2-151.9 -91.1 115.9 -6.3 -2.6 -13.8 15 17 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.858 93.4 49.7 -59.7 -39.3 -8.9 -5.0 -15.2 16 18 A D T 3 S+ 0 0 132 -3,-0.1 -2,-0.0 2,-0.0 -3,-0.0 0.266 82.5 145.8 -89.0 19.5 -9.5 -2.9 -18.4 17 19 A F < + 0 0 35 -3,-1.5 30,-0.0 4,-0.0 -4,-0.0 -0.216 23.8 179.3 -56.8 136.2 -5.7 -2.7 -19.2 18 20 A S > - 0 0 37 1,-0.1 4,-2.5 2,-0.0 3,-0.3 -0.888 15.9-158.4-142.4 104.5 -4.7 -2.7 -22.8 19 21 A P H > S+ 0 0 37 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.834 92.5 48.8 -54.0 -42.4 -0.9 -2.5 -23.4 20 22 A S H > S+ 0 0 65 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.868 112.3 50.3 -69.2 -33.7 -1.1 -1.2 -27.0 21 23 A V H > S+ 0 0 86 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.931 114.7 43.7 -67.1 -48.4 -3.7 1.4 -26.0 22 24 A D H X S+ 0 0 9 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.923 112.6 50.7 -64.9 -45.7 -1.5 2.6 -23.1 23 25 A A H X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.866 111.4 49.4 -62.0 -34.5 1.8 2.6 -25.1 24 26 A E H X S+ 0 0 104 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.912 111.9 48.1 -70.1 -42.4 0.1 4.6 -27.9 25 27 A A H X S+ 0 0 29 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.889 113.0 48.1 -65.1 -41.3 -1.2 7.2 -25.3 26 28 A I H X S+ 0 0 0 -4,-2.7 4,-1.4 2,-0.2 5,-0.2 0.909 110.3 52.0 -66.3 -42.7 2.3 7.4 -23.6 27 29 A Q H X S+ 0 0 20 -4,-2.3 4,-1.7 -5,-0.2 3,-0.3 0.911 110.6 48.4 -62.1 -39.7 4.0 7.9 -27.0 28 30 A K H < S+ 0 0 94 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.925 108.8 53.8 -64.6 -45.1 1.6 10.7 -27.9 29 31 A A H < S+ 0 0 8 -4,-2.1 7,-2.1 1,-0.2 -1,-0.2 0.729 117.4 34.4 -63.3 -26.7 2.1 12.5 -24.6 30 32 A I H < S+ 0 0 14 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.680 96.0 97.1-104.9 -15.2 5.9 12.6 -24.8 31 33 A R S < S+ 0 0 133 -4,-1.7 39,-0.0 -5,-0.2 -4,-0.0 -0.306 81.6 4.0 -79.4 146.0 6.5 13.1 -28.6 32 34 A G S S- 0 0 56 3,-0.0 2,-0.1 0, 0.0 0, 0.0 -0.139 113.8 -23.9 75.8-168.9 7.0 16.6 -30.1 33 35 A I S S+ 0 0 178 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 -0.399 114.0 21.4 -73.4 149.2 7.3 19.8 -28.0 34 36 A G S S- 0 0 55 -2,-0.1 2,-0.4 1,-0.1 40,-0.0 0.192 76.1-117.2 76.6 155.5 5.7 19.9 -24.5 35 37 A T - 0 0 31 39,-0.0 2,-1.2 4,-0.0 -5,-0.2 -0.995 5.1-139.8-133.1 138.6 4.8 16.9 -22.4 36 38 A D >> + 0 0 78 -7,-2.1 4,-1.6 -2,-0.4 3,-0.5 -0.755 31.5 170.2 -97.0 84.3 1.4 15.8 -21.3 37 39 A E H 3> S+ 0 0 61 -2,-1.2 4,-2.9 1,-0.2 5,-0.2 0.860 71.6 61.9 -65.8 -35.9 2.4 14.8 -17.7 38 40 A K H 3> S+ 0 0 108 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.797 105.4 50.1 -59.3 -29.8 -1.1 14.4 -16.5 39 41 A M H <> S+ 0 0 67 -3,-0.5 4,-1.8 2,-0.2 5,-0.2 0.947 110.4 46.4 -73.4 -51.4 -1.5 11.7 -19.1 40 42 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 5,-0.3 0.901 116.7 47.4 -55.9 -42.7 1.7 9.9 -18.1 41 43 A I H X S+ 0 0 2 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.904 108.2 53.1 -64.6 -47.0 0.6 10.2 -14.5 42 44 A S H < S+ 0 0 50 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.814 119.1 35.5 -61.8 -30.7 -3.0 9.0 -15.1 43 45 A I H >< S+ 0 0 9 -4,-1.8 3,-1.4 2,-0.1 -2,-0.2 0.944 117.8 44.4 -86.3 -61.1 -1.8 5.8 -16.8 44 46 A L H >< S+ 0 0 0 -4,-2.3 3,-1.0 1,-0.3 -3,-0.2 0.851 114.0 48.4 -58.1 -39.8 1.4 4.7 -15.0 45 47 A T T 3< S+ 0 0 7 -4,-1.6 -1,-0.3 -5,-0.3 -3,-0.1 0.553 110.9 54.1 -80.1 -3.0 0.1 5.2 -11.5 46 48 A E T < S+ 0 0 86 -3,-1.4 2,-0.3 -5,-0.2 -1,-0.2 0.149 98.2 72.2-115.0 20.5 -3.0 3.3 -12.4 47 49 A R S < S- 0 0 16 -3,-1.0 -34,-0.2 -34,-0.1 2,-0.0 -0.969 83.3-119.1-128.1 144.0 -1.3 0.2 -13.7 48 50 A S > - 0 0 0 -2,-0.3 4,-2.3 1,-0.1 3,-0.2 -0.302 35.7-101.8 -76.3 168.1 0.5 -2.4 -11.5 49 51 A N H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.917 123.0 56.9 -58.9 -39.7 4.2 -3.0 -12.1 50 52 A A H > S+ 0 0 60 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.905 109.3 45.0 -58.7 -41.6 3.4 -6.2 -14.0 51 53 A Q H >> S+ 0 0 19 1,-0.2 4,-1.9 -3,-0.2 3,-0.6 0.902 108.4 57.2 -69.8 -38.4 1.2 -4.3 -16.4 52 54 A R H 3X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.3 -1,-0.2 0.860 102.8 55.1 -58.9 -37.3 3.8 -1.5 -16.8 53 55 A Q H 3X S+ 0 0 48 -4,-2.0 4,-2.3 1,-0.2 -1,-0.3 0.813 106.2 51.1 -66.3 -28.4 6.3 -4.1 -17.9 54 56 A L H > - 0 0 75 -2,-0.3 4,-1.5 1,-0.2 3,-0.9 -0.836 22.9-140.7 -91.1 125.4 12.9 2.1 -24.5 67 69 A L H 3> S+ 0 0 0 -2,-0.6 4,-2.9 1,-0.3 5,-0.2 0.856 101.4 62.1 -51.5 -39.4 10.1 3.9 -22.5 68 70 A K H 3> S+ 0 0 55 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.877 105.4 45.5 -53.9 -44.6 12.7 4.5 -19.7 69 71 A D H <> S+ 0 0 84 -3,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.833 111.3 51.4 -70.9 -35.1 14.8 6.6 -22.1 70 72 A D H X S+ 0 0 23 -4,-1.5 4,-1.3 2,-0.2 5,-0.2 0.939 112.6 47.3 -66.8 -46.1 11.8 8.5 -23.5 71 73 A L H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 3,-0.3 0.935 113.9 47.3 -59.2 -48.8 10.8 9.3 -19.9 72 74 A K H < S+ 0 0 92 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.764 111.5 49.3 -65.5 -30.3 14.3 10.4 -19.0 73 75 A G H < S+ 0 0 72 -4,-1.8 -1,-0.2 -3,-0.1 -2,-0.2 0.716 121.8 34.0 -81.7 -22.7 14.9 12.6 -22.0 74 76 A D H < S+ 0 0 57 -4,-1.3 -2,-0.2 -3,-0.3 2,-0.2 0.794 111.1 62.1 -99.2 -38.4 11.6 14.4 -21.6 75 77 A L < - 0 0 8 -4,-2.9 2,-0.3 -5,-0.2 -45,-0.0 -0.522 61.6-163.8 -95.2 161.9 11.1 14.6 -17.8 76 78 A S >> - 0 0 97 -2,-0.2 4,-1.4 -3,-0.0 3,-0.6 -0.929 39.8 -0.9-140.5 164.0 13.2 16.2 -15.1 77 79 A G H 3> S- 0 0 40 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 -0.139 113.3 -20.3 59.5-146.4 13.8 16.4 -11.4 78 80 A H H 3> S+ 0 0 64 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.842 135.1 57.6 -65.7 -33.8 12.0 14.3 -8.8 79 81 A F H <> S+ 0 0 18 -3,-0.6 4,-2.9 1,-0.2 5,-0.2 0.928 105.8 50.5 -61.2 -46.6 9.0 13.6 -11.1 80 82 A E H X S+ 0 0 39 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.957 111.7 47.3 -55.6 -50.7 11.4 12.1 -13.7 81 83 A H H X S+ 0 0 76 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.917 113.5 47.8 -58.3 -46.5 13.0 9.8 -11.0 82 84 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.892 112.8 48.4 -64.0 -42.3 9.6 8.7 -9.6 83 85 A M H X S+ 0 0 0 -4,-2.9 4,-1.0 1,-0.2 -2,-0.2 0.898 113.4 46.5 -67.4 -40.0 8.3 8.0 -13.1 84 86 A V H < S+ 0 0 24 -4,-2.6 3,-0.3 -5,-0.2 4,-0.3 0.871 109.1 56.5 -69.1 -36.6 11.4 6.0 -14.1 85 87 A A H >< S+ 0 0 6 -4,-2.4 3,-1.1 -5,-0.2 -2,-0.2 0.876 102.5 56.2 -61.4 -40.1 11.1 4.1 -10.7 86 88 A L H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.833 107.8 46.5 -63.9 -32.7 7.6 3.0 -11.5 87 89 A V T 3< S+ 0 0 5 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.356 91.6 99.4 -93.9 8.4 8.6 1.3 -14.8 88 90 A T S < S- 0 0 5 -3,-1.1 5,-0.1 -4,-0.3 -35,-0.1 -0.795 84.6-107.4 -93.6 133.9 11.6 -0.5 -13.3 89 91 A P > - 0 0 48 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.303 34.0-117.0 -56.0 143.2 11.1 -4.2 -12.3 90 92 A P H > S+ 0 0 39 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.819 112.3 47.6 -54.5 -42.1 11.0 -4.5 -8.5 91 93 A A H > S+ 0 0 13 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.892 115.0 48.1 -67.6 -39.0 14.2 -6.6 -8.1 92 94 A V H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.904 109.0 52.9 -68.5 -40.0 16.0 -4.3 -10.4 93 95 A F H X S+ 0 0 16 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.933 110.4 46.9 -61.5 -46.3 14.8 -1.1 -8.6 94 96 A D H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.910 112.2 51.3 -63.7 -40.1 16.0 -2.4 -5.2 95 97 A A H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.916 112.0 45.9 -60.6 -45.3 19.3 -3.4 -6.8 96 98 A K H X S+ 0 0 70 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.860 112.5 51.4 -65.2 -38.0 19.7 0.1 -8.3 97 99 A Q H X S+ 0 0 21 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.823 110.5 48.6 -68.0 -34.5 18.7 1.6 -4.9 98 100 A L H < S+ 0 0 0 -4,-2.2 4,-0.3 2,-0.2 -2,-0.2 0.916 113.5 46.6 -70.1 -44.7 21.3 -0.5 -3.1 99 101 A K H >< S+ 0 0 34 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.885 110.1 53.1 -65.7 -41.9 24.0 0.5 -5.7 100 102 A K H >< S+ 0 0 72 -4,-2.3 3,-1.2 1,-0.3 -1,-0.2 0.840 102.7 60.2 -61.6 -34.9 23.0 4.2 -5.4 101 103 A S T 3< S+ 0 0 4 -4,-1.2 7,-3.9 1,-0.3 -1,-0.3 0.638 110.1 41.3 -69.0 -14.8 23.4 4.0 -1.6 102 104 A M T < S+ 0 0 10 -3,-1.3 2,-0.4 -4,-0.3 -1,-0.3 -0.072 90.4 111.8-122.3 27.0 27.1 3.0 -2.0 103 105 A K < + 0 0 140 -3,-1.2 3,-0.2 43,-0.0 2,-0.2 -0.866 66.6 5.0-111.2 144.2 28.3 5.4 -4.8 104 106 A G S S- 0 0 62 -2,-0.4 -3,-0.0 1,-0.2 0, 0.0 -0.523 111.1 -46.0 90.2-158.8 30.7 8.3 -4.5 105 107 A A S S+ 0 0 111 -2,-0.2 -1,-0.2 2,-0.0 0, 0.0 0.940 121.6 63.2 -75.5 -46.7 32.6 9.3 -1.4 106 108 A G - 0 0 51 -3,-0.2 2,-0.3 2,-0.0 0, 0.0 0.273 69.0-150.1 -62.5-169.2 29.7 9.0 0.9 107 109 A T - 0 0 33 -5,-0.1 2,-1.0 40,-0.0 -5,-0.2 -0.835 12.6-137.6-165.3 130.4 27.6 5.9 1.8 108 110 A N > + 0 0 67 -7,-3.9 4,-1.7 -2,-0.3 3,-0.2 -0.816 26.5 172.5-101.7 92.5 24.0 5.9 2.7 109 111 A E H > S+ 0 0 51 -2,-1.0 4,-2.6 1,-0.2 -1,-0.2 0.827 75.0 60.7 -64.6 -35.1 23.9 3.4 5.6 110 112 A D H > S+ 0 0 67 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.875 106.3 44.5 -61.5 -41.2 20.2 4.3 6.4 111 113 A A H > S+ 0 0 0 2,-0.2 4,-2.7 -3,-0.2 5,-0.3 0.910 112.9 52.2 -70.2 -41.4 19.0 3.1 2.9 112 114 A L H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 5,-0.2 0.926 112.8 45.4 -58.6 -44.4 21.2 0.0 3.2 113 115 A I H X S+ 0 0 9 -4,-2.6 4,-1.8 2,-0.2 5,-0.2 0.944 111.8 51.8 -63.9 -51.9 19.6 -0.7 6.5 114 116 A E H X S+ 0 0 1 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.913 115.7 39.4 -53.2 -50.9 16.1 -0.0 5.3 115 117 A I H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 3,-0.3 0.961 115.5 47.7 -67.7 -52.9 16.3 -2.3 2.3 116 118 A L H < S+ 0 0 5 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.765 116.2 45.3 -64.1 -23.2 18.2 -5.2 3.7 117 119 A T H < S+ 0 0 4 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.758 115.2 44.1 -91.5 -24.4 16.0 -5.4 6.8 118 120 A T H < S+ 0 0 11 -4,-1.4 2,-0.3 -3,-0.3 -2,-0.2 0.662 92.4 88.6 -95.3 -15.9 12.6 -5.1 5.1 119 121 A R S < S- 0 0 16 -4,-1.7 42,-0.1 -5,-0.1 -4,-0.0 -0.626 76.2-124.5 -84.3 141.0 13.0 -7.5 2.1 120 122 A T > - 0 0 78 -2,-0.3 4,-2.3 -117,-0.2 5,-0.2 -0.157 30.7 -98.8 -73.0 173.4 12.1 -11.2 2.7 121 123 A S H > S+ 0 0 12 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.905 124.1 49.2 -62.6 -42.9 14.6 -13.9 2.0 122 124 A R H > S+ 0 0 141 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.869 110.8 51.6 -66.0 -36.7 13.2 -14.8 -1.5 123 125 A Q H > S+ 0 0 10 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.926 107.9 51.9 -64.5 -44.3 13.2 -11.0 -2.4 124 126 A M H X S+ 0 0 4 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.807 106.6 53.2 -61.9 -34.4 16.9 -10.7 -1.4 125 127 A K H X S+ 0 0 87 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.913 111.5 46.9 -66.2 -42.8 17.8 -13.7 -3.6 126 128 A D H X S+ 0 0 57 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.935 113.0 48.0 -62.5 -46.9 16.1 -11.9 -6.5 127 129 A I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.926 111.0 51.0 -60.6 -46.4 17.9 -8.6 -5.7 128 130 A S H X S+ 0 0 31 -4,-2.8 4,-2.1 1,-0.2 11,-0.2 0.895 111.8 48.1 -59.0 -43.4 21.3 -10.4 -5.4 129 131 A Q H X S+ 0 0 110 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.931 114.6 45.0 -63.5 -46.4 20.7 -12.1 -8.8 130 132 A A H X S+ 0 0 15 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.896 111.2 52.9 -65.1 -39.8 19.6 -8.8 -10.5 131 133 A Y H X>S+ 0 0 1 -4,-2.9 4,-3.2 1,-0.2 5,-0.5 0.942 111.3 46.6 -59.1 -47.9 22.5 -6.8 -8.9 132 134 A Y H X5S+ 0 0 140 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.894 114.1 48.8 -62.1 -41.1 25.0 -9.3 -10.2 133 135 A T H <5S+ 0 0 104 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.937 119.6 35.4 -66.0 -49.6 23.3 -9.3 -13.7 134 136 A V H <5S+ 0 0 49 -4,-3.1 -2,-0.2 1,-0.1 -3,-0.2 0.842 130.6 28.0 -75.1 -39.3 23.2 -5.5 -14.0 135 137 A Y H <5S- 0 0 43 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.2 0.611 89.6-135.8-101.4 -11.3 26.5 -4.5 -12.3 136 138 A K S < - 0 0 44 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.442 21.8-125.1 -75.2 155.2 28.2 -9.4 -6.4 139 141 A L H > S+ 0 0 4 -11,-0.2 4,-2.9 2,-0.2 5,-0.2 0.903 112.2 57.1 -63.0 -42.0 26.1 -7.4 -3.9 140 142 A G H > S+ 0 0 24 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.904 105.4 50.4 -54.4 -47.4 28.3 -8.8 -1.1 141 143 A D H > S+ 0 0 101 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.896 113.0 44.2 -62.1 -43.6 31.5 -7.5 -2.7 142 144 A D H X S+ 0 0 21 -4,-1.7 4,-0.5 2,-0.2 -2,-0.2 0.922 114.4 49.5 -70.7 -39.5 30.1 -4.0 -3.1 143 145 A I H >X S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 4,-0.8 0.906 110.6 52.7 -59.6 -42.9 28.7 -4.0 0.4 144 146 A S H 3< S+ 0 0 35 -4,-2.7 3,-0.4 1,-0.3 -1,-0.2 0.842 105.8 52.7 -59.0 -39.7 32.1 -5.2 1.6 145 147 A S H 3< S+ 0 0 82 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.536 113.9 42.2 -77.4 -9.1 34.0 -2.4 -0.1 146 148 A E H << S+ 0 0 73 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.2 0.395 113.2 47.2-118.1 -1.9 31.9 0.3 1.5 147 149 A T < - 0 0 18 -4,-0.8 2,-0.3 -3,-0.4 -40,-0.0 -0.832 59.8-161.2-134.2 170.7 31.5 -0.9 5.1 148 150 A S >> + 0 0 94 -2,-0.3 4,-1.9 -3,-0.0 3,-0.6 -0.904 45.0 3.7-146.2 174.6 33.6 -2.2 7.9 149 151 A G H 3> S- 0 0 42 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 -0.028 114.9 -16.7 49.7-141.2 33.4 -4.2 11.2 150 152 A D H 3> S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.802 134.6 58.3 -66.8 -31.6 30.3 -5.7 12.7 151 153 A F H <> S+ 0 0 15 -3,-0.6 4,-2.5 2,-0.2 -2,-0.2 0.945 107.2 48.4 -62.3 -47.5 28.0 -3.6 10.5 152 154 A R H X S+ 0 0 65 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.912 111.5 49.2 -57.1 -48.0 29.7 -5.1 7.4 153 155 A K H X S+ 0 0 78 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.869 112.9 46.7 -62.9 -39.1 29.4 -8.7 8.7 154 156 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.882 112.7 49.2 -74.3 -33.1 25.7 -8.2 9.6 155 157 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.939 111.5 49.0 -71.9 -43.5 24.9 -6.7 6.2 156 158 A L H X S+ 0 0 38 -4,-2.7 4,-0.7 2,-0.2 -1,-0.2 0.850 109.9 52.7 -62.8 -33.8 26.7 -9.5 4.3 157 159 A T H ><>S+ 0 0 41 -4,-1.6 3,-0.8 -5,-0.2 5,-0.6 0.953 113.3 43.8 -65.0 -46.2 24.7 -12.0 6.4 158 160 A L H ><5S+ 0 0 15 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.871 105.5 61.2 -66.0 -41.2 21.5 -10.2 5.4 159 161 A A H 3<5S+ 0 0 5 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.640 95.0 64.8 -61.5 -16.9 22.5 -9.9 1.7 160 162 A D T <<5S- 0 0 66 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.621 96.9-139.4 -82.0 -14.2 22.7 -13.7 1.5 161 163 A G T < 5 + 0 0 10 -3,-1.8 -3,-0.1 -4,-0.2 -36,-0.1 0.871 57.2 135.6 57.1 44.3 18.9 -14.1 2.1 162 164 A R < + 0 0 161 -5,-0.6 2,-0.1 39,-0.1 -1,-0.1 0.253 19.4 136.4-105.0 14.1 19.4 -17.1 4.4 163 165 A R S S- 0 0 36 -5,-0.2 40,-0.2 1,-0.1 39,-0.2 -0.402 73.2 -92.8 -60.0 130.6 17.0 -15.9 7.1 164 166 A D - 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0 0 4 -2,-0.3 4,-1.7 25,-0.3 5,-0.1 -0.306 22.3-121.1 -76.3 161.1 -2.6 10.8 7.2 298 300 A L H > S+ 0 0 0 -11,-0.2 4,-2.5 1,-0.2 5,-0.2 0.863 114.2 60.0 -65.2 -35.3 0.3 10.1 4.9 299 301 A Y H > S+ 0 0 61 21,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.940 106.9 41.6 -57.8 -53.8 -1.8 11.8 2.2 300 302 A S H > S+ 0 0 43 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.826 112.6 57.1 -68.6 -28.2 -2.0 15.1 4.0 301 303 A A H X S+ 0 0 5 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.911 108.8 44.8 -66.9 -40.8 1.7 14.7 4.9 302 304 A I H X S+ 0 0 0 -4,-2.5 4,-1.2 1,-0.2 3,-0.4 0.912 110.9 55.2 -69.4 -42.2 2.6 14.4 1.2 303 305 A K H < S+ 0 0 109 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 108.5 48.1 -59.6 -36.4 0.3 17.4 0.3 304 306 A S H < S+ 0 0 92 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.743 119.6 33.6 -81.5 -22.3 2.1 19.7 2.8 305 307 A D H < S+ 0 0 62 -4,-1.1 2,-0.3 -3,-0.4 -2,-0.2 0.398 114.6 51.3-113.0 3.8 5.7 19.0 1.9 306 308 A T < - 0 0 13 -4,-1.2 2,-0.3 -5,-0.1 -45,-0.0 -0.922 59.0-177.1-136.1 162.6 5.6 18.4 -1.9 307 309 A S > + 0 0 91 -2,-0.3 4,-1.4 -3,-0.0 3,-0.5 -0.921 38.7 21.8-149.8 176.0 4.1 20.1 -4.9 308 310 A G H > S- 0 0 44 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 -0.213 113.3 -24.4 66.7-152.1 3.6 20.0 -8.6 309 311 A D H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.859 137.0 59.3 -63.6 -36.7 3.5 16.9 -10.8 310 312 A Y H > S+ 0 0 18 -3,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.943 105.3 48.4 -57.4 -50.0 5.7 15.2 -8.2 311 313 A E H X S+ 0 0 31 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.892 110.2 50.9 -59.1 -44.2 3.1 15.7 -5.5 312 314 A I H X S+ 0 0 56 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.913 109.2 50.4 -62.7 -44.0 0.2 14.4 -7.7 313 315 A T H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.916 112.8 46.4 -60.4 -46.6 2.1 11.2 -8.6 314 316 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.879 112.1 50.6 -64.9 -37.6 2.9 10.4 -4.9 315 317 A L H X S+ 0 0 15 -4,-2.2 4,-1.2 2,-0.2 5,-0.3 0.878 110.5 50.1 -67.1 -37.1 -0.8 11.2 -3.9 316 318 A K H < S+ 0 0 69 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.882 112.6 46.5 -68.3 -38.7 -2.0 8.8 -6.7 317 319 A I H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.913 106.7 57.9 -66.1 -43.2 0.4 6.1 -5.4 318 320 A C H < S- 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.877 96.3-155.6 -52.1 -36.4 -0.7 6.7 -1.8 319 321 A G < - 0 0 50 -4,-1.2 2,-0.3 -5,-0.2 -1,-0.1 0.363 49.9 -12.5 75.2 -2.1 -4.2 5.9 -3.1 320 322 A G S S- 0 0 21 -5,-0.3 2,-0.3 2,-0.0 -21,-0.2 -0.936 72.5 -79.0 162.5 174.6 -6.4 7.8 -0.6 321 323 A D 0 0 97 -2,-0.3 -34,-0.0 -22,-0.1 0, 0.0 -0.687 360.0 360.0-101.8 155.2 -6.7 9.6 2.7 322 324 A D 0 0 81 -2,-0.3 -25,-0.3 -35,-0.1 -22,-0.1 -0.907 360.0 360.0-119.2 360.0 -7.0 8.0 6.1