==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 16-NOV-10 3PM2 . COMPND 2 MOLECULE: ODORANT BINDING PROTEIN (AGAP007287-PA); . SOURCE 2 ORGANISM_SCIENTIFIC: ANOPHELES GAMBIAE; . AUTHOR S.SPINELLI,A.LAGARDE,H.QIAO,M.TEGONI,P.PELOSI,C.CAMBILLAU . 173 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10039.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 66.5 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 . 3 1.7 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 . 1 0.6 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 . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 15.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 43.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 0 0 0 1 1 1 0 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 151 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.5 19.7 7.3 27.5 2 2 A D - 0 0 152 1,-0.1 44,-0.1 2,-0.0 3,-0.0 -0.518 360.0-102.8 -69.8 136.8 18.6 10.9 27.2 3 3 A N > - 0 0 58 42,-0.2 3,-1.4 -2,-0.2 4,-0.4 -0.500 26.2-152.4 -66.1 119.0 15.0 11.1 25.7 4 4 A P G > S+ 0 0 52 0, 0.0 3,-1.2 0, 0.0 4,-0.3 0.810 92.6 64.1 -62.5 -25.3 15.5 12.1 22.0 5 5 A a G > S+ 0 0 17 1,-0.3 3,-1.0 2,-0.2 -2,-0.1 0.667 83.3 75.4 -76.4 -11.3 12.0 13.7 22.1 6 6 A L G < S+ 0 0 88 -3,-1.4 -1,-0.3 1,-0.2 40,-0.0 0.782 86.8 64.3 -65.9 -27.9 13.2 16.3 24.6 7 7 A K G < S- 0 0 172 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.734 99.9-142.7 -68.9 -25.2 15.0 18.0 21.7 8 8 A G < - 0 0 21 -3,-1.0 -1,-0.1 -4,-0.3 -2,-0.1 -0.013 47.6 -34.1 77.4 168.4 11.8 18.8 19.9 9 9 A P - 0 0 72 0, 0.0 154,-0.1 0, 0.0 153,-0.0 -0.339 59.2-128.7 -57.8 139.1 11.5 18.7 16.1 10 10 A P S S+ 0 0 77 0, 0.0 153,-0.1 0, 0.0 152,-0.0 0.692 94.0 31.5 -64.1 -19.9 14.9 19.8 14.5 11 11 A V S S- 0 0 14 2,-0.2 -3,-0.0 148,-0.1 0, 0.0 -0.988 75.3-133.9-134.2 143.6 13.1 22.3 12.2 12 12 A P + 0 0 139 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.512 61.8 135.6 -75.4 -1.0 9.8 24.2 12.9 13 13 A K - 0 0 44 1,-0.1 2,-0.2 2,-0.1 -2,-0.2 -0.181 65.1-111.7 -49.6 129.2 8.6 23.2 9.4 14 14 A N > - 0 0 96 1,-0.1 3,-1.7 3,-0.0 4,-0.2 -0.520 19.1-134.2 -66.2 127.0 4.9 22.1 9.5 15 15 A A G >> S+ 0 0 22 1,-0.3 3,-2.4 -2,-0.2 4,-1.8 0.804 102.1 69.6 -57.0 -32.5 4.8 18.3 8.8 16 16 A A G 34 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.2 -3,-0.0 0.747 91.3 62.1 -56.7 -25.4 1.8 18.8 6.3 17 17 A E G <4 S+ 0 0 110 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.588 108.2 42.0 -77.6 -11.7 4.4 20.5 4.1 18 18 A b T <4 S- 0 0 1 -3,-2.4 137,-2.7 1,-0.4 2,-0.3 0.772 135.7 -10.6 -97.1 -43.3 6.3 17.2 3.9 19 19 A c < - 0 0 3 -4,-1.8 2,-0.7 135,-0.2 -1,-0.4 -0.907 58.5-130.0-159.3 137.1 3.2 14.9 3.5 20 20 A V - 0 0 102 133,-0.4 -4,-0.1 -2,-0.3 -3,-0.0 -0.809 41.6-174.0 -89.5 113.9 -0.5 15.3 3.8 21 21 A T - 0 0 45 -2,-0.7 125,-0.1 1,-0.1 121,-0.0 -0.764 28.4 -94.1-110.1 159.0 -1.5 12.4 6.1 22 22 A P - 0 0 4 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.220 44.4-159.2 -61.6 159.0 -4.9 10.9 7.3 23 23 A F - 0 0 84 58,-0.3 61,-0.4 57,-0.2 62,-0.1 -0.958 29.6-155.3-140.6 163.1 -6.1 12.2 10.6 24 24 A L S S+ 0 0 11 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.564 87.3 33.8-108.2 -20.6 -8.5 11.2 13.4 25 25 A V S S- 0 0 18 56,-0.0 -1,-0.2 55,-0.0 36,-0.0 -0.990 87.1-107.2-140.0 144.1 -9.1 14.8 14.7 26 26 A E >> - 0 0 123 -2,-0.3 4,-1.9 1,-0.1 3,-0.6 -0.412 38.7-111.2 -67.3 144.4 -9.3 18.3 13.0 27 27 A P H 3> S+ 0 0 83 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.799 115.7 58.5 -47.8 -36.9 -6.2 20.5 13.7 28 28 A S H 3> S+ 0 0 92 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.932 107.8 44.8 -59.9 -48.2 -8.3 22.9 15.9 29 29 A A H <> S+ 0 0 34 -3,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.874 113.4 51.7 -65.7 -35.6 -9.4 20.2 18.3 30 30 A F H X S+ 0 0 47 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.924 107.5 52.1 -65.3 -45.0 -5.8 18.9 18.4 31 31 A M H X S+ 0 0 106 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.860 105.3 55.0 -62.0 -36.7 -4.4 22.3 19.2 32 32 A T H X S+ 0 0 94 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.915 112.9 43.0 -58.7 -48.5 -6.8 22.8 22.2 33 33 A d H X S+ 0 0 3 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.886 113.8 51.2 -65.7 -41.7 -5.5 19.4 23.6 34 34 A H H X S+ 0 0 46 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.948 110.6 47.9 -60.0 -53.4 -1.8 20.3 22.8 35 35 A S H < S+ 0 0 94 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.911 113.6 48.8 -55.4 -43.3 -2.1 23.8 24.6 36 36 A K H < S+ 0 0 144 -4,-1.9 -1,-0.2 -5,-0.2 4,-0.2 0.877 127.8 18.7 -63.8 -42.7 -3.8 22.2 27.7 37 37 A W H X S+ 0 0 34 -4,-2.0 4,-2.3 2,-0.1 19,-0.2 0.468 91.2 94.6-115.9 -6.1 -1.3 19.3 28.2 38 38 A I H X S+ 0 0 28 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.862 84.0 60.7 -57.4 -36.1 2.0 20.0 26.4 39 39 A G H > S+ 0 0 51 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.949 112.9 33.8 -55.4 -57.3 3.6 21.5 29.6 40 40 A Q H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.827 113.5 61.4 -72.1 -30.9 3.2 18.4 31.7 41 41 A T H X S+ 0 0 9 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.936 106.2 46.5 -59.9 -44.6 3.8 16.1 28.6 42 42 A K H >< S+ 0 0 128 -4,-2.7 3,-0.6 1,-0.2 4,-0.4 0.902 111.0 52.5 -63.7 -40.4 7.3 17.7 28.2 43 43 A R H >< S+ 0 0 140 -4,-1.7 3,-1.6 1,-0.2 -1,-0.2 0.908 106.2 54.2 -61.2 -42.7 7.9 17.3 32.0 44 44 A Q H >< S+ 0 0 16 -4,-2.5 3,-1.1 1,-0.3 8,-0.2 0.740 96.7 65.3 -65.6 -22.6 7.0 13.5 31.7 45 45 A M T << S+ 0 0 26 -4,-1.1 -1,-0.3 -3,-0.6 -42,-0.2 0.651 99.4 54.8 -68.6 -19.1 9.6 13.1 28.9 46 46 A A T < S+ 0 0 72 -3,-1.6 2,-0.4 -4,-0.4 -1,-0.3 -0.102 90.1 97.1-105.0 30.0 12.3 13.8 31.6 47 47 A M < - 0 0 53 -3,-1.1 5,-0.1 2,-0.1 2,-0.1 -0.977 64.6-138.8-124.8 132.5 11.1 11.1 34.0 48 48 A E + 0 0 186 -2,-0.4 2,-0.2 3,-0.1 -2,-0.1 -0.281 59.9 37.1 -81.0 173.8 12.7 7.7 34.3 49 49 A G S S+ 0 0 70 -2,-0.1 3,-0.1 3,-0.0 -2,-0.1 -0.546 102.6 14.5 89.0-154.5 10.9 4.3 34.7 50 50 A I S S- 0 0 74 -2,-0.2 64,-0.0 1,-0.1 -3,-0.0 -0.387 91.5 -97.9 -59.1 131.1 7.6 3.1 33.3 51 51 A P - 0 0 73 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.237 40.1-129.2 -52.2 135.3 6.5 5.4 30.3 52 52 A R - 0 0 53 -8,-0.2 66,-0.1 -5,-0.1 79,-0.1 -0.800 28.1 -99.7 -93.7 137.9 3.9 7.9 31.7 53 53 A G - 0 0 3 77,-0.6 2,-0.7 -2,-0.4 77,-0.4 -0.209 34.1-119.6 -57.3 137.4 0.6 8.2 29.8 54 54 A C > - 0 0 28 78,-0.2 4,-1.7 1,-0.2 81,-0.2 -0.729 20.2-166.4 -85.3 116.1 0.3 11.2 27.4 55 55 A e H > S+ 0 0 0 -2,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.759 86.2 64.9 -72.2 -27.1 -2.6 13.5 28.4 56 56 A V H > S+ 0 0 3 -19,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.949 108.0 42.8 -56.6 -48.7 -2.5 15.4 25.0 57 57 A A H > S+ 0 0 4 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.875 111.4 52.0 -66.5 -41.5 -3.6 12.0 23.4 58 58 A E H X S+ 0 0 26 -4,-1.7 4,-2.9 2,-0.2 -1,-0.2 0.917 109.5 51.7 -62.0 -38.9 -6.2 11.2 26.0 59 59 A d H X S+ 0 0 24 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.914 110.9 47.8 -58.9 -46.8 -7.7 14.7 25.5 60 60 A V H X S+ 0 0 1 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.908 113.1 48.0 -61.4 -46.0 -7.8 14.0 21.6 61 61 A M H ><>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 3,-0.7 0.911 111.9 49.3 -65.8 -38.4 -9.4 10.6 22.2 62 62 A N H ><5S+ 0 0 84 -4,-2.9 3,-1.4 1,-0.2 -1,-0.2 0.857 103.7 60.6 -67.4 -34.4 -12.0 12.1 24.6 63 63 A S H 3<5S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.769 113.9 36.8 -64.5 -23.8 -12.8 14.8 22.1 64 64 A T T <<5S- 0 0 35 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.163 111.9-117.6-110.8 12.5 -13.9 12.0 19.6 65 65 A S T < 5S+ 0 0 105 -3,-1.4 -3,-0.2 1,-0.1 -4,-0.1 0.781 79.1 124.2 52.3 36.3 -15.5 9.7 22.3 66 66 A L < + 0 0 3 -5,-2.8 7,-2.2 -6,-0.1 2,-0.4 0.637 50.8 76.4 -97.0 -16.4 -12.9 7.0 21.5 67 67 A Y E +A 72 0A 43 -6,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.838 48.0 160.2-102.6 137.7 -11.5 6.5 25.0 68 68 A S E > -A 71 0A 76 3,-2.4 3,-1.8 -2,-0.4 -6,-0.0 -0.871 68.2 -36.2-155.1 117.6 -13.2 4.6 27.9 69 69 A N T 3 S- 0 0 155 1,-0.3 3,-0.1 -2,-0.3 -2,-0.0 0.833 126.7 -34.5 34.6 62.4 -11.6 3.2 31.1 70 70 A G T 3 S+ 0 0 8 1,-0.2 2,-0.3 48,-0.0 -1,-0.3 0.488 119.0 103.3 77.4 11.2 -8.3 2.1 29.5 71 71 A K E < -A 68 0A 123 -3,-1.8 -3,-2.4 62,-0.0 2,-0.4 -0.955 55.5-149.0-128.6 147.2 -9.8 1.1 26.1 72 72 A I E -A 67 0A 17 -2,-0.3 2,-1.2 -5,-0.2 -5,-0.2 -0.911 26.9-122.3-110.0 133.0 -9.8 2.7 22.6 73 73 A D > - 0 0 72 -7,-2.2 4,-2.5 -2,-0.4 5,-0.2 -0.669 27.6-172.7 -78.1 96.5 -12.8 2.0 20.3 74 74 A R H > S+ 0 0 85 -2,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.862 80.3 53.7 -59.6 -38.6 -11.1 0.5 17.3 75 75 A E H > S+ 0 0 145 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.968 114.2 40.0 -62.6 -52.1 -14.3 0.4 15.1 76 76 A A H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.864 115.0 53.0 -65.8 -38.4 -15.0 4.1 15.7 77 77 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.911 109.7 48.5 -62.7 -44.0 -11.3 5.1 15.4 78 78 A T H X S+ 0 0 27 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.914 109.4 53.1 -61.4 -45.5 -11.1 3.2 12.0 79 79 A K H X S+ 0 0 167 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.903 111.0 47.0 -54.9 -45.4 -14.3 5.0 10.8 80 80 A L H X S+ 0 0 62 -4,-2.1 4,-1.6 2,-0.2 -57,-0.2 0.920 114.0 45.3 -65.1 -48.8 -12.7 8.4 11.6 81 81 A Y H X S+ 0 0 7 -4,-2.4 4,-1.1 1,-0.2 3,-0.3 0.958 114.0 50.1 -60.7 -46.1 -9.3 7.7 10.0 82 82 A L H X S+ 0 0 50 -4,-3.0 4,-0.8 1,-0.2 3,-0.3 0.828 104.6 59.3 -61.3 -34.5 -11.1 6.3 6.9 83 83 A D H >< S+ 0 0 95 -4,-2.1 3,-1.0 1,-0.2 4,-0.3 0.931 103.9 50.0 -56.6 -47.8 -13.3 9.4 6.7 84 84 A S H 3< S+ 0 0 16 -4,-1.6 3,-0.5 -61,-0.4 -1,-0.2 0.789 108.7 54.2 -62.4 -27.3 -10.2 11.6 6.3 85 85 A T H >< S+ 0 0 13 -4,-1.1 3,-1.5 -3,-0.3 -1,-0.2 0.588 80.2 92.2 -82.2 -14.6 -8.9 9.3 3.5 86 86 A K T << S+ 0 0 150 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.1 0.764 98.9 30.3 -54.8 -32.9 -12.1 9.5 1.3 87 87 A S T 3 S+ 0 0 110 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.280 107.7 93.8-109.7 9.7 -10.8 12.5 -0.8 88 88 A M S < S- 0 0 42 -3,-1.5 5,-0.1 1,-0.2 -3,-0.1 -0.353 94.9 -63.8 -91.0 174.7 -7.1 11.5 -0.4 89 89 A A > - 0 0 30 1,-0.1 3,-1.7 -2,-0.1 4,-0.3 -0.275 52.3-117.3 -56.2 142.3 -4.8 9.5 -2.8 90 90 A P T > S+ 0 0 114 0, 0.0 3,-1.1 0, 0.0 4,-0.5 0.714 108.5 74.3 -63.0 -18.8 -6.2 5.9 -3.0 91 91 A E T 3> S+ 0 0 66 1,-0.2 4,-1.7 2,-0.1 3,-0.2 0.783 83.4 70.4 -58.5 -31.1 -2.9 4.5 -1.5 92 92 A W H <> S+ 0 0 3 -3,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.745 83.3 67.7 -63.4 -26.5 -4.1 5.8 1.9 93 93 A N H <> S+ 0 0 74 -3,-1.1 4,-2.5 -4,-0.3 -1,-0.2 0.966 110.5 32.6 -57.1 -59.2 -6.9 3.3 2.4 94 94 A K H > S+ 0 0 122 -4,-0.5 4,-2.8 2,-0.2 5,-0.2 0.846 117.9 54.6 -66.0 -41.6 -4.6 0.2 2.8 95 95 A I H X S+ 0 0 26 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.942 112.5 45.1 -58.8 -45.1 -1.8 2.2 4.4 96 96 A T H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.933 113.6 47.5 -64.4 -50.2 -4.3 3.4 7.1 97 97 A L H X S+ 0 0 51 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.918 114.9 46.8 -58.9 -43.4 -5.9 0.0 7.7 98 98 A D H X S+ 0 0 99 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.894 111.0 52.5 -63.6 -42.2 -2.3 -1.6 8.0 99 99 A A H X S+ 0 0 3 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.922 110.1 47.9 -61.1 -44.0 -1.2 1.3 10.3 100 100 A I H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.918 112.5 49.0 -62.7 -45.7 -4.3 0.7 12.7 101 101 A D H X S+ 0 0 86 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.928 113.6 46.2 -60.2 -47.6 -3.7 -3.1 12.7 102 102 A G H X S+ 0 0 38 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.837 112.9 49.4 -64.9 -37.3 0.1 -2.7 13.5 103 103 A f H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.903 112.8 45.5 -72.2 -39.5 -0.6 -0.1 16.3 104 104 A F H X S+ 0 0 36 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.879 113.2 51.6 -71.1 -36.1 -3.2 -2.1 18.1 105 105 A K H X S+ 0 0 157 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.923 111.4 47.7 -63.2 -45.3 -1.0 -5.3 17.8 106 106 A M H X S+ 0 0 67 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.911 109.9 52.3 -60.3 -47.1 1.9 -3.3 19.3 107 107 A A H >< S+ 0 0 6 -4,-2.3 3,-0.8 1,-0.2 7,-0.2 0.914 108.1 51.2 -59.9 -42.2 -0.3 -2.0 22.1 108 108 A D H >< S+ 0 0 101 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.863 104.6 57.8 -62.0 -37.1 -1.4 -5.5 23.0 109 109 A S H 3< S+ 0 0 87 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.741 113.7 38.4 -66.3 -24.0 2.3 -6.6 23.1 110 110 A I T S+ 0 0 87 -3,-1.4 4,-2.9 1,-0.2 5,-0.2 0.841 73.5 51.9 -44.3 -48.8 -0.3 -4.4 27.8 112 112 A D H > S+ 0 0 146 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.926 111.6 44.7 -62.2 -43.4 1.5 -5.0 31.1 113 113 A E H > S+ 0 0 90 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.914 114.6 49.7 -64.8 -43.8 3.6 -1.8 30.8 114 114 A I H X S+ 0 0 7 -4,-2.6 4,-2.0 -7,-0.2 -2,-0.2 0.938 112.0 48.5 -60.3 -49.1 0.5 0.2 29.7 115 115 A E H X S+ 0 0 79 -4,-2.9 4,-0.6 2,-0.2 -2,-0.2 0.868 111.9 48.5 -59.6 -37.3 -1.5 -1.1 32.6 116 116 A A H >< S+ 0 0 38 -4,-2.2 3,-1.0 1,-0.2 4,-0.3 0.906 108.6 54.8 -69.6 -38.9 1.4 -0.3 35.1 117 117 A G H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.3 -64,-0.3 0.887 101.7 57.5 -60.5 -40.6 1.6 3.2 33.6 118 118 A A H 3< S+ 0 0 29 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.755 106.2 52.0 -61.2 -24.8 -2.1 3.8 34.2 119 119 A K T << S+ 0 0 175 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.399 80.9 123.6 -96.1 3.5 -1.4 3.1 38.0 120 120 A L < - 0 0 36 -3,-1.5 9,-0.1 -4,-0.3 -3,-0.0 -0.240 56.2-133.1 -65.6 148.7 1.5 5.6 38.4 121 121 A T - 0 0 104 1,-0.1 -1,-0.1 7,-0.0 7,-0.1 -0.794 37.7 -81.7-101.4 149.9 1.1 8.2 41.1 122 122 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.253 40.1-170.5 -53.3 124.3 1.8 11.9 40.5 123 123 A A + 0 0 63 1,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.456 68.4 28.5-100.7 -3.6 5.6 12.5 40.8 124 124 A F S > S- 0 0 35 3,-0.0 3,-1.9 0, 0.0 2,-0.2 -0.958 104.2 -66.6-147.9 171.5 5.5 16.2 40.8 125 125 A E T 3 S+ 0 0 184 -2,-0.3 -2,-0.1 1,-0.3 0, 0.0 -0.329 115.9 0.1 -68.6 120.7 3.1 19.0 41.8 126 126 A G T 3 S+ 0 0 66 1,-0.3 2,-0.5 -2,-0.2 -1,-0.3 0.615 84.4 155.8 82.3 12.1 -0.0 19.1 39.7 127 127 A E < - 0 0 6 -3,-1.9 2,-0.5 -87,-0.0 -1,-0.3 -0.635 31.5-150.7 -72.5 124.5 0.9 16.1 37.5 128 128 A Q - 0 0 98 -2,-0.5 2,-0.5 -7,-0.1 -73,-0.1 -0.855 10.2-136.8 -96.9 125.4 -2.3 14.5 36.1 129 129 A I - 0 0 47 -2,-0.5 2,-0.3 -9,-0.1 -75,-0.1 -0.717 23.4-173.4 -85.4 125.9 -2.0 10.8 35.4 130 130 A e - 0 0 5 -2,-0.5 -77,-0.6 -77,-0.4 -75,-0.1 -0.873 34.6-100.2-114.7 150.4 -3.6 9.7 32.1 131 131 A H > - 0 0 18 -2,-0.3 3,-0.7 1,-0.1 4,-0.5 -0.501 30.1-135.6 -67.3 134.6 -4.0 6.1 30.9 132 132 A P T 3> S+ 0 0 11 0, 0.0 4,-2.5 0, 0.0 -78,-0.2 0.655 87.0 86.5 -69.3 -13.7 -1.2 5.4 28.4 133 133 A I H 3> S+ 0 0 20 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.896 85.6 52.4 -54.4 -45.6 -3.4 3.6 25.8 134 134 A S H <> S+ 0 0 0 -3,-0.7 4,-2.7 1,-0.2 -1,-0.2 0.928 114.5 41.3 -57.7 -48.1 -4.5 6.9 24.0 135 135 A G H > S+ 0 0 10 -4,-0.5 4,-2.7 -81,-0.2 5,-0.4 0.858 110.3 58.2 -66.7 -38.7 -0.9 8.0 23.5 136 136 A T H X S+ 0 0 25 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.953 115.5 36.3 -56.5 -49.2 0.4 4.5 22.5 137 137 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.945 120.6 45.1 -68.4 -52.7 -2.2 4.4 19.7 138 138 A L H X S+ 0 0 30 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.883 112.8 49.5 -63.4 -43.5 -2.0 8.0 18.6 139 139 A A H X S+ 0 0 28 -4,-2.7 4,-2.2 1,-0.2 33,-0.3 0.935 114.5 46.2 -59.0 -49.1 1.8 8.3 18.6 140 140 A f H X S+ 0 0 16 -4,-1.5 4,-2.7 -5,-0.4 5,-0.2 0.890 111.3 52.7 -61.9 -44.3 2.1 5.1 16.6 141 141 A M H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.950 111.4 44.7 -58.9 -52.4 -0.5 6.2 14.1 142 142 A G H X S+ 0 0 22 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.911 116.4 45.1 -59.2 -46.2 1.1 9.5 13.4 143 143 A M H X S+ 0 0 39 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.912 115.8 46.6 -66.4 -43.4 4.6 8.1 13.0 144 144 A T H X S+ 0 0 44 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.907 111.6 50.2 -65.5 -47.1 3.5 5.2 10.9 145 145 A L H < S+ 0 0 3 -4,-2.7 4,-0.4 -5,-0.2 -2,-0.2 0.920 113.0 46.7 -57.5 -45.6 1.3 7.3 8.5 146 146 A F H >< S+ 0 0 9 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.899 113.2 48.5 -62.3 -44.9 4.1 9.8 7.9 147 147 A A H 3< S+ 0 0 76 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.764 109.8 52.8 -66.7 -29.7 6.8 7.0 7.3 148 148 A E T 3< S+ 0 0 109 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.481 76.9 131.5 -86.9 -5.2 4.5 5.2 4.8 149 149 A c < - 0 0 15 -3,-0.9 5,-0.1 -4,-0.4 -128,-0.1 -0.266 66.7-112.8 -49.6 121.7 3.9 8.3 2.7 150 150 A P > - 0 0 28 0, 0.0 3,-2.4 0, 0.0 4,-0.4 -0.371 21.8-121.4 -56.6 140.9 4.5 7.4 -1.0 151 151 A A G > S+ 0 0 83 1,-0.3 3,-1.4 2,-0.2 5,-0.1 0.851 113.9 62.5 -54.1 -33.3 7.6 9.2 -2.4 152 152 A K G 3 S+ 0 0 154 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.662 110.0 40.0 -65.5 -19.5 5.3 10.8 -5.1 153 153 A L G < S+ 0 0 67 -3,-2.4 -133,-0.4 2,-0.0 2,-0.4 0.286 101.1 90.1-109.6 3.2 3.4 12.5 -2.2 154 154 A F S < S- 0 0 37 -3,-1.4 2,-0.7 -4,-0.4 -135,-0.2 -0.889 78.4-124.3-109.9 134.3 6.4 13.4 -0.0 155 155 A T - 0 0 61 -137,-2.7 2,-1.3 -2,-0.4 5,-0.1 -0.641 24.3-148.6 -78.4 112.3 8.4 16.6 -0.3 156 156 A V + 0 0 132 -2,-0.7 2,-0.3 -5,-0.1 -1,-0.1 -0.691 49.7 115.6 -88.4 86.8 12.0 15.5 -1.0 157 157 A N S > S- 0 0 67 -2,-1.3 4,-1.9 1,-0.0 5,-0.1 -0.915 77.1 -97.5-143.9 168.8 14.1 18.2 0.7 158 158 A D H > S+ 0 0 130 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.843 119.6 51.5 -55.3 -43.5 16.6 18.5 3.6 159 159 A D H > S+ 0 0 62 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.878 111.7 45.8 -66.7 -38.7 14.1 19.8 6.1 160 160 A b H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.794 108.6 56.7 -74.7 -27.3 11.7 17.0 5.4 161 161 A N H X S+ 0 0 85 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.910 108.3 49.1 -64.4 -41.9 14.6 14.5 5.6 162 162 A K H X S+ 0 0 98 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.902 112.3 46.7 -62.7 -42.9 15.2 16.0 9.2 163 163 A L H X S+ 0 0 1 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.867 110.4 53.3 -67.5 -35.2 11.5 15.5 10.1 164 164 A K H X S+ 0 0 124 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.940 113.2 44.1 -62.4 -49.2 11.6 11.9 8.6 165 165 A S H >< S+ 0 0 58 -4,-2.5 3,-0.9 2,-0.2 4,-0.5 0.958 117.8 43.9 -59.1 -52.8 14.6 11.2 10.9 166 166 A Y H >X S+ 0 0 28 -4,-2.8 4,-2.2 1,-0.2 3,-1.2 0.926 115.7 46.4 -59.7 -48.4 13.1 12.9 14.0 167 167 A H H 3< S+ 0 0 13 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.450 92.2 77.7 -81.6 1.0 9.6 11.4 13.6 168 168 A S T << S+ 0 0 70 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.762 119.7 14.5 -75.3 -21.4 10.8 7.9 12.9 169 169 A K T <4 S+ 0 0 131 -3,-1.2 -2,-0.2 -4,-0.5 -1,-0.1 0.649 123.4 63.0-119.3 -33.0 11.3 7.8 16.8 170 170 A a S < S- 0 0 1 -4,-2.2 -1,-0.2 -5,-0.2 3,-0.1 -0.913 75.6-128.7-108.2 129.4 9.4 10.8 18.1 171 171 A P - 0 0 34 0, 0.0 2,-0.6 0, 0.0 -32,-0.1 -0.205 30.5 -96.7 -72.3 162.1 5.6 11.3 17.9 172 172 A F 0 0 63 -33,-0.3 -30,-0.1 -34,-0.2 -29,-0.1 -0.671 360.0 360.0 -75.4 110.4 3.8 14.4 16.6 173 173 A L 0 0 60 -2,-0.6 -139,-0.1 -3,-0.1 -135,-0.0 -0.643 360.0 360.0 -97.3 360.0 3.0 16.3 19.8