==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 27-AUG-08 2K7W . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BAX; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.GAVATHIOTIS,M.SUZUKI,M.L.DAVIS,K.PITTER,G.H.BIRD,S.G.KATZ, . 212 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13506.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 76.4 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 . 1 0.5 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 . 14 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 56.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.9 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 0 0 1 2 0 0 0 0 0 0 1 1 0 2 1 1 1 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 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 1 A M > 0 0 197 0, 0.0 4,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.4 40.0 5.3 -2.9 2 2 A D T >4 + 0 0 144 1,-0.2 3,-0.5 2,-0.2 0, 0.0 0.888 360.0 44.0 -62.0 -40.2 36.3 6.0 -3.5 3 3 A G T 34 S+ 0 0 48 1,-0.2 -1,-0.2 3,-0.0 4,-0.1 0.815 108.3 58.4 -74.1 -30.3 35.6 5.4 0.2 4 4 A S T 34 S+ 0 0 102 2,-0.1 -1,-0.2 0, 0.0 -2,-0.2 0.616 91.2 99.2 -73.0 -13.2 38.6 7.5 1.2 5 5 A G S << S- 0 0 37 -4,-0.7 2,-0.4 -3,-0.5 -3,-0.0 -0.285 93.0 -83.0 -73.0 161.3 37.0 10.3 -0.8 6 6 A E + 0 0 204 2,-0.0 -1,-0.1 -2,-0.0 -2,-0.1 -0.517 53.8 173.8 -69.9 119.8 35.1 13.1 0.9 7 7 A Q - 0 0 107 -2,-0.4 2,-1.5 -4,-0.1 4,-0.1 -0.989 33.9-128.8-133.1 123.5 31.5 12.1 1.6 8 8 A P S S- 0 0 118 0, 0.0 2,-2.9 0, 0.0 -2,-0.0 -0.552 76.1 -57.9 -73.8 89.0 28.9 14.1 3.5 9 9 A R S S- 0 0 262 -2,-1.5 2,-0.2 0, 0.0 -2,-0.0 -0.272 122.9 -0.1 72.0 -56.3 27.7 11.5 6.0 10 10 A G S S- 0 0 38 -2,-2.9 2,-0.2 1,-0.1 0, 0.0 -0.510 78.6-103.1-137.6-153.1 26.6 9.2 3.3 11 11 A G - 0 0 59 -2,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.556 21.8-111.4-129.6-166.1 26.5 8.8 -0.5 12 12 A G + 0 0 81 -2,-0.2 2,-0.1 2,-0.0 3,-0.1 -0.600 43.9 164.2-135.1 73.4 24.1 9.0 -3.4 13 13 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.357 52.9 -71.2 -85.2 168.9 23.6 5.6 -5.0 14 14 A T + 0 0 112 1,-0.2 4,-0.2 -2,-0.1 -2,-0.0 -0.440 49.9 170.1 -63.5 117.2 20.8 4.6 -7.4 15 15 A S > + 0 0 42 -2,-0.4 4,-2.6 3,-0.1 5,-0.2 0.327 51.9 96.7-110.1 5.2 17.6 4.5 -5.4 16 16 A S H > S+ 0 0 55 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.978 98.6 24.1 -58.6 -62.3 15.3 4.0 -8.5 17 17 A E H > S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.799 118.1 66.9 -74.3 -28.0 15.0 0.3 -8.3 18 18 A Q H > S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.925 100.1 47.9 -57.4 -48.0 15.7 0.4 -4.6 19 19 A I H X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.908 110.9 52.0 -60.5 -42.5 12.5 2.2 -3.9 20 20 A M H X S+ 0 0 2 -4,-1.1 4,-1.4 1,-0.2 -2,-0.2 0.916 109.7 48.7 -60.1 -45.2 10.6 -0.3 -6.0 21 21 A K H X S+ 0 0 53 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.856 107.8 55.5 -63.5 -36.0 12.1 -3.1 -4.1 22 22 A T H X S+ 0 0 28 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.874 102.6 56.7 -65.0 -36.9 11.2 -1.4 -0.8 23 23 A G H X S+ 0 0 1 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.897 104.0 51.8 -61.8 -40.6 7.5 -1.2 -1.9 24 24 A A H X S+ 0 0 0 -4,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.850 113.2 45.6 -64.7 -34.4 7.4 -5.0 -2.4 25 25 A L H X S+ 0 0 17 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.895 110.2 53.4 -74.9 -41.4 8.7 -5.4 1.1 26 26 A L H X S+ 0 0 8 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.916 107.4 51.0 -59.7 -46.4 6.4 -2.9 2.6 27 27 A L H X S+ 0 0 10 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.867 108.8 53.2 -60.6 -37.0 3.3 -4.6 1.1 28 28 A Q H X S+ 0 0 12 -4,-1.1 4,-3.4 -5,-0.2 5,-0.3 0.969 109.0 46.9 -62.9 -54.2 4.5 -7.9 2.6 29 29 A G H X S+ 0 0 23 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.901 112.9 48.9 -55.1 -46.7 4.9 -6.6 6.2 30 30 A F H X S+ 0 0 15 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.900 117.2 41.4 -62.1 -42.3 1.5 -4.8 6.1 31 31 A I H X S+ 0 0 26 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.944 114.4 50.1 -72.0 -47.9 -0.3 -7.9 4.8 32 32 A Q H X S+ 0 0 81 -4,-3.4 4,-1.1 1,-0.2 -2,-0.2 0.897 109.7 52.4 -57.6 -43.0 1.6 -10.5 7.0 33 33 A D H < S+ 0 0 64 -4,-2.4 -1,-0.2 -5,-0.3 3,-0.2 0.891 116.3 38.1 -61.8 -42.7 0.9 -8.4 10.1 34 34 A R H >< S+ 0 0 56 -4,-1.4 3,-1.3 -5,-0.2 -1,-0.2 0.752 107.7 64.5 -81.8 -25.0 -2.9 -8.2 9.5 35 35 A A H >< S+ 0 0 27 -4,-2.4 3,-2.1 1,-0.3 4,-0.4 0.758 85.9 74.3 -69.1 -23.7 -3.1 -11.8 8.1 36 36 A G G >< S+ 0 0 52 -4,-1.1 3,-0.8 1,-0.3 -1,-0.3 0.684 80.4 72.0 -63.3 -17.0 -2.1 -13.1 11.6 37 37 A R G < S+ 0 0 164 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.526 92.3 57.7 -76.1 -5.1 -5.6 -12.2 12.7 38 38 A M G < S- 0 0 85 -3,-2.1 2,-0.8 1,-0.2 -1,-0.2 0.588 104.6-132.7 -98.2 -14.6 -6.8 -15.2 10.7 39 39 A G < - 0 0 62 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.2 -0.852 27.4-118.6 103.5-103.6 -4.7 -17.7 12.5 40 40 A G - 0 0 73 -2,-0.8 -4,-0.0 -3,-0.1 -3,-0.0 -0.954 25.9 -77.9 164.5-143.8 -2.9 -20.0 10.1 41 41 A E S S- 0 0 186 -2,-0.3 3,-0.2 0, 0.0 -2,-0.0 -0.099 81.7 -71.6-150.2 39.2 -2.5 -23.6 9.2 42 42 A A - 0 0 86 1,-0.2 2,-1.4 2,-0.1 3,-0.2 0.971 47.9-134.6 65.3 89.5 -0.3 -25.1 11.9 43 43 A P + 0 0 113 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.584 40.9 157.6 -77.0 90.2 3.3 -23.8 11.3 44 44 A E S S+ 0 0 175 -2,-1.4 -2,-0.1 -3,-0.2 0, 0.0 0.841 82.7 0.9 -80.0 -36.4 5.3 -27.0 11.7 45 45 A L S S+ 0 0 146 -3,-0.2 -3,-0.0 2,-0.0 0, 0.0 0.658 82.8 158.0-112.2 -85.9 8.2 -25.6 9.8 46 46 A A - 0 0 79 1,-0.1 2,-0.6 2,-0.0 167,-0.0 0.386 46.0-101.8 68.0 153.4 7.8 -22.0 8.5 47 47 A L + 0 0 98 166,-0.9 -1,-0.1 2,-0.0 3,-0.1 -0.910 41.9 166.8-114.4 105.5 10.6 -19.6 7.5 48 48 A D + 0 0 124 -2,-0.6 165,-0.1 1,-0.1 164,-0.1 -0.813 9.7 159.5-121.3 89.6 11.3 -17.0 10.2 49 49 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 164,-0.1 0.487 56.7-116.8 -85.1 -2.9 14.6 -15.2 9.4 50 50 A V - 0 0 79 162,-0.3 2,-0.3 -3,-0.1 163,-0.1 0.810 32.0 -86.9 66.7 113.8 13.5 -12.3 11.6 51 51 A P - 0 0 57 0, 0.0 -1,-0.1 0, 0.0 161,-0.1 -0.312 44.6-176.8 -52.8 108.6 13.0 -8.8 9.9 52 52 A Q + 0 0 150 -2,-0.3 2,-0.2 2,-0.0 -2,-0.0 0.878 59.1 82.9 -76.5 -40.7 16.5 -7.3 10.0 53 53 A D - 0 0 51 1,-0.1 4,-0.3 2,-0.0 0, 0.0 -0.442 54.1-172.3 -70.0 134.7 15.4 -4.0 8.4 54 54 A A S > S+ 0 0 66 -2,-0.2 4,-2.7 2,-0.1 5,-0.2 0.617 76.2 71.9 -99.5 -17.9 13.9 -1.4 10.8 55 55 A S H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.970 105.1 36.1 -62.0 -56.7 12.8 1.0 8.1 56 56 A T H > S+ 0 0 12 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.847 115.5 58.7 -65.8 -33.4 10.0 -1.1 6.8 57 57 A K H > S+ 0 0 110 -4,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.939 108.9 42.6 -60.9 -49.3 9.3 -2.3 10.3 58 58 A K H X S+ 0 0 144 -4,-2.7 4,-1.9 2,-0.2 5,-0.2 0.905 114.8 50.8 -64.7 -43.1 8.7 1.3 11.5 59 59 A L H X S+ 0 0 12 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.913 110.1 48.8 -61.9 -43.8 6.7 2.2 8.4 60 60 A S H X S+ 0 0 15 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.828 106.6 60.0 -65.6 -31.0 4.4 -0.8 8.8 61 61 A E H X S+ 0 0 77 -4,-1.6 4,-2.5 -5,-0.2 5,-0.2 0.973 109.4 39.0 -60.6 -57.2 4.0 0.1 12.5 62 62 A C H X S+ 0 0 23 -4,-1.9 4,-2.5 1,-0.2 5,-0.3 0.900 117.8 50.4 -61.8 -41.2 2.4 3.5 11.8 63 63 A L H X S+ 0 0 25 -4,-2.2 4,-2.8 -5,-0.2 5,-0.2 0.916 111.5 48.5 -63.5 -43.5 0.4 2.1 8.8 64 64 A K H X S+ 0 0 45 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.934 114.1 44.4 -63.1 -48.9 -0.9 -0.7 10.8 65 65 A R H X S+ 0 0 122 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.914 116.9 45.6 -65.0 -42.9 -2.0 1.4 13.8 66 66 A I H X S+ 0 0 61 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.933 114.3 48.1 -66.1 -45.6 -3.5 4.1 11.6 67 67 A G H < S+ 0 0 13 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.878 112.6 49.2 -62.4 -37.1 -5.3 1.5 9.4 68 68 A D H >< S+ 0 0 75 -4,-2.3 3,-1.2 -5,-0.2 -1,-0.2 0.873 110.6 50.2 -68.9 -37.9 -6.6 -0.2 12.5 69 69 A E H >< S+ 0 0 110 -4,-2.1 3,-1.5 1,-0.3 4,-0.4 0.788 99.8 65.4 -70.7 -27.6 -7.8 3.1 13.9 70 70 A L T 3< S+ 0 0 12 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.355 93.5 63.1 -76.8 6.5 -9.6 3.9 10.6 71 71 A D T < S+ 0 0 43 -3,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.419 80.5 80.9-106.8 -4.2 -11.8 0.9 11.4 72 72 A S S < S+ 0 0 94 -3,-1.5 2,-1.1 1,-0.1 -2,-0.2 0.856 73.6 82.8 -69.1 -35.9 -13.3 2.4 14.5 73 73 A N > - 0 0 31 -4,-0.4 4,-2.0 1,-0.2 -1,-0.1 -0.599 60.7-172.0 -74.8 99.1 -15.7 4.5 12.4 74 74 A M H > S+ 0 0 135 -2,-1.1 4,-2.5 1,-0.2 5,-0.2 0.731 80.2 67.3 -64.2 -22.3 -18.5 2.1 11.8 75 75 A E H > S+ 0 0 127 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.988 109.2 32.4 -60.7 -61.1 -20.0 4.7 9.4 76 76 A L H > S+ 0 0 11 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.823 115.8 62.0 -65.4 -31.7 -17.2 4.4 6.8 77 77 A Q H X S+ 0 0 85 -4,-2.0 4,-1.5 1,-0.2 3,-0.2 0.933 105.6 43.8 -60.4 -47.9 -16.8 0.7 7.7 78 78 A R H < S+ 0 0 190 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.805 108.1 61.0 -67.8 -29.1 -20.4 -0.1 6.6 79 79 A M H >< S+ 0 0 63 -4,-1.3 3,-0.9 1,-0.2 -1,-0.2 0.880 104.5 47.8 -64.6 -38.6 -19.8 2.0 3.5 80 80 A I H >< S+ 0 0 19 -4,-1.8 3,-1.5 1,-0.2 -1,-0.2 0.863 106.2 57.7 -69.7 -35.0 -17.0 -0.3 2.5 81 81 A A T 3< S+ 0 0 87 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.523 99.8 61.3 -72.6 -5.1 -19.2 -3.3 3.1 82 82 A A T < S+ 0 0 40 -3,-0.9 -1,-0.3 -4,-0.2 -2,-0.2 0.065 81.5 118.5-107.2 20.5 -21.6 -1.7 0.6 83 83 A V < - 0 0 29 -3,-1.5 2,-0.8 1,-0.0 -3,-0.0 -0.421 69.4-116.0 -83.9 162.4 -19.1 -1.9 -2.2 84 84 A D > - 0 0 65 -2,-0.1 2,-1.9 3,-0.1 3,-0.6 -0.845 21.3-168.1-105.4 100.3 -19.6 -3.9 -5.4 85 85 A T T 3 + 0 0 77 -2,-0.8 -1,-0.1 1,-0.2 -2,-0.0 -0.349 57.3 107.0 -82.9 56.9 -17.1 -6.7 -5.7 86 86 A D T 3 S+ 0 0 139 -2,-1.9 -1,-0.2 1,-0.2 4,-0.0 0.856 83.9 26.4 -96.9 -52.0 -17.9 -7.4 -9.3 87 87 A S <> - 0 0 29 -3,-0.6 4,-2.6 1,-0.2 -1,-0.2 -0.842 64.3-179.6-118.4 93.1 -14.9 -6.0 -11.1 88 88 A P H > S+ 0 0 52 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.915 85.2 43.6 -57.2 -48.2 -11.8 -6.0 -8.8 89 89 A R H > S+ 0 0 45 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.913 114.6 49.8 -66.3 -43.0 -9.5 -4.5 -11.4 90 90 A E H > S+ 0 0 101 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.906 110.6 49.5 -63.0 -43.4 -12.0 -1.9 -12.5 91 91 A V H X S+ 0 0 8 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.944 115.4 43.7 -60.8 -47.4 -12.7 -0.8 -8.9 92 92 A F H X S+ 0 0 2 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.899 114.0 50.2 -64.8 -42.5 -9.0 -0.4 -8.2 93 93 A F H X S+ 0 0 103 -4,-2.9 4,-2.4 2,-0.2 5,-0.3 0.892 109.3 52.7 -63.9 -40.2 -8.4 1.3 -11.5 94 94 A R H X S+ 0 0 69 -4,-2.6 4,-3.3 1,-0.2 -2,-0.2 0.967 112.0 42.3 -60.5 -55.4 -11.2 3.8 -10.9 95 95 A V H X S+ 0 0 6 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.762 113.1 56.3 -64.7 -24.5 -10.0 4.9 -7.4 96 96 A A H < S+ 0 0 4 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.922 116.5 33.4 -72.0 -44.5 -6.5 5.0 -8.8 97 97 A A H >X S+ 0 0 47 -4,-2.4 3,-2.0 1,-0.2 4,-1.9 0.827 110.0 67.4 -79.8 -33.5 -7.3 7.4 -11.6 98 98 A D H 3X S+ 0 0 36 -4,-3.3 4,-0.5 1,-0.3 3,-0.4 0.930 105.8 40.2 -51.5 -53.2 -10.0 9.2 -9.5 99 99 A M H 3< S+ 0 0 22 -4,-1.3 -1,-0.3 1,-0.2 5,-0.2 0.229 116.0 55.7 -83.2 15.0 -7.4 10.7 -7.1 100 100 A F H <4 S+ 0 0 87 -3,-2.0 3,-0.3 3,-0.1 -2,-0.2 0.621 84.0 78.5-116.2 -25.8 -5.1 11.3 -10.0 101 101 A S H < S+ 0 0 100 -4,-1.9 -2,-0.1 -3,-0.4 -3,-0.1 0.884 100.2 42.5 -52.1 -45.1 -7.4 13.4 -12.3 102 102 A D S < S- 0 0 130 -4,-0.5 -1,-0.3 2,-0.1 3,-0.1 0.765 100.7-137.6 -75.4 -25.2 -6.7 16.5 -10.2 103 103 A G + 0 0 32 -3,-0.3 2,-0.8 1,-0.2 -3,-0.1 0.767 39.1 168.7 72.2 25.2 -3.0 15.7 -9.9 104 104 A N - 0 0 78 -5,-0.2 2,-1.4 1,-0.1 3,-0.3 -0.626 25.4-161.7 -76.9 109.4 -3.1 16.7 -6.2 105 105 A F + 0 0 129 -2,-0.8 -1,-0.1 1,-0.2 -5,-0.0 -0.365 44.2 135.1 -87.8 56.4 0.2 15.6 -4.7 106 106 A N - 0 0 37 -2,-1.4 2,-1.7 1,-0.1 -1,-0.2 0.439 61.3-136.6 -83.3 -2.2 -1.3 15.8 -1.2 107 107 A W S >> S+ 0 0 21 -3,-0.3 3,-2.2 1,-0.2 4,-1.2 -0.078 89.3 90.8 72.3 -37.9 0.3 12.5 -0.3 108 108 A G H 3> S+ 0 0 1 -2,-1.7 4,-2.6 1,-0.3 5,-0.3 0.794 71.9 69.3 -57.5 -29.5 -3.0 11.5 1.4 109 109 A R H 3> S+ 0 0 15 -5,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.676 102.0 47.4 -63.7 -16.8 -4.2 10.0 -1.8 110 110 A V H <> S+ 0 0 16 -3,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.895 111.8 44.8 -89.6 -49.2 -1.5 7.3 -1.3 111 111 A V H X S+ 0 0 33 -4,-1.2 4,-1.6 1,-0.2 -2,-0.2 0.857 113.0 53.5 -64.0 -34.1 -2.2 6.4 2.3 112 112 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.883 106.8 51.9 -67.1 -37.6 -6.0 6.4 1.6 113 113 A L H X S+ 0 0 17 -4,-0.5 4,-2.9 -5,-0.3 -1,-0.2 0.860 105.0 56.7 -66.5 -35.3 -5.3 3.9 -1.2 114 114 A F H X S+ 0 0 34 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.891 106.9 48.1 -63.2 -40.7 -3.4 1.7 1.1 115 115 A Y H X S+ 0 0 11 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.879 113.5 47.7 -67.4 -38.7 -6.4 1.5 3.5 116 116 A F H X S+ 0 0 15 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.917 113.1 48.1 -67.9 -43.5 -8.7 0.7 0.6 117 117 A A H X S+ 0 0 6 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.927 110.9 49.7 -63.4 -46.7 -6.3 -2.0 -0.8 118 118 A S H X S+ 0 0 21 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.862 107.5 55.4 -61.9 -36.2 -5.8 -3.7 2.6 119 119 A K H X S+ 0 0 36 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.896 110.4 45.4 -63.3 -40.1 -9.6 -3.8 3.1 120 120 A L H X S+ 0 0 29 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.898 112.7 50.8 -69.2 -41.6 -9.9 -5.6 -0.3 121 121 A V H X S+ 0 0 7 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.928 111.3 47.8 -61.9 -45.6 -7.0 -7.9 0.6 122 122 A L H X S+ 0 0 35 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.898 111.7 51.2 -62.3 -40.9 -8.6 -8.8 4.0 123 123 A K H < S+ 0 0 93 -4,-2.0 4,-0.4 1,-0.2 -2,-0.2 0.941 112.3 45.0 -61.3 -49.2 -11.9 -9.4 2.3 124 124 A A H ><>S+ 0 0 7 -4,-2.7 5,-1.1 1,-0.2 3,-1.1 0.849 109.4 57.0 -63.9 -35.0 -10.4 -11.7 -0.3 125 125 A L H ><5S+ 0 0 47 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.864 101.8 55.7 -64.5 -34.6 -8.4 -13.4 2.5 126 126 A C T 3<5S+ 0 0 86 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.597 102.8 57.0 -73.3 -10.6 -11.7 -14.1 4.2 127 127 A T T < 5S- 0 0 88 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.419 113.6-121.2 -97.7 -1.7 -12.8 -15.9 1.0 128 128 A K T < 5 + 0 0 187 -3,-1.4 -3,-0.2 -4,-0.2 -2,-0.1 0.942 66.8 135.8 60.6 51.8 -9.8 -18.2 1.3 129 129 A V >< + 0 0 48 -5,-1.1 4,-1.2 1,-0.1 3,-0.2 -0.768 25.1 173.1-132.3 88.2 -8.3 -17.2 -2.1 130 130 A P H > S+ 0 0 97 0, 0.0 4,-1.5 0, 0.0 5,-0.2 0.796 77.3 67.3 -62.5 -30.2 -4.5 -16.7 -2.0 131 131 A E H >> S+ 0 0 115 1,-0.2 4,-1.4 2,-0.2 3,-0.8 0.959 101.4 44.5 -55.6 -55.2 -4.4 -16.3 -5.7 132 132 A L H 3> S+ 0 0 52 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.825 105.6 63.5 -60.7 -32.8 -6.4 -13.0 -5.7 133 133 A I H 3X S+ 0 0 13 -4,-1.2 4,-1.4 1,-0.2 -1,-0.3 0.880 105.7 45.0 -59.4 -37.6 -4.2 -11.8 -2.8 134 134 A R H S+ 0 0 30 -4,-2.0 4,-2.1 1,-0.2 5,-1.5 0.807 112.6 58.3 -65.0 -29.4 0.3 1.7 -10.5 144 144 A L H <>S+ 0 0 17 -4,-1.0 5,-3.2 -5,-0.2 6,-0.3 0.945 111.0 39.1 -66.2 -48.4 3.4 2.4 -8.5 145 145 A R H <5S+ 0 0 83 -4,-2.9 -2,-0.2 3,-0.2 -1,-0.2 0.830 111.4 63.5 -70.4 -31.7 5.8 1.5 -11.3 146 146 A E H <5S- 0 0 70 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.974 136.6 -33.8 -56.3 -61.7 3.4 3.3 -13.7 147 147 A R T >X5S+ 0 0 154 -4,-2.1 3,-1.3 -5,-0.1 4,-0.8 0.623 123.3 77.4-134.2 -35.6 3.7 6.8 -12.3 148 148 A L H >> S+ 0 0 45 -3,-1.3 4,-1.1 -6,-0.3 -1,-0.3 0.822 110.0 42.8 -66.0 -31.3 8.5 9.1 -10.5 151 151 A W H S+ 0 0 2 -4,-2.2 5,-2.0 2,-0.2 7,-0.2 0.879 109.6 50.2 -70.0 -37.7 8.8 9.0 -4.9 153 153 A Q H ><5S+ 0 0 112 -4,-2.3 3,-1.6 -5,-0.2 -1,-0.2 0.915 107.2 55.0 -66.3 -41.6 12.2 9.3 -6.6 154 154 A D H 3<5S+ 0 0 126 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.885 105.0 52.2 -59.6 -41.6 11.8 13.1 -6.8 155 155 A Q T 3<5S- 0 0 37 -4,-1.5 -1,-0.3 2,-0.1 5,-0.2 0.356 125.7 -99.9 -79.9 7.7 11.2 13.5 -3.1 156 156 A G T X 5 - 0 0 57 -3,-1.6 3,-0.5 3,-0.1 -3,-0.2 0.915 69.6 -62.7 77.0 43.9 14.3 11.5 -2.3 157 157 A G T > S+ 0 0 29 1,-0.2 4,-2.3 -2,-0.2 -1,-0.2 0.217 105.5 106.2 -84.9 16.9 10.3 7.6 1.3 159 159 A D H <> S+ 0 0 93 -3,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.870 76.0 55.0 -62.7 -36.3 11.7 10.7 3.0 160 160 A G H <> S+ 0 0 16 -3,-0.8 4,-1.3 2,-0.2 -1,-0.2 0.905 108.1 47.8 -63.9 -40.9 8.6 12.5 2.1 161 161 A L H > S+ 0 0 31 1,-0.2 4,-1.1 2,-0.2 3,-0.2 0.906 109.7 52.6 -66.3 -41.5 6.4 9.9 3.8 162 162 A L H < S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.747 114.3 43.8 -65.9 -23.9 8.6 10.0 6.9 163 163 A S H < S+ 0 0 82 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.640 104.7 62.9 -94.2 -18.4 8.1 13.7 7.0 164 164 A Y H < S+ 0 0 98 -4,-1.3 2,-1.1 -3,-0.2 -2,-0.2 0.732 78.4 98.0 -77.3 -23.4 4.4 13.6 6.2 165 165 A F < + 0 0 123 -4,-1.1 2,-0.1 -5,-0.1 -1,-0.1 -0.543 56.6 159.9 -70.0 98.2 3.9 11.7 9.5 166 166 A G - 0 0 47 -2,-1.1 3,-0.1 1,-0.1 -2,-0.1 -0.142 33.5-160.0-103.5-158.3 2.8 14.5 11.8 167 167 A T > + 0 0 99 1,-0.3 3,-1.4 -2,-0.1 4,-0.2 0.353 58.8 88.6-151.8 -55.8 0.9 14.6 15.1 168 168 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.3 0, 0.0 -2,-0.0 -0.340 106.8 5.4 -60.5 133.9 -0.6 18.1 15.9 169 169 A T T >> S+ 0 0 99 1,-0.1 4,-1.0 -3,-0.1 3,-0.8 0.810 80.5 152.5 61.5 33.0 -4.2 18.5 14.5 170 170 A W H <> + 0 0 156 -3,-1.4 4,-2.0 1,-0.2 5,-0.1 0.729 60.6 72.6 -64.3 -21.2 -4.1 14.8 13.4 171 171 A Q H 3> S+ 0 0 127 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.916 96.0 48.2 -60.5 -44.2 -7.9 14.9 13.8 172 172 A T H <> S+ 0 0 82 -3,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.868 108.8 54.8 -64.4 -35.7 -8.3 17.0 10.7 173 173 A V H X S+ 0 0 69 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.875 105.8 52.5 -64.8 -36.9 -5.9 14.6 8.9 174 174 A T H X S+ 0 0 52 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.918 110.7 46.5 -64.6 -43.4 -8.2 11.8 9.8 175 175 A I H X S+ 0 0 111 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.855 109.9 56.0 -66.3 -35.3 -11.2 13.6 8.4 176 176 A F H X S+ 0 0 78 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.952 109.2 44.2 -61.4 -51.4 -9.1 14.4 5.3 177 177 A V H X S+ 0 0 12 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.917 115.2 49.1 -60.5 -44.9 -8.4 10.7 4.6 178 178 A A H X S+ 0 0 26 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.910 110.5 51.1 -61.6 -43.7 -12.0 9.8 5.3 179 179 A G H X S+ 0 0 38 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.914 108.2 50.9 -60.8 -45.7 -13.3 12.5 3.0 180 180 A V H X S+ 0 0 27 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.927 113.3 45.1 -58.9 -46.9 -11.0 11.5 0.1 181 181 A L H X S+ 0 0 13 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.905 113.2 51.0 -63.7 -41.6 -12.2 7.8 0.4 182 182 A T H X S+ 0 0 47 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.908 106.2 56.2 -62.1 -42.7 -15.8 9.0 0.7 183 183 A A H X S+ 0 0 52 -4,-2.8 4,-1.4 1,-0.2 3,-0.3 0.950 109.5 43.0 -55.2 -56.4 -15.5 11.1 -2.4 184 184 A S H X S+ 0 0 8 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.879 114.0 52.6 -59.7 -38.6 -14.3 8.3 -4.7 185 185 A L H X S+ 0 0 24 -4,-2.0 4,-3.0 1,-0.2 -1,-0.2 0.846 104.1 57.0 -66.5 -33.1 -17.0 6.0 -3.2 186 186 A T H < S+ 0 0 97 -4,-2.2 -1,-0.2 -3,-0.3 -2,-0.2 0.835 109.6 44.7 -66.5 -33.6 -19.7 8.6 -3.9 187 187 A I H < S+ 0 0 102 -4,-1.4 3,-0.3 -3,-0.2 -1,-0.2 0.724 115.8 49.4 -81.8 -23.3 -18.7 8.6 -7.6 188 188 A W H < S+ 0 0 48 -4,-1.3 2,-2.2 1,-0.2 4,-0.2 0.960 105.3 52.9 -79.3 -56.4 -18.6 4.8 -7.6 189 189 A K < + 0 0 81 -4,-3.0 2,-2.1 1,-0.1 -1,-0.2 -0.411 67.3 165.8 -81.8 65.3 -21.9 4.0 -5.9 190 190 A K S S- 0 0 119 -2,-2.2 -1,-0.1 2,-0.7 -3,-0.1 -0.494 82.5 -58.8 -82.1 68.7 -24.0 6.1 -8.3 191 191 A M 0 0 197 -2,-2.1 -1,-0.2 0, 0.0 -2,-0.1 0.131 360.0 360.0 77.1 -19.9 -27.3 4.5 -7.2 192 192 A G 0 0 72 -4,-0.2 -2,-0.7 -108,-0.0 -108,-0.1 -0.935 360.0 360.0 175.2 360.0 -25.9 1.1 -8.3 193 !* 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 0.0 194 145 B E 0 0 89 0, 0.0 -52,-0.1 0, 0.0 -51,-0.1 0.000 360.0 360.0 360.0-162.1 -0.2 -2.0 -17.2 195 146 B I > + 0 0 146 3,-0.1 4,-1.2 2,-0.1 -53,-0.0 0.706 360.0 41.4-114.4 -50.1 -0.5 -5.8 -17.6 196 147 B W H > S+ 0 0 171 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.909 115.4 52.2 -66.7 -43.0 3.1 -6.9 -18.2 197 148 B I H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.920 105.6 54.5 -59.8 -45.4 4.5 -4.6 -15.6 198 149 B A H > S+ 0 0 10 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.820 105.4 55.2 -58.9 -32.6 2.0 -5.9 -13.0 199 150 B Q H X S+ 0 0 135 -4,-1.2 4,-1.8 -3,-0.3 -1,-0.2 0.939 110.0 43.4 -67.2 -48.5 3.3 -9.4 -13.7 200 151 B E H X S+ 0 0 71 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.923 116.1 48.6 -63.0 -43.4 6.9 -8.5 -13.0 201 152 B L H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.861 107.0 56.0 -64.9 -35.7 5.9 -6.5 -9.9 202 153 B R H X S+ 0 0 72 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.894 108.9 47.9 -61.7 -38.8 3.8 -9.4 -8.8 203 154 B R H X S+ 0 0 103 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.882 110.5 51.1 -68.6 -39.6 7.0 -11.5 -9.0 204 155 B I H X S+ 0 0 3 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.890 107.1 54.0 -64.7 -40.6 8.9 -8.8 -7.0 205 156 B G H X S+ 0 0 0 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.855 113.9 41.3 -61.8 -35.5 6.2 -8.8 -4.4 206 157 B D H X S+ 0 0 77 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.805 108.1 63.1 -79.5 -32.1 6.6 -12.5 -4.0 207 158 B E H < S+ 0 0 75 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.918 113.5 32.8 -57.5 -47.2 10.4 -12.1 -4.3 208 159 B F H >X S+ 0 0 42 -4,-2.2 4,-0.6 2,-0.2 3,-0.6 0.770 113.4 63.0 -82.5 -27.2 10.5 -10.1 -1.1 209 160 B N H >X S+ 0 0 32 -4,-1.2 3,-1.3 -5,-0.3 4,-1.0 0.963 107.0 41.6 -61.6 -52.5 7.6 -11.9 0.5 210 161 B A H 3< S+ 0 0 54 -4,-2.5 -1,-0.2 3,-0.3 -2,-0.2 0.454 104.1 71.7 -75.4 0.5 9.4 -15.3 0.6 211 162 B Y H <4 S+ 0 0 151 -3,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.696 115.1 20.0 -87.2 -21.2 12.5 -13.4 1.7 212 163 B Y H << 0 0 32 -3,-1.3 -162,-0.3 -4,-0.6 -2,-0.2 0.364 360.0 360.0-126.9 -0.5 11.1 -12.7 5.1 213 164 B A < 0 0 50 -4,-1.0 -166,-0.9 -5,-0.1 -3,-0.3 0.441 360.0 360.0-149.6 360.0 8.4 -15.4 5.4