==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID TRANSPORT 01-NOV-04 1WBE . COMPND 2 MOLECULE: GLYCOLIPID TRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR T.T.AIRENNE,H.KIDRON,G.WEST,Y.NYMALM,M.NYLUND,P.MATTJUS, . 204 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10868.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 152 74.5 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 . 2 1.0 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 . 7 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 53.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.5 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 2 0 0 1 2 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 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 . 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 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 6 A E 0 0 168 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -13.6 25.7 18.4 25.1 2 7 A H + 0 0 55 2,-0.1 22,-0.1 23,-0.0 2,-0.0 0.270 360.0 127.8-174.8 9.4 24.6 16.5 28.3 3 8 A L - 0 0 78 1,-0.1 2,-0.2 178,-0.0 175,-0.1 -0.369 62.5-115.4 -58.2 147.4 24.6 19.0 31.1 4 9 A L - 0 0 10 174,-0.3 177,-0.1 1,-0.1 178,-0.1 -0.634 37.9 -94.9 -79.3 155.0 21.4 19.0 33.0 5 10 A R - 0 0 145 -2,-0.2 -1,-0.1 1,-0.1 180,-0.1 -0.308 49.1 -93.3 -59.3 150.2 19.3 22.2 32.9 6 11 A P - 0 0 96 0, 0.0 -1,-0.1 0, 0.0 175,-0.0 -0.307 47.0 -96.1 -62.0 154.8 19.9 24.7 35.7 7 12 A L - 0 0 63 -3,-0.1 6,-0.1 1,-0.1 178,-0.0 -0.640 40.5-125.6 -71.2 122.3 17.5 24.5 38.7 8 13 A P > - 0 0 50 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.274 20.6-112.3 -65.8 157.9 14.5 26.9 38.5 9 14 A A T 3 S+ 0 0 112 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.893 120.4 50.5 -54.9 -44.4 13.9 29.4 41.3 10 15 A D T 3 S- 0 0 101 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.441 107.4-128.6 -78.3 2.3 10.6 27.6 42.1 11 16 A K < + 0 0 81 -3,-1.8 2,-0.8 1,-0.2 -2,-0.1 0.627 58.8 144.5 59.5 16.5 12.5 24.2 42.2 12 17 A Q - 0 0 57 53,-0.1 2,-0.5 52,-0.1 -1,-0.2 -0.760 40.3-149.2 -88.8 111.9 9.9 22.6 39.8 13 18 A I - 0 0 14 -2,-0.8 52,-2.5 -3,-0.1 2,-0.3 -0.708 12.1-126.3 -89.2 122.2 11.8 20.2 37.5 14 19 A E B > -A 64 0A 83 -2,-0.5 4,-1.5 50,-0.2 50,-0.3 -0.477 15.4-147.3 -68.7 126.5 10.5 19.8 34.0 15 20 A T H > S+ 0 0 0 48,-2.7 4,-2.6 -2,-0.3 5,-0.2 0.916 88.9 50.4 -63.7 -46.1 9.9 16.1 33.3 16 21 A G H > S+ 0 0 14 47,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.942 113.2 42.8 -64.7 -52.5 10.7 15.9 29.6 17 22 A P H > S+ 0 0 35 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.826 113.9 54.7 -60.1 -34.5 14.1 17.7 29.7 18 23 A F H X S+ 0 0 9 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.958 109.9 44.6 -62.9 -53.6 15.1 15.8 32.8 19 24 A L H X S+ 0 0 3 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.895 112.2 53.4 -57.6 -39.2 14.4 12.4 31.2 20 25 A E H < S+ 0 0 108 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.949 111.9 45.0 -62.6 -45.6 16.3 13.5 28.0 21 26 A A H >< S+ 0 0 12 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.945 114.2 46.1 -65.0 -50.8 19.4 14.5 30.0 22 27 A V H >< S+ 0 0 0 -4,-2.7 3,-2.2 1,-0.3 -1,-0.2 0.792 97.7 71.6 -70.0 -20.6 19.6 11.4 32.3 23 28 A S T 3< S+ 0 0 47 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.699 90.3 63.4 -65.8 -15.6 19.0 9.1 29.3 24 29 A H T < S+ 0 0 68 -3,-1.7 -1,-0.3 -4,-0.4 4,-0.2 0.445 90.4 71.3 -80.3 -0.7 22.6 10.1 28.3 25 30 A L S X> S+ 0 0 12 -3,-2.2 3,-2.0 2,-0.1 4,-0.6 0.927 82.1 61.9 -88.1 -44.1 24.0 8.5 31.5 26 31 A P G >4 S+ 0 0 12 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.871 96.6 63.0 -48.1 -39.9 23.5 4.7 30.8 27 32 A P G >4 S+ 0 0 72 0, 0.0 3,-1.3 0, 0.0 -2,-0.1 0.749 92.1 65.3 -57.1 -23.7 26.0 4.9 27.8 28 33 A F G X4 S+ 0 0 63 -3,-2.0 3,-1.0 1,-0.3 4,-0.1 0.771 91.7 61.5 -71.5 -24.1 28.8 6.0 30.1 29 34 A F G << S+ 0 0 14 -3,-1.8 7,-2.8 -4,-0.6 -1,-0.3 0.622 105.1 50.5 -69.8 -13.1 28.6 2.6 31.7 30 35 A D G X S+ 0 0 59 -3,-1.3 3,-1.8 -4,-0.3 -1,-0.2 0.241 74.9 107.8-105.4 4.0 29.6 1.2 28.2 31 36 A C T < S+ 0 0 41 -3,-1.0 -1,-0.1 1,-0.3 -2,-0.1 0.630 79.2 50.6 -64.2 -16.2 32.6 3.5 27.6 32 37 A L T 3 S- 0 0 68 2,-0.3 2,-1.2 -3,-0.2 -1,-0.3 0.184 113.1-112.6-104.0 14.9 35.1 0.6 28.1 33 38 A G S < S+ 0 0 57 -3,-1.8 -1,-0.1 3,-0.0 3,-0.1 -0.736 103.0 64.5 88.8 -89.7 33.4 -1.9 25.6 34 39 A S S S- 0 0 99 -2,-1.2 -2,-0.3 1,-0.1 -3,-0.0 -0.511 103.0-107.9 -63.4 125.9 32.2 -4.5 28.1 35 40 A P - 0 0 64 0, 0.0 2,-0.3 0, 0.0 3,-0.3 -0.244 32.3-147.2 -56.5 144.8 29.6 -2.7 30.3 36 41 A V S S+ 0 0 25 -7,-2.8 5,-0.2 1,-0.2 114,-0.1 -0.794 73.4 12.7-111.6 156.2 30.6 -1.8 33.9 37 42 A F S >> S+ 0 0 17 109,-0.3 4,-2.3 -2,-0.3 3,-1.1 0.891 76.3 176.6 46.7 49.2 28.4 -1.7 37.1 38 43 A T H 3> + 0 0 72 -3,-0.3 4,-3.0 1,-0.3 5,-0.3 0.857 68.7 55.7 -58.5 -37.5 25.7 -3.4 35.0 39 44 A P H 3> S+ 0 0 31 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.867 111.7 45.2 -64.3 -27.7 23.1 -3.8 37.8 40 45 A I H <> S+ 0 0 8 -3,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.938 114.7 48.0 -79.8 -46.0 23.2 -0.0 38.4 41 46 A K H X S+ 0 0 45 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.923 110.7 51.2 -52.9 -50.1 23.1 0.8 34.7 42 47 A A H X S+ 0 0 55 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.899 110.7 48.1 -62.6 -41.4 20.1 -1.6 34.1 43 48 A D H X S+ 0 0 80 -4,-1.6 4,-2.3 -5,-0.3 -1,-0.2 0.917 111.4 49.1 -67.8 -41.7 18.0 -0.1 36.9 44 49 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.964 115.0 45.0 -57.7 -52.0 18.6 3.5 35.8 45 50 A S H X S+ 0 0 52 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.891 113.6 48.7 -61.1 -42.9 17.7 2.6 32.2 46 51 A G H X S+ 0 0 32 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.878 112.3 48.5 -65.9 -41.4 14.6 0.6 33.1 47 52 A N H X S+ 0 0 17 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.899 108.7 53.2 -71.3 -37.3 13.3 3.3 35.5 48 53 A I H X S+ 0 0 13 -4,-2.5 4,-3.0 -5,-0.2 5,-0.2 0.946 108.3 51.3 -57.3 -47.5 13.8 6.0 32.9 49 54 A T H X S+ 0 0 92 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.919 109.9 49.5 -58.5 -42.3 11.7 4.0 30.4 50 55 A K H X S+ 0 0 129 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.912 113.7 44.6 -65.2 -43.6 8.9 3.6 32.9 51 56 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.932 112.3 52.1 -67.0 -43.4 8.7 7.3 33.7 52 57 A K H X S+ 0 0 77 -4,-3.0 4,-2.8 -5,-0.2 -2,-0.2 0.873 104.8 56.6 -60.6 -38.0 8.9 8.3 30.1 53 58 A A H X S+ 0 0 61 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.918 111.5 42.9 -61.0 -44.1 6.0 5.9 29.2 54 59 A V H >X S+ 0 0 34 -4,-1.6 3,-1.1 2,-0.2 4,-0.7 0.961 115.0 49.3 -65.7 -48.7 3.8 7.7 31.8 55 60 A Y H >< S+ 0 0 43 -4,-2.8 3,-1.5 1,-0.2 7,-0.3 0.906 104.2 58.8 -54.8 -46.5 5.0 11.2 30.7 56 61 A D H 3< S+ 0 0 89 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.718 96.1 63.8 -63.1 -22.3 4.4 10.6 27.0 57 62 A T H << S+ 0 0 106 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.778 128.5 0.3 -70.1 -27.8 0.7 9.9 27.6 58 63 A N 4 S+ 0 0 120 1,-0.2 3,-1.3 2,-0.2 4,-0.2 0.941 110.9 47.3 -72.9 -44.3 1.0 18.7 30.2 61 66 A K T 34 S+ 0 0 100 1,-0.3 3,-0.2 -3,-0.1 -1,-0.2 0.841 123.2 35.6 -57.1 -36.5 -0.5 16.7 33.1 62 67 A F T 3< S+ 0 0 9 -4,-2.1 -1,-0.3 -7,-0.3 -47,-0.2 -0.129 79.5 133.3-111.0 37.4 3.0 15.3 33.9 63 68 A R S < S+ 0 0 116 -3,-1.3 -48,-2.7 -48,-0.1 -47,-0.5 0.846 70.7 29.0 -63.2 -37.7 4.9 18.5 33.0 64 69 A T B > S-A 14 0A 2 -50,-0.3 4,-1.6 -3,-0.2 -50,-0.2 -0.782 83.3-114.9-118.1 162.3 7.0 18.5 36.2 65 70 A L H > S+ 0 0 0 -52,-2.5 4,-1.6 -2,-0.3 5,-0.1 0.914 119.4 55.0 -61.5 -36.7 8.3 15.8 38.4 66 71 A Q H > S+ 0 0 5 -53,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.908 102.5 57.3 -63.3 -38.0 6.1 17.2 41.2 67 72 A N H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.886 101.8 56.0 -58.7 -40.6 3.1 16.9 38.9 68 73 A I H X S+ 0 0 0 -4,-1.6 4,-2.6 1,-0.2 5,-0.3 0.966 111.2 42.7 -55.2 -49.2 3.8 13.1 38.5 69 74 A L H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.907 116.6 47.9 -67.0 -42.6 3.7 12.6 42.3 70 75 A E H X S+ 0 0 93 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.936 115.6 43.8 -60.5 -51.1 0.6 14.8 42.7 71 76 A V H X S+ 0 0 31 -4,-2.8 4,-2.8 -5,-0.2 -2,-0.2 0.930 115.6 46.2 -64.6 -47.0 -1.3 13.2 39.9 72 77 A E H X S+ 0 0 2 -4,-2.6 4,-2.8 -5,-0.3 5,-0.3 0.860 108.1 56.9 -68.7 -33.3 -0.5 9.6 40.8 73 78 A K H X S+ 0 0 117 -4,-2.1 4,-1.5 -5,-0.3 7,-0.2 0.948 113.5 41.6 -59.6 -45.8 -1.3 10.2 44.5 74 79 A E H < S+ 0 0 154 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.935 117.6 47.0 -66.7 -44.9 -4.8 11.3 43.4 75 80 A M H < S+ 0 0 88 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.893 121.6 32.3 -61.8 -42.4 -5.1 8.5 40.8 76 81 A Y H >< S- 0 0 94 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.523 83.1-169.1-105.6 -8.0 -4.0 5.6 42.9 77 82 A G G >< + 0 0 41 -4,-1.5 3,-1.6 -5,-0.3 -1,-0.2 -0.223 69.5 3.4 57.5-134.3 -5.1 6.5 46.4 78 83 A A G 3 S+ 0 0 111 1,-0.3 -1,-0.3 3,-0.1 -2,-0.0 0.667 124.1 66.0 -65.4 -18.7 -3.8 4.4 49.3 79 84 A E G X S+ 0 0 128 -3,-1.5 3,-1.6 2,-0.1 -1,-0.3 0.819 86.1 127.6 -69.9 -32.4 -1.5 2.2 47.0 80 85 A W T < + 0 0 21 -3,-1.6 4,-0.0 1,-0.3 -7,-0.0 -0.421 56.3 29.5 -65.1 142.9 0.6 5.4 46.3 81 86 A P T 3 S+ 0 0 16 0, 0.0 2,-1.9 0, 0.0 -1,-0.3 -0.960 110.6 68.4 -94.8 11.7 3.5 5.9 46.4 82 87 A K S < S+ 0 0 109 -3,-1.6 2,-0.3 4,-0.1 -2,-0.1 -0.268 95.3 81.1 -84.8 54.8 4.3 2.2 45.7 83 88 A V S > S- 0 0 10 -2,-1.9 4,-2.2 1,-0.0 3,-0.5 -0.995 82.3 -25.3-152.7 151.1 3.0 2.7 42.0 84 89 A G H > S- 0 0 41 -2,-0.3 4,-2.0 1,-0.2 3,-0.2 0.066 112.7 -16.0 56.3-146.3 3.7 3.9 38.6 85 90 A A H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.767 130.2 66.2 -71.9 -25.2 6.3 6.6 37.7 86 91 A T H > S+ 0 0 0 -3,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.936 107.1 41.2 -60.0 -43.0 6.4 7.7 41.4 87 92 A L H X S+ 0 0 37 -4,-2.2 4,-1.7 2,-0.2 5,-0.2 0.928 113.7 52.4 -71.3 -40.8 7.9 4.3 42.2 88 93 A A H X S+ 0 0 3 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.911 112.1 45.7 -59.9 -43.0 10.2 4.2 39.2 89 94 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.827 104.7 62.5 -71.5 -26.9 11.5 7.7 40.0 90 95 A M H X S+ 0 0 1 -4,-1.7 4,-0.5 -5,-0.3 -1,-0.2 0.896 113.6 35.7 -62.7 -38.9 12.0 6.7 43.7 91 96 A W H X S+ 0 0 32 -4,-1.7 4,-1.8 2,-0.2 3,-0.5 0.847 112.9 58.8 -80.9 -38.4 14.5 4.1 42.5 92 97 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.929 101.1 56.1 -55.0 -45.0 15.9 6.2 39.7 93 98 A K H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.839 104.3 53.5 -61.8 -28.8 17.0 8.9 42.1 94 99 A R H X S+ 0 0 0 -4,-0.5 4,-2.1 -3,-0.5 -1,-0.2 0.917 110.6 45.5 -73.8 -39.3 19.0 6.3 44.1 95 100 A G H X S+ 0 0 7 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.907 114.0 49.7 -65.6 -38.8 20.9 5.2 41.0 96 101 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.920 110.1 51.1 -65.9 -39.7 21.4 8.9 40.0 97 102 A R H X S+ 0 0 36 -4,-2.5 4,-3.0 -5,-0.2 5,-0.3 0.891 105.9 55.9 -65.4 -37.7 22.7 9.6 43.6 98 103 A F H X S+ 0 0 6 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.948 109.7 45.3 -55.7 -51.8 25.1 6.6 43.3 99 104 A I H X S+ 0 0 14 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.936 113.6 50.9 -58.6 -47.5 26.6 8.2 40.1 100 105 A Q H X S+ 0 0 23 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.948 113.7 42.0 -55.4 -53.7 26.8 11.7 41.9 101 106 A V H X S+ 0 0 17 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.922 115.5 50.8 -65.2 -39.9 28.5 10.5 45.0 102 107 A F H X S+ 0 0 8 -4,-2.6 4,-2.2 -5,-0.3 -2,-0.2 0.952 114.7 41.9 -60.6 -54.2 30.9 8.2 43.0 103 108 A L H X S+ 0 0 20 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 0.895 114.7 51.0 -62.5 -43.2 31.9 11.0 40.5 104 109 A Q H X S+ 0 0 61 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.906 109.3 51.8 -62.7 -41.4 32.2 13.6 43.3 105 110 A S H <>S+ 0 0 2 -4,-2.6 5,-2.1 -5,-0.2 -2,-0.2 0.937 112.0 45.6 -59.7 -44.2 34.5 11.2 45.3 106 111 A I H ><5S+ 0 0 7 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.923 112.8 50.2 -64.5 -45.0 36.8 10.7 42.4 107 112 A C H 3<5S+ 0 0 7 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.822 106.3 56.1 -63.1 -33.4 36.9 14.5 41.6 108 113 A D T 3<5S- 0 0 91 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.369 116.9-115.0 -80.3 1.4 37.7 15.2 45.3 109 114 A G T < 5 + 0 0 50 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.685 55.6 163.9 75.7 16.7 40.8 12.9 45.0 110 115 A E < + 0 0 63 -5,-2.1 2,-0.3 -6,-0.2 -1,-0.2 -0.512 14.8 138.5 -70.9 132.2 39.5 10.4 47.5 111 116 A R - 0 0 116 -2,-0.2 2,-0.6 10,-0.1 8,-0.1 -0.982 60.2-100.8-162.6 164.2 41.4 7.1 47.2 112 117 A D > - 0 0 61 3,-0.5 3,-1.8 -2,-0.3 6,-0.2 -0.882 32.1-145.1 -88.9 118.5 43.0 4.2 49.1 113 118 A E T 3 S+ 0 0 130 -2,-0.6 -1,-0.1 1,-0.3 4,-0.1 0.740 99.9 57.2 -62.4 -20.9 46.8 5.1 49.0 114 119 A N T 3 S+ 0 0 136 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.654 119.9 28.4 -76.6 -18.5 47.6 1.4 48.7 115 120 A H S X S+ 0 0 92 -3,-1.8 3,-2.0 1,-0.1 -3,-0.5 -0.442 70.8 159.0-137.4 61.8 45.4 1.1 45.5 116 121 A P T 3 S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.741 75.0 52.6 -65.6 -20.5 45.6 4.6 43.9 117 122 A N T 3 S+ 0 0 63 -3,-0.1 36,-2.6 36,-0.1 37,-0.4 0.213 95.9 83.6-101.5 12.3 44.6 3.3 40.5 118 123 A L < - 0 0 38 -3,-2.0 -6,-0.2 34,-0.3 34,-0.1 -0.688 60.7-155.6-100.5 164.6 41.5 1.5 41.7 119 124 A I > + 0 0 1 32,-0.4 4,-2.5 -2,-0.2 5,-0.2 0.078 62.3 110.3-122.9 21.0 38.0 3.0 42.2 120 125 A R H > S+ 0 0 99 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.915 77.4 51.5 -62.7 -43.4 36.7 0.4 44.7 121 126 A V H > S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 112.6 47.3 -63.2 -35.5 36.7 2.9 47.7 122 127 A N H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.914 114.0 46.2 -71.8 -42.1 34.8 5.5 45.6 123 128 A A H X S+ 0 0 5 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.884 112.2 50.3 -68.4 -37.9 32.2 2.9 44.4 124 129 A T H X S+ 0 0 48 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.926 110.8 49.1 -64.2 -45.2 31.8 1.4 47.9 125 130 A K H X S+ 0 0 80 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.948 113.4 47.6 -58.6 -45.9 31.2 4.9 49.4 126 131 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.4 0.908 112.5 49.0 -63.6 -41.8 28.7 5.7 46.7 127 132 A Y H X>S+ 0 0 29 -4,-2.5 5,-2.6 1,-0.2 4,-2.3 0.952 111.6 48.8 -64.3 -44.4 26.9 2.3 47.1 128 133 A E H <5S+ 0 0 107 -4,-2.8 5,-0.4 1,-0.2 -1,-0.2 0.890 115.6 44.1 -59.5 -40.4 26.6 2.8 50.9 129 134 A M H <5S+ 0 0 131 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.865 128.2 23.0 -79.9 -31.2 25.3 6.3 50.6 130 135 A A H <5S+ 0 0 1 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.815 132.5 5.2-102.9 -43.0 22.8 5.6 47.8 131 136 A L T ><5S+ 0 0 8 -4,-2.3 3,-2.2 -5,-0.4 -3,-0.2 0.715 94.9 85.8-124.1 -35.2 21.6 2.0 47.5 132 137 A K G > - 0 0 22 68,-3.8 4,-2.3 -2,-0.5 5,-0.2 -0.049 42.7 -85.9 -68.9-177.9 18.5 -7.4 50.6 137 142 A W H > S+ 0 0 185 1,-0.2 4,-1.4 2,-0.2 -1,-0.0 0.871 124.9 50.5 -70.8 -34.4 21.2 -10.0 51.0 138 143 A I H > S+ 0 0 98 1,-0.2 4,-1.6 2,-0.2 3,-0.2 0.938 112.1 47.4 -67.5 -45.4 21.0 -11.5 47.5 139 144 A V H > S+ 0 0 24 65,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.895 105.7 58.1 -68.9 -40.1 21.2 -8.1 45.7 140 145 A Q H X S+ 0 0 67 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.884 104.5 51.9 -53.1 -40.8 24.1 -6.9 47.7 141 146 A K H X S+ 0 0 128 -4,-1.4 4,-1.5 -3,-0.2 -1,-0.2 0.903 105.1 55.7 -63.3 -39.2 26.1 -9.9 46.5 142 147 A I H X S+ 0 0 85 -4,-1.6 4,-1.3 1,-0.2 -2,-0.2 0.915 109.3 48.3 -59.1 -41.6 25.2 -9.0 42.9 143 148 A F H X S+ 0 0 16 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.908 104.9 57.4 -66.6 -40.4 26.7 -5.5 43.6 144 149 A Q H X S+ 0 0 100 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.844 103.9 53.6 -57.5 -35.0 29.9 -6.9 45.1 145 150 A A H X S+ 0 0 58 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.920 106.7 50.6 -65.0 -38.5 30.6 -8.8 42.0 146 151 A A H < S+ 0 0 18 -4,-1.3 -109,-0.3 1,-0.2 -2,-0.2 0.855 110.7 52.8 -68.9 -28.0 30.2 -5.5 40.0 147 152 A L H >< S+ 0 0 34 -4,-2.0 3,-1.7 2,-0.2 -2,-0.2 0.926 106.7 49.0 -67.5 -49.0 32.7 -4.0 42.6 148 153 A Y H 3< S+ 0 0 136 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.802 113.2 49.6 -65.1 -29.1 35.4 -6.7 42.1 149 154 A A T 3< S+ 0 0 78 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.378 81.8 132.9 -89.3 3.2 35.1 -6.3 38.4 150 155 A A < - 0 0 18 -3,-1.7 -30,-0.1 1,-0.1 3,-0.1 -0.174 59.0-111.7 -55.2 144.2 35.4 -2.4 38.5 151 156 A P - 0 0 19 0, 0.0 -32,-0.4 0, 0.0 -1,-0.1 -0.309 37.1 -87.2 -71.8 162.0 37.9 -0.9 35.9 152 157 A Y > - 0 0 134 -34,-0.1 4,-2.8 1,-0.1 -34,-0.3 -0.353 37.4-118.8 -57.7 145.1 41.2 0.8 36.8 153 158 A K H > S+ 0 0 22 -36,-2.6 4,-2.9 1,-0.2 5,-0.2 0.916 113.6 51.5 -54.5 -48.9 40.8 4.5 37.5 154 159 A S H > S+ 0 0 35 -37,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.900 112.1 47.1 -60.5 -37.5 43.1 5.5 34.6 155 160 A D H > S+ 0 0 76 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.924 111.9 50.3 -71.0 -42.9 41.1 3.3 32.2 156 161 A F H X S+ 0 0 16 -4,-2.8 4,-1.2 1,-0.2 -2,-0.2 0.951 114.7 43.6 -59.2 -47.8 37.8 4.7 33.5 157 162 A L H X S+ 0 0 4 -4,-2.9 4,-1.1 1,-0.2 3,-0.5 0.907 111.6 52.8 -67.5 -39.8 39.0 8.3 33.1 158 163 A K H >< S+ 0 0 138 -4,-2.5 3,-0.6 1,-0.2 5,-0.3 0.913 109.4 51.5 -58.5 -41.7 40.6 7.7 29.6 159 164 A A H >< S+ 0 0 16 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.726 100.3 60.5 -73.8 -21.5 37.3 6.3 28.4 160 165 A L H 3< S+ 0 0 32 -4,-1.2 2,-0.6 -3,-0.5 -1,-0.2 0.798 100.2 57.2 -72.8 -29.3 35.2 9.3 29.6 161 166 A S T X< S- 0 0 6 -4,-1.1 3,-2.7 -3,-0.6 -1,-0.3 -0.309 95.2-154.1 -94.0 49.8 37.2 11.5 27.3 162 167 A K T < - 0 0 186 -3,-0.6 -3,-0.1 -2,-0.6 -2,-0.1 0.070 66.8 -30.4 -38.9 92.7 36.2 9.3 24.3 163 168 A G T 3 S+ 0 0 83 -5,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.810 104.3 133.9 67.0 34.1 39.0 9.8 21.8 164 169 A Q < - 0 0 101 -3,-2.7 2,-1.6 -6,-0.3 -1,-0.2 -0.850 65.3-120.6-114.1 153.1 39.9 13.4 22.8 165 170 A N + 0 0 175 -2,-0.3 2,-0.4 2,-0.0 0, 0.0 -0.501 67.8 131.0 -87.9 66.6 43.3 14.9 23.4 166 171 A V - 0 0 34 -2,-1.6 -2,-0.1 -5,-0.2 -5,-0.1 -0.947 53.9-124.6-129.0 137.2 42.5 15.9 27.0 167 172 A T > - 0 0 73 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.362 30.4-107.9 -75.6 161.1 44.5 15.3 30.2 168 173 A E H > S+ 0 0 100 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.882 122.8 51.7 -52.3 -40.1 43.1 13.5 33.3 169 174 A E H > S+ 0 0 107 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.879 109.0 48.6 -66.0 -39.6 42.9 16.9 35.1 170 175 A E H > S+ 0 0 96 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.879 111.1 51.8 -66.6 -37.8 41.0 18.5 32.2 171 176 A C H X S+ 0 0 4 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.943 108.4 50.4 -62.6 -47.8 38.6 15.5 32.3 172 177 A L H X S+ 0 0 23 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.903 106.4 55.9 -60.9 -38.7 38.0 15.9 36.0 173 178 A E H X S+ 0 0 110 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.902 107.0 49.5 -57.3 -43.4 37.3 19.6 35.4 174 179 A K H X S+ 0 0 95 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.899 110.6 50.2 -61.3 -42.0 34.6 18.7 32.9 175 180 A V H X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.924 107.6 54.2 -65.8 -40.3 33.1 16.2 35.5 176 181 A R H X S+ 0 0 70 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.913 108.6 48.8 -60.3 -40.6 33.1 18.9 38.2 177 182 A L H >X S+ 0 0 108 -4,-1.9 3,-1.3 1,-0.2 4,-0.7 0.942 110.1 50.3 -63.9 -47.8 31.1 21.2 35.9 178 183 A F H 3X S+ 0 0 13 -4,-2.3 4,-1.6 1,-0.2 -174,-0.3 0.894 104.5 61.4 -52.0 -42.0 28.6 18.5 35.1 179 184 A L H 3X S+ 0 0 4 -4,-2.5 4,-2.4 1,-0.2 5,-0.3 0.721 89.7 71.0 -61.8 -19.8 28.2 17.8 38.9 180 185 A V H S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 6,-0.8 0.919 113.3 44.5 -56.1 -43.7 10.1 12.8 48.0 194 199 A T H ><5S+ 0 0 97 -4,-2.1 3,-1.3 3,-0.2 -2,-0.2 0.942 113.6 50.0 -66.3 -44.9 10.5 13.5 51.7 195 200 A R H 3<5S+ 0 0 152 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.892 114.9 43.6 -59.7 -41.4 8.1 16.5 51.6 196 201 A M T 3<5S- 0 0 25 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.391 108.3-121.3 -87.2 4.9 5.4 14.5 49.8 197 202 A N T < 5S+ 0 0 137 -3,-1.3 -3,-0.2 -4,-0.3 -4,-0.1 0.903 74.5 131.2 55.5 37.3 5.8 11.5 52.1 198 203 A A < + 0 0 0 -5,-2.5 2,-0.3 -6,-0.2 -4,-0.2 0.453 34.1 105.4 -95.5 -8.2 6.6 9.5 48.8 199 204 A E - 0 0 44 -6,-0.8 2,-0.3 -5,-0.1 -112,-0.0 -0.629 49.2-169.6 -82.6 134.4 9.8 7.8 50.1 200 205 A L - 0 0 44 -2,-0.3 -2,-0.0 -119,-0.1 -3,-0.0 -0.847 17.6-154.2-118.9 159.7 9.6 4.1 51.0 201 206 A N + 0 0 93 -2,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.401 45.3 131.3-117.6 4.0 12.2 2.0 52.8 202 207 A Y - 0 0 65 1,-0.1 2,-0.3 -67,-0.0 -2,-0.1 -0.131 50.1-128.5 -60.4 154.7 11.5 -1.6 51.6 203 208 A K 0 0 133 -68,-0.1 -68,-0.3 0, 0.0 -69,-0.1 -0.720 360.0 360.0-108.0 150.7 14.4 -3.7 50.4 204 209 A V 0 0 98 -70,-2.1 -68,-3.8 -2,-0.3 -65,-0.3 -0.838 360.0 360.0-106.6 360.0 14.7 -5.6 47.1