==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID TRANSPORT 07-AUG-12 4GH0 . COMPND 2 MOLECULE: GLYCOLIPID TRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.R.SAMYGINA,A.CABO-BILBAO,B.OCHOA-LIZARRALDE,A.N.POPOV,L.MA . 200 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 75.5 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 . 3 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 54.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.0 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 1 0 0 0 2 0 1 1 1 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 10 A K 0 0 183 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.7 1.5 12.3 8.5 2 11 A P - 0 0 95 0, 0.0 175,-0.0 0, 0.0 176,-0.0 -0.265 360.0 -93.7 -60.7 154.4 1.4 11.2 4.8 3 12 A L - 0 0 37 1,-0.1 6,-0.1 2,-0.1 2,-0.0 -0.383 40.8-112.0 -60.1 143.5 4.5 11.7 2.6 4 13 A P > - 0 0 57 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.376 36.5-100.9 -68.1 163.4 4.6 14.9 0.6 5 14 A A T 3 S+ 0 0 99 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.831 124.9 53.8 -55.6 -34.5 4.4 14.4 -3.1 6 15 A D T 3 S- 0 0 107 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.482 105.5-130.9 -81.1 -3.9 8.1 14.8 -3.5 7 16 A K < + 0 0 98 -3,-2.0 2,-0.3 1,-0.2 -2,-0.1 0.587 53.3 149.3 67.4 15.6 8.8 12.1 -0.8 8 17 A Q - 0 0 63 53,-0.1 2,-0.7 52,-0.0 -1,-0.2 -0.611 40.4-141.4 -80.5 137.1 11.2 14.2 1.1 9 18 A I - 0 0 13 -2,-0.3 52,-2.5 -3,-0.1 53,-0.3 -0.883 12.5-132.8-104.9 111.2 11.1 13.3 4.8 10 19 A E B > -A 60 0A 108 -2,-0.7 4,-2.0 50,-0.2 50,-0.3 -0.451 11.2-145.7 -65.9 128.5 11.5 16.3 7.1 11 20 A T H > S+ 0 0 0 48,-2.7 4,-2.8 -2,-0.2 5,-0.2 0.902 91.1 52.4 -66.8 -45.6 14.0 15.5 9.8 12 21 A G H > S+ 0 0 9 47,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.959 113.7 41.3 -57.0 -57.8 12.5 17.5 12.6 13 22 A P H > S+ 0 0 27 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.876 113.6 55.1 -58.8 -36.7 9.1 16.0 12.4 14 23 A F H X S+ 0 0 15 -4,-2.0 4,-3.1 2,-0.2 5,-0.3 0.941 108.6 47.5 -60.8 -47.2 10.6 12.5 11.8 15 24 A L H X S+ 0 0 11 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.893 110.9 51.5 -61.8 -41.2 12.6 12.8 15.0 16 25 A E H < S+ 0 0 133 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.939 114.4 44.5 -60.4 -45.1 9.5 14.0 17.0 17 26 A A H >< S+ 0 0 60 -4,-2.5 3,-2.0 1,-0.2 4,-0.2 0.966 113.2 47.3 -65.7 -51.8 7.5 11.0 15.6 18 27 A V H >< S+ 0 0 14 -4,-3.1 3,-2.0 1,-0.3 -1,-0.2 0.781 96.6 73.2 -67.7 -21.1 10.2 8.3 16.1 19 28 A S T 3< S+ 0 0 59 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.724 87.7 65.2 -66.6 -13.0 10.9 9.5 19.6 20 29 A H T <> S+ 0 0 133 -3,-2.0 4,-0.5 -4,-0.4 -1,-0.3 0.610 90.1 69.9 -76.6 -13.0 7.5 7.9 20.6 21 30 A L H X> S+ 0 0 30 -3,-2.0 3,-1.5 -4,-0.2 4,-0.6 0.944 85.1 58.5 -78.4 -47.5 8.8 4.5 19.8 22 31 A P H >4 S+ 0 0 7 0, 0.0 3,-2.1 0, 0.0 4,-0.5 0.887 98.6 60.4 -52.4 -45.5 11.3 3.7 22.6 23 32 A P H >4 S+ 0 0 65 0, 0.0 3,-1.3 0, 0.0 4,-0.2 0.786 92.5 67.7 -57.1 -24.9 8.8 4.2 25.4 24 33 A F H X< S+ 0 0 82 -3,-1.5 3,-1.6 -4,-0.5 -3,-0.1 0.795 88.4 65.7 -61.4 -26.2 6.7 1.3 23.9 25 34 A F G X< S+ 0 0 32 -3,-2.1 3,-0.9 -4,-0.6 5,-0.4 0.768 94.8 58.5 -66.9 -22.0 9.5 -1.1 24.8 26 35 A D G < S+ 0 0 90 -3,-1.3 3,-0.3 -4,-0.5 -1,-0.3 0.465 99.4 60.2 -81.2 -0.1 8.7 -0.3 28.5 27 36 A C G < S+ 0 0 68 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.270 79.9 88.4-107.6 6.5 5.2 -1.5 27.9 28 37 A L S < S- 0 0 26 -3,-0.9 -1,-0.1 2,-0.2 -2,-0.1 0.334 96.4-117.4 -93.0 3.7 6.2 -5.1 26.9 29 38 A G S S+ 0 0 78 -3,-0.3 -3,-0.1 1,-0.1 -2,-0.1 0.609 84.1 88.6 74.0 12.9 6.3 -6.6 30.4 30 39 A S > - 0 0 23 -5,-0.4 3,-1.9 1,-0.1 -2,-0.2 -0.912 62.1-153.7-148.8 120.3 9.9 -7.5 30.4 31 40 A P G > S+ 0 0 104 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.627 89.5 86.9 -55.7 -13.0 13.0 -5.6 31.4 32 41 A V G 3 S+ 0 0 68 1,-0.2 4,-0.3 2,-0.1 110,-0.1 0.804 86.0 55.7 -53.3 -30.4 14.8 -7.8 28.8 33 42 A F G <> S+ 0 0 27 -3,-1.9 4,-2.4 1,-0.2 3,-0.3 0.566 80.7 89.8 -88.2 -3.3 13.7 -5.1 26.3 34 43 A T H <> S+ 0 0 66 -3,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.900 85.9 50.2 -58.4 -45.6 15.4 -2.2 28.1 35 44 A P H > S+ 0 0 79 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.841 110.3 51.7 -65.8 -27.6 18.7 -2.5 26.3 36 45 A I H > S+ 0 0 77 -4,-0.3 4,-2.4 -3,-0.3 5,-0.3 0.937 108.6 50.6 -69.1 -45.3 16.8 -2.6 23.0 37 46 A K H X S+ 0 0 64 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.921 111.4 49.7 -50.4 -46.8 15.0 0.6 24.0 38 47 A A H X S+ 0 0 59 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.870 108.7 50.2 -68.3 -39.3 18.3 2.2 24.8 39 48 A V H X S+ 0 0 84 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.925 113.2 46.2 -67.5 -42.1 20.0 1.2 21.6 40 49 A I H X S+ 0 0 17 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.930 111.4 51.5 -65.0 -43.6 17.2 2.6 19.5 41 50 A S H X S+ 0 0 50 -4,-2.6 4,-2.8 -5,-0.3 -1,-0.2 0.889 106.6 56.4 -59.9 -36.2 17.1 5.8 21.6 42 51 A G H X S+ 0 0 39 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.892 105.4 49.7 -62.6 -42.3 20.8 6.1 20.9 43 52 A N H X S+ 0 0 33 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.940 112.4 48.0 -59.0 -45.0 20.3 6.0 17.2 44 53 A I H X S+ 0 0 8 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.929 110.5 51.6 -63.3 -43.8 17.7 8.8 17.5 45 54 A T H X S+ 0 0 84 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.872 108.2 51.3 -60.4 -40.2 19.9 10.9 19.8 46 55 A K H X S+ 0 0 99 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.918 111.3 47.0 -65.9 -43.8 22.8 10.7 17.3 47 56 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.936 112.8 50.3 -62.7 -43.3 20.6 11.8 14.4 48 57 A K H X S+ 0 0 100 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.888 107.1 54.7 -60.2 -40.6 19.2 14.6 16.6 49 58 A A H X S+ 0 0 52 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.885 111.6 43.7 -62.8 -42.1 22.7 15.8 17.5 50 59 A V H >X S+ 0 0 17 -4,-1.8 3,-1.2 2,-0.2 4,-0.7 0.950 114.0 50.5 -65.7 -50.1 23.7 16.1 13.9 51 60 A Y H >< S+ 0 0 54 -4,-2.8 3,-1.5 1,-0.3 7,-0.3 0.915 105.5 56.8 -52.0 -44.4 20.4 17.8 13.0 52 61 A D H 3< S+ 0 0 83 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.719 93.8 68.2 -66.7 -21.4 20.8 20.3 15.8 53 62 A T H << S- 0 0 104 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.793 128.8 -5.9 -65.5 -29.4 24.2 21.4 14.5 54 63 A N 4 S+ 0 0 48 2,-0.2 3,-1.3 1,-0.2 4,-0.2 0.911 110.8 47.8 -72.8 -46.8 18.5 24.0 7.6 57 66 A K T 34 S+ 0 0 89 1,-0.3 3,-0.2 -6,-0.1 10,-0.2 0.841 121.7 38.4 -62.8 -32.6 21.4 21.9 6.1 58 67 A F T 3< S+ 0 0 4 -4,-2.0 -1,-0.3 -7,-0.3 -47,-0.2 -0.083 77.0 131.4-107.3 34.8 19.8 18.8 7.6 59 68 A R S < S+ 0 0 139 -3,-1.3 -48,-2.7 -48,-0.1 -47,-0.5 0.814 72.0 29.9 -63.2 -33.7 16.2 19.7 6.9 60 69 A T B > S-A 10 0A 13 -50,-0.3 4,-1.5 -3,-0.2 -50,-0.2 -0.832 80.4-118.1-122.8 159.7 15.4 16.3 5.3 61 70 A L H > S+ 0 0 0 -52,-2.5 4,-1.6 -2,-0.3 3,-0.2 0.902 118.2 56.9 -60.5 -38.3 16.7 12.8 5.8 62 71 A Q H > S+ 0 0 17 -53,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.907 102.7 54.7 -58.2 -41.8 17.8 12.9 2.2 63 72 A N H > S+ 0 0 37 1,-0.2 4,-2.9 2,-0.2 5,-0.4 0.846 101.4 59.2 -60.9 -36.9 19.9 15.9 3.1 64 73 A I H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.969 110.3 40.3 -57.7 -48.9 21.6 14.1 5.9 65 74 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.915 117.3 49.0 -65.6 -44.8 23.0 11.4 3.5 66 75 A E H X S+ 0 0 80 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.919 116.1 42.1 -60.5 -50.3 23.8 13.9 0.8 67 76 A V H X S+ 0 0 19 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.929 115.1 48.9 -65.3 -45.9 25.7 16.3 3.1 68 77 A E H X S+ 0 0 1 -4,-2.7 4,-2.5 -5,-0.4 5,-0.2 0.888 105.6 57.4 -66.7 -35.5 27.5 13.6 5.0 69 78 A K H X S+ 0 0 107 -4,-2.3 4,-0.8 -5,-0.3 -1,-0.2 0.922 113.6 41.3 -55.5 -39.1 28.6 11.9 1.8 70 79 A E H < S+ 0 0 161 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.821 117.5 48.1 -77.8 -34.9 30.3 15.2 0.9 71 80 A M H < S+ 0 0 96 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 118.8 33.8 -72.6 -38.3 31.6 15.9 4.5 72 81 A Y H >< S- 0 0 82 -4,-2.5 3,-1.9 1,-0.2 4,-0.4 0.383 76.7-175.8-112.9 -2.9 33.2 12.5 5.2 73 82 A G G >< S+ 0 0 47 -4,-0.8 3,-1.9 1,-0.3 -1,-0.2 -0.017 72.0 10.7 44.6-126.8 34.6 11.2 2.0 74 83 A A G 3 S+ 0 0 106 1,-0.3 -1,-0.3 3,-0.1 -2,-0.0 0.688 125.0 60.0 -63.1 -20.9 36.0 7.6 2.2 75 84 A E G X S+ 0 0 137 -3,-1.9 3,-1.0 2,-0.1 -1,-0.3 0.704 87.5 130.9 -79.4 -19.1 34.7 6.9 5.7 76 85 A W T < + 0 0 24 -3,-1.9 4,-0.0 -4,-0.4 -7,-0.0 -0.563 57.3 25.5 -78.6 143.8 31.1 7.4 4.6 77 86 A P T 3 S+ 0 0 17 0, 0.0 2,-1.8 0, 0.0 -1,-0.3 -0.972 113.4 67.4 -89.3 6.7 28.5 5.8 5.0 78 87 A K S < S+ 0 0 116 -3,-1.0 2,-0.3 4,-0.1 -2,-0.1 -0.305 96.2 72.8 -85.7 53.9 30.0 4.2 8.2 79 88 A V S > S- 0 0 30 -2,-1.8 4,-2.0 0, 0.0 3,-0.5 -0.985 84.1 -12.4-157.2 157.6 29.8 7.5 10.0 80 89 A G H > S- 0 0 10 -2,-0.3 4,-1.7 1,-0.2 3,-0.1 0.080 112.1 -20.6 57.3-150.1 27.6 10.0 11.6 81 90 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.753 130.0 67.5 -70.0 -24.8 23.8 10.2 11.3 82 91 A T H > S+ 0 0 0 -3,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.931 105.6 42.1 -60.8 -44.1 24.0 8.1 8.2 83 92 A L H X S+ 0 0 41 -4,-2.0 4,-1.7 2,-0.2 5,-0.2 0.917 113.8 51.1 -68.2 -42.0 25.1 5.2 10.2 84 93 A A H X S+ 0 0 9 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.917 113.1 45.4 -61.5 -44.2 22.7 5.8 13.0 85 94 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.832 105.6 61.9 -70.6 -29.2 19.8 6.0 10.6 86 95 A M H X S+ 0 0 1 -4,-1.7 4,-0.7 -5,-0.3 -1,-0.2 0.901 113.1 36.5 -61.3 -41.1 21.0 2.9 8.8 87 96 A W H X S+ 0 0 47 -4,-1.7 4,-1.8 2,-0.2 3,-0.4 0.869 113.8 56.1 -79.0 -40.4 20.5 1.0 12.0 88 97 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.919 103.8 54.5 -55.3 -45.7 17.4 2.9 13.1 89 98 A K H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.801 103.6 55.8 -61.6 -31.0 15.7 2.0 9.9 90 99 A R H X S+ 0 0 0 -4,-0.7 4,-2.2 -3,-0.4 -1,-0.2 0.885 109.1 47.0 -68.4 -37.8 16.3 -1.7 10.5 91 100 A G H X S+ 0 0 16 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.910 111.7 50.8 -67.3 -38.9 14.6 -1.4 13.8 92 101 A L H X S+ 0 0 6 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.892 110.6 49.3 -64.3 -41.0 11.7 0.4 12.2 93 102 A R H X S+ 0 0 35 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.884 106.8 55.3 -66.0 -40.9 11.4 -2.3 9.5 94 103 A F H X S+ 0 0 40 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.949 109.9 46.4 -53.3 -50.4 11.4 -5.0 12.1 95 104 A I H X S+ 0 0 26 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.909 111.9 52.3 -60.7 -44.6 8.5 -3.2 13.8 96 105 A Q H X S+ 0 0 23 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.944 113.1 42.0 -51.8 -54.6 6.7 -2.9 10.4 97 106 A V H X S+ 0 0 13 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.906 114.9 51.7 -66.8 -39.8 7.0 -6.5 9.5 98 107 A F H X S+ 0 0 21 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.956 114.1 41.8 -59.3 -55.7 6.1 -7.7 13.0 99 108 A L H X S+ 0 0 14 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.902 114.7 51.2 -60.8 -43.7 2.9 -5.5 13.2 100 109 A Q H X S+ 0 0 63 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.898 108.5 52.4 -60.6 -41.3 2.0 -6.4 9.6 101 110 A S H <>S+ 0 0 2 -4,-2.4 5,-2.0 2,-0.2 -2,-0.2 0.924 111.2 46.5 -63.1 -43.0 2.4 -10.1 10.3 102 111 A I H ><5S+ 0 0 5 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.950 113.2 48.8 -63.3 -49.1 0.1 -9.9 13.4 103 112 A C H 3<5S+ 0 0 6 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.818 105.6 58.9 -60.9 -31.1 -2.5 -7.9 11.4 104 113 A D T 3<5S- 0 0 92 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.413 116.9-112.0 -82.7 3.3 -2.4 -10.4 8.6 105 114 A G T < 5 + 0 0 31 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.645 59.2 160.1 79.0 15.5 -3.4 -13.2 10.9 106 115 A E < + 0 0 64 -5,-2.0 2,-0.3 2,-0.0 -1,-0.3 -0.550 14.9 144.5 -73.1 132.7 -0.1 -15.1 10.8 107 116 A R - 0 0 128 -2,-0.3 2,-0.6 10,-0.1 8,-0.1 -0.984 56.5-103.6-160.2 161.2 0.2 -17.4 13.8 108 117 A D > - 0 0 69 3,-0.4 3,-1.7 -2,-0.3 6,-0.2 -0.886 32.3-145.0 -90.6 118.0 1.5 -20.7 15.1 109 118 A E T 3 S+ 0 0 107 -2,-0.6 -1,-0.1 1,-0.3 0, 0.0 0.724 98.6 48.1 -64.5 -19.1 -1.6 -22.9 15.3 110 119 A N T 3 S+ 0 0 138 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.462 122.5 33.1 -98.0 -3.5 -0.3 -24.6 18.4 111 120 A H X + 0 0 92 -3,-1.7 3,-1.9 3,-0.1 -3,-0.4 -0.347 67.6 152.4-138.9 58.8 0.7 -21.4 20.2 112 121 A P T 3 S+ 0 0 69 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 0.659 70.1 63.8 -65.1 -11.9 -1.9 -18.9 19.0 113 122 A N T 3 S+ 0 0 86 36,-0.1 36,-2.5 -5,-0.1 37,-0.4 0.432 95.4 73.0 -89.2 -3.3 -1.5 -17.0 22.2 114 123 A L < - 0 0 39 -3,-1.9 -6,-0.2 34,-0.2 34,-0.1 -0.607 63.9-151.5-105.5 168.7 2.1 -16.1 21.4 115 124 A I > + 0 0 3 32,-0.4 4,-2.2 -2,-0.2 5,-0.2 0.029 63.7 113.4-124.2 24.0 3.8 -13.7 18.9 116 125 A R H > S+ 0 0 110 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.924 75.9 50.4 -64.1 -43.3 7.0 -15.7 18.5 117 126 A V H > S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.862 111.2 49.2 -66.0 -33.7 6.3 -16.6 14.9 118 127 A N H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.907 112.2 47.8 -71.7 -42.7 5.6 -12.9 14.1 119 128 A A H X S+ 0 0 8 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.877 110.7 52.3 -63.9 -37.4 8.8 -11.7 15.8 120 129 A T H X S+ 0 0 43 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.929 109.0 48.8 -69.1 -42.3 10.9 -14.4 14.0 121 130 A K H X S+ 0 0 70 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.937 112.8 48.6 -61.7 -45.4 9.6 -13.4 10.6 122 131 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-0.4 0.911 111.3 50.2 -59.2 -41.7 10.4 -9.8 11.4 123 132 A Y H X>S+ 0 0 10 -4,-2.5 5,-2.8 1,-0.2 4,-2.4 0.954 111.3 48.0 -62.7 -47.2 13.8 -10.7 12.6 124 133 A E H <5S+ 0 0 105 -4,-2.7 5,-0.4 1,-0.2 -1,-0.2 0.894 117.1 42.5 -60.0 -40.8 14.6 -12.7 9.5 125 134 A M H <5S+ 0 0 127 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0 0 38 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.933 109.6 50.3 -52.6 -48.2 17.5 -12.9 20.0 140 149 A Q H < S+ 0 0 95 -4,-2.3 4,-0.4 1,-0.2 3,-0.3 0.897 111.6 47.0 -60.2 -43.3 16.3 -16.5 20.4 141 150 A A H >< S+ 0 0 70 -4,-2.1 3,-1.6 1,-0.2 4,-0.4 0.925 107.9 57.1 -61.4 -44.1 16.7 -16.4 24.2 142 151 A A H >< S+ 0 0 24 -4,-2.6 3,-1.7 1,-0.3 4,-0.4 0.755 90.1 73.4 -62.4 -27.1 15.0 -13.0 24.3 143 152 A L G >< S+ 0 0 15 -4,-1.3 3,-1.0 -3,-0.3 -1,-0.3 0.753 84.8 66.5 -58.1 -29.1 11.9 -14.6 22.6 144 153 A Y G < S+ 0 0 212 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.845 101.8 48.9 -59.0 -32.7 11.1 -16.3 25.9 145 154 A A G < S+ 0 0 21 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.510 83.0 118.7 -85.4 -6.7 10.5 -12.8 27.3 146 155 A A S < S- 0 0 24 -3,-1.0 -30,-0.1 -4,-0.4 3,-0.1 -0.297 70.9-107.5 -62.3 140.7 8.2 -11.7 24.5 147 156 A P - 0 0 20 0, 0.0 -32,-0.4 0, 0.0 -1,-0.1 -0.266 32.5 -96.2 -66.9 156.9 4.7 -10.8 25.7 148 157 A Y > - 0 0 130 -34,-0.1 4,-2.5 1,-0.1 -34,-0.2 -0.384 42.7-108.6 -57.5 148.6 1.6 -12.9 25.1 149 158 A K H > S+ 0 0 24 -36,-2.5 4,-2.3 1,-0.2 5,-0.2 0.899 118.3 51.9 -49.5 -46.7 -0.3 -11.6 22.1 150 159 A S H > S+ 0 0 63 -37,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.904 110.8 47.3 -61.7 -40.4 -3.1 -10.2 24.3 151 160 A D H > S+ 0 0 84 -3,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.880 109.6 53.9 -67.6 -40.3 -0.7 -8.4 26.5 152 161 A F H >X S+ 0 0 16 -4,-2.5 3,-0.7 1,-0.2 4,-0.6 0.939 108.2 48.7 -59.8 -48.3 1.1 -6.9 23.5 153 162 A L H >X S+ 0 0 9 -4,-2.3 3,-1.0 1,-0.3 4,-0.7 0.877 106.7 57.9 -64.1 -30.0 -2.1 -5.6 22.0 154 163 A K H ><>S+ 0 0 107 -4,-1.7 5,-0.6 1,-0.3 3,-0.5 0.825 98.2 60.2 -67.8 -29.4 -2.9 -4.0 25.4 155 164 A A H <<5S+ 0 0 20 -4,-1.3 3,-0.3 -3,-0.7 -1,-0.3 0.700 107.8 46.6 -66.2 -21.4 0.4 -2.1 25.3 156 165 A L H <<5S+ 0 0 48 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.571 90.9 78.8 -99.9 -7.5 -0.8 -0.4 22.1 157 166 A S T X<5S- 0 0 19 -4,-0.7 3,-1.6 -3,-0.5 -1,-0.2 0.310 102.4-112.4 -91.5 10.2 -4.4 0.6 23.0 158 167 A K T 3 5 - 0 0 201 -3,-0.3 -3,-0.1 1,-0.3 -2,-0.1 0.901 68.8 -68.4 62.2 41.0 -3.5 3.7 25.1 159 168 A G T 3 - 0 0 78 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.281 37.8-112.9 -67.1 158.8 -11.2 -5.6 21.7 164 173 A E H > S+ 0 0 92 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.899 119.9 57.7 -56.3 -38.5 -8.3 -7.2 19.9 165 174 A E H > S+ 0 0 129 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.918 106.8 45.6 -63.3 -42.8 -10.2 -6.6 16.7 166 175 A E H > S+ 0 0 100 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.929 111.5 52.7 -66.6 -42.5 -10.4 -2.9 17.3 167 176 A C H X S+ 0 0 7 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.928 109.5 48.9 -58.2 -47.2 -6.7 -2.8 18.3 168 177 A L H X S+ 0 0 17 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.882 107.4 54.8 -65.2 -34.2 -5.7 -4.5 15.0 169 178 A E H X S+ 0 0 117 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.911 108.7 48.7 -63.6 -41.9 -7.8 -2.2 12.9 170 179 A K H X S+ 0 0 140 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.916 110.8 50.3 -63.8 -40.4 -6.0 0.8 14.4 171 180 A I H X S+ 0 0 12 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.919 107.6 54.7 -63.7 -42.8 -2.6 -0.9 13.8 172 181 A R H X S+ 0 0 97 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.909 109.9 45.8 -58.5 -42.5 -3.7 -1.5 10.1 173 182 A L H >X S+ 0 0 122 -4,-1.9 3,-1.1 1,-0.2 4,-0.6 0.932 111.8 51.8 -66.4 -43.5 -4.5 2.1 9.6 174 183 A F H 3X S+ 0 0 101 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.881 102.1 61.9 -55.2 -40.5 -1.2 3.2 11.3 175 184 A L H 3X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.708 88.6 71.9 -65.8 -21.8 0.8 0.9 9.0 176 185 A V H S+ 0 0 0 -4,-2.0 5,-2.7 2,-0.2 6,-0.7 0.927 114.9 47.2 -59.8 -42.2 19.8 4.2 1.1 190 199 A T H ><5S+ 0 0 93 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.939 113.1 46.6 -64.3 -51.8 19.6 2.0 -2.0 191 200 A Q H 3<5S+ 0 0 149 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.834 116.1 45.3 -67.3 -27.4 19.7 4.9 -4.4 192 201 A M T 3<5S- 0 0 51 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.419 106.5-123.6 -92.4 2.0 22.7 6.6 -2.6 193 202 A N T < 5S+ 0 0 136 -3,-1.2 -3,-0.2 -4,-0.4 -4,-0.1 0.891 70.9 133.6 51.4 44.4 24.6 3.3 -2.2 194 203 A A < + 0 0 0 -5,-2.7 2,-0.3 -6,-0.2 -4,-0.2 0.389 30.0 109.1-102.4 -3.1 24.7 4.0 1.5 195 204 A E - 0 0 43 -6,-0.7 2,-0.3 -5,-0.1 -112,-0.0 -0.630 49.9-162.0 -79.7 137.5 23.7 0.6 2.7 196 205 A L - 0 0 41 -2,-0.3 -2,-0.1 -119,-0.1 -3,-0.0 -0.786 12.0-161.0-113.8 158.7 26.3 -1.6 4.4 197 206 A N + 0 0 86 -2,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.173 40.1 133.7-131.0 19.0 26.2 -5.3 5.0 198 207 A Y - 0 0 67 1,-0.1 2,-0.3 -68,-0.0 -2,-0.1 -0.329 49.7-126.6 -65.6 153.5 28.7 -6.0 7.7 199 208 A K 0 0 133 -68,-0.1 -68,-0.3 -2,-0.0 -69,-0.1 -0.761 360.0 360.0-102.1 149.6 27.7 -8.2 10.6 200 209 A V 0 0 95 -70,-2.7 -68,-3.0 -2,-0.3 -65,-0.3 -0.856 360.0 360.0-107.1 360.0 27.8 -7.5 14.2