==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID TRANSPORT 28-OCT-05 2EUK . COMPND 2 MOLECULE: GLYCOLIPID TRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.MALININA,M.L.MALAKHOVA,A.T.KANACK,R.ABAGYAN,R.E.BROWN, . 204 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11035.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 72.5 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 . 4 2.0 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 . 1 0.5 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 . 4 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 52.0 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 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 . 2 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 4 A L > 0 0 39 0, 0.0 3,-1.4 0, 0.0 175,-0.1 0.000 360.0 360.0 360.0 -47.3 -1.6 3.8 18.1 2 5 A A T 3 + 0 0 22 1,-0.3 3,-0.4 2,-0.1 174,-0.0 0.337 360.0 74.9 -81.6 7.8 -4.1 5.2 15.7 3 6 A E T 3 S+ 0 0 164 1,-0.2 -1,-0.3 0, 0.0 2,-0.1 0.582 104.4 39.2 -83.9 -17.3 -4.1 8.6 17.5 4 7 A H S < S+ 0 0 86 -3,-1.4 -1,-0.2 22,-0.0 22,-0.1 -0.491 82.8 176.5-133.0 62.5 -0.7 9.3 16.0 5 8 A L - 0 0 77 -3,-0.4 2,-0.2 1,-0.1 174,-0.1 -0.342 32.4-116.3 -66.0 147.3 -0.9 8.0 12.4 6 9 A L - 0 0 11 173,-0.3 176,-0.2 1,-0.1 177,-0.1 -0.576 36.7-104.0 -77.2 152.2 2.1 8.5 10.2 7 10 A K - 0 0 114 -2,-0.2 -1,-0.1 1,-0.1 179,-0.1 -0.420 39.6-101.3 -68.7 151.7 1.4 10.7 7.1 8 11 A P - 0 0 91 0, 0.0 -1,-0.1 0, 0.0 174,-0.1 -0.300 47.7 -92.0 -61.8 158.8 1.0 8.9 3.8 9 12 A L - 0 0 48 -3,-0.1 6,-0.1 1,-0.1 2,-0.0 -0.584 41.0-122.4 -72.1 140.1 4.1 9.1 1.5 10 13 A P > - 0 0 56 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.277 37.1 -92.2 -71.7 168.5 4.1 12.0 -0.9 11 14 A A T 3 S+ 0 0 115 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.796 126.9 52.0 -56.3 -31.6 4.3 11.3 -4.6 12 15 A D T 3 S- 0 0 102 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.367 105.9-126.6 -90.3 5.3 8.1 11.5 -4.6 13 16 A K < + 0 0 88 -3,-1.9 2,-0.4 1,-0.2 -2,-0.1 0.656 59.1 146.5 63.8 21.0 8.5 9.1 -1.7 14 17 A Q - 0 0 62 53,-0.1 2,-0.7 52,-0.0 -1,-0.2 -0.720 41.0-143.6 -89.5 129.3 10.6 11.6 0.2 15 18 A I - 0 0 19 -2,-0.4 52,-2.3 -3,-0.1 2,-0.3 -0.880 11.5-132.4 -97.4 119.3 10.1 11.4 4.0 16 19 A E B > -A 66 0A 90 -2,-0.7 4,-1.8 50,-0.2 50,-0.3 -0.473 13.1-144.4 -68.4 131.7 10.2 14.7 5.8 17 20 A T H > S+ 0 0 0 48,-2.6 4,-2.5 -2,-0.3 5,-0.2 0.897 90.2 52.0 -66.1 -51.6 12.4 14.4 8.9 18 21 A G H > S+ 0 0 19 47,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.963 113.2 41.4 -55.0 -59.5 10.6 16.6 11.3 19 22 A P H > S+ 0 0 47 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.853 114.2 55.0 -57.1 -36.9 7.1 15.1 11.0 20 23 A F H X S+ 0 0 10 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.918 109.2 45.2 -60.3 -50.6 8.6 11.5 10.9 21 24 A L H X S+ 0 0 7 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.920 112.6 52.2 -61.8 -38.9 10.5 12.0 14.2 22 25 A E H < S+ 0 0 109 -4,-2.3 4,-0.3 -5,-0.2 -2,-0.2 0.938 112.0 46.9 -60.8 -45.9 7.4 13.6 15.8 23 26 A A H >< S+ 0 0 10 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.948 114.8 42.5 -60.8 -53.9 5.3 10.6 14.7 24 27 A V H >< S+ 0 0 0 -4,-2.7 3,-1.9 1,-0.3 -1,-0.2 0.723 96.7 76.7 -77.4 -17.2 7.6 7.8 15.9 25 28 A S T 3< S+ 0 0 52 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.658 85.9 66.5 -62.3 -12.3 8.4 9.6 19.1 26 29 A H T < S+ 0 0 47 -3,-1.6 4,-0.3 -4,-0.3 -1,-0.3 0.588 90.4 65.8 -81.4 -9.5 4.9 8.3 20.2 27 30 A L S X S+ 0 0 10 -3,-1.9 3,-1.8 1,-0.1 4,-0.5 0.917 85.2 62.8 -82.9 -44.6 6.1 4.7 20.2 28 31 A P G > S+ 0 0 2 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.825 95.5 63.5 -52.5 -40.0 8.7 4.4 23.0 29 32 A P G > S+ 0 0 66 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.782 88.6 68.7 -54.1 -28.5 6.0 5.3 25.6 30 33 A F G X S+ 0 0 57 -3,-1.8 3,-1.1 -4,-0.3 -3,-0.1 0.792 89.9 65.6 -59.5 -27.5 4.1 2.1 24.7 31 34 A F G X S+ 0 0 28 -3,-1.6 3,-0.7 -4,-0.5 5,-0.4 0.661 90.9 61.8 -68.1 -21.9 7.0 0.2 26.3 32 35 A D G < S+ 0 0 99 -3,-1.5 3,-0.3 -4,-0.3 -1,-0.2 0.639 101.8 54.7 -73.8 -16.1 6.2 1.6 29.8 33 36 A C G < S+ 0 0 83 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.242 80.7 86.4-103.7 8.0 2.8 -0.1 29.6 34 37 A L S < S- 0 0 27 -3,-0.7 -1,-0.2 2,-0.2 -2,-0.1 0.392 97.6-119.3 -92.3 -1.4 4.0 -3.7 29.0 35 38 A G S S+ 0 0 76 -3,-0.3 -2,-0.1 1,-0.1 -3,-0.1 0.702 74.9 97.9 78.5 27.0 4.4 -4.4 32.7 36 39 A S > - 0 0 30 -5,-0.4 3,-1.5 1,-0.1 -2,-0.2 -0.977 64.4-145.2-151.1 135.1 8.1 -5.2 32.8 37 40 A P G > S+ 0 0 107 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.634 96.1 81.6 -65.1 -16.5 11.5 -3.5 33.6 38 41 A V G 3 S+ 0 0 61 1,-0.2 4,-0.4 2,-0.1 110,-0.1 0.853 86.2 59.0 -57.6 -28.3 12.9 -5.7 30.9 39 42 A F G <> S+ 0 0 26 -3,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.613 80.8 86.7 -79.3 -9.4 11.6 -3.0 28.5 40 43 A T H <> S+ 0 0 89 -3,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.928 91.9 41.8 -61.8 -46.0 13.5 -0.1 29.9 41 44 A P H > S+ 0 0 88 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.761 113.1 55.6 -72.2 -21.7 16.7 -0.6 27.9 42 45 A I H > S+ 0 0 64 -4,-0.4 4,-2.1 2,-0.2 5,-0.2 0.941 108.5 46.9 -69.7 -50.6 14.6 -1.3 24.7 43 46 A K H X S+ 0 0 66 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.911 111.0 53.4 -53.0 -45.4 12.8 1.9 25.2 44 47 A A H X S+ 0 0 61 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.828 108.1 50.2 -63.7 -38.7 16.3 3.7 25.7 45 48 A D H X S+ 0 0 88 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.953 115.3 40.8 -60.3 -51.3 17.7 2.2 22.5 46 49 A I H X S+ 0 0 12 -4,-2.1 4,-2.1 1,-0.2 3,-0.3 0.963 120.1 44.0 -68.3 -52.8 14.8 3.3 20.3 47 50 A S H X S+ 0 0 37 -4,-2.9 4,-2.8 -5,-0.2 -1,-0.2 0.880 110.1 57.7 -57.8 -41.7 14.4 6.7 22.0 48 51 A G H X S+ 0 0 28 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.873 107.4 46.8 -57.7 -40.3 18.2 7.2 21.9 49 52 A N H X S+ 0 0 9 -4,-1.9 4,-2.1 -3,-0.3 -2,-0.2 0.910 110.7 51.2 -69.3 -43.0 18.2 6.8 18.1 50 53 A I H X S+ 0 0 13 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.941 111.8 48.7 -52.8 -50.6 15.3 9.2 17.6 51 54 A T H X S+ 0 0 94 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.917 108.8 53.0 -55.1 -42.5 17.2 11.7 19.8 52 55 A K H X S+ 0 0 129 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.866 114.2 42.6 -60.3 -41.6 20.5 11.2 17.8 53 56 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 3,-0.4 0.939 111.9 52.8 -73.2 -46.5 18.6 11.9 14.5 54 57 A K H X S+ 0 0 88 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.883 107.3 54.3 -56.3 -40.1 16.6 14.9 16.0 55 58 A A H X S+ 0 0 55 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.2 0.846 109.4 45.3 -68.4 -33.7 19.9 16.4 17.2 56 59 A V H >X S+ 0 0 29 -4,-1.2 3,-1.0 -3,-0.4 4,-0.8 0.933 114.8 50.1 -67.4 -49.2 21.5 16.2 13.6 57 60 A Y H >< S+ 0 0 49 -4,-2.8 3,-1.2 1,-0.2 7,-0.3 0.921 104.3 58.4 -50.5 -48.3 18.2 17.7 12.1 58 61 A D H 3< S+ 0 0 85 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.740 96.5 62.4 -62.5 -25.5 18.1 20.5 14.7 59 62 A T H << S- 0 0 110 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.847 130.3 -0.3 -68.7 -33.0 21.6 21.8 13.5 60 63 A N 4 S+ 0 0 46 1,-0.2 3,-1.4 2,-0.2 4,-0.2 0.944 113.5 43.8 -66.5 -47.5 16.6 22.9 5.8 63 66 A K T 34 S+ 0 0 86 1,-0.3 3,-0.2 -6,-0.1 -1,-0.2 0.795 122.8 39.6 -65.9 -30.6 19.7 20.8 4.9 64 67 A F T 3< S+ 0 0 3 -4,-2.2 -1,-0.3 -7,-0.3 -47,-0.3 -0.048 77.4 131.4-105.8 30.3 18.2 17.8 6.8 65 68 A R S < S+ 0 0 148 -3,-1.4 -48,-2.6 -48,-0.1 -47,-0.5 0.838 73.2 25.7 -52.0 -43.2 14.6 18.4 5.5 66 69 A T B > S-A 16 0A 17 -50,-0.3 4,-1.8 -3,-0.2 -50,-0.2 -0.818 81.9-114.4-120.3 165.2 14.1 14.8 4.5 67 70 A L H > S+ 0 0 1 -52,-2.3 4,-1.7 -2,-0.3 5,-0.2 0.887 120.4 55.7 -66.4 -39.2 15.6 11.4 5.6 68 71 A Q H > S+ 0 0 42 -53,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.918 103.2 54.8 -52.3 -48.1 17.2 11.2 2.1 69 72 A N H > S+ 0 0 35 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.912 105.2 55.5 -53.7 -45.1 18.8 14.6 2.7 70 73 A I H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.934 109.7 42.7 -53.5 -54.2 20.4 13.1 5.9 71 74 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.898 118.0 45.1 -62.7 -45.3 22.1 10.1 4.3 72 75 A E H X S+ 0 0 81 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.926 114.8 46.8 -70.6 -43.5 23.4 12.1 1.3 73 76 A V H X S+ 0 0 28 -4,-3.0 4,-2.9 -5,-0.2 -2,-0.2 0.899 114.9 47.4 -59.0 -44.4 24.6 15.1 3.3 74 77 A E H X S+ 0 0 1 -4,-2.3 4,-2.8 -5,-0.3 5,-0.4 0.906 107.0 56.0 -71.1 -39.5 26.3 12.8 5.8 75 78 A K H X S+ 0 0 111 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.2 0.931 115.7 39.0 -51.7 -48.5 27.9 10.7 3.0 76 79 A E H < S+ 0 0 166 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.888 117.8 49.7 -67.2 -41.9 29.5 14.0 1.7 77 80 A M H < S+ 0 0 92 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.827 120.0 32.0 -71.7 -32.3 30.2 15.4 5.2 78 81 A Y H >< S- 0 0 82 -4,-2.8 3,-1.0 1,-0.2 2,-0.3 0.682 76.5-172.6-107.1 -24.1 32.0 12.3 6.6 79 82 A G G >< S+ 0 0 46 -4,-1.6 3,-1.1 -5,-0.4 -1,-0.2 -0.465 71.3 10.7 68.0-123.0 33.8 10.5 3.8 80 83 A A G 3 S+ 0 0 96 -2,-0.3 -1,-0.2 1,-0.3 -5,-0.0 0.596 122.7 60.1 -74.8 -16.9 35.3 7.1 4.8 81 84 A E G X S+ 0 0 116 -3,-1.0 3,-0.7 -6,-0.1 -1,-0.3 0.696 87.0 130.7 -88.0 -18.3 33.6 6.7 8.2 82 85 A W T < + 0 0 27 -3,-1.1 4,-0.1 1,-0.3 -7,-0.0 -0.567 58.6 24.0 -76.2 141.2 30.2 6.8 6.6 83 86 A P T 3 S+ 0 0 18 0, 0.0 2,-1.7 0, 0.0 -1,-0.3 -0.979 116.0 64.7 -89.0 -0.4 27.6 5.0 6.9 84 87 A K S < S+ 0 0 111 -3,-0.7 2,-0.3 4,-0.1 -2,-0.1 -0.229 99.4 71.0 -76.6 49.6 28.8 3.9 10.4 85 88 A V S > S- 0 0 25 -2,-1.7 4,-2.1 0, 0.0 3,-0.4 -0.983 84.6 -10.6-157.2 156.4 28.4 7.5 11.7 86 89 A G H > S- 0 0 33 -2,-0.3 4,-1.6 2,-0.2 3,-0.2 0.066 112.6 -20.5 61.3-151.2 26.0 10.2 12.7 87 90 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.799 132.0 65.4 -67.0 -28.9 22.2 10.2 12.1 88 91 A T H > S+ 0 0 0 -3,-0.4 4,-1.6 -18,-0.2 -2,-0.2 0.929 105.3 43.6 -55.7 -46.8 22.8 7.6 9.3 89 92 A L H X S+ 0 0 39 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.919 113.7 49.6 -65.7 -42.7 23.9 5.1 11.9 90 93 A A H X S+ 0 0 2 -4,-1.6 4,-2.8 1,-0.2 3,-0.2 0.906 112.5 47.4 -64.4 -46.6 21.2 5.9 14.3 91 94 A L H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.804 104.7 61.1 -60.6 -31.7 18.5 5.6 11.6 92 95 A M H X S+ 0 0 0 -4,-1.6 4,-0.7 -5,-0.2 -1,-0.2 0.887 114.3 35.3 -64.7 -40.4 20.0 2.3 10.5 93 96 A W H X S+ 0 0 30 -4,-1.5 4,-2.0 -3,-0.2 -2,-0.2 0.826 114.4 56.7 -81.8 -33.7 19.2 0.9 13.9 94 97 A L H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.947 103.4 54.6 -59.9 -43.2 16.0 2.8 14.4 95 98 A K H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 -1,-0.2 0.870 106.6 51.9 -59.5 -36.1 14.5 1.3 11.3 96 99 A R H X S+ 0 0 0 -4,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.889 110.2 47.4 -71.7 -38.7 15.2 -2.2 12.6 97 100 A G H X S+ 0 0 11 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.923 114.7 47.7 -64.8 -41.7 13.4 -1.4 15.9 98 101 A L H X S+ 0 0 2 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.928 110.7 50.8 -62.0 -44.5 10.5 0.1 13.8 99 102 A R H X S+ 0 0 51 -4,-3.2 4,-2.6 1,-0.2 5,-0.3 0.884 106.9 55.7 -61.5 -41.0 10.5 -3.0 11.5 100 103 A F H X S+ 0 0 39 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.954 109.3 45.2 -54.1 -51.1 10.4 -5.2 14.6 101 104 A I H X S+ 0 0 19 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.912 113.9 51.8 -60.8 -41.0 7.2 -3.3 15.9 102 105 A Q H X S+ 0 0 20 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.936 111.1 43.3 -58.4 -52.7 5.8 -3.6 12.4 103 106 A V H X S+ 0 0 16 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.901 115.8 50.9 -63.9 -43.2 6.2 -7.3 11.9 104 107 A F H X S+ 0 0 19 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.964 113.2 42.9 -60.6 -53.8 5.0 -8.0 15.4 105 108 A L H X S+ 0 0 5 -4,-2.9 4,-2.8 -5,-0.2 -2,-0.2 0.921 115.3 49.8 -59.4 -44.6 1.9 -6.0 15.1 106 109 A Q H X S+ 0 0 63 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.892 108.9 52.6 -60.8 -44.2 1.1 -7.3 11.6 107 110 A S H <>S+ 0 0 1 -4,-2.8 5,-2.1 2,-0.2 -1,-0.2 0.892 111.0 47.5 -54.6 -45.8 1.6 -10.9 12.8 108 111 A I H ><5S+ 0 0 6 -4,-2.2 3,-1.7 -5,-0.2 -2,-0.2 0.969 113.5 47.2 -62.2 -50.9 -0.9 -10.3 15.6 109 112 A C H 3<5S+ 0 0 6 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.818 105.8 58.7 -59.0 -35.5 -3.4 -8.7 13.2 110 113 A D T 3<5S- 0 0 93 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.472 115.1-116.9 -77.6 -0.2 -3.0 -11.6 10.7 111 114 A G T < 5 + 0 0 29 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.746 55.1 163.1 71.4 23.7 -4.1 -14.0 13.5 112 115 A E < + 0 0 63 -5,-2.1 2,-0.3 -6,-0.2 -1,-0.2 -0.601 15.0 149.1 -73.5 136.7 -0.8 -15.9 13.6 113 116 A R - 0 0 130 -2,-0.3 2,-0.7 10,-0.1 3,-0.1 -0.953 56.0 -99.0-159.0 163.8 -0.7 -17.8 16.9 114 117 A D B > -B 117 0B 55 3,-0.5 3,-0.9 -2,-0.3 6,-0.2 -0.919 31.1-150.9 -90.6 113.8 0.6 -21.0 18.6 115 118 A E T 3 S+ 0 0 140 -2,-0.7 -1,-0.2 1,-0.3 0, 0.0 0.886 97.3 50.4 -54.7 -38.5 -2.5 -23.3 18.5 116 119 A N T 3 S+ 0 0 132 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.700 124.3 27.5 -71.6 -25.6 -1.2 -24.9 21.7 117 120 A H B X S+B 114 0B 104 -3,-0.9 3,-1.4 1,-0.1 -3,-0.5 -0.572 74.9 166.5-137.3 69.4 -0.7 -21.6 23.5 118 121 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.734 70.1 53.0 -66.2 -30.6 -3.3 -19.3 21.9 119 122 A N T 3 S+ 0 0 59 36,-0.1 36,-3.4 -6,-0.1 37,-0.3 0.275 92.3 92.7 -93.6 12.5 -3.2 -16.4 24.4 120 123 A L < - 0 0 43 -3,-1.4 -6,-0.2 34,-0.3 34,-0.1 -0.580 59.5-156.7 -97.2 161.7 0.6 -15.9 24.2 121 124 A I > + 0 0 5 32,-0.4 4,-2.2 -2,-0.2 5,-0.2 0.103 63.4 108.8-124.1 18.5 2.4 -13.6 21.8 122 125 A R H > S+ 0 0 77 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.870 77.4 50.8 -65.7 -37.6 5.7 -15.4 21.8 123 126 A V H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.877 111.2 49.3 -67.8 -36.4 5.4 -16.7 18.3 124 127 A N H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.915 114.4 44.3 -68.9 -41.7 4.6 -13.1 17.0 125 128 A A H X S+ 0 0 9 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.924 111.6 53.0 -70.1 -45.2 7.6 -11.6 18.9 126 129 A T H X S+ 0 0 41 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.911 109.9 48.5 -54.9 -46.4 9.9 -14.5 17.8 127 130 A K H X S+ 0 0 71 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.922 112.2 49.0 -57.8 -47.8 8.9 -13.9 14.1 128 131 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.4 0.931 112.0 49.0 -60.1 -45.8 9.5 -10.1 14.4 129 132 A Y H X>S+ 0 0 10 -4,-3.2 5,-2.7 1,-0.2 4,-2.5 0.955 112.3 47.8 -56.9 -52.4 12.9 -10.7 16.1 130 133 A E H <5S+ 0 0 108 -4,-2.6 5,-0.4 1,-0.2 -1,-0.2 0.908 117.4 42.2 -57.1 -41.2 14.0 -13.2 13.3 131 134 A M H <5S+ 0 0 110 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.839 129.4 20.9 -79.9 -30.8 12.9 -10.8 10.6 132 135 A A H <5S+ 0 0 3 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.739 133.0 10.8-108.6 -34.0 14.1 -7.5 11.9 133 136 A L T ><5S+ 0 0 30 -4,-2.5 3,-2.6 -5,-0.4 -3,-0.2 0.771 95.4 83.6-119.9 -43.3 16.9 -7.9 14.5 134 137 A K G > - 0 0 20 67,-2.8 4,-2.2 -2,-0.4 5,-0.2 -0.155 44.4 -85.6 -70.0 179.1 25.7 -12.1 18.3 139 142 A W H > S+ 0 0 196 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.821 123.8 55.9 -66.0 -32.5 25.0 -15.1 20.4 140 143 A I H > S+ 0 0 105 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.947 110.0 43.5 -64.0 -49.0 24.9 -13.3 23.7 141 144 A V H > S+ 0 0 47 64,-0.4 4,-2.9 2,-0.2 5,-0.2 0.918 111.6 55.8 -65.4 -39.7 22.3 -10.7 22.8 142 145 A Q H X S+ 0 0 43 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.934 107.0 50.1 -56.1 -43.9 20.2 -13.5 21.1 143 146 A K H X S+ 0 0 121 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.877 108.8 51.5 -60.8 -39.8 20.3 -15.4 24.4 144 147 A I H X S+ 0 0 105 -4,-1.8 4,-2.9 2,-0.2 3,-0.4 0.908 107.6 53.0 -63.3 -42.9 19.1 -12.2 26.2 145 148 A F H X S+ 0 0 38 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.936 105.8 54.0 -56.1 -44.3 16.2 -11.9 23.7 146 149 A Q H < S+ 0 0 84 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.826 112.8 43.7 -60.1 -30.8 15.3 -15.5 24.5 147 150 A A H >< S+ 0 0 67 -4,-1.1 3,-1.3 -3,-0.4 -1,-0.2 0.894 111.7 51.8 -79.1 -42.7 15.1 -14.6 28.2 148 151 A A H >< S+ 0 0 24 -4,-2.9 3,-2.6 1,-0.3 4,-0.3 0.799 93.4 74.9 -67.1 -27.0 13.3 -11.3 27.7 149 152 A L G >< 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H X S+ 0 0 5 -4,-2.1 4,-0.6 1,-0.2 3,-0.4 0.910 109.7 54.1 -77.3 -40.4 -4.4 -5.6 23.4 160 163 A K H >< S+ 0 0 135 -4,-1.8 3,-1.1 -5,-0.3 -1,-0.2 0.896 105.6 55.4 -53.8 -43.9 -6.3 -4.3 26.4 161 164 A A H 3< S+ 0 0 53 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.803 106.1 49.5 -62.3 -32.5 -3.2 -2.2 27.2 162 165 A L H 3< 0 0 33 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.565 360.0 360.0 -80.7 -9.3 -3.3 -0.6 23.7 163 166 A S << 0 0 51 -3,-1.1 -3,-0.1 -4,-0.6 3,-0.1 0.163 360.0 360.0-125.7 360.0 -7.1 0.1 24.4 164 ! 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 0.0 165 169 A Q 0 0 103 0, 0.0 2,-0.6 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 160.4 -11.2 3.2 25.7 166 170 A N + 0 0 166 -3,-0.1 2,-0.3 2,-0.0 -6,-0.0 -0.899 360.0 140.5-114.2 99.2 -13.7 0.5 26.2 167 171 A V - 0 0 69 -2,-0.6 -4,-0.1 -7,-0.1 2,-0.0 -0.920 52.6-102.5-142.6 148.7 -13.5 -1.3 22.8 168 172 A T > - 0 0 84 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.346 33.4-111.3 -76.3 164.6 -13.6 -5.0 21.7 169 173 A E H > S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.879 121.0 55.0 -57.4 -38.4 -10.5 -6.8 20.8 170 174 A E H > S+ 0 0 135 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 108.6 48.0 -64.5 -44.1 -11.7 -6.9 17.2 171 175 A E H > S+ 0 0 74 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.925 110.4 52.0 -57.5 -49.6 -12.1 -3.1 17.2 172 176 A C H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 3,-0.3 0.938 110.3 47.9 -53.4 -51.4 -8.6 -2.7 18.7 173 177 A L H X S+ 0 0 20 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.866 106.9 56.4 -61.0 -39.9 -7.1 -4.9 16.0 174 178 A E H X S+ 0 0 107 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.896 108.8 47.8 -59.7 -35.3 -8.9 -2.9 13.3 175 179 A K H X S+ 0 0 104 -4,-1.8 4,-2.5 -3,-0.3 -2,-0.2 0.866 109.2 52.5 -73.7 -35.5 -7.3 0.3 14.6 176 180 A I H X S+ 0 0 4 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.918 107.4 53.0 -60.3 -45.1 -3.9 -1.4 14.7 177 181 A R H X S+ 0 0 84 -4,-2.8 4,-0.7 2,-0.2 -2,-0.2 0.890 107.3 51.9 -54.4 -42.9 -4.5 -2.4 11.0 178 182 A L H >X S+ 0 0 86 -4,-1.6 3,-1.2 1,-0.2 4,-0.6 0.952 110.7 47.6 -59.0 -55.1 -5.2 1.3 10.2 179 183 A F H 3X S+ 0 0 3 -4,-2.5 4,-1.6 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0.254 39.9 138.2-115.7 13.3 25.5 -6.1 8.6 203 207 A Y - 0 0 67 1,-0.1 2,-0.2 -66,-0.0 -2,-0.1 -0.262 47.8-131.3 -54.7 143.5 27.9 -6.0 11.6 204 208 A K 0 0 128 -67,-0.1 -67,-0.3 1,-0.0 -68,-0.1 -0.660 360.0 360.0 -94.6 155.9 26.6 -7.9 14.6 205 209 A V 0 0 104 -69,-2.0 -67,-2.8 -2,-0.2 -64,-0.4 -0.844 360.0 360.0-111.4 360.0 26.5 -6.6 18.2