==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID TRANSPORT 13-APR-11 3RIC . COMPND 2 MOLECULE: GLYCOLIPID TRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.SAMYGINA,B.OCHOA-LIZARRALDE,D.J.PATEL,R.E.BROWN,L.MALININA . 207 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11270.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 72.0 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 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 51.2 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 0 0 2 0 0 2 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 1 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 3 A L > 0 0 83 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 96.0 3.2 4.1 -21.4 2 4 A L G > + 0 0 17 161,-0.4 3,-1.7 1,-0.3 176,-0.1 0.894 360.0 52.5 -61.7 -51.5 1.4 3.3 -18.1 3 5 A A G 3 S+ 0 0 26 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.322 93.2 74.0 -77.9 9.7 3.9 4.7 -15.6 4 6 A E G < S+ 0 0 130 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.539 104.1 41.2 -88.5 -12.6 4.0 8.1 -17.4 5 7 A H S < S+ 0 0 78 -3,-1.7 -1,-0.2 -4,-0.2 22,-0.1 -0.396 82.9 174.9-129.0 58.1 0.5 8.8 -15.9 6 8 A L - 0 0 80 -3,-0.4 2,-0.2 1,-0.1 175,-0.1 -0.207 34.4-112.5 -57.0 147.6 0.7 7.4 -12.4 7 9 A L - 0 0 10 174,-0.3 177,-0.2 1,-0.1 178,-0.1 -0.619 38.2 -99.4 -76.8 149.4 -2.3 8.0 -10.2 8 10 A K - 0 0 114 -2,-0.2 180,-0.1 1,-0.1 -1,-0.1 -0.256 42.9-101.7 -53.3 152.2 -1.9 10.4 -7.3 9 11 A P - 0 0 93 0, 0.0 -1,-0.1 0, 0.0 175,-0.0 -0.399 43.6 -95.3 -72.3 157.9 -1.2 8.8 -3.9 10 12 A L - 0 0 49 -3,-0.1 2,-0.1 -2,-0.1 6,-0.1 -0.509 38.7-126.5 -66.0 139.8 -4.1 8.6 -1.5 11 13 A P > - 0 0 59 0, 0.0 3,-2.2 0, 0.0 -1,-0.0 -0.469 32.5 -96.8 -76.7 166.7 -4.3 11.5 1.0 12 14 A A T 3 S+ 0 0 110 1,-0.3 -2,-0.1 -2,-0.1 0, 0.0 0.848 126.8 51.2 -50.2 -42.5 -4.5 10.8 4.7 13 15 A D T 3 S- 0 0 106 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.395 106.2-129.6 -82.6 3.0 -8.3 11.2 4.6 14 16 A K < + 0 0 133 -3,-2.2 2,-0.4 1,-0.2 -2,-0.1 0.633 56.2 146.8 59.0 20.1 -8.6 8.7 1.7 15 17 A Q - 0 0 67 53,-0.0 2,-0.6 52,-0.0 -1,-0.2 -0.706 40.6-142.6 -85.9 133.9 -10.8 11.1 -0.3 16 18 A I - 0 0 20 -2,-0.4 52,-1.8 -3,-0.1 2,-0.3 -0.859 11.5-131.0-105.5 116.5 -10.3 11.0 -4.1 17 19 A E B > -A 67 0A 93 -2,-0.6 4,-1.9 50,-0.2 50,-0.3 -0.522 14.8-144.4 -66.2 128.9 -10.4 14.2 -6.1 18 20 A T H > S+ 0 0 0 48,-2.5 4,-2.6 -2,-0.3 5,-0.2 0.870 90.9 52.0 -63.5 -47.7 -12.7 13.7 -9.0 19 21 A G H > S+ 0 0 19 47,-0.4 4,-2.5 2,-0.2 5,-0.2 0.968 112.8 43.4 -57.3 -62.4 -11.0 15.9 -11.6 20 22 A P H > S+ 0 0 48 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.879 114.0 52.2 -47.5 -49.4 -7.5 14.3 -11.2 21 23 A F H X S+ 0 0 9 -4,-1.9 4,-2.7 2,-0.2 5,-0.3 0.916 110.8 45.9 -51.9 -55.1 -8.9 10.8 -11.1 22 24 A L H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.905 112.1 51.8 -58.5 -43.1 -10.9 11.2 -14.3 23 25 A E H < S+ 0 0 108 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.893 112.1 47.2 -62.5 -37.6 -7.9 12.7 -16.0 24 26 A A H >< S+ 0 0 11 -4,-2.1 3,-1.4 -5,-0.2 -2,-0.2 0.936 114.1 43.2 -67.3 -50.7 -5.7 9.8 -14.9 25 27 A V H >< S+ 0 0 1 -4,-2.7 3,-2.0 1,-0.3 -1,-0.2 0.752 95.5 77.4 -76.8 -16.8 -8.0 7.0 -15.9 26 28 A S T 3< S+ 0 0 49 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.631 86.3 64.0 -64.0 -10.9 -8.9 8.6 -19.2 27 29 A H T <> S+ 0 0 54 -3,-1.4 4,-0.6 -4,-0.2 -1,-0.3 0.578 93.3 67.3 -84.4 -9.8 -5.4 7.4 -20.5 28 30 A L T X4 S+ 0 0 8 -3,-2.0 3,-0.8 -4,-0.2 4,-0.5 0.922 85.9 59.6 -80.7 -47.7 -6.5 3.8 -20.1 29 31 A P G >4 S+ 0 0 1 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.860 96.1 62.0 -58.2 -33.7 -9.2 3.3 -22.6 30 32 A P G >4 S+ 0 0 67 0, 0.0 3,-3.7 0, 0.0 4,-0.2 0.910 86.8 73.9 -55.8 -39.2 -7.0 4.1 -25.7 31 33 A F G X< S+ 0 0 49 -3,-0.8 3,-1.9 -4,-0.6 -3,-0.1 0.755 83.1 71.2 -41.4 -30.5 -4.7 1.1 -24.9 32 34 A F G < S+ 0 0 28 -3,-1.6 3,-0.5 -4,-0.5 -1,-0.3 0.612 87.8 63.5 -67.5 -10.6 -7.5 -1.1 -26.1 33 35 A D G < S+ 0 0 78 -3,-3.7 -1,-0.3 1,-0.2 -2,-0.2 0.359 100.6 51.4 -93.3 3.9 -6.8 0.1 -29.7 34 36 A C S < S+ 0 0 86 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.086 78.1 94.6-126.0 18.7 -3.2 -1.4 -29.7 35 37 A L S S- 0 0 30 -3,-0.5 -2,-0.1 2,-0.2 -1,-0.1 0.404 101.8-104.2 -90.4 -3.6 -4.1 -5.0 -28.6 36 38 A G S S+ 0 0 78 1,-0.1 -3,-0.1 -3,-0.1 -4,-0.0 0.371 86.7 73.0 106.3 0.4 -4.2 -6.2 -32.2 37 39 A S S > S- 0 0 32 -5,-0.3 3,-1.3 1,-0.1 -2,-0.2 -0.999 70.2-131.7-149.4 143.8 -7.9 -6.5 -33.0 38 40 A P G > S+ 0 0 108 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.592 96.4 86.9 -67.1 -10.8 -11.1 -4.5 -33.7 39 41 A V G 3 S+ 0 0 67 1,-0.2 4,-0.2 2,-0.1 110,-0.1 0.763 87.5 51.8 -60.1 -21.7 -12.8 -6.7 -31.1 40 42 A F G X> S+ 0 0 17 -3,-1.3 4,-2.3 -8,-0.2 3,-0.5 0.596 84.3 83.7 -91.5 -13.1 -11.5 -4.3 -28.4 41 43 A T H <> S+ 0 0 49 -3,-1.1 4,-2.1 1,-0.3 5,-0.2 0.950 88.9 53.5 -59.3 -50.2 -12.8 -1.0 -29.9 42 44 A P H 3> S+ 0 0 84 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.837 108.0 54.1 -51.3 -27.8 -16.3 -1.5 -28.4 43 45 A I H <> S+ 0 0 61 -3,-0.5 4,-1.9 -4,-0.2 5,-0.3 0.924 103.6 52.1 -74.6 -46.1 -14.5 -2.0 -25.1 44 46 A K H X S+ 0 0 51 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.923 112.5 49.0 -44.3 -49.8 -12.6 1.3 -25.3 45 47 A D H X S+ 0 0 87 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.843 106.7 53.8 -70.2 -30.2 -16.0 2.9 -25.9 46 48 A V H X S+ 0 0 100 -4,-1.6 4,-1.3 -5,-0.2 -1,-0.2 0.930 114.7 40.0 -70.2 -45.8 -17.8 1.2 -23.0 47 49 A I H X S+ 0 0 15 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.886 114.8 52.2 -72.3 -39.7 -15.2 2.4 -20.4 48 50 A S H X S+ 0 0 36 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.905 104.9 57.5 -59.4 -45.3 -14.8 5.8 -22.0 49 51 A G H X S+ 0 0 37 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.840 105.7 49.6 -51.1 -41.3 -18.6 6.2 -21.8 50 52 A N H X S+ 0 0 33 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.916 113.0 46.7 -64.2 -42.5 -18.4 5.6 -18.0 51 53 A I H X S+ 0 0 14 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.879 111.2 51.8 -64.4 -42.7 -15.7 8.3 -17.7 52 54 A T H X S+ 0 0 93 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.898 108.6 51.0 -62.6 -44.1 -17.6 10.7 -19.9 53 55 A K H X S+ 0 0 101 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.911 111.1 47.0 -59.0 -51.5 -20.8 10.4 -17.8 54 56 A I H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.927 114.5 47.8 -55.9 -46.2 -18.9 11.0 -14.5 55 57 A K H X S+ 0 0 92 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.906 107.6 56.1 -63.1 -41.1 -17.1 14.1 -16.1 56 58 A A H < S+ 0 0 54 -4,-2.6 4,-0.5 2,-0.2 -1,-0.2 0.930 112.6 41.2 -58.2 -45.4 -20.5 15.4 -17.5 57 59 A V H >X S+ 0 0 20 -4,-1.8 3,-1.0 1,-0.2 4,-0.9 0.894 114.6 52.2 -66.9 -44.7 -22.0 15.4 -13.9 58 60 A Y H >< S+ 0 0 46 -4,-2.8 3,-0.6 1,-0.2 7,-0.3 0.871 103.9 58.6 -55.9 -40.1 -18.7 16.8 -12.4 59 61 A D T 3< S+ 0 0 81 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.653 94.0 65.0 -69.4 -18.9 -18.8 19.6 -15.0 60 62 A T T <4 S- 0 0 108 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.896 130.1 -4.9 -70.4 -37.5 -22.2 20.8 -13.8 61 63 A N 4 S+ 0 0 46 2,-0.2 3,-1.0 1,-0.2 4,-0.2 0.916 111.9 45.4 -72.4 -43.9 -17.1 22.1 -6.0 64 66 A K T 34 S+ 0 0 92 1,-0.2 3,-0.2 2,-0.1 -1,-0.2 0.827 124.1 36.3 -63.1 -32.6 -20.2 20.1 -5.2 65 67 A F T 3< S+ 0 0 3 -4,-2.0 -1,-0.2 -7,-0.3 -47,-0.2 0.049 78.0 130.4-110.9 27.4 -18.6 17.0 -6.9 66 68 A R S < S+ 0 0 134 -3,-1.0 -48,-2.5 -48,-0.1 -47,-0.4 0.740 74.1 27.5 -52.4 -37.7 -15.0 17.7 -5.9 67 69 A T B > S-A 17 0A 17 -50,-0.3 4,-1.7 -3,-0.2 -50,-0.2 -0.859 83.7-114.2-125.2 163.9 -14.4 14.2 -4.6 68 70 A L H > S+ 0 0 1 -52,-1.8 4,-1.8 -2,-0.3 5,-0.1 0.792 118.6 55.5 -67.4 -32.7 -15.9 10.7 -5.6 69 71 A Q H > S+ 0 0 42 -53,-0.2 4,-2.3 2,-0.2 5,-0.3 0.880 103.7 55.6 -65.1 -39.4 -17.5 10.5 -2.1 70 72 A N H > S+ 0 0 35 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.919 104.9 53.4 -58.1 -45.1 -19.1 13.8 -2.8 71 73 A I H X S+ 0 0 0 -4,-1.7 4,-2.2 -6,-0.2 5,-0.2 0.932 110.7 44.8 -57.1 -50.3 -20.7 12.4 -5.9 72 74 A L H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.927 117.2 42.8 -61.8 -47.7 -22.2 9.4 -4.1 73 75 A E H X S+ 0 0 81 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.843 115.0 49.8 -70.2 -33.8 -23.6 11.4 -1.1 74 76 A V H X S+ 0 0 30 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.942 113.5 45.2 -70.2 -43.2 -24.9 14.2 -3.3 75 77 A E H X S+ 0 0 1 -4,-2.2 4,-2.3 -5,-0.3 5,-0.3 0.792 105.6 60.1 -72.6 -35.4 -26.7 11.9 -5.7 76 78 A K H X S+ 0 0 99 -4,-2.0 4,-1.2 -5,-0.2 -1,-0.2 0.923 112.3 41.1 -51.2 -45.9 -28.1 9.8 -2.9 77 79 A E H < S+ 0 0 163 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.864 116.0 49.8 -69.2 -40.8 -29.8 13.1 -1.8 78 80 A M H < S+ 0 0 102 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.817 121.6 29.3 -67.0 -37.3 -30.7 14.2 -5.4 79 81 A Y H >< S- 0 0 91 -4,-2.3 3,-1.9 1,-0.2 2,-0.4 0.470 77.2-173.3-111.9 -9.5 -32.4 11.0 -6.5 80 82 A G T 3< S+ 0 0 49 -4,-1.2 3,-0.4 -5,-0.3 -1,-0.2 -0.259 74.6 10.7 56.0-108.9 -33.8 9.3 -3.5 81 83 A A T 3 S+ 0 0 101 -2,-0.4 -1,-0.3 1,-0.2 -5,-0.0 0.619 123.3 60.1 -91.9 -13.0 -35.1 5.9 -4.4 82 84 A E S X S+ 0 0 136 -3,-1.9 3,-0.9 -6,-0.1 -1,-0.2 0.653 88.7 126.6 -81.7 -20.4 -33.7 5.6 -7.9 83 85 A W T 3 + 0 0 21 -3,-0.4 4,-0.1 1,-0.3 -7,-0.0 -0.587 57.9 28.9 -73.8 141.3 -30.2 5.9 -6.4 84 86 A P T 3 S+ 0 0 18 0, 0.0 2,-1.4 0, 0.0 -1,-0.3 -0.972 115.8 63.4 -87.7 3.2 -27.7 4.1 -6.6 85 87 A K S < S+ 0 0 108 -3,-0.9 2,-0.3 4,-0.1 -2,-0.1 -0.339 98.3 69.2 -87.2 55.9 -28.8 3.0 -10.1 86 88 A V S > S- 0 0 25 -2,-1.4 4,-1.7 1,-0.0 3,-0.5 -0.981 85.4 -8.3-157.8 161.7 -28.6 6.5 -11.6 87 89 A G H > S- 0 0 15 -2,-0.3 4,-1.7 1,-0.2 3,-0.3 0.058 113.7 -20.3 56.5-152.5 -26.2 9.3 -12.7 88 90 A A H > S+ 0 0 1 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.770 130.9 65.7 -64.8 -27.6 -22.5 9.3 -12.0 89 91 A T H > S+ 0 0 0 -3,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.902 105.8 42.5 -62.1 -42.4 -22.9 6.8 -9.2 90 92 A L H X S+ 0 0 41 -4,-1.7 4,-1.5 -3,-0.3 -1,-0.2 0.866 113.8 52.2 -69.2 -40.7 -24.0 4.1 -11.6 91 93 A A H X S+ 0 0 7 -4,-1.7 4,-2.8 1,-0.2 3,-0.4 0.962 113.7 43.5 -61.0 -48.4 -21.2 5.1 -14.2 92 94 A L H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.788 106.4 62.0 -68.7 -26.1 -18.6 4.8 -11.4 93 95 A M H < S+ 0 0 0 -4,-1.4 4,-0.5 -5,-0.2 -1,-0.2 0.868 113.8 35.4 -61.6 -41.1 -20.1 1.6 -10.2 94 96 A W H >X S+ 0 0 44 -4,-1.5 4,-1.6 -3,-0.4 3,-0.5 0.858 113.8 58.4 -83.0 -36.1 -19.4 0.0 -13.6 95 97 A L H 3X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.895 101.0 55.9 -55.4 -44.2 -16.1 2.0 -14.1 96 98 A K H 3X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.807 105.6 53.4 -63.9 -28.1 -14.5 0.6 -11.0 97 99 A R H <> S+ 0 0 0 -3,-0.5 4,-1.6 -4,-0.5 -1,-0.2 0.858 110.3 44.5 -75.4 -41.7 -15.2 -2.9 -12.3 98 100 A G H X S+ 0 0 13 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.866 115.7 48.7 -64.5 -39.7 -13.4 -2.3 -15.6 99 101 A L H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.894 111.1 50.0 -68.3 -40.4 -10.6 -0.6 -13.7 100 102 A R H X S+ 0 0 35 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.824 107.2 55.3 -65.1 -34.8 -10.5 -3.6 -11.4 101 103 A F H X S+ 0 0 35 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.921 109.4 46.2 -63.6 -46.1 -10.4 -6.0 -14.3 102 104 A I H X S+ 0 0 19 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.875 112.4 52.1 -63.4 -37.2 -7.3 -4.1 -15.7 103 105 A Q H X S+ 0 0 20 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.936 111.0 44.3 -66.4 -48.0 -5.7 -4.2 -12.2 104 106 A V H X S+ 0 0 21 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.917 114.5 51.2 -65.4 -38.7 -6.1 -7.9 -11.7 105 107 A F H X S+ 0 0 18 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.925 113.4 43.4 -63.8 -47.9 -4.9 -8.6 -15.2 106 108 A L H X S+ 0 0 6 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.885 114.4 49.7 -67.3 -39.3 -1.8 -6.5 -14.9 107 109 A Q H X S+ 0 0 61 -4,-2.5 4,-2.1 -5,-0.2 6,-0.2 0.918 109.5 52.0 -67.8 -41.5 -1.0 -7.8 -11.5 108 110 A S H <>S+ 0 0 2 -4,-2.7 5,-1.6 -5,-0.2 4,-0.2 0.918 110.7 48.1 -56.4 -47.5 -1.4 -11.5 -12.6 109 111 A I H ><5S+ 0 0 4 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.939 113.8 47.0 -58.6 -50.0 1.0 -10.9 -15.5 110 112 A C H 3<5S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.715 106.2 57.7 -65.6 -29.4 3.5 -9.2 -13.2 111 113 A D T 3<5S- 0 0 94 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.377 116.5-114.3 -79.7 1.4 3.3 -12.0 -10.5 112 114 A G T < 5 + 0 0 28 -3,-1.3 2,-0.2 1,-0.3 -3,-0.2 0.571 57.6 161.8 77.0 9.9 4.3 -14.5 -13.2 113 115 A E < + 0 0 63 -5,-1.6 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5,-0.1 -0.223 30.1-115.1 -59.8 156.4 13.5 -5.9 -21.7 171 173 A E H > S+ 0 0 74 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.899 119.2 60.8 -57.5 -37.9 10.2 -7.5 -20.6 172 174 A E H > S+ 0 0 135 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 105.6 44.8 -56.3 -49.1 11.7 -7.4 -17.1 173 175 A E H > S+ 0 0 93 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.915 112.1 53.4 -58.2 -46.6 12.0 -3.6 -17.3 174 176 A C H X S+ 0 0 10 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.949 108.2 48.5 -54.4 -50.4 8.5 -3.4 -18.7 175 177 A L H X S+ 0 0 30 -4,-3.2 4,-2.7 1,-0.2 -1,-0.2 0.889 107.4 56.5 -64.5 -33.0 7.0 -5.4 -15.9 176 178 A E H X S+ 0 0 104 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.906 106.0 49.7 -65.8 -39.1 8.8 -3.2 -13.3 177 179 A K H X S+ 0 0 100 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.865 111.3 50.6 -63.7 -34.7 7.2 -0.1 -14.7 178 180 A I H X S+ 0 0 6 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.897 106.5 53.2 -68.3 -46.2 3.8 -1.9 -14.5 179 181 A R H X S+ 0 0 80 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.929 109.7 50.8 -51.7 -44.1 4.4 -2.9 -10.9 180 182 A L H >X S+ 0 0 93 -4,-2.1 3,-0.7 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