==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID TRANSPORT 12-MAY-11 3RZN . COMPND 2 MOLECULE: GLYCOLIPID TRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.SAMYGINA,A.CABO-BILBAO,A.N.POPOV,B.OCHOA-LIZARRALDE,D.J.PA . 206 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11254.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 71.8 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 . 31 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 51.0 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 . 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 4 A L > 0 0 36 0, 0.0 3,-1.8 0, 0.0 25,-0.1 0.000 360.0 360.0 360.0 -39.2 0.8 3.8 17.0 2 5 A A T 3 + 0 0 25 1,-0.3 3,-0.5 2,-0.1 175,-0.0 0.500 360.0 72.8 -77.0 -1.9 -1.7 5.1 14.5 3 6 A E T 3 S+ 0 0 143 1,-0.2 -1,-0.3 0, 0.0 2,-0.0 0.605 104.5 40.5 -79.8 -12.6 -1.7 8.6 16.1 4 7 A H S < S+ 0 0 79 -3,-1.8 -1,-0.2 22,-0.0 22,-0.1 -0.498 79.8 174.1-135.8 62.9 1.8 9.1 14.6 5 8 A L - 0 0 79 -3,-0.5 2,-0.1 1,-0.1 175,-0.1 -0.391 33.3-113.8 -65.1 146.1 1.7 7.7 11.1 6 9 A L - 0 0 10 174,-0.3 177,-0.1 1,-0.1 178,-0.1 -0.472 39.2 -93.4 -75.5 154.1 4.7 8.2 8.9 7 10 A K - 0 0 111 -2,-0.1 -1,-0.1 1,-0.1 180,-0.1 -0.319 43.7-104.5 -58.7 147.7 4.4 10.4 5.8 8 11 A P - 0 0 93 0, 0.0 -1,-0.1 0, 0.0 175,-0.0 -0.339 43.6-100.0 -65.9 158.2 3.6 8.6 2.5 9 12 A L - 0 0 52 -3,-0.1 6,-0.1 6,-0.1 2,-0.0 -0.667 33.6-131.1 -82.0 135.6 6.6 8.3 0.1 10 13 A P > - 0 0 61 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.291 32.3 -97.1 -74.6 170.3 6.8 10.8 -2.7 11 14 A A T 3 S+ 0 0 111 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.837 126.3 53.3 -56.8 -36.0 7.4 9.7 -6.3 12 15 A D T 3 S- 0 0 98 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.454 106.2-129.3 -82.8 1.1 11.1 10.4 -5.9 13 16 A K < + 0 0 112 -3,-2.1 2,-0.3 1,-0.2 -2,-0.1 0.665 54.4 151.2 59.8 23.3 11.3 8.2 -2.7 14 17 A Q - 0 0 56 53,-0.1 2,-0.6 52,-0.0 -1,-0.2 -0.632 36.3-147.3 -85.7 141.8 13.0 10.9 -0.8 15 18 A I - 0 0 17 -2,-0.3 52,-2.2 -3,-0.1 2,-0.3 -0.943 12.5-131.2-113.5 116.1 12.4 10.9 2.9 16 19 A E B > -A 66 0A 79 -2,-0.6 4,-1.7 50,-0.2 50,-0.3 -0.494 13.4-145.1 -68.3 128.7 12.4 14.3 4.7 17 20 A T H > S+ 0 0 0 48,-2.6 4,-2.6 -2,-0.3 5,-0.2 0.902 90.3 52.8 -63.7 -48.6 14.6 14.1 7.7 18 21 A G H > S+ 0 0 16 47,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.952 113.3 40.7 -58.4 -55.3 12.6 16.4 10.1 19 22 A P H > S+ 0 0 44 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.845 114.0 55.1 -64.0 -32.5 9.3 14.6 9.8 20 23 A F H X S+ 0 0 8 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.952 110.4 44.3 -62.4 -49.9 10.9 11.2 9.8 21 24 A L H X S+ 0 0 7 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.896 112.1 53.5 -64.3 -39.3 12.7 11.9 13.1 22 25 A E H < S+ 0 0 104 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 0.931 112.8 44.7 -60.0 -45.2 9.5 13.4 14.6 23 26 A A H >< S+ 0 0 7 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.949 114.1 44.9 -65.5 -51.9 7.6 10.3 13.7 24 27 A V H >< S+ 0 0 1 -4,-2.6 3,-2.0 1,-0.3 -1,-0.2 0.732 96.8 75.5 -72.6 -19.4 10.0 7.7 14.9 25 28 A S T 3< S+ 0 0 50 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.684 87.8 63.7 -61.8 -16.6 10.6 9.6 18.1 26 29 A H T < S+ 0 0 49 -3,-1.6 4,-0.3 -4,-0.3 -1,-0.3 0.554 90.7 69.0 -80.6 -7.6 7.2 8.3 19.2 27 30 A L S X S+ 0 0 10 -3,-2.0 3,-1.8 1,-0.2 4,-0.4 0.914 85.3 60.2 -83.5 -43.6 8.5 4.7 19.1 28 31 A P G > S+ 0 0 4 0, 0.0 3,-2.0 0, 0.0 4,-0.4 0.854 94.7 64.8 -56.1 -34.8 10.9 4.5 22.0 29 32 A P G > S+ 0 0 63 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.761 88.8 70.4 -57.1 -25.4 8.3 5.4 24.7 30 33 A F G X S+ 0 0 54 -3,-1.8 3,-1.7 -4,-0.3 -3,-0.1 0.780 85.7 67.5 -59.9 -26.1 6.5 2.1 23.8 31 34 A F G X S+ 0 0 28 -3,-2.0 3,-0.9 -4,-0.4 5,-0.4 0.746 91.3 60.4 -69.0 -20.7 9.4 0.3 25.5 32 35 A D G < S+ 0 0 96 -3,-1.4 3,-0.3 -4,-0.4 -1,-0.3 0.515 98.9 59.9 -78.3 -4.8 8.3 1.7 28.8 33 36 A C G < S+ 0 0 69 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.254 81.4 83.4-106.0 11.9 4.9 -0.2 28.3 34 37 A L S < S- 0 0 23 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.1 0.458 97.9-118.8 -98.4 -4.2 6.4 -3.7 28.1 35 38 A G S S+ 0 0 79 -3,-0.3 -3,-0.1 1,-0.1 -2,-0.1 0.647 75.0 92.0 82.6 20.0 6.5 -4.3 31.8 36 39 A S > - 0 0 29 -5,-0.4 3,-1.8 1,-0.1 4,-0.2 -0.971 66.0-141.3-151.3 138.1 10.3 -4.8 32.4 37 40 A P G > S+ 0 0 109 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.679 96.5 82.2 -61.3 -17.4 13.6 -3.0 33.2 38 41 A V G 3 S+ 0 0 64 1,-0.3 4,-0.4 2,-0.1 110,-0.1 0.814 85.3 58.6 -59.2 -26.3 15.2 -5.2 30.7 39 42 A F G <> S+ 0 0 27 -3,-1.8 4,-2.6 1,-0.2 5,-0.3 0.622 81.2 89.0 -81.9 -7.7 13.9 -2.8 27.9 40 43 A T H <> S+ 0 0 90 -3,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.921 88.4 43.3 -57.1 -52.2 15.7 0.2 29.4 41 44 A P H > S+ 0 0 86 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.777 112.8 55.6 -66.8 -24.3 19.1 -0.1 27.5 42 45 A I H > S+ 0 0 67 -4,-0.4 4,-2.2 -3,-0.2 5,-0.3 0.945 107.9 46.3 -69.3 -51.9 17.1 -0.9 24.3 43 46 A K H X S+ 0 0 56 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.921 111.7 54.5 -54.5 -44.2 15.2 2.3 24.5 44 47 A A H X S+ 0 0 62 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.886 107.5 48.1 -61.4 -41.7 18.4 4.1 25.2 45 48 A D H X S+ 0 0 100 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.948 114.4 44.4 -68.4 -43.7 20.2 2.8 22.1 46 49 A I H X S+ 0 0 17 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.943 115.2 48.0 -66.3 -46.9 17.3 3.6 19.7 47 50 A S H X S+ 0 0 39 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.884 107.3 57.9 -59.9 -36.9 16.8 7.0 21.2 48 51 A G H X S+ 0 0 36 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.902 106.0 48.7 -61.2 -41.8 20.6 7.6 21.1 49 52 A N H X S+ 0 0 21 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.937 111.9 48.8 -61.8 -46.9 20.5 7.1 17.3 50 53 A I H X S+ 0 0 16 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.930 110.7 51.1 -59.4 -45.3 17.6 9.4 16.9 51 54 A T H X S+ 0 0 95 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.886 110.0 49.7 -58.4 -43.5 19.3 12.1 19.0 52 55 A K H X S+ 0 0 114 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.913 111.8 46.9 -64.6 -44.6 22.5 11.8 16.9 53 56 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.933 113.0 49.7 -63.9 -43.4 20.7 12.2 13.6 54 57 A K H X S+ 0 0 83 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.892 107.1 55.5 -62.3 -37.9 18.7 15.1 14.9 55 58 A A H X S+ 0 0 55 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.891 110.9 44.2 -65.0 -39.8 21.9 16.8 16.2 56 59 A V H >X S+ 0 0 25 -4,-1.8 3,-1.3 2,-0.2 4,-0.6 0.960 113.6 50.7 -65.5 -50.7 23.4 16.6 12.7 57 60 A Y H >< S+ 0 0 46 -4,-2.7 3,-1.7 1,-0.3 7,-0.3 0.894 104.4 58.2 -50.8 -44.9 20.2 17.8 11.1 58 61 A D H 3< S+ 0 0 83 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.724 91.4 69.5 -65.7 -22.6 20.0 20.7 13.4 59 62 A T H << S- 0 0 108 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.789 130.5 -9.5 -64.6 -27.7 23.4 22.0 12.3 60 63 A N 4 S+ 0 0 81 1,-0.2 3,-1.3 2,-0.2 4,-0.2 0.927 109.9 47.3 -68.4 -44.9 18.3 22.7 4.6 63 66 A K T 34 S+ 0 0 108 1,-0.3 3,-0.3 -6,-0.1 -1,-0.2 0.866 120.1 40.4 -59.9 -37.3 21.6 20.9 3.9 64 67 A F T 3< S+ 0 0 9 -4,-2.0 -47,-0.3 -7,-0.3 -1,-0.3 -0.120 75.5 135.2-104.5 37.6 20.2 17.8 5.6 65 68 A R S < S+ 0 0 115 -3,-1.3 -48,-2.6 -49,-0.1 -47,-0.5 0.842 70.8 26.6 -58.3 -40.8 16.7 18.1 4.2 66 69 A T B > S-A 16 0A 2 -50,-0.3 4,-1.8 -3,-0.3 -50,-0.2 -0.805 81.2-114.3-119.8 165.3 16.4 14.4 3.4 67 70 A L H > S+ 0 0 1 -52,-2.2 4,-1.9 -2,-0.3 5,-0.1 0.890 119.9 55.9 -65.1 -37.6 18.0 11.2 4.6 68 71 A Q H > S+ 0 0 32 -53,-0.2 4,-2.6 1,-0.2 5,-0.3 0.893 103.7 54.9 -58.1 -42.2 19.7 10.8 1.3 69 72 A N H > S+ 0 0 35 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.905 104.2 54.9 -58.4 -41.7 21.2 14.3 1.8 70 73 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 5,-0.3 0.960 111.3 43.3 -56.9 -50.6 22.6 13.1 5.2 71 74 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.919 117.6 44.1 -63.3 -45.7 24.4 10.2 3.6 72 75 A E H X S+ 0 0 80 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.895 115.8 46.8 -70.6 -38.4 25.7 12.1 0.6 73 76 A V H X S+ 0 0 30 -4,-2.8 4,-2.6 -5,-0.3 -2,-0.2 0.933 114.4 47.2 -66.5 -44.9 26.8 15.2 2.6 74 77 A E H X S+ 0 0 1 -4,-2.6 4,-2.6 -5,-0.4 5,-0.4 0.898 107.5 56.2 -66.6 -38.2 28.5 13.1 5.2 75 78 A K H X S+ 0 0 112 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.925 114.3 40.7 -56.3 -39.8 30.3 11.0 2.5 76 79 A E H < S+ 0 0 164 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.872 117.1 48.9 -72.0 -43.6 31.7 14.3 1.2 77 80 A M H < S+ 0 0 114 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.849 121.1 30.6 -66.8 -40.0 32.5 15.7 4.7 78 81 A Y H >< S- 0 0 98 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.681 75.2-174.5 -99.4 -24.6 34.2 12.7 6.2 79 82 A G G >< + 0 0 45 -4,-1.3 3,-1.5 -5,-0.4 -1,-0.2 -0.351 68.8 17.1 52.3-126.0 36.1 10.8 3.5 80 83 A A G 3 S+ 0 0 106 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.0 0.714 120.8 52.6 -64.4 -30.0 37.7 7.5 4.7 81 84 A E G X S+ 0 0 143 -3,-0.6 3,-1.7 2,-0.1 -1,-0.3 0.764 90.8 134.5 -74.2 -20.6 35.9 6.7 8.2 82 85 A W T < + 0 0 28 -3,-1.5 4,-0.1 1,-0.3 -7,-0.0 -0.463 56.9 28.7 -69.7 137.0 32.5 7.1 6.4 83 86 A P T 3 S+ 0 0 15 0, 0.0 2,-1.5 0, 0.0 -1,-0.3 -0.969 114.2 65.8 -93.3 6.7 30.1 5.3 6.6 84 87 A K S < S+ 0 0 104 -3,-1.7 2,-0.3 4,-0.1 -2,-0.1 -0.260 98.5 69.6 -82.5 47.7 31.2 4.3 10.2 85 88 A V S > S- 0 0 21 -2,-1.5 4,-2.1 0, 0.0 3,-0.4 -0.983 84.9 -8.4-152.0 160.4 30.6 7.9 11.4 86 89 A G H > S- 0 0 16 -2,-0.3 4,-1.8 1,-0.2 3,-0.1 0.049 112.3 -22.1 61.9-154.2 28.0 10.5 12.2 87 90 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.779 131.2 66.4 -67.9 -25.1 24.4 10.3 11.4 88 91 A T H > S+ 0 0 0 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.935 106.1 41.4 -61.3 -45.4 25.1 7.8 8.7 89 92 A L H X S+ 0 0 36 -4,-2.1 4,-1.7 2,-0.2 5,-0.2 0.912 113.9 52.8 -68.6 -42.5 26.2 5.3 11.4 90 93 A A H X S+ 0 0 5 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.919 112.5 44.2 -58.8 -44.3 23.4 6.2 13.7 91 94 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.815 105.7 62.8 -71.0 -30.2 20.8 5.7 10.9 92 95 A M H < S+ 0 0 0 -4,-1.8 4,-0.5 -5,-0.3 -1,-0.2 0.890 114.1 34.3 -59.4 -41.2 22.5 2.4 9.9 93 96 A W H >X S+ 0 0 36 -4,-1.7 4,-1.7 2,-0.2 3,-0.7 0.866 114.1 58.1 -79.7 -40.0 21.7 1.1 13.4 94 97 A L H 3X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.3 5,-0.2 0.904 101.3 56.1 -57.9 -44.0 18.4 2.9 13.7 95 98 A K H 3X S+ 0 0 1 -4,-2.6 4,-2.4 1,-0.2 -1,-0.3 0.831 104.0 54.7 -60.9 -31.2 17.0 1.2 10.6 96 99 A R H <> S+ 0 0 0 -3,-0.7 4,-2.4 -4,-0.5 -1,-0.2 0.902 110.3 45.0 -67.4 -44.3 17.8 -2.2 12.1 97 100 A G H X S+ 0 0 12 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.904 113.5 50.6 -64.5 -39.7 15.7 -1.4 15.2 98 101 A L H X S+ 0 0 2 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.912 110.3 49.4 -63.5 -41.1 13.0 0.0 13.1 99 102 A R H X S+ 0 0 36 -4,-2.4 4,-3.0 -5,-0.2 5,-0.3 0.893 107.4 55.2 -64.6 -40.2 13.0 -3.1 11.0 100 103 A F H X S+ 0 0 40 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.956 110.4 45.5 -54.7 -50.7 12.8 -5.3 14.1 101 104 A I H X S+ 0 0 20 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.910 113.3 50.8 -61.1 -44.4 9.7 -3.4 15.2 102 105 A Q H X S+ 0 0 19 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.948 113.4 42.8 -57.0 -52.7 8.2 -3.7 11.6 103 106 A V H X S+ 0 0 7 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.906 115.2 50.8 -63.9 -41.9 8.8 -7.4 11.4 104 107 A F H X S+ 0 0 16 -4,-2.6 4,-2.2 -5,-0.3 -2,-0.2 0.955 114.0 42.5 -59.9 -53.8 7.6 -8.0 14.9 105 108 A L H X S+ 0 0 6 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.896 114.5 50.8 -62.8 -41.9 4.4 -6.0 14.5 106 109 A Q H X S+ 0 0 55 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.892 108.6 52.5 -62.4 -39.2 3.7 -7.5 11.0 107 110 A S H <>S+ 0 0 2 -4,-2.3 5,-1.9 -5,-0.2 4,-0.2 0.911 110.8 47.0 -63.4 -45.0 4.2 -11.0 12.4 108 111 A I H ><5S+ 0 0 7 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.950 113.6 48.2 -59.2 -51.2 1.6 -10.3 15.2 109 112 A C H 3<5S+ 0 0 7 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.825 105.8 58.9 -61.7 -31.5 -0.8 -8.8 12.7 110 113 A D T 3<5S- 0 0 92 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.421 115.7-113.0 -81.0 0.8 -0.4 -11.8 10.4 111 114 A G T < 5 + 0 0 29 -3,-1.7 2,-0.2 1,-0.3 -3,-0.2 0.619 58.2 161.2 81.2 13.8 -1.5 -14.2 13.0 112 115 A E < + 0 0 61 -5,-1.9 2,-0.3 -6,-0.2 -1,-0.3 -0.475 15.3 142.2 -70.6 134.8 1.8 -15.9 13.4 113 116 A R - 0 0 124 -2,-0.2 2,-0.8 10,-0.1 8,-0.1 -0.985 60.9 -98.3-164.1 160.1 2.0 -17.8 16.6 114 117 A D > - 0 0 58 3,-0.5 3,-1.4 -2,-0.3 6,-0.2 -0.872 35.0-151.0 -83.1 109.6 3.2 -20.8 18.5 115 118 A E T 3 S+ 0 0 149 -2,-0.8 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