==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 29-APR-09 3H90 . COMPND 2 MOLECULE: FERROUS-IRON EFFLUX PUMP FIEF; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; . AUTHOR M.LU . 1132 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 59423.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 827 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 3.9 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 . 8 0.7 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 . 2 0.2 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 . 66 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 112 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 543 48.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 2 0 0 2 2 0 0 6 2 0 0 0 4 2 0 2 1 5 0 0 6 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 4 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 4 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 4 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 8 A L 0 0 199 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 107.0 -18.2 -25.2 -19.5 2 9 A V - 0 0 124 1,-0.1 2,-0.1 2,-0.0 4,-0.0 -0.270 360.0-103.1 -87.0-176.6 -19.8 -21.8 -20.5 3 10 A S > - 0 0 80 -2,-0.1 3,-2.0 1,-0.0 -1,-0.1 -0.382 48.5 -70.6-103.3-176.3 -19.3 -18.6 -18.5 4 11 A R T >> S+ 0 0 53 1,-0.3 3,-1.3 2,-0.2 4,-0.7 0.468 115.4 87.6 -57.5 -2.4 -21.5 -16.6 -16.1 5 12 A A H 3> + 0 0 54 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.431 66.8 85.8 -70.5 -2.1 -23.6 -15.7 -19.2 6 13 A A H <> S+ 0 0 23 -3,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.856 89.5 46.8 -60.9 -36.9 -25.2 -19.0 -18.1 7 14 A I H <> S+ 0 0 0 -3,-1.3 4,-1.5 2,-0.2 3,-0.3 0.887 103.0 60.6 -74.0 -40.7 -27.3 -16.7 -15.8 8 15 A A H X S+ 0 0 20 -4,-0.7 4,-0.8 1,-0.2 3,-0.4 0.926 104.1 54.2 -44.7 -45.4 -28.0 -14.3 -18.6 9 16 A A H >X S+ 0 0 46 -4,-1.7 4,-1.4 1,-0.2 3,-0.5 0.847 102.2 53.6 -63.0 -40.7 -29.7 -17.3 -20.3 10 17 A T H 3X S+ 0 0 1 -4,-1.1 4,-1.6 -3,-0.3 -1,-0.2 0.830 96.9 68.6 -63.7 -33.2 -32.0 -18.2 -17.4 11 18 A A H 3X S+ 0 0 4 -4,-1.5 4,-0.7 -3,-0.4 -1,-0.2 0.856 106.6 37.9 -55.3 -41.4 -33.4 -14.6 -17.4 12 19 A M H << S+ 0 0 81 -4,-0.8 -1,-0.2 -3,-0.5 4,-0.2 0.785 106.9 66.3 -77.7 -30.0 -35.0 -15.2 -20.8 13 20 A A H >< S+ 0 0 21 -4,-1.4 3,-0.5 1,-0.3 4,-0.2 0.804 99.5 52.5 -60.6 -27.6 -35.9 -18.7 -19.7 14 21 A S H >< S+ 0 0 0 -4,-1.6 3,-1.6 1,-0.2 -1,-0.3 0.847 103.3 56.1 -68.1 -38.0 -38.1 -16.8 -17.2 15 22 A L T >< S+ 0 0 32 -4,-0.7 3,-1.3 1,-0.3 -2,-0.2 0.394 82.6 86.9 -76.5 2.4 -39.5 -14.9 -20.2 16 23 A L T X> S+ 0 0 65 -3,-0.5 3,-2.2 1,-0.2 4,-0.5 0.828 74.6 71.0 -60.3 -33.5 -40.4 -18.4 -21.5 17 24 A L H <> S+ 0 0 8 -3,-1.6 4,-1.3 1,-0.3 -1,-0.2 0.487 73.6 86.6 -66.9 -1.4 -43.5 -17.8 -19.5 18 25 A L H <> S+ 0 0 77 -3,-1.3 4,-0.9 2,-0.2 -1,-0.3 0.864 89.1 48.5 -57.4 -40.9 -44.3 -15.3 -22.3 19 26 A I H <> S+ 0 0 110 -3,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.795 104.9 59.4 -72.3 -27.1 -45.8 -18.3 -24.1 20 27 A K H < S+ 0 0 30 -4,-0.5 -2,-0.2 2,-0.3 -1,-0.2 0.805 100.3 54.6 -69.3 -31.5 -47.7 -19.1 -20.9 21 28 A I H < S+ 0 0 35 -4,-1.3 3,-0.5 1,-0.2 -1,-0.2 0.807 114.1 42.1 -68.7 -30.0 -49.4 -15.7 -21.0 22 29 A F H < S+ 0 0 133 -4,-0.9 -2,-0.3 1,-0.2 -1,-0.2 0.720 101.1 69.2 -84.8 -24.8 -50.4 -16.7 -24.5 23 30 A A S < S+ 0 0 46 -4,-1.8 2,-0.2 -6,-0.1 -1,-0.2 0.141 86.4 92.0 -78.5 19.7 -51.3 -20.2 -23.3 24 31 A W S S- 0 0 75 -3,-0.5 2,-0.4 -5,-0.1 4,-0.1 -0.640 72.9-140.8 -95.3 166.0 -54.1 -18.3 -21.5 25 32 A W + 0 0 118 -2,-0.2 6,-0.6 6,-0.2 -2,-0.1 -0.950 49.1 131.8-145.3 130.1 -57.4 -18.1 -23.4 26 33 A Y S S+ 0 0 127 -2,-0.4 -1,-0.1 4,-0.1 6,-0.0 0.526 93.9 38.2-122.7 -44.9 -60.2 -15.6 -24.0 27 34 A T S S+ 0 0 120 1,-0.1 3,-0.2 2,-0.1 -2,-0.1 0.732 118.5 50.9 -81.3 -25.2 -60.7 -15.8 -27.8 28 35 A G S S- 0 0 45 1,-0.3 2,-0.3 -4,-0.1 -1,-0.1 0.918 137.1 -2.5 -72.6 -49.0 -60.1 -19.6 -27.7 29 36 A S S S- 0 0 84 2,-0.2 2,-2.0 0, 0.0 -1,-0.3 -0.919 76.0-126.2-146.3 120.7 -62.7 -20.0 -25.0 30 37 A V S S+ 0 0 122 -2,-0.3 2,-0.3 -3,-0.2 -4,-0.1 -0.429 70.2 110.2 -70.3 81.5 -64.5 -17.1 -23.4 31 38 A S - 0 0 74 -2,-2.0 2,-0.4 -6,-0.6 -6,-0.2 -0.977 47.7-155.8-154.6 144.8 -63.7 -17.8 -19.7 32 39 A I + 0 0 118 -2,-0.3 2,-0.2 -8,-0.1 -6,-0.1 -0.984 14.4 168.2-135.5 135.1 -61.5 -16.0 -17.2 33 40 A L - 0 0 107 -2,-0.4 3,-0.3 76,-0.0 4,-0.0 -0.616 44.4-102.7-124.2-169.9 -59.6 -16.9 -14.0 34 41 A A S >> S+ 0 0 76 -2,-0.2 3,-2.1 1,-0.2 4,-1.0 0.756 99.1 80.9 -91.9 -27.0 -56.9 -15.1 -11.9 35 42 A A T 34 S+ 0 0 42 1,-0.3 -1,-0.2 2,-0.2 4,-0.1 0.074 78.0 73.8 -76.2 27.3 -53.7 -16.9 -13.0 36 43 A L T 34 S+ 0 0 39 -2,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.488 101.2 42.3-104.5 -15.1 -53.4 -14.8 -16.2 37 44 A V T X> S+ 0 0 79 -3,-2.1 4,-3.1 2,-0.2 3,-0.7 0.767 107.0 58.0 -99.5 -38.9 -52.4 -11.8 -14.1 38 45 A D H 3X S+ 0 0 72 -4,-1.0 4,-1.7 1,-0.2 -3,-0.1 0.886 112.7 43.9 -54.6 -38.9 -50.0 -13.6 -11.8 39 46 A S H 3> S+ 0 0 1 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.474 110.5 54.0 -88.6 -3.5 -48.2 -14.6 -15.1 40 47 A L H <> S+ 0 0 98 -3,-0.7 4,-1.5 2,-0.2 -2,-0.2 0.753 108.4 49.1 -90.6 -35.6 -48.5 -11.1 -16.4 41 48 A V H X S+ 0 0 85 -4,-3.1 4,-2.9 2,-0.2 5,-0.2 0.925 107.4 58.2 -57.9 -47.3 -46.8 -9.8 -13.3 42 49 A D H X S+ 0 0 5 -4,-1.7 4,-2.4 1,-0.2 5,-0.3 0.886 101.4 52.9 -51.0 -49.3 -44.2 -12.6 -14.0 43 50 A I H X S+ 0 0 28 -4,-0.8 4,-1.1 2,-0.2 -1,-0.2 0.949 116.7 39.0 -52.7 -53.5 -43.4 -11.1 -17.4 44 51 A G H >X S+ 0 0 33 -4,-1.5 4,-3.0 2,-0.2 3,-0.7 0.985 117.8 47.0 -60.0 -64.2 -42.7 -7.7 -15.9 45 52 A A H 3X S+ 0 0 49 -4,-2.9 4,-2.4 1,-0.3 -3,-0.2 0.915 119.2 38.1 -42.9 -63.3 -41.0 -8.8 -12.7 46 53 A S H 3X S+ 0 0 1 -4,-2.4 4,-1.2 1,-0.2 -1,-0.3 0.608 112.5 58.2 -77.7 -9.0 -38.6 -11.3 -14.2 47 54 A L H < S+ 0 0 75 -4,-1.8 3,-1.6 1,-0.2 -1,-0.2 0.911 108.7 58.4 -68.0 -45.6 -26.5 -4.5 -15.3 56 63 A S H 3< S+ 0 0 7 -4,-2.7 12,-0.5 1,-0.3 -2,-0.2 0.790 101.3 56.4 -52.2 -33.9 -24.9 -6.9 -12.8 57 64 A L T 3< S+ 0 0 65 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.564 78.5 113.8 -83.5 -10.2 -22.6 -8.3 -15.5 58 65 A Q < - 0 0 85 -3,-1.6 10,-0.2 -4,-0.3 3,-0.1 -0.314 65.5-122.6 -61.5 143.0 -21.0 -5.0 -16.5 59 66 A P - 0 0 104 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 -0.193 55.5 -40.5 -79.2 178.1 -17.3 -4.7 -15.8 60 67 A A - 0 0 73 5,-0.1 5,-0.2 1,-0.1 7,-0.1 -0.080 66.2-160.9 -44.2 131.3 -15.5 -2.0 -13.7 61 68 A D - 0 0 66 3,-2.5 -1,-0.1 5,-0.5 7,-0.0 -0.174 33.2 -99.9-103.4-172.0 -17.0 1.4 -14.4 62 69 A D S S+ 0 0 112 1,-0.1 3,-0.2 -2,-0.1 -1,-0.1 0.906 125.7 23.5 -78.9 -44.5 -15.8 4.9 -13.9 63 70 A N S S+ 0 0 43 1,-0.2 707,-2.5 707,-0.1 2,-0.2 0.261 120.4 60.4-109.2 13.1 -17.9 5.3 -10.7 64 71 A H + 0 0 5 705,-0.2 -3,-2.5 2,-0.1 -1,-0.2 -0.736 61.0 165.4-124.6 82.0 -18.2 1.6 -9.9 65 72 A S S S+ 0 0 17 732,-0.4 -5,-0.1 703,-0.3 2,-0.1 0.659 70.6 44.9 -79.1 -16.5 -14.5 0.8 -9.5 66 73 A F S S- 0 0 5 702,-0.7 -5,-0.5 1,-0.3 -2,-0.1 -0.169 116.0 -54.1 -95.4-157.7 -15.4 -2.4 -7.8 67 74 A G - 0 0 16 -2,-0.1 -1,-0.3 -7,-0.1 -6,-0.2 0.275 23.1-135.5 -65.3-167.6 -18.1 -4.7 -9.4 68 75 A H S > S+ 0 0 4 -12,-0.5 3,-2.0 -10,-0.2 4,-0.3 -0.002 78.2 114.9-118.7 9.5 -21.6 -4.1 -10.4 69 76 A G T > + 0 0 4 1,-0.3 3,-2.8 163,-0.2 4,-0.4 0.856 56.0 67.1 -47.3 -54.0 -22.1 -7.5 -8.6 70 77 A K T 3> S+ 0 0 2 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.655 79.2 83.2 -44.4 -24.9 -24.2 -6.3 -5.7 71 78 A A H <> S+ 0 0 3 -3,-2.0 4,-3.2 1,-0.2 -1,-0.3 0.890 89.4 53.8 -47.3 -42.2 -27.0 -5.6 -8.3 72 79 A E H <> S+ 0 0 0 -3,-2.8 4,-2.9 -4,-0.3 -1,-0.2 0.950 107.2 47.5 -58.0 -53.2 -27.8 -9.3 -7.9 73 80 A S H > S+ 0 0 1 -4,-0.4 4,-3.2 2,-0.2 -2,-0.2 0.852 113.6 48.8 -61.9 -36.9 -28.1 -9.1 -4.1 74 81 A L H X S+ 0 0 28 -4,-2.7 4,-3.4 2,-0.2 5,-0.2 0.984 111.4 49.5 -58.4 -58.0 -30.4 -6.0 -4.5 75 82 A A H X S+ 0 0 10 -4,-3.2 4,-2.0 -5,-0.2 -2,-0.2 0.842 113.9 47.4 -51.7 -38.5 -32.4 -7.9 -7.1 76 83 A A H X S+ 0 0 0 -4,-2.9 4,-3.4 2,-0.2 5,-0.3 0.992 111.6 47.8 -62.7 -61.8 -32.6 -10.8 -4.7 77 84 A L H X S+ 0 0 18 -4,-3.2 4,-1.4 1,-0.3 -2,-0.2 0.821 111.0 53.6 -52.5 -37.3 -33.6 -8.7 -1.7 78 85 A A H X S+ 0 0 48 -4,-3.4 4,-1.6 2,-0.2 3,-0.4 0.964 114.2 40.5 -56.4 -53.2 -36.2 -7.0 -3.9 79 86 A Q H X S+ 0 0 26 -4,-2.0 4,-3.2 1,-0.2 5,-0.4 0.901 108.6 59.8 -68.2 -42.1 -37.7 -10.3 -4.9 80 87 A S H X S+ 0 0 6 -4,-3.4 4,-1.8 1,-0.2 -1,-0.2 0.813 106.7 48.2 -57.4 -33.9 -37.4 -11.9 -1.4 81 88 A M H X S+ 0 0 85 -4,-1.4 4,-0.9 -3,-0.4 -1,-0.2 0.924 115.0 44.0 -69.8 -45.6 -39.7 -9.1 -0.0 82 89 A F H X S+ 0 0 166 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.823 118.4 43.9 -69.3 -34.1 -42.3 -9.5 -2.8 83 90 A I H X S+ 0 0 11 -4,-3.2 4,-1.1 2,-0.2 -1,-0.2 0.842 111.5 54.3 -77.4 -35.0 -42.1 -13.3 -2.5 84 91 A S H X S+ 0 0 25 -4,-1.8 4,-0.7 -5,-0.4 -2,-0.2 0.697 109.9 50.3 -67.7 -21.2 -42.2 -13.0 1.3 85 92 A G H >X S+ 0 0 39 -4,-0.9 4,-2.4 2,-0.2 3,-0.7 0.938 107.1 49.0 -80.2 -54.1 -45.4 -10.9 0.8 86 93 A S H 3X S+ 0 0 79 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.722 110.7 55.4 -55.8 -24.7 -47.3 -13.3 -1.4 87 94 A A H 3X S+ 0 0 6 -4,-1.1 4,-0.8 2,-0.2 97,-0.2 0.778 108.3 43.6 -84.9 -31.9 -46.5 -16.0 1.1 88 95 A L H < S+ 0 0 80 -4,-1.2 3,-0.8 81,-0.1 -1,-0.2 0.620 113.3 68.7 -88.1 -16.6 -56.5 -19.8 7.8 96 103 A Q H 3< S+ 0 0 118 -4,-0.9 2,-0.8 1,-0.3 4,-0.4 1.000 110.3 28.5 -62.9 -73.1 -59.0 -17.5 6.1 97 104 A H T 3< S+ 0 0 50 -4,-1.8 2,-1.6 3,-0.2 76,-0.4 -0.263 71.7 138.4 -87.6 50.2 -60.9 -20.2 4.1 98 105 A L S < S- 0 0 85 -3,-0.8 -1,-0.2 -2,-0.8 -3,-0.1 -0.311 108.3 -65.6 -73.6 48.5 -60.2 -22.9 6.7 99 106 A I S S+ 0 0 54 -2,-1.6 -2,-0.2 3,-0.1 -1,-0.1 0.884 108.0 131.7 53.7 46.1 -63.8 -23.4 5.7 100 107 A S S S+ 0 0 90 -4,-0.4 -3,-0.2 2,-0.1 -4,-0.1 0.876 93.0 11.1 -83.6 -51.9 -64.8 -20.1 7.2 101 108 A P S S- 0 0 79 0, 0.0 -4,-0.1 0, 0.0 -3,-0.0 0.788 124.0 -93.5 -73.5 -90.7 -66.7 -19.3 4.1 102 109 A T - 0 0 60 -5,-0.0 2,-1.2 0, 0.0 3,-0.1 -0.923 39.9 -70.6-178.0 154.2 -66.6 -22.7 2.3 103 110 A P + 0 0 19 0, 0.0 60,-0.0 0, 0.0 -5,-0.0 -0.506 62.1 165.7 -56.4 96.4 -64.6 -24.7 -0.3 104 111 A M + 0 0 119 -2,-1.2 2,-2.9 1,-0.2 0, 0.0 0.678 44.5 91.2 -98.2 -23.2 -65.7 -22.4 -3.2 105 112 A T + 0 0 109 1,-0.2 -1,-0.2 -3,-0.1 0, 0.0 -0.372 51.0 126.7 -74.0 64.1 -63.4 -23.3 -6.0 106 113 A D + 0 0 104 -2,-2.9 -1,-0.2 2,-0.0 2,-0.2 0.753 27.8 110.5 -93.0 -32.1 -65.8 -26.0 -7.2 107 114 A P - 0 0 87 0, 0.0 2,-2.2 0, 0.0 -3,-0.0 -0.297 64.9-143.8 -50.2 112.9 -66.2 -24.9 -10.9 108 115 A G + 0 0 87 -2,-0.2 3,-0.3 2,-0.0 -2,-0.0 -0.227 37.4 175.1 -72.9 48.0 -64.5 -27.7 -12.9 109 116 A V - 0 0 62 -2,-2.2 2,-0.3 1,-0.2 -78,-0.0 -0.241 54.0 -64.4 -59.5 144.5 -63.3 -25.0 -15.3 110 117 A G > - 0 0 48 1,-0.2 3,-1.3 2,-0.1 4,-0.2 0.006 56.4-175.7 -35.2 85.7 -60.9 -26.1 -18.1 111 118 A V T 3> + 0 0 75 -2,-0.3 4,-1.8 1,-0.3 5,-0.2 0.408 60.3 100.5 -75.1 3.4 -58.1 -27.1 -15.8 112 119 A I H 3> S+ 0 0 111 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.664 78.8 59.0 -61.6 -17.4 -56.0 -27.8 -18.9 113 120 A V H <> S+ 0 0 61 -3,-1.3 4,-3.8 2,-0.2 -1,-0.2 0.970 105.3 43.7 -70.3 -58.8 -54.5 -24.4 -18.1 114 121 A T H > S+ 0 0 24 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.727 114.3 50.6 -66.8 -25.2 -53.2 -25.3 -14.6 115 122 A I H X S+ 0 0 91 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.898 114.8 42.5 -75.7 -42.5 -51.8 -28.7 -15.7 116 123 A V H X S+ 0 0 63 -4,-1.1 4,-2.4 -5,-0.2 5,-0.4 0.929 110.9 58.8 -63.3 -44.0 -50.0 -27.0 -18.6 117 124 A A H X S+ 0 0 2 -4,-3.8 4,-1.7 1,-0.2 5,-0.2 0.927 109.0 43.8 -46.9 -54.4 -49.0 -24.3 -16.1 118 125 A L H X S+ 0 0 48 -4,-1.9 4,-4.1 1,-0.2 3,-0.5 0.978 111.6 54.0 -51.5 -58.7 -47.4 -27.0 -14.0 119 126 A I H X S+ 0 0 115 -4,-2.5 4,-1.1 1,-0.3 -2,-0.2 0.775 115.7 35.2 -56.6 -38.7 -45.7 -28.7 -17.0 120 127 A C H X S+ 0 0 20 -4,-2.4 4,-1.6 2,-0.2 -1,-0.3 0.691 118.8 51.3 -90.2 -20.0 -43.9 -25.6 -18.4 121 128 A T H X S+ 0 0 13 -4,-1.7 4,-2.7 -3,-0.5 5,-0.2 0.899 108.1 52.8 -75.7 -44.3 -43.2 -24.1 -15.0 122 129 A I H X S+ 0 0 74 -4,-4.1 4,-1.4 -5,-0.2 -2,-0.2 0.917 108.6 52.3 -49.4 -47.0 -41.7 -27.5 -13.9 123 130 A I H X S+ 0 0 112 -4,-1.1 4,-1.7 -5,-0.3 3,-0.2 0.933 112.7 43.5 -55.4 -52.2 -39.5 -27.2 -17.1 124 131 A L H >X S+ 0 0 7 -4,-1.6 4,-3.1 1,-0.2 3,-0.7 0.975 107.6 56.7 -57.8 -62.7 -38.3 -23.7 -16.1 125 132 A V H 3X S+ 0 0 13 -4,-2.7 4,-2.7 1,-0.3 -1,-0.2 0.742 109.5 48.1 -45.2 -33.3 -37.7 -24.3 -12.4 126 133 A S H 3X S+ 0 0 73 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.3 0.886 110.4 48.0 -79.7 -39.6 -35.3 -27.2 -13.3 127 134 A F H - 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