==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 27-AUG-00 1FOC . COMPND 2 MOLECULE: CYTOCHROME RC557; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR D.E.MCREE,P.A.WILLIAMS,J.A.FEE,K.L.BREN . 256 2 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13563.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 64.5 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 . 12 4.7 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 1 0.4 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 . 20 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 2 1 1 2 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 G 0 0 27 0, 0.0 80,-0.1 0, 0.0 76,-0.0 0.000 360.0 360.0 360.0 30.4 40.1 6.6 7.0 2 5 A A + 0 0 44 78,-0.1 4,-0.2 81,-0.1 0, 0.0 0.064 360.0 68.3-173.1 -22.5 36.9 8.0 5.4 3 6 A K S >> S+ 0 0 152 2,-0.2 3,-1.5 1,-0.1 4,-0.9 0.953 101.0 52.0 -68.1 -52.4 35.2 8.4 8.7 4 7 A I H >> S+ 0 0 39 1,-0.3 3,-2.1 2,-0.3 4,-0.6 0.911 102.4 55.1 -42.9 -65.2 37.9 11.1 9.2 5 8 A Y H 34 S+ 0 0 46 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.679 109.2 54.1 -43.6 -22.0 37.1 12.9 5.9 6 9 A A H <4 S+ 0 0 55 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.3 0.793 80.3 86.0 -86.6 -31.7 33.7 12.9 7.5 7 10 A Q H << S+ 0 0 56 -3,-2.1 2,-0.6 -4,-0.9 -2,-0.2 0.784 100.3 38.4 -45.2 -32.9 34.7 14.6 10.8 8 11 A a S < S- 0 0 17 -4,-0.6 2,-0.4 -3,-0.2 -1,-0.2 -0.900 86.0-153.3-121.4 100.7 34.2 17.9 9.1 9 12 A A + 0 0 17 -2,-0.6 2,-0.4 -3,-0.1 -3,-0.1 -0.541 64.1 20.3 -74.3 127.1 31.2 17.8 6.7 10 13 A G S > S+ 0 0 13 -2,-0.4 3,-1.6 188,-0.1 2,-0.7 -0.951 75.3 94.1 122.3-141.5 31.5 20.3 3.9 11 14 A C T 3 S+ 0 0 31 -2,-0.4 11,-0.1 1,-0.3 12,-0.1 -0.189 115.3 12.3 51.6 -99.1 34.7 22.0 2.5 12 15 A H T 3> S- 0 0 32 -2,-0.7 4,-1.1 6,-0.2 6,-1.0 0.106 114.0-127.9 -97.8 22.0 35.5 19.5 -0.2 13 16 A Q T X4 - 0 0 20 -3,-1.6 3,-1.2 4,-0.2 5,-0.2 0.623 26.1 -80.4 52.4 150.6 32.0 17.8 0.0 14 17 A Q T 34 S+ 0 0 173 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.835 128.9 53.9 -49.2 -33.9 31.0 14.1 0.4 15 18 A N T 34 S- 0 0 62 3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.578 104.1-120.9 -78.6 -15.7 31.6 13.9 -3.4 16 19 A G S << S+ 0 0 0 -3,-1.2 11,-3.3 -4,-1.1 10,-2.6 0.124 100.9 95.9 91.3 -21.5 35.1 15.1 -3.9 17 20 A Q S S- 0 0 116 1,-0.3 2,-0.6 8,-0.2 -4,-0.2 0.797 72.6-171.9 -65.6 -26.7 33.7 17.8 -6.2 18 21 A G - 0 0 1 -6,-1.0 -1,-0.3 -5,-0.2 -3,-0.2 -0.612 51.7 -58.2 66.9-116.3 33.9 19.5 -2.8 19 22 A I > - 0 0 58 -2,-0.6 3,-1.4 4,-0.5 4,-0.4 -0.214 59.4-139.2-162.3 59.3 32.1 22.5 -3.7 20 23 A P T 3 S+ 0 0 49 0, 0.0 -2,-0.0 0, 0.0 42,-0.0 0.218 85.7 51.6 -23.0 131.1 33.6 24.4 -6.6 21 24 A G T 3 S+ 0 0 57 2,-0.2 40,-0.0 40,-0.1 173,-0.0 -0.374 127.3 21.5 123.9 -34.6 33.7 28.1 -6.2 22 25 A A S < S+ 0 0 37 -3,-1.4 41,-0.2 1,-0.4 42,-0.2 0.648 125.8 35.4-131.5 -27.5 35.3 27.9 -2.8 23 26 A F S S- 0 0 35 -4,-0.4 -4,-0.5 -12,-0.1 -1,-0.4 -0.972 85.8-116.2-128.9 140.1 37.0 24.6 -2.4 24 27 A P - 0 0 26 0, 0.0 2,-0.4 0, 0.0 3,-0.2 -0.445 35.1 -88.9 -80.5 163.9 38.7 23.0 -5.2 25 28 A P + 0 0 14 0, 0.0 -8,-0.2 0, 0.0 -7,-0.1 -0.500 36.0 175.5 -64.9 115.0 37.8 19.6 -6.8 26 29 A L > + 0 0 27 -10,-2.6 4,-5.0 -2,-0.4 5,-0.3 0.775 53.8 117.4 -81.5 -29.2 39.7 16.9 -5.0 27 30 A A T 4 S- 0 0 29 -11,-3.3 2,-3.1 1,-0.3 -11,-0.1 -0.021 105.1 -36.8 -38.4 104.6 37.6 15.0 -7.4 28 31 A G T >> S+ 0 0 22 1,-0.2 3,-4.2 56,-0.2 4,-0.7 -0.071 125.8 95.2 64.3 -41.5 39.9 13.1 -9.7 29 32 A H H 3> + 0 0 10 -2,-3.1 4,-1.1 1,-0.3 5,-0.3 0.874 70.0 72.8 -48.2 -37.3 42.1 16.3 -9.4 30 33 A V H >X S+ 0 0 2 -4,-5.0 4,-1.2 1,-0.2 3,-0.8 0.895 91.6 55.2 -51.3 -29.5 43.8 14.4 -6.8 31 34 A A H X> S+ 0 0 11 -3,-4.2 3,-5.2 -5,-0.3 4,-2.7 0.994 101.9 53.3 -62.2 -64.9 45.3 12.2 -9.5 32 35 A E H 3< S+ 0 0 52 -4,-0.7 4,-0.3 1,-0.3 -1,-0.2 0.627 115.8 42.3 -43.8 -14.9 46.9 15.0 -11.5 33 36 A I H << S+ 0 0 28 -4,-1.1 -1,-0.3 -3,-0.8 9,-0.2 0.592 114.0 52.3-103.3 -17.4 48.5 16.1 -8.3 34 37 A L H << S+ 0 0 14 -3,-5.2 6,-0.3 -4,-1.2 -2,-0.3 0.684 106.0 56.0 -90.6 -19.0 49.3 12.5 -7.4 35 38 A A S < S+ 0 0 45 -4,-2.7 5,-0.3 -5,-0.2 3,-0.2 0.784 88.8 72.5 -67.4-105.9 50.9 11.9 -10.8 36 39 A K S > S- 0 0 74 -4,-0.3 3,-1.8 1,-0.1 4,-0.1 0.330 102.3-100.2 -14.8 107.2 53.6 14.6 -10.9 37 40 A E T 3 S+ 0 0 171 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.032 107.5 29.0 -51.9 141.0 56.2 13.3 -8.4 38 41 A G T >> S+ 0 0 13 -3,-0.2 3,-5.8 -4,-0.2 4,-1.0 -0.345 90.9 109.3 99.7 -40.1 56.3 14.7 -4.9 39 42 A G H <> S+ 0 0 0 -3,-1.8 4,-3.4 1,-0.3 -2,-0.2 0.752 75.5 52.0 -29.2 -45.5 52.6 15.3 -5.4 40 43 A R H 3> S+ 0 0 36 -6,-0.3 4,-1.4 -5,-0.3 -1,-0.3 0.694 113.8 47.8 -73.5 -16.1 51.8 12.6 -2.9 41 44 A E H <> S+ 0 0 95 -3,-5.8 4,-1.6 2,-0.2 -2,-0.3 0.806 109.2 51.8 -71.7 -49.4 54.3 14.7 -0.8 42 45 A Y H X S+ 0 0 12 -4,-1.0 4,-2.0 -9,-0.2 3,-0.3 0.957 111.5 48.0 -59.0 -46.3 52.5 18.0 -1.7 43 46 A L H X S+ 0 0 19 -4,-3.4 4,-1.0 1,-0.3 -2,-0.2 0.933 109.4 50.4 -56.8 -67.6 49.2 16.3 -0.6 44 47 A I H X S+ 0 0 0 -4,-1.4 4,-1.0 1,-0.2 -1,-0.3 0.716 111.4 55.5 -26.1 -46.9 50.7 15.0 2.8 45 48 A L H >X S+ 0 0 13 -4,-1.6 3,-3.0 -3,-0.3 4,-2.1 0.988 96.2 60.1 -54.4 -79.0 51.9 18.5 3.3 46 49 A V H 3X S+ 0 0 17 -4,-2.0 4,-1.8 1,-0.3 -2,-0.2 0.602 107.3 43.0 -20.6 -55.5 48.6 20.2 2.9 47 50 A L H 3< S+ 0 0 28 -4,-1.0 22,-6.2 1,-0.2 23,-1.3 0.779 118.9 45.3 -71.6 -28.3 46.8 18.6 5.8 48 51 A L H << S+ 0 0 4 -3,-3.0 -2,-0.2 -4,-1.0 -1,-0.2 0.850 131.2 16.9 -77.7 -49.7 49.8 18.9 8.1 49 52 A Y H < S- 0 0 26 -4,-2.1 19,-0.3 1,-0.2 2,-0.2 0.834 97.1-124.5-102.4 -32.9 50.7 22.5 7.3 50 53 A G < - 0 0 2 -4,-1.8 2,-0.3 -5,-0.3 17,-0.2 -0.474 18.5-128.1 107.2 164.5 47.9 24.2 5.6 51 54 A L B +A 66 0A 24 15,-1.5 15,-1.5 -2,-0.2 2,-0.3 -0.961 28.6 158.8-152.0 156.6 47.9 26.0 2.3 52 55 A Q + 0 0 80 63,-0.9 13,-0.2 -2,-0.3 12,-0.1 -0.906 23.3 96.6-161.5-175.4 46.9 29.4 1.1 53 56 A G S S- 0 0 26 10,-0.7 -1,-0.2 11,-0.4 11,-0.1 0.871 79.5 -71.7 81.6 104.0 47.5 31.7 -1.8 54 57 A Q + 0 0 128 9,-0.3 2,-0.3 1,-0.1 9,-0.3 0.388 63.7 169.3 -20.0 135.0 45.3 32.2 -4.9 55 58 A I E -B 62 0B 26 7,-2.4 7,-3.8 2,-0.1 2,-0.4 -0.958 30.4-125.7-153.3 164.2 45.8 29.2 -7.1 56 59 A E E +B 61 0B 84 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.941 23.5 176.3-122.1 140.1 44.2 27.8 -10.2 57 60 A V S S- 0 0 2 3,-1.6 3,-0.4 -2,-0.4 -2,-0.1 -0.930 78.0 -11.7-146.1 122.3 42.8 24.3 -10.4 58 61 A K S S- 0 0 115 -2,-0.4 2,-4.2 1,-0.3 -1,-0.1 0.973 121.9 -70.6 42.4 64.2 41.1 23.1 -13.5 59 62 A G S S+ 0 0 40 -3,-0.1 2,-0.3 1,-0.0 -1,-0.3 -0.082 116.2 102.2 51.7 -49.8 41.1 26.7 -14.6 60 63 A M S S- 0 0 90 -2,-4.2 -3,-1.6 -3,-0.4 2,-0.2 -0.518 71.6-141.7 -61.6 123.9 38.5 28.0 -12.1 61 64 A K E -B 56 0B 106 -2,-0.3 -5,-0.3 -5,-0.2 2,-0.3 -0.488 18.0-164.7 -90.8 164.3 40.9 29.6 -9.6 62 65 A Y E -B 55 0B 13 -7,-3.8 -7,-2.4 -2,-0.2 -40,-0.1 -0.804 15.1-179.8-135.8 169.6 40.6 29.8 -5.9 63 66 A N + 0 0 97 -9,-0.3 -10,-0.7 -2,-0.3 -9,-0.3 0.458 41.0 119.9-148.7 -12.3 42.3 31.8 -3.3 64 67 A G - 0 0 47 -42,-0.2 -11,-0.4 -12,-0.1 2,-0.3 0.564 59.5-101.9 -45.5-174.1 41.1 30.8 0.0 65 68 A V - 0 0 57 -13,-0.2 2,-0.4 -12,-0.0 -13,-0.2 -0.832 26.3-172.0-113.9 155.3 42.6 29.4 3.1 66 69 A M B -A 51 0A 47 -15,-1.5 -15,-1.5 -2,-0.3 73,-0.1 -0.947 20.0-134.4-147.5 138.6 42.6 25.8 4.3 67 70 A S - 0 0 28 71,-0.5 2,-0.3 -2,-0.4 -17,-0.3 -0.191 12.5-120.9 -85.8 176.9 43.8 24.8 7.6 68 71 A S - 0 0 22 -19,-0.3 -20,-0.3 1,-0.2 -21,-0.2 -0.813 9.4-162.5-113.8 159.5 46.1 22.0 8.6 69 72 A F + 0 0 60 -22,-6.2 -21,-0.2 -2,-0.3 -1,-0.2 0.810 25.7 160.7-103.0 -47.4 44.9 19.4 10.9 70 73 A A + 0 0 32 -23,-1.3 -22,-0.1 1,-0.2 4,-0.1 0.743 59.3 84.2 31.3 34.2 48.5 18.2 11.6 71 74 A Q + 0 0 125 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.686 58.3 93.6-118.5 -51.9 47.0 16.7 14.7 72 75 A L S S- 0 0 18 1,-0.1 2,-0.1 4,-0.1 -3,-0.1 -0.194 93.4-104.5 -44.6 134.7 45.7 13.6 13.4 73 76 A K > - 0 0 119 1,-0.1 4,-1.8 4,-0.1 -1,-0.1 -0.397 35.9 -95.8 -67.0 146.5 48.5 11.1 14.1 74 77 A D T 4 S+ 0 0 20 2,-0.2 4,-0.2 3,-0.1 -1,-0.1 0.810 134.8 52.6 -29.5 -37.6 50.6 10.2 11.0 75 78 A E T 4 S+ 0 0 137 1,-0.1 4,-0.4 3,-0.1 -3,-0.1 0.771 101.5 51.9 -62.5-107.1 48.2 7.4 11.2 76 79 A E T >> S+ 0 0 70 2,-0.2 4,-1.1 3,-0.1 3,-0.6 0.383 121.7 37.3 4.4 -63.6 44.9 9.4 11.2 77 80 A I T >< S+ 0 0 0 -4,-1.8 2,-8.9 1,-0.2 3,-0.9 0.733 96.8 74.2 -60.5-110.1 46.2 11.2 8.1 78 81 A A T 3> S+ 0 0 13 1,-0.3 4,-0.6 -4,-0.2 -1,-0.2 0.118 109.5 37.6 30.5 -43.1 48.0 8.5 6.2 79 82 A A H X> S+ 0 0 32 -2,-8.9 2,-4.2 -3,-0.6 4,-2.4 0.934 94.8 68.2 -90.6 -69.6 44.4 7.3 5.4 80 83 A V H << S+ 0 0 8 -4,-1.1 -2,-0.1 -3,-0.9 -1,-0.1 0.169 109.3 52.7 -48.2 27.5 42.0 10.1 4.7 81 84 A L H 3> S+ 0 0 0 -2,-4.2 4,-2.1 -4,-0.2 5,-0.3 0.515 101.5 46.9-131.9 -61.7 44.2 10.4 1.7 82 85 A N H < S+ 0 0 57 -4,-0.7 3,-4.9 -3,-0.4 2,-4.4 0.610 99.3 91.0-123.4 -49.6 40.8 6.3 -4.4 87 90 A A T 3< S+ 0 0 45 -4,-1.3 -4,-0.1 -5,-0.5 -3,-0.1 0.006 105.6 27.6 -54.3 36.8 37.3 6.9 -3.0 88 91 A W T 3 S- 0 0 76 -2,-4.4 -1,-0.3 -3,-0.1 -4,-0.1 0.045 133.2 -77.9-173.5 12.9 36.1 8.5 -6.2 89 92 A G S < S+ 0 0 34 -3,-4.9 -58,-0.2 3,-0.0 -3,-0.2 0.861 88.7 115.6 80.0 99.2 38.5 6.7 -8.6 90 93 A D > + 0 0 2 -4,-0.1 4,-1.5 -60,-0.1 -4,-0.3 0.207 64.1 69.6-160.0 -52.6 42.0 7.9 -8.8 91 94 A A T 4 S+ 0 0 38 -6,-1.3 6,-0.3 -9,-0.2 -5,-0.1 0.744 108.4 61.1 -46.2 -11.9 44.3 5.2 -7.6 92 95 A K T 4 S+ 0 0 146 -7,-0.2 -3,-0.0 -6,-0.1 -2,-0.0 0.694 102.3 35.1 -75.6-123.7 42.8 4.2 -10.9 93 96 A K T 4 S+ 0 0 165 3,-0.1 -2,-0.1 -4,-0.0 3,-0.1 0.468 112.1 74.4 0.1 -57.8 43.7 6.6 -13.6 94 97 A V S < S- 0 0 25 -4,-1.5 3,-0.1 1,-0.1 -4,-0.1 -0.314 100.8 -93.4 -70.2 148.2 47.1 7.0 -11.9 95 98 A K - 0 0 190 1,-0.2 2,-2.5 -2,-0.0 -1,-0.1 -0.241 64.1 -68.4 -62.3 148.9 49.6 4.2 -12.2 96 99 A G S S- 0 0 87 -3,-0.1 -1,-0.2 1,-0.1 -4,-0.1 -0.058 71.2-166.2 -42.4 71.3 49.7 1.6 -9.4 97 100 A F - 0 0 33 -2,-2.5 -1,-0.1 -6,-0.3 -62,-0.0 -0.268 27.7-104.2 -66.0 144.8 51.0 4.1 -7.0 98 101 A K - 0 0 125 1,-0.1 -1,-0.1 0, 0.0 -3,-0.0 -0.512 46.1-117.7 -64.8 135.7 52.4 3.0 -3.7 99 102 A P - 0 0 68 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.318 36.5 -83.2 -59.6-157.2 49.7 3.8 -1.2 100 103 A F - 0 0 13 -22,-0.2 2,-0.2 -21,-0.1 -21,-0.0 -0.527 44.7-167.7-104.8 178.0 50.3 6.3 1.7 101 104 A T >> - 0 0 40 -2,-0.2 4,-0.7 -27,-0.1 3,-0.6 -0.900 28.2-121.9-167.2 148.0 52.0 5.5 5.2 102 105 A A H 3> S+ 0 0 33 1,-0.2 4,-2.9 -2,-0.2 5,-0.3 0.703 104.5 58.1 -63.1 -32.4 52.6 6.9 8.6 103 106 A E H 3> S+ 0 0 170 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.912 108.6 50.8 -67.2 -35.2 56.3 7.0 8.9 104 107 A E H <4 S+ 0 0 34 -3,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.706 107.3 56.3 -69.5 -23.8 56.2 9.2 5.8 105 108 A V H >X S+ 0 0 0 -4,-0.7 3,-1.5 2,-0.2 4,-0.5 0.960 113.9 34.0 -77.9 -51.2 53.8 11.2 7.6 106 109 A K H >X S+ 0 0 145 -4,-2.9 3,-0.9 1,-0.3 4,-0.8 0.830 105.3 76.1 -71.5 -23.5 55.9 11.9 10.7 107 110 A K H 3< S+ 0 0 144 -4,-3.0 4,-0.3 -5,-0.3 -1,-0.3 0.649 105.1 37.4 -52.1 -15.6 58.8 11.9 8.2 108 111 A L H <> S+ 0 0 10 -3,-1.5 4,-0.6 2,-0.2 -1,-0.3 0.539 86.0 85.4-120.5 -9.7 57.4 15.3 7.4 109 112 A R H X< S+ 0 0 66 -3,-0.9 3,-0.7 -4,-0.5 -2,-0.1 0.760 91.1 66.7 -55.7 -27.0 56.3 16.8 10.7 110 113 A A T 3< S+ 0 0 73 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.970 83.1 63.8 -53.5 -68.7 60.0 17.6 10.5 111 114 A K T 34 S- 0 0 120 -4,-0.3 -1,-0.3 1,-0.1 -2,-0.2 0.721 81.7-173.4 -25.5 -39.1 59.5 20.0 7.6 112 115 A K << + 0 0 180 -3,-0.7 -3,-0.1 -4,-0.6 -1,-0.1 0.836 28.1 161.4 22.9 75.3 57.4 22.0 10.2 113 116 A L - 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