==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT (CYTOCHROME) 14-FEB-94 1CXC . COMPND 2 MOLECULE: CYTOCHROME C2; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR H.L.AXELROD,G.FEHER,J.P.ALLEN,A.J.CHIRINO,M.W.DAY,B.T.HSU, . 124 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6765.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 74 59.7 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 . 6 4.8 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 0.8 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 . 7 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 38 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 1 1 2 0 0 0 0 1 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 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 ANTIPARALLEL 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 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 1 A Q 0 0 126 0, 0.0 111,-0.1 0, 0.0 110,-0.0 0.000 360.0 360.0 360.0 -89.6 72.6 8.3 11.9 2 2 A E + 0 0 196 109,-0.1 110,-0.1 2,-0.1 109,-0.0 0.533 360.0 97.7 -85.6 0.5 74.0 5.0 13.2 3 3 A G S S- 0 0 17 108,-0.3 109,-0.2 1,-0.1 106,-0.1 -0.055 84.8-105.5 -77.9 169.2 75.2 6.9 16.3 4 4 A D > - 0 0 73 1,-0.1 4,-1.9 2,-0.0 112,-0.2 -0.885 23.5-160.8-101.9 108.7 73.4 6.9 19.6 5 5 A P H > S+ 0 0 41 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.689 88.9 52.6 -56.9 -40.4 71.7 10.3 20.2 6 6 A E H > S+ 0 0 161 2,-0.2 4,-1.2 1,-0.1 5,-0.1 0.849 112.3 44.9 -65.2 -43.8 71.4 9.9 24.0 7 7 A A H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.840 112.6 55.2 -64.0 -35.6 75.0 9.1 24.4 8 8 A G H X S+ 0 0 0 -4,-1.9 4,-1.8 104,-0.3 -1,-0.2 0.832 100.8 56.3 -60.7 -47.5 75.6 12.0 22.0 9 9 A A H < S+ 0 0 35 -4,-1.4 4,-0.2 2,-0.2 -1,-0.2 0.820 111.0 45.3 -50.9 -44.0 73.6 14.4 24.2 10 10 A K H >< S+ 0 0 130 -4,-1.2 3,-1.2 2,-0.2 4,-0.3 0.846 111.1 51.5 -66.2 -44.7 76.0 13.5 27.1 11 11 A A H >< S+ 0 0 11 -4,-2.1 3,-1.4 1,-0.2 4,-0.3 0.855 97.8 70.1 -65.0 -19.7 79.1 13.8 24.9 12 12 A F G >X S+ 0 0 1 -4,-1.8 3,-1.3 1,-0.3 4,-1.0 0.677 75.2 82.6 -73.4 -12.7 77.9 17.2 23.8 13 13 A N G X4 S+ 0 0 93 -3,-1.2 3,-0.7 1,-0.3 -1,-0.3 0.868 84.3 60.6 -59.7 -35.8 78.6 18.7 27.3 14 14 A Q G X4 S+ 0 0 75 -3,-1.4 3,-0.5 -4,-0.3 -1,-0.3 0.751 102.3 51.8 -58.1 -35.8 82.2 19.1 26.2 15 15 A C G X> S+ 0 0 25 -3,-1.3 4,-2.5 -4,-0.3 3,-2.0 0.711 88.8 80.8 -73.8 -17.9 81.1 21.4 23.4 16 16 A Q G << S+ 0 0 39 -4,-1.0 16,-0.5 -3,-0.7 18,-0.3 0.572 71.4 78.8 -69.9 -8.7 79.1 23.6 25.8 17 17 A T G <4 S+ 0 0 110 -3,-0.5 -1,-0.3 -4,-0.2 19,-0.2 0.799 121.1 5.6 -65.4 -21.7 82.2 25.4 26.9 18 18 A C T <4 S+ 0 0 39 -3,-2.0 19,-2.7 1,-0.2 2,-0.3 0.599 122.8 60.7-136.1 -22.0 81.9 27.3 23.6 19 19 A H < - 0 0 28 -4,-2.5 13,-0.3 17,-0.2 15,-0.2 -0.894 49.0-168.6-114.5 168.2 78.7 26.4 21.8 20 20 A V - 0 0 16 -2,-0.3 20,-2.6 18,-0.3 2,-0.4 -0.672 17.3-144.0-147.7 149.4 75.0 26.5 22.3 21 21 A I E +A 30 0A 0 9,-2.3 8,-2.8 -2,-0.2 9,-1.8 -0.916 33.6 162.6-118.6 95.0 72.0 25.0 20.5 22 22 A V E -A 28 0A 31 -2,-0.4 6,-0.2 6,-0.2 19,-0.2 -0.988 28.2-135.3-113.2 131.4 69.2 27.6 20.7 23 23 A D > - 0 0 44 4,-2.4 3,-1.4 -2,-0.4 18,-0.1 0.087 32.0 -90.0 -84.6 179.7 66.2 27.3 18.3 24 24 A D T 3 S+ 0 0 106 1,-0.2 -1,-0.1 2,-0.1 99,-0.0 0.693 124.0 55.4 -67.5 0.1 64.5 29.9 16.3 25 25 A S T 3 S- 0 0 95 2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.506 121.5-101.8-109.5 3.5 62.0 30.7 19.1 26 26 A G S < S+ 0 0 53 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.421 73.7 144.0 90.2 9.6 64.8 31.5 21.6 27 27 A T - 0 0 76 1,-0.1 -4,-2.4 -5,-0.1 2,-0.6 -0.540 47.5-134.5 -86.7 134.1 64.6 28.2 23.4 28 28 A T E +A 22 0A 81 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.764 27.0 173.0 -84.4 111.6 67.8 26.7 24.7 29 29 A I E S- 0 0 62 -8,-2.8 2,-0.3 -2,-0.6 -1,-0.2 0.790 73.9 -5.1 -90.0 -20.8 67.9 23.0 23.9 30 30 A A E S+A 21 0A 9 -9,-1.8 -9,-2.3 -18,-0.0 -1,-0.4 -0.999 95.8 66.3-168.4 133.0 71.5 22.6 25.0 31 31 A G - 0 0 21 -2,-0.3 -11,-0.1 -11,-0.2 -14,-0.1 -0.278 61.6-111.7 143.1 175.0 74.1 25.0 26.3 32 32 A R - 0 0 122 -16,-0.5 -1,-0.1 -13,-0.3 -12,-0.1 -0.484 68.7 -88.2-138.8 34.8 75.3 27.3 29.0 33 33 A N S S+ 0 0 83 1,-0.2 2,-0.1 -2,-0.1 -13,-0.1 0.549 73.9 156.8 63.9 21.3 75.1 30.7 27.1 34 34 A A - 0 0 20 -18,-0.3 -1,-0.2 -15,-0.2 -14,-0.1 -0.396 22.0-175.6 -76.4 140.4 78.7 30.4 25.8 35 35 A K + 0 0 131 -18,-0.2 -1,-0.1 -16,-0.1 -16,-0.1 0.142 51.6 104.5-123.1 18.3 79.3 32.5 22.6 36 36 A T S S+ 0 0 101 -19,-0.2 -17,-0.2 -18,-0.2 -1,-0.1 0.869 89.4 29.1 -62.8 -48.5 82.8 31.5 21.6 37 37 A G S S- 0 0 13 -19,-2.7 -17,-0.2 1,-0.1 3,-0.1 -0.707 102.7 -81.0-106.0 172.5 81.7 29.3 18.8 38 38 A P - 0 0 19 0, 0.0 -18,-0.3 0, 0.0 -1,-0.1 -0.262 50.3 -88.6 -72.3 163.5 78.5 29.6 16.6 39 39 A N - 0 0 29 1,-0.2 -18,-0.2 -20,-0.1 15,-0.1 -0.442 34.3-154.8 -68.6 126.4 75.0 28.5 17.5 40 40 A L > + 0 0 22 -20,-2.6 3,-1.9 -2,-0.1 2,-0.2 0.426 57.0 115.7 -85.8 -6.9 74.8 24.8 16.3 41 41 A Y T 3 S+ 0 0 26 -21,-0.3 81,-0.1 1,-0.3 80,-0.1 -0.544 87.6 16.2 -62.2 125.6 71.0 24.8 15.9 42 42 A G T 3 S+ 0 0 6 79,-1.9 -1,-0.3 -2,-0.2 80,-0.1 0.664 85.9 127.9 86.7 10.0 70.4 24.3 12.2 43 43 A V X + 0 0 9 -3,-1.9 3,-1.5 78,-0.3 2,-0.5 0.643 40.0 102.9 -65.3 -39.0 74.0 23.1 11.5 44 44 A V T 3 S- 0 0 33 77,-0.7 79,-0.3 1,-0.2 28,-0.1 -0.601 103.5 -3.2 -49.9 112.0 72.8 20.0 9.7 45 45 A G T 3 S+ 0 0 51 26,-2.0 -1,-0.2 -2,-0.5 2,-0.2 0.388 100.8 142.6 80.0 11.1 73.2 20.8 6.0 46 46 A R < - 0 0 27 -3,-1.5 25,-2.4 24,-0.1 -1,-0.3 -0.443 57.8-110.8 -89.3 142.4 74.4 24.3 6.7 47 47 A T B > -B 70 0B 59 23,-0.3 3,-1.1 -2,-0.2 23,-0.3 -0.452 44.1-104.8 -67.6 132.6 77.1 25.9 4.6 48 48 A A T 3 S+ 0 0 2 21,-2.4 20,-0.1 1,-0.2 -1,-0.1 -0.267 99.6 19.3 -61.1 138.8 80.2 26.3 6.7 49 49 A G T 3 S+ 0 0 17 16,-0.1 -1,-0.2 -3,-0.1 8,-0.1 0.680 97.3 101.4 75.2 33.2 81.0 29.8 7.9 50 50 A T < + 0 0 75 -3,-1.1 2,-0.1 3,-0.0 -2,-0.1 0.397 26.9 133.6-131.3 0.2 77.6 31.2 7.4 51 51 A Q > - 0 0 23 1,-0.2 3,-1.5 -4,-0.1 -9,-0.0 -0.412 54.9-137.2 -53.9 123.4 75.7 31.4 10.7 52 52 A A T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -2,-0.1 0, 0.0 0.867 93.5 41.9 -61.5 -27.9 74.2 34.9 10.5 53 53 A D T 3 S+ 0 0 112 -14,-0.0 2,-0.7 2,-0.0 -1,-0.3 0.267 89.6 96.6-102.3 9.0 74.9 36.1 14.0 54 54 A F < + 0 0 33 -3,-1.5 3,-0.4 1,-0.1 -1,-0.0 -0.892 42.6 176.0 -99.2 116.7 78.3 34.7 14.5 55 55 A K + 0 0 181 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.0 0.626 61.9 78.1-100.8 12.6 81.0 37.3 13.8 56 56 A G + 0 0 25 -20,-0.0 -1,-0.2 2,-0.0 2,-0.0 0.185 54.5 135.8-109.3 26.3 84.0 35.2 14.7 57 57 A Y - 0 0 25 -3,-0.4 2,-0.1 -8,-0.1 41,-0.0 -0.360 49.1-128.7 -72.3 147.4 84.7 32.9 11.8 58 58 A G > - 0 0 13 1,-0.1 4,-1.8 -2,-0.0 3,-0.2 -0.441 23.9-108.8 -84.8 169.4 88.2 32.5 10.6 59 59 A E H > S+ 0 0 134 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.908 116.5 59.1 -73.0 -23.6 89.2 32.9 7.0 60 60 A G H > S+ 0 0 6 37,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.908 108.0 44.9 -69.4 -39.6 89.9 29.2 6.6 61 61 A M H > S+ 0 0 20 36,-0.3 4,-1.6 -3,-0.2 -1,-0.2 0.839 112.7 50.4 -70.5 -40.3 86.2 28.3 7.5 62 62 A K H X S+ 0 0 91 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.948 111.0 50.6 -62.7 -42.3 84.8 31.0 5.4 63 63 A E H X S+ 0 0 56 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.822 107.8 51.4 -58.3 -52.8 86.9 29.7 2.5 64 64 A A H <>S+ 0 0 0 -4,-1.7 5,-2.4 -5,-0.2 -1,-0.2 0.823 109.9 49.7 -53.5 -45.9 85.8 26.1 2.9 65 65 A G H ><5S+ 0 0 6 -4,-1.6 3,-1.4 3,-0.2 -2,-0.2 0.853 108.6 52.7 -59.8 -46.7 82.1 27.2 2.9 66 66 A A H 3<5S+ 0 0 86 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.850 103.5 58.6 -55.5 -36.3 82.7 29.2 -0.3 67 67 A K T 3<5S- 0 0 107 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.407 132.0 -96.9 -64.2 -21.6 84.2 26.1 -1.8 68 68 A G T < 5 + 0 0 53 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.441 65.8 159.8 115.8 15.1 80.9 24.5 -1.1 69 69 A L < + 0 0 2 -5,-2.4 -21,-2.4 -22,-0.1 2,-0.4 -0.313 9.6 175.0 -76.5 117.4 81.3 22.7 2.2 70 70 A A B -B 47 0B 41 -23,-0.3 -23,-0.3 -2,-0.1 5,-0.2 -0.999 40.8 -97.1-116.8 141.1 77.9 22.0 3.9 71 71 A W + 0 0 21 -25,-2.4 -26,-2.0 -2,-0.4 2,-0.3 -0.279 54.5 152.8 -71.6 116.8 77.9 19.9 7.1 72 72 A D > - 0 0 73 -28,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.876 57.7 -91.3-122.7-178.0 77.2 16.2 6.8 73 73 A E H > S+ 0 0 43 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.927 120.3 50.2 -66.7 -40.2 78.3 13.3 9.0 74 74 A E H > S+ 0 0 61 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.926 116.3 40.1 -67.8 -37.8 81.4 12.4 7.2 75 75 A H H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.898 114.2 54.9 -76.1 -34.6 82.8 16.0 7.1 76 76 A F H X S+ 0 0 22 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.944 107.7 48.6 -65.8 -41.5 81.6 16.7 10.6 77 77 A V H X S+ 0 0 11 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.918 113.5 46.2 -76.5 -18.7 83.4 13.7 12.1 78 78 A Q H X S+ 0 0 85 -4,-1.4 4,-0.9 -5,-0.3 3,-0.2 0.925 113.7 50.1 -81.4 -40.4 86.7 14.5 10.4 79 79 A Y H >< S+ 0 0 21 -4,-2.5 3,-1.0 1,-0.2 7,-0.2 0.949 106.8 50.2 -63.1 -52.8 86.4 18.2 11.4 80 80 A V H 3< S+ 0 0 14 -4,-2.4 24,-2.6 1,-0.2 -1,-0.2 0.745 105.9 59.4 -60.2 -26.4 85.7 17.8 15.1 81 81 A Q H 3< S- 0 0 60 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.765 133.5 -6.1 -72.7 -29.1 88.7 15.4 15.5 82 82 A D S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.909 84.0 47.6 -66.9 -30.4 89.7 21.3 12.9 84 84 A T H > S+ 0 0 46 1,-0.2 4,-2.2 16,-0.2 5,-0.2 0.937 113.1 46.9 -81.1 -33.4 92.9 22.8 11.5 85 85 A K H > S+ 0 0 102 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.885 112.0 51.5 -69.7 -47.0 94.0 19.7 9.6 86 86 A F H X S+ 0 0 16 -4,-2.2 4,-2.2 -7,-0.2 5,-0.3 0.939 110.4 48.9 -53.4 -46.5 90.5 19.2 8.2 87 87 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 6,-0.4 0.879 109.3 52.7 -66.6 -34.3 90.5 22.8 7.0 88 88 A K H X S+ 0 0 74 -4,-2.2 4,-1.4 1,-0.2 5,-0.3 0.943 113.9 41.9 -68.9 -39.9 93.9 22.6 5.4 89 89 A E H < S+ 0 0 110 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.875 118.5 43.5 -71.1 -50.6 93.0 19.5 3.4 90 90 A Y H < S+ 0 0 75 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.823 116.5 45.6 -55.4 -59.4 89.5 20.6 2.3 91 91 A T H < S- 0 0 13 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.772 99.7-134.7 -59.5 -23.0 90.5 24.1 1.5 92 92 A G S < S+ 0 0 70 -4,-1.4 2,-0.6 -5,-0.3 -3,-0.1 0.450 72.5 112.3 72.9 12.8 93.6 22.9 -0.5 93 93 A D > - 0 0 59 -6,-0.4 3,-2.1 -5,-0.3 -1,-0.2 -0.866 55.9-158.9-121.2 116.3 95.5 25.7 1.3 94 94 A A T 3 S+ 0 0 77 -2,-0.6 -6,-0.1 1,-0.3 -1,-0.1 0.518 89.2 62.1 -68.8 -20.6 98.2 24.5 3.7 95 95 A K T 3 S+ 0 0 107 -7,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.284 77.1 123.5 -80.5 -8.2 98.3 27.7 5.6 96 96 A A < - 0 0 6 -3,-2.1 2,-0.3 -36,-0.1 -8,-0.2 -0.482 40.1-172.1 -54.7 141.9 94.7 27.4 6.6 97 97 A K - 0 0 59 -2,-0.2 -37,-0.5 -10,-0.1 -36,-0.3 -0.958 15.6-138.2-140.1 139.6 93.9 27.6 10.3 98 98 A G - 0 0 19 -2,-0.3 -14,-0.1 -38,-0.1 -39,-0.1 -0.673 8.1-145.5 -94.7 148.4 90.8 27.0 12.4 99 99 A K S S+ 0 0 136 -2,-0.3 2,-0.9 -41,-0.1 -1,-0.1 0.439 77.5 95.7 -82.7 -17.4 89.8 29.2 15.3 100 100 A M - 0 0 45 1,-0.1 -16,-0.2 2,-0.0 -2,-0.1 -0.796 52.4-176.6 -76.1 114.2 88.3 26.1 17.1 101 101 A T + 0 0 139 -2,-0.9 2,-0.2 -18,-0.1 -1,-0.1 0.631 49.3 98.0-100.6 19.1 91.0 24.9 19.4 102 102 A F - 0 0 76 -87,-0.0 2,-0.4 -20,-0.0 -2,-0.0 -0.470 52.6-164.0-106.7 132.9 89.2 21.9 20.8 103 103 A K - 0 0 110 -2,-0.2 2,-0.6 -21,-0.1 -22,-0.2 -0.972 14.5-141.2-116.1 128.4 89.8 18.4 19.4 104 104 A L - 0 0 5 -24,-2.6 6,-0.1 -2,-0.4 -2,-0.0 -0.673 13.1-162.5 -83.8 119.7 87.4 15.5 20.1 105 105 A K + 0 0 135 -2,-0.6 2,-0.6 1,-0.1 -1,-0.2 0.837 65.2 70.9 -80.3 -21.8 89.6 12.4 20.6 106 106 A K > - 0 0 86 1,-0.1 4,-1.6 2,-0.0 3,-0.4 -0.773 58.2-161.3-104.8 126.9 87.0 9.7 20.2 107 107 A E H > S+ 0 0 109 -2,-0.6 4,-2.1 1,-0.3 5,-0.2 0.796 95.0 58.0 -61.5 -46.1 85.4 8.9 16.8 108 108 A A H > S+ 0 0 59 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.881 104.6 50.6 -53.6 -43.2 82.5 7.2 18.4 109 109 A D H > S+ 0 0 40 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.902 107.4 55.2 -63.4 -35.9 81.7 10.4 20.3 110 110 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.941 110.9 43.6 -63.0 -43.3 81.8 12.3 17.0 111 111 A H H X S+ 0 0 58 -4,-2.1 4,-2.0 2,-0.2 -108,-0.3 0.854 113.9 51.1 -68.3 -39.6 79.2 10.0 15.4 112 112 A N H X S+ 0 0 31 -4,-2.2 4,-2.0 2,-0.2 -104,-0.3 0.903 109.6 49.7 -63.6 -42.7 77.0 10.0 18.6 113 113 A I H X S+ 0 0 5 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.933 108.9 53.0 -65.0 -34.4 77.0 13.8 18.7 114 114 A W H X S+ 0 0 7 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.933 108.3 50.1 -68.0 -38.9 76.1 13.9 15.0 115 115 A A H < S+ 0 0 3 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.902 109.1 52.5 -65.5 -32.7 73.1 11.6 15.7 116 116 A Y H >X S+ 0 0 26 -4,-2.0 4,-2.4 -112,-0.2 3,-1.4 0.954 108.5 50.5 -68.8 -36.9 72.1 13.8 18.6 117 117 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.828 104.2 56.9 -71.6 -32.6 72.2 16.9 16.3 118 118 A Q H 3< S+ 0 0 64 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.635 111.2 47.1 -69.9 -16.5 70.0 15.1 13.7 119 119 A Q H <4 S+ 0 0 130 -3,-1.4 -2,-0.2 -4,-0.5 3,-0.2 0.862 131.1 11.4 -92.5 -34.0 67.5 14.7 16.5 120 120 A V H < S+ 0 0 44 -4,-2.4 -3,-0.2 1,-0.1 -2,-0.2 0.519 120.3 54.5-119.5 -17.1 67.4 18.2 17.9 121 121 A A < + 0 0 0 -4,-2.3 -79,-1.9 -5,-0.3 -77,-0.7 0.107 69.1 118.9-112.1 27.3 69.2 20.7 15.7 122 122 A V - 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