==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 04-JUN-10 3NBS . COMPND 2 MOLECULE: CYTOCHROME C; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR M.TAKETA,H.KOMORI,S.HIROTA,Y.HIGUCHI . 416 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23923.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 243 58.4 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 2.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 20 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 138 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 5 3 0 0 0 4 0 4 0 0 4 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 . 6 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 1 A G 0 0 87 0, 0.0 2,-0.8 0, 0.0 197,-0.1 0.000 360.0 360.0 360.0 139.8 21.9 -11.3 11.7 2 2 A D > - 0 0 56 192,-0.3 4,-2.4 1,-0.2 200,-0.2 -0.744 360.0-167.1 -91.0 106.0 21.4 -8.3 14.1 3 3 A V H > S+ 0 0 34 -2,-0.8 4,-2.1 1,-0.2 5,-0.2 0.882 83.8 53.4 -55.8 -50.0 18.0 -8.5 15.8 4 4 A E H > S+ 0 0 46 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.891 113.6 43.5 -56.9 -42.3 18.0 -4.9 17.3 5 5 A K H > S+ 0 0 116 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.916 111.6 54.2 -69.3 -43.0 18.7 -3.4 13.9 6 6 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 192,-0.3 -2,-0.2 0.808 104.4 55.8 -60.4 -31.6 16.2 -5.6 12.2 7 7 A K H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.898 107.5 48.2 -68.0 -40.4 13.6 -4.5 14.6 8 8 A K H X S+ 0 0 92 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.915 111.8 49.3 -66.0 -43.9 14.1 -0.8 13.7 9 9 A I H X S+ 0 0 15 -4,-2.2 4,-3.0 1,-0.2 5,-0.4 0.927 111.1 50.2 -60.7 -45.2 14.0 -1.6 10.0 10 10 A F H X>S+ 0 0 2 -4,-2.3 5,-2.9 1,-0.2 4,-2.5 0.928 109.1 51.4 -59.2 -46.6 10.8 -3.6 10.4 11 11 A V H <5S+ 0 0 18 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.822 118.1 37.9 -60.6 -32.9 9.2 -0.7 12.3 12 12 A Q H <5S+ 0 0 113 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.871 130.4 23.8 -88.6 -38.4 10.1 1.8 9.6 13 13 A K H <5S+ 0 0 131 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.589 134.3 20.0-105.3 -13.2 9.6 -0.2 6.4 14 14 A C T >X5S+ 0 0 26 -4,-2.5 4,-2.4 -5,-0.4 3,-2.3 0.704 95.8 80.6-126.6 -36.2 7.1 -2.9 7.3 15 15 A A T 34 S- 0 0 27 1,-0.1 3,-3.0 2,-0.1 12,-0.3 -0.235 81.9 -97.6 -60.2 142.5 2.8 -11.0 16.9 22 22 A K T 3 S+ 0 0 156 187,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.424 118.3 19.0 -60.2 130.2 1.1 -14.3 17.3 23 23 A G T 3 S+ 0 0 74 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.1 0.426 96.2 161.6 84.9 -1.7 -2.6 -13.7 16.8 24 24 A G < - 0 0 18 -3,-3.0 -1,-0.3 1,-0.1 7,-0.2 -0.185 41.1-106.8 -54.2 143.4 -1.5 -10.4 15.1 25 25 A K - 0 0 165 -3,-0.1 -6,-0.3 1,-0.1 2,-0.3 -0.281 25.2-114.5 -72.4 153.7 -4.1 -8.7 13.0 26 26 A H + 0 0 63 4,-0.1 2,-0.1 -8,-0.1 -8,-0.1 -0.708 42.0 169.9 -84.7 142.7 -4.0 -8.6 9.2 27 27 A K - 0 0 122 2,-3.3 -10,-0.1 -10,-0.6 -9,-0.1 -0.197 67.1 -39.4-124.5-141.9 -3.6 -5.1 7.9 28 28 A T S S+ 0 0 84 -12,-0.4 53,-0.1 -2,-0.1 -10,-0.1 0.892 141.4 33.5 -54.8 -35.3 -2.9 -4.0 4.3 29 29 A G S S- 0 0 6 -12,-2.1 -2,-3.3 1,-0.1 2,-0.2 -0.638 103.3 -89.4-113.0 171.8 -0.6 -7.0 4.5 30 30 A P - 0 0 12 0, 0.0 -11,-0.2 0, 0.0 -4,-0.1 -0.487 45.5 -94.0 -84.1 153.3 -1.0 -10.4 6.2 31 31 A N - 0 0 18 -7,-0.2 -11,-0.2 -13,-0.2 -5,-0.1 -0.347 33.3-152.9 -58.7 144.1 0.2 -11.2 9.7 32 32 A L > + 0 0 26 -13,-2.6 3,-1.3 -11,-0.1 -12,-0.2 0.422 45.3 130.8-105.3 1.7 3.6 -12.8 9.5 33 33 A H T 3 S+ 0 0 21 -14,-0.4 175,-0.2 -12,-0.3 174,-0.1 -0.237 78.3 17.5 -56.8 141.4 3.8 -14.9 12.6 34 34 A G T 3 S+ 0 0 27 173,-3.7 -1,-0.3 -14,-0.2 174,-0.1 0.762 83.4 144.1 66.8 24.7 5.0 -18.5 11.9 35 35 A L X + 0 0 9 -3,-1.3 3,-1.9 168,-0.2 2,-0.6 0.845 41.5 87.5 -63.0 -37.9 6.3 -17.3 8.5 36 36 A F T 3 S+ 0 0 36 1,-0.3 24,-0.2 167,-0.1 3,-0.1 -0.550 100.6 15.8 -73.0 114.7 9.4 -19.6 8.6 37 37 A G T 3 S+ 0 0 60 22,-2.6 2,-0.3 -2,-0.6 -1,-0.3 0.261 101.9 120.5 105.5 -6.4 8.5 -22.9 7.0 38 38 A R < - 0 0 55 -3,-1.9 21,-3.1 21,-0.4 -1,-0.4 -0.718 61.4-126.2 -96.3 142.9 5.3 -21.5 5.5 39 39 A K B > -A 58 0A 122 -2,-0.3 3,-0.5 19,-0.3 19,-0.2 -0.428 43.7 -80.5 -79.5 156.7 4.6 -21.5 1.8 40 40 A T T 3 S+ 0 0 3 17,-2.0 -1,-0.2 1,-0.2 16,-0.1 -0.208 108.2 12.6 -58.1 146.2 3.7 -18.3 0.1 41 41 A G T 3 S+ 0 0 9 -3,-0.1 -1,-0.2 1,-0.1 7,-0.1 0.872 85.4 117.6 54.6 52.2 0.1 -17.1 0.4 42 42 A Q < + 0 0 107 -3,-0.5 -2,-0.1 2,-0.1 -1,-0.1 0.441 25.9 126.7-123.3 -4.2 -1.3 -19.3 3.2 43 43 A A > - 0 0 7 1,-0.1 3,-1.8 2,-0.1 5,-0.1 -0.419 66.4-119.3 -60.8 110.7 -2.1 -16.8 5.9 44 44 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.177 92.0 19.7 -52.1 138.9 -5.8 -17.7 6.7 45 45 A G T 3 S+ 0 0 82 1,-0.2 2,-0.3 -15,-0.1 -2,-0.1 0.334 97.2 114.4 84.3 -8.4 -8.3 -14.9 6.2 46 46 A F < - 0 0 50 -3,-1.8 2,-0.9 -15,-0.1 -1,-0.2 -0.764 61.5-135.5-101.4 144.5 -6.1 -12.8 3.9 47 47 A T - 0 0 128 -2,-0.3 2,-0.1 -3,-0.1 -6,-0.0 -0.814 28.5-175.8-101.0 100.6 -6.7 -12.1 0.2 48 48 A Y - 0 0 38 -2,-0.9 2,-0.1 -7,-0.1 30,-0.0 -0.385 29.8-105.7 -85.4 166.1 -3.5 -12.6 -1.8 49 49 A T > - 0 0 37 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.477 37.3-106.2 -83.8 164.6 -3.1 -11.8 -5.5 50 50 A D H > S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.857 122.1 58.9 -61.7 -31.5 -2.9 -14.9 -7.7 51 51 A A H > S+ 0 0 27 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.941 111.1 37.7 -61.2 -49.8 0.9 -14.2 -8.0 52 52 A N H 4 S+ 0 0 22 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.825 115.9 56.1 -71.5 -30.7 1.4 -14.4 -4.3 53 53 A K H < S+ 0 0 108 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.846 118.1 31.4 -69.7 -33.4 -1.1 -17.3 -4.1 54 54 A N H < S+ 0 0 109 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.388 78.8 110.0-108.7 3.5 0.8 -19.4 -6.7 55 55 A K < - 0 0 71 -4,-0.9 -1,-0.1 -3,-0.2 -2,-0.1 0.893 64.3-155.1 -44.1 -44.7 4.5 -18.4 -6.2 56 56 A G + 0 0 57 -4,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.868 44.5 119.1 71.8 38.4 4.9 -22.0 -4.8 57 57 A I - 0 0 35 -19,-0.0 -17,-2.0 6,-0.0 2,-0.5 -0.840 61.7-114.3-128.2 168.2 8.0 -21.4 -2.6 58 58 A T B -A 39 0A 56 -2,-0.3 2,-0.3 -19,-0.2 5,-0.3 -0.911 28.0-123.6-109.0 127.3 8.7 -21.7 1.1 59 59 A W + 0 0 19 -21,-3.1 -22,-2.6 -2,-0.5 -21,-0.4 -0.514 56.0 120.7 -70.2 126.6 9.5 -18.7 3.2 60 60 A K S > S- 0 0 85 -2,-0.3 4,-3.0 -24,-0.2 5,-0.4 -0.936 77.2 -65.4-169.8 173.5 12.8 -18.9 5.0 61 61 A E H > S+ 0 0 68 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.857 128.8 44.7 -38.1 -56.4 16.2 -17.1 5.3 62 62 A E H > S+ 0 0 136 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.942 116.9 41.8 -59.5 -54.4 17.2 -17.8 1.7 63 63 A T H > S+ 0 0 14 -5,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.905 115.1 52.2 -61.6 -40.8 13.9 -17.1 -0.1 64 64 A L H X S+ 0 0 6 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.867 104.5 56.9 -63.5 -37.3 13.3 -14.0 2.1 65 65 A M H X S+ 0 0 43 -4,-2.2 4,-0.9 -5,-0.4 -1,-0.2 0.914 113.7 38.5 -61.0 -43.7 16.8 -12.7 1.2 66 66 A E H X S+ 0 0 114 -4,-1.6 4,-1.0 2,-0.2 3,-0.5 0.956 118.7 48.3 -71.9 -50.5 16.0 -12.8 -2.5 67 67 A Y H >< S+ 0 0 34 -4,-2.9 3,-1.2 1,-0.2 7,-0.3 0.940 109.1 52.0 -53.9 -54.8 12.4 -11.6 -2.1 68 68 A L H 3< S+ 0 0 25 -4,-3.0 122,-2.4 1,-0.3 -1,-0.2 0.753 100.0 62.2 -58.3 -27.3 13.2 -8.7 0.2 69 69 A E H 3< S- 0 0 81 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.863 132.8 -6.2 -67.2 -32.9 15.8 -7.2 -2.2 70 70 A N S+ 0 0 4 0, 0.0 4,-2.8 0, 0.0 7,-0.2 0.894 89.3 49.5 -50.4 -53.9 9.5 -8.1 -4.2 72 72 A K H 4 S+ 0 0 86 115,-0.5 6,-0.2 1,-0.2 116,-0.1 0.877 110.4 52.5 -56.8 -40.7 8.2 -7.6 -7.8 73 73 A K H 4 S+ 0 0 155 -3,-0.2 -1,-0.2 1,-0.2 -6,-0.1 0.929 114.9 39.6 -62.4 -47.2 11.2 -9.3 -9.2 74 74 A Y H < S+ 0 0 17 -4,-2.0 -2,-0.2 -7,-0.3 -1,-0.2 0.844 133.0 24.5 -73.7 -34.9 10.8 -12.4 -7.0 75 75 A I S >< S- 0 0 3 -4,-2.8 3,-2.5 -5,-0.2 -1,-0.3 -0.621 82.2-154.8-131.6 74.4 7.0 -12.5 -7.3 76 76 A P T 3 S+ 0 0 83 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.255 85.0 36.0 -50.2 122.9 6.0 -10.7 -10.6 77 77 A G T 3 S+ 0 0 30 1,-0.4 2,-0.4 -26,-0.1 -26,-0.2 0.222 84.5 128.6 113.1 -12.0 2.4 -9.5 -10.0 78 78 A T < + 0 0 5 -3,-2.5 -1,-0.4 -6,-0.2 109,-0.3 -0.628 29.8 125.6 -81.3 132.6 2.9 -8.7 -6.3 79 79 A K - 0 0 57 -2,-0.4 2,-0.5 107,-0.1 107,-0.2 -0.971 60.3 -94.4-168.8 174.1 1.8 -5.2 -5.3 80 80 A M B -B 185 0B 27 105,-3.1 105,-1.9 -2,-0.3 2,-0.5 -0.924 36.2-151.0-106.7 128.9 -0.3 -3.1 -3.0 81 81 A I - 0 0 72 -2,-0.5 2,-0.5 103,-0.2 103,-0.1 -0.891 22.5-114.0-104.7 128.2 -3.7 -2.3 -4.4 82 82 A F - 0 0 68 -2,-0.5 95,-0.4 101,-0.2 2,-0.1 -0.458 41.1-114.1 -62.4 112.8 -5.5 0.9 -3.3 83 83 A A - 0 0 90 -2,-0.5 -1,-0.1 35,-0.1 92,-0.1 -0.244 29.8-132.5 -54.1 122.2 -8.6 -0.3 -1.4 84 84 A G - 0 0 37 90,-0.1 2,-0.6 -2,-0.1 90,-0.3 -0.303 5.8-132.3 -75.0 160.6 -11.8 0.6 -3.1 85 85 A I + 0 0 14 88,-2.9 6,-0.1 1,-0.1 90,-0.1 -0.899 23.7 179.4-117.7 99.9 -14.8 2.1 -1.4 86 86 A K + 0 0 138 -2,-0.6 2,-0.4 4,-0.1 -1,-0.1 0.763 53.0 91.3 -73.1 -29.8 -17.9 0.2 -2.4 87 87 A K > - 0 0 124 1,-0.2 4,-2.0 2,-0.1 5,-0.2 -0.565 64.8-151.9 -74.5 122.9 -20.5 2.1 -0.3 88 88 A K H > S+ 0 0 122 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.892 93.0 51.6 -61.6 -44.1 -22.0 4.9 -2.4 89 89 A T H > S+ 0 0 68 1,-0.2 4,-2.3 2,-0.2 18,-0.3 0.853 109.2 52.0 -63.9 -33.0 -22.9 7.2 0.5 90 90 A E H > S+ 0 0 70 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.929 109.9 48.0 -68.5 -43.4 -19.4 6.9 1.9 91 91 A R H X S+ 0 0 22 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.865 112.1 51.2 -63.0 -36.1 -17.8 7.8 -1.5 92 92 A E H X S+ 0 0 70 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.913 111.9 45.5 -67.9 -42.5 -20.2 10.8 -1.6 93 93 A D H X S+ 0 0 19 -4,-2.3 4,-2.0 1,-0.2 18,-0.4 0.887 112.6 51.3 -68.7 -38.0 -19.3 12.0 1.9 94 94 A L H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.892 111.3 47.1 -65.3 -40.1 -15.6 11.5 1.1 95 95 A I H X S+ 0 0 5 -4,-2.0 4,-3.5 2,-0.2 -1,-0.2 0.839 108.3 55.3 -71.0 -33.7 -15.8 13.5 -2.1 96 96 A A H X S+ 0 0 20 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.914 111.3 44.8 -65.2 -41.9 -17.8 16.3 -0.3 97 97 A Y H X S+ 0 0 25 -4,-2.0 4,-2.9 10,-0.2 5,-0.3 0.900 114.8 48.9 -67.4 -39.9 -15.0 16.6 2.2 98 98 A L H X S+ 0 0 10 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.920 107.6 54.1 -64.8 -44.5 -12.4 16.4 -0.6 99 99 A K H < S+ 0 0 98 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.883 116.1 40.3 -57.9 -37.8 -14.2 19.1 -2.6 100 100 A K H >< S+ 0 0 102 -4,-1.6 3,-0.8 -5,-0.2 -2,-0.2 0.955 119.4 40.3 -75.8 -53.4 -14.1 21.4 0.4 101 101 A A H >< S+ 0 0 1 -4,-2.9 3,-0.9 1,-0.2 26,-0.2 0.821 111.8 53.1 -69.9 -35.2 -10.6 20.8 1.8 102 102 A T T 3< S+ 0 0 0 -4,-2.4 37,-2.9 -5,-0.3 -1,-0.2 0.511 115.5 45.1 -78.7 -1.4 -8.7 20.6 -1.5 103 103 A N T < 0 0 91 -3,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.236 360.0 360.0-122.8 11.6 -10.2 24.0 -2.3 104 104 A E < 0 0 134 -3,-0.9 23,-0.4 -4,-0.1 35,-0.1 -0.706 360.0 360.0-116.8 360.0 -9.8 25.9 0.9 105 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 106 1 B G 0 0 86 0, 0.0 2,-1.0 0, 0.0 -13,-0.2 0.000 360.0 360.0 360.0 141.0 -22.4 15.0 0.7 107 2 B D > - 0 0 50 -18,-0.3 4,-2.5 1,-0.2 5,-0.2 -0.706 360.0-169.2 -87.3 97.5 -21.8 14.8 4.4 108 3 B V H > S+ 0 0 53 -2,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.887 84.5 54.4 -50.6 -50.0 -18.6 16.7 5.1 109 4 B E H > S+ 0 0 146 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.920 112.4 43.5 -54.0 -47.0 -18.2 15.6 8.7 110 5 B K H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.894 111.8 52.9 -68.5 -39.2 -18.4 11.9 7.6 111 6 B G H X S+ 0 0 0 -4,-2.5 4,-3.0 -18,-0.4 -1,-0.2 0.857 104.5 58.1 -63.3 -34.2 -16.1 12.4 4.7 112 7 B K H X S+ 0 0 117 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.923 108.6 43.9 -60.9 -47.5 -13.6 13.9 7.0 113 8 B K H X S+ 0 0 127 -4,-1.5 4,-2.3 2,-0.2 5,-0.2 0.922 113.8 50.3 -66.0 -44.7 -13.4 10.8 9.2 114 9 B I H X S+ 0 0 25 -4,-2.3 4,-3.0 2,-0.2 5,-0.5 0.961 110.6 50.4 -57.3 -50.4 -13.3 8.5 6.3 115 10 B F H X>S+ 0 0 13 -4,-3.0 4,-3.4 1,-0.2 5,-2.6 0.938 111.7 46.8 -52.3 -53.7 -10.5 10.5 4.7 116 11 B V H <5S+ 0 0 83 -4,-2.3 5,-0.2 3,-0.2 -1,-0.2 0.834 118.7 40.8 -60.3 -35.0 -8.4 10.4 7.9 117 12 B Q H <5S+ 0 0 122 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.777 130.9 23.7 -86.7 -26.2 -8.9 6.7 8.5 118 13 B K H <5S+ 0 0 126 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.626 135.3 17.0-114.3 -15.9 -8.5 5.6 4.9 119 14 B C T >X5S+ 0 0 25 -4,-3.4 3,-2.5 -5,-0.5 4,-1.9 0.731 95.7 81.3-126.8 -39.3 -6.5 8.2 3.1 120 15 B A T 34 S- 0 0 109 1,-0.1 3,-2.2 2,-0.1 12,-0.3 -0.321 80.7 -95.6 -67.2 147.4 -4.1 21.3 2.7 127 22 B K T 3 S+ 0 0 139 -23,-0.4 -1,-0.1 1,-0.3 -2,-0.1 -0.402 117.6 18.7 -61.0 132.4 -2.8 23.9 0.4 128 23 B G T 3 S+ 0 0 75 1,-0.1 -1,-0.3 -2,-0.1 -2,-0.1 0.649 97.7 157.5 78.2 11.9 1.0 23.7 0.4 129 24 B G < - 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0 0 63 -2,-0.4 2,-0.4 -103,-0.1 -103,-0.2 -0.949 62.9-101.5-169.0-175.7 20.2 12.0 34.6 395 80 D M B -E 290 0E 63 -105,-2.3 -105,-3.7 -2,-0.3 2,-0.3 -0.998 31.2-151.4-127.2 124.7 23.0 11.9 32.0 396 81 D I - 0 0 101 -2,-0.4 2,-0.5 -107,-0.2 -107,-0.1 -0.742 25.2-106.1 -98.3 151.2 26.0 14.1 32.4 397 82 D F - 0 0 68 -2,-0.3 -115,-0.4 -109,-0.3 -109,-0.0 -0.637 30.6-128.7 -80.4 117.9 28.0 15.4 29.5 398 83 D A - 0 0 89 -2,-0.5 2,-0.2 -175,-0.1 -118,-0.1 -0.354 26.0-128.4 -63.2 141.2 31.4 13.7 29.0 399 84 D G - 0 0 12 -120,-0.2 2,-0.9 -119,-0.1 -120,-0.3 -0.537 9.3-122.2 -91.3 159.3 34.2 16.2 28.7 400 85 D I - 0 0 14 -122,-3.2 6,-0.1 -2,-0.2 -120,-0.1 -0.867 29.9-174.6-101.5 98.7 36.8 16.3 25.9 401 86 D K + 0 0 149 -2,-0.9 -1,-0.2 4,-0.1 -122,-0.1 0.922 53.9 85.0 -60.5 -53.9 40.1 16.0 27.9 402 87 D K > - 0 0 116 1,-0.1 4,-2.0 2,-0.0 5,-0.2 -0.291 69.1-144.4 -58.3 131.8 42.7 16.4 25.1 403 88 D K H > S+ 0 0 132 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.894 99.3 51.8 -62.1 -43.8 43.6 20.1 24.4 404 89 D T H > S+ 0 0 64 2,-0.2 4,-3.4 1,-0.2 -192,-0.3 0.902 108.6 50.1 -62.3 -43.0 44.0 19.4 20.7 405 90 D E H > S+ 0 0 63 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.929 110.0 50.1 -62.9 -45.1 40.7 17.7 20.3 406 91 D R H X S+ 0 0 30 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.932 114.1 47.6 -57.3 -43.7 38.9 20.5 22.0 407 92 D E H X S+ 0 0 79 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.934 113.7 44.4 -62.4 -50.7 40.7 22.8 19.6 408 93 D D H X S+ 0 0 19 -4,-3.4 4,-2.3 2,-0.2 -192,-0.3 0.950 113.2 51.7 -61.3 -47.6 39.9 20.8 16.5 409 94 D L H X S+ 0 0 1 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.916 109.8 50.4 -53.9 -45.8 36.3 20.4 17.6 410 95 D I H X S+ 0 0 8 -4,-2.4 4,-2.8 -5,-0.3 -1,-0.2 0.876 107.0 53.1 -63.0 -38.2 36.0 24.2 18.1 411 96 D A H X S+ 0 0 17 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.929 110.1 48.3 -63.4 -42.7 37.5 24.9 14.7 412 97 D Y H X S+ 0 0 23 -4,-2.3 4,-2.9 -200,-0.2 5,-0.3 0.916 113.4 48.3 -62.1 -41.3 34.8 22.6 13.1 413 98 D L H X S+ 0 0 10 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.877 108.0 54.1 -66.1 -37.5 32.2 24.4 15.2 414 99 D K H < S+ 0 0 102 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.890 117.9 36.9 -64.0 -38.1 33.5 27.8 14.2 415 100 D K H >X S+ 0 0 97 -4,-2.1 4,-2.2 -5,-0.2 3,-1.5 0.977 120.5 41.2 -77.0 -61.9 33.2 26.8 10.5 416 101 D A H 3< S+ 0 0 2 -4,-2.9 -184,-0.2 1,-0.3 -3,-0.2 0.784 110.2 56.5 -60.3 -33.9 30.0 24.7 10.4 417 102 D T T 3< S+ 0 0 1 -4,-1.8 -173,-4.7 -5,-0.3 -1,-0.3 0.418 116.6 37.0 -81.8 4.5 27.9 26.9 12.8 418 103 D N T <4 0 0 128 -3,-1.5 -2,-0.2 -175,-0.2 -1,-0.2 0.651 360.0 360.0-120.6 -35.8 28.5 30.0 10.6 419 104 D E < 0 0 147 -4,-2.2 -187,-0.4 -5,-0.1 -175,-0.1 -0.185 360.0 360.0 -70.0 360.0 28.4 28.6 7.0