==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 31-DEC-09 3L8K . COMPND 2 MOLECULE: DIHYDROLIPOYL DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR J.B.BONANNO,M.RUTTER,K.T.BAIN,S.MILLER,P.SAMPATHKUMAR, . 913 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34593.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 666 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 77 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 131 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 9 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 75 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 249 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.8 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 2 6 2 0 0 0 4 4 1 1 0 2 0 0 0 1 1 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 3 3 0 2 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 4 0 5 7 2 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 . 2 2 0 4 0 0 2 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 0 A S 0 0 94 0, 0.0 2,-0.3 0, 0.0 129,-0.2 0.000 360.0 360.0 360.0 -41.8 -27.2 60.8 28.0 2 1 A L E -a 130 0A 88 127,-1.2 129,-2.7 2,-0.0 2,-0.4 -0.815 360.0-132.8 -91.2 155.3 -24.9 58.2 29.5 3 2 A K E +a 131 0A 145 -2,-0.3 2,-0.3 127,-0.2 129,-0.2 -0.945 28.4 169.7-124.3 134.0 -22.4 59.9 31.8 4 3 A Y E -a 132 0A 27 127,-1.9 129,-0.8 -2,-0.4 25,-0.2 -0.911 37.3-136.1-137.8 159.6 -18.6 59.5 32.2 5 4 A D E S+ 0 0 35 23,-2.0 129,-2.2 1,-0.3 128,-0.6 0.881 92.3 10.3 -77.8 -40.9 -15.7 61.0 33.9 6 5 A V E -ab 134 29A 0 22,-1.6 24,-2.2 127,-0.2 2,-0.4 -0.989 58.0-153.9-143.9 141.6 -13.4 60.9 30.8 7 6 A V E -ab 135 30A 0 127,-1.6 129,-2.4 -2,-0.3 2,-0.6 -0.983 13.1-160.8-111.6 132.1 -13.7 60.1 27.2 8 7 A V E -ab 136 31A 0 22,-3.0 24,-1.6 -2,-0.4 2,-0.8 -0.952 4.4-155.3-114.2 116.1 -10.7 58.9 25.4 9 8 A I E +ab 137 32A 11 127,-2.5 129,-2.4 -2,-0.6 24,-0.1 -0.783 67.9 19.0 -92.8 107.7 -10.6 59.2 21.7 10 9 A G - 0 0 7 22,-2.3 23,-0.2 -2,-0.8 129,-0.1 0.156 64.7-134.1 105.2 138.1 -8.3 56.6 20.2 11 10 A A + 0 0 0 26,-0.2 28,-2.3 4,-0.2 29,-0.3 -0.025 65.8 107.5-117.3 25.0 -6.9 53.4 21.7 12 11 A G S >> S- 0 0 11 126,-0.5 4,-2.6 27,-0.3 3,-1.9 -0.141 95.0 -71.0 -77.8-167.7 -3.3 53.5 20.8 13 12 A G H 3> S+ 0 0 5 26,-0.5 4,-0.9 1,-0.3 5,-0.4 0.901 133.2 59.8 -52.0 -47.1 -0.5 54.2 23.3 14 13 A A H 34 S+ 0 0 8 1,-0.2 -1,-0.3 2,-0.1 125,-0.1 0.666 119.4 27.7 -52.1 -19.1 -1.5 57.8 23.6 15 14 A G H <> S+ 0 0 0 -3,-1.9 4,-2.3 123,-0.2 -2,-0.2 0.832 113.2 49.8-115.0 -53.4 -5.0 56.6 24.9 16 15 A Y H X S+ 0 0 11 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.840 103.7 55.9 -75.0 -32.7 -5.1 53.4 26.6 17 16 A H H X S+ 0 0 23 -4,-0.9 4,-1.9 -5,-0.3 -1,-0.2 0.932 114.4 43.5 -62.8 -43.2 -2.3 53.8 29.2 18 17 A G H > S+ 0 0 0 -5,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.931 113.0 51.8 -62.6 -45.3 -4.0 56.9 30.4 19 18 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.907 109.4 49.7 -58.9 -45.9 -7.4 55.2 30.3 20 19 A F H X S+ 0 0 18 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.883 110.0 50.5 -62.6 -44.2 -6.1 52.2 32.3 21 20 A R H X S+ 0 0 17 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.930 113.3 45.8 -61.6 -42.0 -4.6 54.5 35.0 22 21 A L H ><>S+ 0 0 0 -4,-2.6 5,-1.8 2,-0.2 3,-1.0 0.974 112.3 50.4 -62.2 -51.1 -7.9 56.4 35.2 23 22 A A H ><5S+ 0 0 2 -4,-3.1 3,-1.8 1,-0.3 79,-0.3 0.850 105.8 56.2 -55.9 -39.2 -10.0 53.2 35.4 24 23 A K H 3<5S+ 0 0 118 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.850 102.6 55.4 -62.3 -34.8 -7.8 51.9 38.1 25 24 A A T <<5S- 0 0 46 -4,-1.2 -1,-0.3 -3,-1.0 -2,-0.2 0.256 125.2-108.6 -76.4 9.5 -8.6 55.1 40.1 26 25 A K T < 5 + 0 0 131 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.692 69.1 150.0 65.0 24.6 -12.3 54.0 39.6 27 26 A Y < - 0 0 46 -5,-1.8 2,-0.5 -6,-0.1 -1,-0.2 -0.665 52.5-119.5 -78.2 141.4 -13.1 56.8 37.1 28 27 A N - 0 0 77 -2,-0.3 -23,-2.0 75,-0.1 -22,-1.6 -0.770 41.8-177.1 -83.9 125.9 -15.7 55.9 34.6 29 28 A V E -bc 6 103A 0 73,-2.3 75,-2.6 -2,-0.5 2,-0.5 -0.973 21.3-158.5-133.9 134.0 -14.0 56.1 31.2 30 29 A L E -bc 7 104A 1 -24,-2.2 -22,-3.0 -2,-0.4 2,-0.4 -0.974 14.9-178.4-114.6 124.0 -15.3 55.6 27.7 31 30 A M E -bc 8 105A 0 73,-2.6 75,-2.2 -2,-0.5 2,-0.3 -0.961 1.0-176.3-119.2 139.3 -12.7 54.8 25.1 32 31 A A E +bc 9 106A 3 -24,-1.6 -22,-2.3 -2,-0.4 75,-0.2 -0.997 9.2 166.5-135.5 141.8 -13.5 54.3 21.4 33 32 A D > - 0 0 17 73,-2.2 3,-1.9 -2,-0.3 76,-0.2 -0.924 35.6-134.1-150.7 130.6 -11.4 53.3 18.4 34 33 A P T 3 S+ 0 0 45 0, 0.0 75,-0.1 0, 0.0 73,-0.1 0.742 105.4 61.9 -51.8 -33.1 -12.5 52.2 14.8 35 34 A K T 3 S- 0 0 63 2,-0.2 72,-0.1 73,-0.1 3,-0.1 0.761 95.3-143.2 -64.7 -23.7 -10.0 49.3 14.9 36 35 A G S < S+ 0 0 7 -3,-1.9 2,-0.3 70,-0.2 71,-0.1 0.751 70.5 90.4 62.1 24.6 -11.8 47.8 17.9 37 36 A E S S- 0 0 62 -4,-0.0 3,-0.4 56,-0.0 -1,-0.2 -0.956 77.7-113.6-142.6 158.8 -8.4 46.8 19.2 38 37 A L S S+ 0 0 0 -2,-0.3 -26,-0.2 52,-0.3 55,-0.1 -0.536 84.9 57.8 -91.7 158.4 -5.8 48.4 21.4 39 38 A G S > S- 0 0 2 -28,-2.3 4,-1.5 -2,-0.2 -26,-0.5 0.094 81.0-142.8 114.0 -19.5 -2.3 49.5 20.3 40 39 A G H > - 0 0 8 -3,-0.4 4,-2.6 -29,-0.3 3,-0.2 -0.063 56.1 -32.5 63.5-158.3 -3.2 51.9 17.5 41 40 A N H >>S+ 0 0 48 1,-0.2 4,-3.3 2,-0.2 5,-1.3 0.830 132.8 65.2 -63.9 -32.9 -1.3 52.2 14.3 42 41 A C H >5S+ 0 0 26 -3,-0.4 6,-0.8 3,-0.2 4,-0.7 0.921 113.2 32.4 -60.4 -43.6 2.0 51.5 16.0 43 42 A L H <5S+ 0 0 5 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.885 121.2 50.3 -75.2 -42.6 0.9 47.9 16.8 44 43 A Y H <5S- 0 0 82 -4,-2.6 119,-0.7 1,-0.1 -2,-0.2 0.970 141.8 -15.8 -61.2 -48.8 -1.3 47.5 13.7 45 44 A S H <5S+ 0 0 4 -4,-3.3 116,-0.2 117,-0.2 -3,-0.2 0.359 119.1 62.5-143.5 3.8 1.4 48.7 11.2 46 45 A G S X S+ 0 0 34 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.794 121.6 54.1 -48.9 -55.1 7.1 49.7 15.4 48 47 A V H > S+ 0 0 3 -6,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.962 118.3 33.2 -54.2 -59.1 6.0 46.3 16.8 49 48 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.901 118.4 54.3 -65.3 -38.0 5.7 44.5 13.5 50 49 A S H X S+ 0 0 10 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.932 111.9 44.1 -63.3 -40.6 8.6 46.5 11.9 51 50 A K H X S+ 0 0 13 -4,-3.2 4,-3.2 2,-0.2 -1,-0.2 0.864 109.9 56.3 -69.1 -35.7 11.0 45.5 14.7 52 51 A T H X S+ 0 0 1 -4,-2.1 4,-2.2 -5,-0.3 -2,-0.2 0.957 111.4 42.9 -57.6 -47.6 9.8 42.0 14.6 53 52 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.948 113.7 52.4 -63.5 -48.3 10.7 41.8 11.0 54 53 A R H X S+ 0 0 9 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.870 110.2 48.7 -53.3 -43.7 14.0 43.7 11.7 55 54 A E H X S+ 0 0 10 -4,-3.2 4,-2.3 2,-0.2 -1,-0.2 0.905 108.6 50.8 -66.9 -43.9 14.9 41.2 14.4 56 55 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.968 115.8 42.9 -62.3 -46.9 14.2 38.0 12.5 57 56 A I H X S+ 0 0 10 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.810 112.4 51.9 -66.3 -37.5 16.3 39.3 9.6 58 57 A Q H X S+ 0 0 7 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.869 109.9 50.8 -63.1 -39.3 19.1 40.6 11.8 59 58 A T H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.924 109.9 49.7 -65.0 -47.5 19.3 37.2 13.5 60 59 A A H X S+ 0 0 13 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.943 113.7 46.7 -50.8 -49.3 19.5 35.4 10.1 61 60 A W H X S+ 0 0 103 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.870 109.2 52.0 -68.4 -41.9 22.3 37.8 9.0 62 61 A R H X S+ 0 0 16 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.928 110.4 49.7 -58.4 -44.2 24.4 37.6 12.3 63 62 A L H X S+ 0 0 14 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.836 107.4 55.0 -63.3 -32.7 24.3 33.8 12.0 64 63 A T H X S+ 0 0 31 -4,-1.5 4,-0.5 1,-0.2 5,-0.3 0.859 107.8 49.1 -69.7 -34.6 25.4 34.2 8.4 65 64 A N H < S+ 0 0 41 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.667 117.4 42.5 -72.7 -18.9 28.4 36.2 9.5 66 65 A I H < S+ 0 0 9 -4,-1.0 -2,-0.2 -5,-0.2 -3,-0.2 0.875 121.6 34.1 -95.0 -48.0 29.3 33.6 12.1 67 66 A A H < S- 0 0 36 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.1 0.480 94.5-145.7 -84.7 -3.6 28.7 30.2 10.3 68 67 A N < + 0 0 142 -4,-0.5 2,-0.3 -5,-0.3 -3,-0.1 0.802 66.2 99.8 30.1 48.6 30.0 31.9 7.1 69 68 A V S S- 0 0 69 -5,-0.3 -2,-0.2 -6,-0.2 2,-0.1 -0.888 85.6 -92.8-134.3 160.0 27.7 29.9 4.9 70 69 A K - 0 0 99 -2,-0.3 -9,-0.0 -3,-0.1 -5,-0.0 -0.451 34.2-136.2 -76.3 146.4 24.4 31.5 3.6 71 70 A I - 0 0 38 -2,-0.1 2,-0.6 -11,-0.1 -7,-0.1 -0.901 11.6-135.5-109.0 127.9 21.1 31.0 5.5 72 71 A P + 0 0 122 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.703 34.7 157.8 -88.0 115.0 17.8 30.2 3.7 73 72 A L - 0 0 59 -2,-0.6 2,-0.3 120,-0.1 -2,-0.0 -0.988 30.8-143.2-139.3 125.4 14.7 32.2 4.9 74 73 A D >> - 0 0 102 -2,-0.4 4,-1.1 1,-0.1 3,-0.8 -0.684 19.0-131.5 -84.8 140.8 11.5 32.9 3.0 75 74 A F H 3> S+ 0 0 8 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.795 106.2 64.0 -61.0 -28.1 10.0 36.3 3.5 76 75 A S H 3> S+ 0 0 31 1,-0.2 4,-1.7 92,-0.2 -1,-0.2 0.844 100.1 51.8 -66.2 -33.2 6.6 34.6 4.2 77 76 A T H <> S+ 0 0 44 -3,-0.8 4,-1.5 2,-0.2 -1,-0.2 0.832 108.9 50.4 -69.3 -34.3 8.0 32.9 7.2 78 77 A V H X S+ 0 0 3 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.884 110.1 50.4 -68.8 -40.2 9.2 36.3 8.5 79 78 A Q H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.823 106.3 56.0 -70.9 -29.8 5.7 37.7 7.9 80 79 A D H X S+ 0 0 82 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.896 107.6 48.0 -63.6 -40.3 4.2 34.8 9.8 81 80 A R H X S+ 0 0 28 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.887 109.0 53.6 -70.5 -36.6 6.3 35.6 12.8 82 81 A K H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.932 113.1 44.1 -59.5 -44.8 5.3 39.3 12.5 83 82 A D H X S+ 0 0 8 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.869 109.1 55.1 -70.3 -39.7 1.7 38.2 12.6 84 83 A Y H X S+ 0 0 81 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.963 111.8 45.8 -59.0 -43.1 2.1 35.7 15.4 85 84 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.936 111.7 50.3 -66.5 -44.9 3.6 38.5 17.5 86 85 A Q H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.953 110.1 52.1 -60.7 -43.8 0.9 41.0 16.6 87 86 A E H X S+ 0 0 71 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.901 107.2 50.9 -57.7 -46.3 -1.8 38.4 17.5 88 87 A L H X S+ 0 0 38 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.915 112.4 48.4 -56.7 -41.3 -0.3 37.7 21.0 89 88 A R H X S+ 0 0 16 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.889 105.6 54.0 -76.6 -34.2 -0.3 41.4 21.7 90 89 A F H X S+ 0 0 19 -4,-2.4 4,-1.9 1,-0.2 -52,-0.3 0.944 114.0 45.3 -56.6 -45.6 -3.9 42.2 20.5 91 90 A K H X S+ 0 0 121 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.835 111.0 52.9 -64.0 -40.0 -5.0 39.4 22.9 92 91 A Q H X S+ 0 0 10 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.920 108.0 48.6 -66.9 -46.2 -2.8 40.6 25.7 93 92 A H H X S+ 0 0 7 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.908 113.4 49.3 -62.8 -38.1 -4.1 44.3 25.6 94 93 A K H X S+ 0 0 77 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.926 111.2 48.9 -63.4 -42.8 -7.7 43.0 25.6 95 94 A R H < S+ 0 0 146 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.893 113.0 47.1 -68.8 -35.0 -7.0 40.7 28.6 96 95 A N H >< S+ 0 0 21 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.905 111.8 51.4 -67.7 -42.0 -5.4 43.6 30.4 97 96 A M H >< S+ 0 0 18 -4,-2.6 3,-2.3 1,-0.2 -2,-0.2 0.878 97.5 67.0 -58.9 -39.2 -8.3 45.9 29.6 98 97 A S T 3< S+ 0 0 94 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.734 87.8 69.7 -63.1 -18.0 -10.9 43.4 30.8 99 98 A Q T < S+ 0 0 131 -3,-1.0 2,-0.8 -4,-0.5 -1,-0.3 0.564 83.0 78.1 -70.7 -14.4 -9.5 43.9 34.4 100 99 A Y X - 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0 0 21 -9,-2.2 -47,-3.0 -2,-0.8 2,-0.3 0.574 59.7 -2.9-100.9 -9.4 23.2 67.1 28.2 407 406 A G E -QS 358 397F 0 -10,-1.5 -10,-2.8 -49,-0.3 2,-0.3 -0.978 55.2-171.7-169.3 167.0 23.0 64.8 25.2 408 407 A A E -QS 357 396F 0 -51,-1.9 -51,-2.0 -2,-0.3 2,-0.3 -0.939 1.1-171.3-166.0 147.5 24.2 61.7 23.4 409 408 A W E -QS 356 395F 1 -14,-2.3 -14,-3.0 -2,-0.3 2,-0.3 -0.992 4.9-174.1-145.0 157.0 24.0 59.8 20.1 410 409 A M E -QS 355 394F 2 -55,-2.6 -55,-2.4 -2,-0.3 2,-0.5 -0.984 14.6-164.7-154.6 129.1 25.0 56.5 18.9 411 410 A I E +QS 354 393F 0 -18,-2.6 -18,-0.7 -2,-0.3 2,-0.3 -0.991 57.1 56.0-111.7 122.8 25.2 54.5 15.6 412 411 A G S > S- 0 0 0 -59,-2.1 3,-1.5 -2,-0.5 -59,-0.4 -0.848 86.5 -20.3 153.6-175.3 25.7 50.8 16.1 413 412 A V T 3 S+ 0 0 7 -24,-0.4 -29,-0.1 -22,-0.3 -30,-0.1 -0.275 121.5 5.7 -58.6 136.1 24.7 47.5 17.5 414 413 A H T >> S+ 0 0 16 1,-0.1 4,-2.2 3,-0.1 3,-1.6 0.612 79.5 139.8 63.3 19.3 22.4 47.7 20.6 415 414 A S H <> + 0 0 0 -3,-1.5 4,-2.6 1,-0.3 5,-0.2 0.860 67.0 63.4 -61.1 -31.9 22.0 51.5 20.4 416 415 A Q H 34 S+ 0 0 12 2,-0.2 -1,-0.3 1,-0.2 4,-0.3 0.782 108.8 40.1 -61.5 -25.7 18.4 51.1 21.4 417 416 A Y H X> S+ 0 0 5 -3,-1.6 3,-1.1 2,-0.1 4,-1.0 0.891 116.0 48.3 -88.7 -46.1 19.5 49.7 24.8 418 417 A L H 3X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 3,-0.3 0.858 100.6 66.0 -59.9 -38.2 22.3 52.0 25.5 419 418 A I H 3X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.742 98.7 54.7 -57.7 -23.7 20.3 55.1 24.6 420 419 A N H <> S+ 0 0 0 -3,-1.1 4,-2.2 -4,-0.3 -1,-0.2 0.883 106.1 48.7 -80.1 -43.1 18.0 54.4 27.7 421 420 A E H X S+ 0 0 2 -4,-1.0 4,-1.5 -3,-0.3 -2,-0.2 0.953 117.3 43.5 -54.5 -48.8 20.9 54.3 30.1 422 421 A L H X S+ 0 0 1 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.872 109.9 55.8 -69.4 -38.6 22.1 57.5 28.6 423 422 A G H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.2 -1,-0.2 0.892 105.5 53.3 -60.4 -36.5 18.6 59.1 28.5 424 423 A L H X S+ 0 0 2 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.930 109.0 48.0 -63.6 -43.2 18.3 58.4 32.2 425 424 A A H <>S+ 0 0 0 -4,-1.5 5,-2.1 1,-0.2 -2,-0.2 0.898 114.2 47.7 -62.2 -41.4 21.5 60.3 32.8 426 425 A V H ><5S+ 0 0 23 -4,-2.4 3,-1.0 3,-0.2 -2,-0.2 0.923 108.5 53.4 -67.2 -44.9 20.3 63.1 30.6 427 426 A A H 3<5S+ 0 0 23 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.812 121.0 30.7 -61.6 -32.8 16.9 63.3 32.3 428 427 A Y T 3<5S- 0 0 72 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.121 112.3-115.5-119.6 23.6 18.3 63.7 35.8 429 428 A G T < 5 + 0 0 18 -3,-1.0 -3,-0.2 -24,-0.2 -4,-0.1 0.794 42.0 179.8 58.1 41.5 21.5 65.5 34.8 430 429 A L < - 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0 0 0 -3,-1.5 4,-1.7 -4,-0.2 5,-0.2 -0.473 67.4-135.6 -69.9 135.5 7.8 41.8 26.7 839 381 B V H > S+ 0 0 1 1,-0.2 4,-2.7 -2,-0.2 3,-0.4 0.958 103.5 46.3 -55.7 -52.8 7.9 42.3 23.0 840 382 B S H > S+ 0 0 6 60,-0.4 4,-2.0 1,-0.3 6,-0.2 0.874 109.0 55.5 -65.6 -33.1 11.5 40.9 22.5 841 383 B A H >>S+ 0 0 0 1,-0.2 5,-2.5 2,-0.2 4,-0.6 0.897 111.4 46.1 -60.1 -36.6 10.7 37.9 24.7 842 384 B Q H ><5S+ 0 0 3 -4,-1.7 3,-0.8 -3,-0.4 -2,-0.2 0.916 107.8 54.1 -75.4 -44.3 7.7 37.3 22.4 843 385 B I H 3<5S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.932 117.6 37.6 -54.2 -46.3 9.6 37.7 19.1 844 386 B Y H 3<5S- 0 0 4 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.483 106.8-120.1 -85.9 -3.8 12.2 35.1 20.2 845 387 B G T <<5S+ 0 0 16 -3,-0.8 2,-0.5 -4,-0.6 -3,-0.2 0.842 74.3 128.8 63.7 33.2 9.9 32.7 22.0 846 388 B Q < + 0 0 7 -5,-2.5 24,-0.4 -6,-0.2 -1,-0.1 -0.721 18.0 148.3-119.9 77.1 11.8 33.3 25.3 847 389 B K + 0 0 64 -2,-0.5 2,-0.2 -5,-0.1 -11,-0.2 0.467 29.2 109.1 -98.9 -2.7 9.0 34.1 27.6 848 390 B E + 0 0 92 -13,-0.1 22,-0.2 -3,-0.1 2,-0.2 -0.523 56.5 59.5 -75.9 135.7 10.3 32.7 31.0 849 391 B G - 0 0 9 -2,-0.2 -14,-2.0 20,-0.1 -13,-0.4 -0.673 53.0-126.4 137.3 176.2 11.3 35.3 33.5 850 392 B V E -LM 834 868M 11 18,-1.8 18,-2.7 -16,-0.2 2,-0.4 -0.991 7.6-144.3-160.0 144.6 10.6 38.2 35.8 851 393 B L E -LM 833 867M 0 -18,-2.1 -18,-2.2 -2,-0.3 2,-0.4 -0.977 19.6-171.3-114.0 132.5 11.8 41.7 36.7 852 394 B K E -LM 832 866M 33 14,-3.2 14,-2.2 -2,-0.4 2,-0.4 -0.995 7.9-159.9-126.6 126.3 11.6 42.9 40.4 853 395 B L E -LM 831 865M 0 -22,-2.6 -22,-1.7 -2,-0.4 2,-0.6 -0.871 9.7-149.5 -98.7 132.0 12.3 46.4 41.6 854 396 B I E -LM 830 864M 0 10,-3.0 9,-2.5 -2,-0.4 10,-1.4 -0.913 18.7-173.4-106.8 114.1 13.2 46.9 45.3 855 397 B F E -LM 829 862M 0 -26,-2.9 -26,-2.1 -2,-0.6 2,-0.5 -0.825 24.6-124.3-107.9 142.2 12.0 50.3 46.7 856 398 B E E > -L 828 0M 49 5,-3.1 4,-2.1 -2,-0.4 5,-0.5 -0.725 35.3-114.4 -82.0 126.1 12.7 51.7 50.1 857 399 B R T 4 S+ 0 0 157 -30,-2.1 2,-1.1 -2,-0.5 -30,-0.1 -0.343 94.6 15.0 -57.6 136.6 9.5 52.6 51.9 858 400 B G T 4 S+ 0 0 78 1,-0.2 -1,-0.2 2,-0.0 -30,-0.0 -0.658 132.9 42.1 101.1 -75.5 9.1 56.4 52.4 859 401 B S T 4 S- 0 0 49 -2,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.742 91.5-146.4 -65.4 -26.3 11.7 57.7 50.0 860 402 B M < + 0 0 54 -4,-2.1 29,-2.2 1,-0.2 2,-0.2 0.816 38.2 167.4 45.1 36.1 10.6 55.1 47.4 861 403 B R B -N 888 0N 122 -5,-0.5 -5,-3.1 27,-0.2 2,-0.8 -0.540 43.1-117.0 -69.4 136.7 14.3 55.2 46.5 862 404 B L E + M 0 855M 1 25,-2.6 -7,-0.2 -7,-0.2 24,-0.2 -0.728 43.9 165.2 -76.9 113.0 15.3 52.3 44.2 863 405 B I E - 0 0 19 -9,-2.5 -47,-3.0 -2,-0.8 2,-0.3 0.543 59.8 -2.0-108.9 -9.1 17.8 50.3 46.3 864 406 B G E -KM 815 854M 0 -10,-1.4 -10,-3.0 -49,-0.3 2,-0.3 -0.993 53.3-171.1-171.6 163.6 17.9 47.1 44.3 865 407 B A E -KM 814 853M 0 -51,-2.0 -51,-2.1 -2,-0.3 2,-0.3 -0.971 1.5-171.3-160.4 151.2 16.7 45.2 41.4 866 408 B W E -KM 813 852M 8 -14,-2.2 -14,-3.2 -2,-0.3 2,-0.4 -0.993 6.3-177.5-148.2 150.0 16.8 41.7 40.0 867 409 B M E -KM 812 851M 1 -55,-2.4 -55,-2.9 -2,-0.3 2,-0.5 -0.973 16.0-166.2-150.7 128.6 15.7 40.3 36.7 868 410 B I E +KM 811 850M 0 -18,-2.7 -18,-1.8 -2,-0.4 2,-0.3 -0.992 55.6 69.1-107.9 127.3 15.7 36.9 35.0 869 411 B G E > S-K 810 0M 0 -59,-1.4 3,-1.5 -2,-0.5 -59,-0.5 -0.934 86.0 -33.2 156.5-177.7 15.0 37.1 31.3 870 412 B V T 3 S+ 0 0 7 -24,-0.4 -29,-0.1 -2,-0.3 -30,-0.1 -0.429 123.0 10.8 -70.7 138.6 16.3 38.1 27.9 871 413 B H T >> S+ 0 0 17 -2,-0.1 4,-2.4 3,-0.1 3,-1.6 0.639 77.3 140.2 67.3 19.1 18.5 41.2 27.9 872 414 B S H <> + 0 0 0 -3,-1.5 4,-2.3 1,-0.3 5,-0.2 0.882 68.8 63.4 -55.9 -32.3 18.8 41.2 31.6 873 415 B Q H 34 S+ 0 0 23 -4,-0.2 -1,-0.3 2,-0.2 -432,-0.2 0.720 109.3 37.7 -66.3 -23.2 22.4 42.1 31.0 874 416 B Y H X> S+ 0 0 8 -3,-1.6 3,-1.4 2,-0.1 4,-1.0 0.867 114.7 51.9 -90.6 -49.4 21.3 45.4 29.3 875 417 B L H 3X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 3,-0.4 0.867 100.2 64.0 -52.8 -42.8 18.5 46.3 31.6 876 418 B I H 3X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.726 96.9 57.4 -58.2 -23.7 20.6 45.9 34.7 877 419 B N H <> S+ 0 0 0 -3,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.907 106.3 47.3 -75.5 -42.7 22.8 48.8 33.7 878 420 B E H X S+ 0 0 1 -4,-1.0 4,-1.9 -3,-0.4 3,-0.2 0.958 118.0 43.7 -56.0 -50.2 20.0 51.3 33.5 879 421 B L H X S+ 0 0 1 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.862 109.9 55.8 -65.9 -36.0 18.8 50.0 36.9 880 422 B G H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.840 105.4 52.6 -65.3 -33.8 22.2 50.0 38.3 881 423 B L H X S+ 0 0 2 -4,-1.8 4,-1.7 -3,-0.2 -2,-0.2 0.907 109.4 48.9 -68.8 -38.4 22.6 53.6 37.4 882 424 B A H X>S+ 0 0 0 -4,-1.9 5,-1.8 2,-0.2 4,-0.6 0.922 113.7 46.1 -69.7 -40.9 19.3 54.4 39.3 883 425 B V H ><5S+ 0 0 20 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.965 111.1 52.8 -60.7 -54.9 20.5 52.5 42.3 884 426 B A H 3<5S+ 0 0 24 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.750 120.1 31.4 -50.2 -38.6 24.0 54.1 42.3 885 427 B Y H 3<5S- 0 0 68 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.212 112.9-111.9-117.1 15.5 22.7 57.7 42.2 886 428 B G T <<5 + 0 0 23 -3,-1.1 -3,-0.2 -4,-0.6 -4,-0.1 0.721 44.8 176.4 75.9 32.3 19.5 57.2 44.2 887 429 B L < - 0 0 12 -5,-1.8 -25,-2.6 -6,-0.2 2,-0.2 -0.303 19.3-138.0 -69.2 148.8 16.6 57.7 41.8 888 430 B N B > -N 861 0N 52 -27,-0.3 4,-1.8 -33,-0.1 -27,-0.2 -0.541 27.3 -94.2-105.7 171.6 13.1 57.1 43.1 889 431 B A H > S+ 0 0 3 -29,-2.2 4,-2.4 1,-0.2 5,-0.2 0.827 122.9 53.4 -50.1 -39.3 9.9 55.4 41.8 890 432 B K H > S+ 0 0 51 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.976 108.3 50.7 -65.0 -50.4 8.5 58.8 40.5 891 433 B Q H > S+ 0 0 52 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.822 113.9 43.3 -54.3 -37.7 11.7 59.4 38.5 892 434 B L H < S+ 0 0 1 -4,-1.8 3,-0.4 2,-0.2 -1,-0.2 0.878 112.9 52.3 -77.1 -42.4 11.7 56.0 36.9 893 435 B A H < S+ 0 0 9 -4,-2.4 -2,-0.2 17,-0.2 -1,-0.2 0.896 109.5 50.7 -55.2 -42.4 8.0 56.2 36.2 894 436 B S H < S+ 0 0 43 -4,-2.8 2,-0.3 -5,-0.2 -1,-0.2 0.633 91.9 91.1 -75.7 -16.2 8.5 59.6 34.5 895 437 B F S < S- 0 0 4 -4,-0.6 2,-0.8 -3,-0.4 -551,-0.1 -0.646 70.1-144.7 -83.7 139.2 11.3 58.4 32.2 896 438 B A - 0 0 4 -2,-0.3 3,-0.1 -553,-0.2 8,-0.1 -0.790 12.8-151.1-109.3 94.6 10.2 57.0 28.8 897 439 B E - 0 0 2 -2,-0.8 2,-0.1 6,-0.2 -480,-0.1 -0.309 34.8 -86.7 -62.7 144.2 12.3 54.1 27.5 898 440 B Q > - 0 0 6 -482,-0.2 3,-1.3 2,-0.1 6,-0.4 -0.282 58.0-104.1 -50.0 118.7 12.7 53.5 23.8 899 441 B H T 3 S+ 0 0 4 1,-0.3 -552,-0.2 -3,-0.1 -583,-0.1 -0.761 98.1 15.8 -89.0 135.9 9.9 51.4 22.4 900 442 B P T 3 S+ 0 0 5 0, 0.0 -60,-0.4 0, 0.0 -1,-0.3 -0.774 94.9 113.6-100.6 36.1 10.0 48.5 21.7 901 443 B S S X S- 0 0 0 -3,-1.3 3,-1.7 1,-0.1 4,-0.2 -0.211 78.1-113.8 -61.7 156.6 13.3 47.8 23.6 902 444 B T T > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.1 4,-0.2 0.776 109.8 79.5 -63.8 -20.2 13.0 45.5 26.6 903 445 B N T >> S+ 0 0 2 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.703 72.0 78.5 -55.8 -25.7 13.9 48.6 28.7 904 446 B E H <> S+ 0 0 32 -3,-1.7 4,-2.0 -6,-0.4 -1,-0.3 0.756 79.7 69.9 -58.4 -23.2 10.3 49.8 28.5 905 447 B I H <> S+ 0 0 2 -3,-1.8 4,-2.7 -4,-0.2 -1,-0.3 0.761 89.8 63.8 -66.5 -23.8 9.3 47.3 31.2 906 448 B I H <> S+ 0 0 0 -3,-1.7 4,-2.6 -4,-0.2 5,-0.2 0.974 110.3 32.5 -65.2 -55.9 11.3 49.3 33.8 907 449 B S H X S+ 0 0 3 -4,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.881 117.4 58.1 -74.4 -32.4 9.2 52.5 33.7 908 450 B Y H X S+ 0 0 73 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.962 110.7 43.0 -53.9 -49.0 6.2 50.4 32.9 909 451 B T H X S+ 0 0 0 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.861 111.9 52.5 -69.7 -38.2 6.9 48.5 36.2 910 452 B A H X S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 3,-0.2 0.827 105.7 56.3 -62.3 -33.6 7.6 51.7 38.2 911 453 B R H X S+ 0 0 19 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.842 103.1 56.0 -66.9 -31.2 4.3 53.2 37.0 912 454 B K H < S+ 0 0 85 -4,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.736 101.5 54.1 -72.6 -29.5 2.4 50.1 38.5 913 455 B V H < S+ 0 0 41 -4,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.944 105.0 54.5 -68.0 -44.0 3.8 50.6 42.0 914 456 B I H < 0 0 87 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.749 360.0 360.0 -61.0 -27.4 2.5 54.2 41.9 915 457 B E < 0 0 79 -4,-0.8 -2,-0.2 -5,-0.1 -1,-0.2 0.769 360.0 360.0 -91.6 360.0 -0.9 52.5 41.0