==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-NOV-11 4A73 . COMPND 2 MOLECULE: L-LACTATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR E.DE MENDOZA-BARBERA,F.M.D.VELLIEUX . 1238 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45600.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 966 78.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 9.9 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 . 12 1.0 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 . 113 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 131 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 441 35.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.6 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 3 1 0 4 0 3 0 0 11 2 4 3 3 1 1 0 1 3 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 4 9 7 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 . 12 6 3 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 4 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 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 22 A M 0 0 56 0, 0.0 26,-1.4 0, 0.0 25,-1.2 0.000 360.0 360.0 360.0 69.5 34.9 -41.9 5.3 2 23 A K E -a 27 0A 29 65,-0.5 67,-1.8 24,-0.2 68,-0.8 -0.915 360.0-165.2-117.2 136.3 37.9 -40.1 6.8 3 24 A V E -ab 28 70A 0 24,-3.6 26,-2.5 -2,-0.4 2,-0.4 -0.952 2.9-162.3-128.2 130.1 41.2 -41.6 7.7 4 25 A G E -ab 29 71A 0 66,-2.6 68,-2.9 -2,-0.4 2,-0.4 -0.859 1.4-166.8-109.2 144.8 44.1 -40.3 9.8 5 26 A I E -ab 30 72A 0 24,-2.6 26,-2.3 -2,-0.4 2,-0.5 -0.947 7.3-158.4-130.3 116.0 47.7 -41.5 9.9 6 27 A V E S+ab 31 73A 4 66,-2.8 68,-3.6 -2,-0.4 26,-0.2 -0.817 71.4 41.8 -95.5 123.4 50.0 -40.3 12.7 7 28 A G - 0 0 9 24,-2.7 2,-2.2 -2,-0.5 5,-0.2 0.791 67.3-151.9 103.3 76.2 53.7 -40.6 11.8 8 29 A S + 0 0 0 23,-0.3 33,-0.1 4,-0.2 67,-0.1 -0.243 52.6 122.9 -78.2 53.2 54.4 -39.5 8.3 9 30 A G S > S- 0 0 34 -2,-2.2 4,-3.0 65,-0.5 5,-0.2 0.031 85.3 -71.9 -84.0-156.9 57.5 -41.7 7.8 10 31 A M H > S+ 0 0 71 2,-0.2 4,-3.3 1,-0.2 5,-0.4 1.000 138.0 40.9 -61.8 -67.5 57.8 -44.3 5.0 11 32 A V H > S+ 0 0 47 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.865 117.5 52.5 -46.2 -43.6 55.3 -46.7 6.5 12 33 A G H >> S+ 0 0 1 62,-0.2 4,-1.0 -5,-0.2 3,-0.6 0.981 116.3 35.7 -54.4 -59.7 53.2 -43.7 7.3 13 34 A S H 3X S+ 0 0 0 -4,-3.0 4,-1.6 1,-0.3 -2,-0.2 0.719 112.1 58.3 -77.5 -24.8 53.1 -42.2 3.9 14 35 A A H 3X S+ 0 0 0 -4,-3.3 4,-2.7 2,-0.2 -1,-0.3 0.762 104.2 54.5 -69.2 -26.7 53.0 -45.4 1.9 15 36 A T H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 3,-1.0 0.986 112.0 43.5 -67.5 -60.6 49.6 -43.9 -0.9 18 39 A A H 3X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.3 5,-0.2 0.885 112.8 55.8 -52.7 -40.3 48.0 -47.3 -1.0 19 40 A L H 3<>S+ 0 0 0 -4,-1.7 5,-2.6 -5,-0.2 6,-0.5 0.855 113.9 40.0 -56.6 -36.9 44.9 -45.8 0.6 20 41 A A H <<5S+ 0 0 2 -4,-1.3 33,-0.6 -3,-1.0 -2,-0.2 0.835 116.1 46.2 -89.2 -37.9 44.7 -43.2 -2.3 21 42 A L H <5S+ 0 0 1 -4,-2.8 32,-0.3 1,-0.2 -2,-0.2 0.870 117.0 45.1 -71.8 -39.2 45.6 -45.4 -5.2 22 43 A L T <5S- 0 0 33 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.562 106.7-136.7 -76.9 -8.7 43.2 -48.2 -4.0 23 44 A G T 5 + 0 0 28 -5,-0.2 -3,-0.2 30,-0.2 -4,-0.1 0.931 50.5 150.2 51.3 53.4 40.7 -45.3 -3.4 24 45 A V < + 0 0 31 -5,-2.6 2,-0.3 -6,-0.2 -4,-0.1 0.962 58.8 25.5 -81.7 -57.8 39.7 -46.7 -0.0 25 46 A A - 0 0 3 -6,-0.5 -1,-0.2 1,-0.1 -23,-0.1 -0.786 67.3-136.2-112.0 157.1 38.8 -43.6 1.9 26 47 A R S S+ 0 0 123 -25,-1.2 30,-2.2 -2,-0.3 2,-0.4 0.727 90.8 33.8 -82.2 -23.3 37.6 -40.3 0.7 27 48 A E E -ac 2 56A 44 -26,-1.4 -24,-3.6 28,-0.2 2,-0.5 -0.969 61.8-173.4-139.5 123.7 39.8 -38.2 3.0 28 49 A V E -ac 3 57A 0 28,-2.6 30,-2.0 -2,-0.4 2,-0.5 -0.913 5.2-167.1-122.2 110.7 43.3 -38.9 4.3 29 50 A V E -ac 4 58A 0 -26,-2.5 -24,-2.6 -2,-0.5 2,-0.6 -0.828 6.1-157.2 -99.9 123.2 44.9 -36.6 6.9 30 51 A L E -ac 5 59A 0 28,-3.3 30,-1.4 -2,-0.5 2,-0.5 -0.865 11.2-170.1 -99.8 118.8 48.7 -37.0 7.6 31 52 A V E +ac 6 60A 1 -26,-2.3 -24,-2.7 -2,-0.6 -23,-0.3 -0.927 15.6 151.5-117.9 128.0 49.9 -35.8 11.0 32 53 A D - 0 0 34 28,-0.6 6,-0.1 -2,-0.5 7,-0.1 -0.993 51.3-126.6-149.1 152.8 53.5 -35.4 12.0 33 54 A L S S+ 0 0 139 -2,-0.3 2,-1.5 1,-0.2 3,-0.1 0.838 107.8 71.3 -67.3 -31.5 55.6 -33.2 14.3 34 55 A D S >> S- 0 0 68 1,-0.2 4,-1.7 -3,-0.1 3,-0.8 -0.719 76.2-171.5 -80.6 90.4 57.7 -32.5 11.3 35 56 A R H 3> S+ 0 0 115 -2,-1.5 4,-1.6 1,-0.3 -1,-0.2 0.759 80.0 48.6 -60.5 -27.9 54.9 -30.3 9.8 36 57 A K H 3> S+ 0 0 124 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.694 105.9 56.5 -87.7 -24.6 56.7 -30.0 6.5 37 58 A L H <> S+ 0 0 32 -3,-0.8 4,-1.9 2,-0.2 -2,-0.2 0.823 111.8 43.2 -74.1 -34.5 57.4 -33.7 6.1 38 59 A A H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.921 114.2 50.8 -72.6 -43.7 53.7 -34.4 6.4 39 60 A Q H X S+ 0 0 83 -4,-1.6 4,-0.7 -5,-0.2 -2,-0.2 0.689 112.1 48.9 -69.8 -16.1 53.0 -31.5 4.1 40 61 A A H X S+ 0 0 0 -4,-0.8 4,-2.1 493,-0.3 -1,-0.2 0.920 110.9 45.1 -88.6 -49.1 55.4 -32.9 1.6 41 62 A H H X S+ 0 0 4 -4,-1.9 4,-2.5 492,-0.2 5,-0.2 0.903 114.3 51.5 -57.5 -42.5 54.3 -36.5 1.5 42 63 A A H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.851 108.2 50.8 -67.3 -33.1 50.7 -35.3 1.3 43 64 A E H X S+ 0 0 29 -4,-0.7 4,-1.4 -5,-0.2 -1,-0.2 0.875 111.3 49.1 -70.1 -37.1 51.5 -33.0 -1.6 44 65 A D H X S+ 0 0 0 -4,-2.1 4,-0.6 2,-0.2 3,-0.3 0.960 112.1 46.5 -65.4 -52.2 53.2 -35.8 -3.5 45 66 A I H >X S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 4,-1.0 0.898 108.2 56.7 -58.2 -43.3 50.3 -38.3 -3.0 46 67 A L H >< S+ 0 0 29 -4,-2.1 3,-0.7 1,-0.3 -1,-0.2 0.891 100.8 57.5 -57.5 -37.8 47.7 -35.7 -4.0 47 68 A H H 3< S+ 0 0 15 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.688 103.9 56.5 -65.5 -15.6 49.5 -35.2 -7.4 48 69 A A H X< S+ 0 0 1 -3,-1.5 3,-2.1 -4,-0.6 -1,-0.2 0.781 88.4 76.8 -84.4 -28.6 49.0 -38.9 -7.9 49 70 A T G X< S+ 0 0 17 -4,-1.0 3,-1.8 -3,-0.7 -1,-0.2 0.731 79.3 65.8 -62.3 -27.4 45.2 -38.8 -7.5 50 71 A P G 3 S+ 0 0 68 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.652 104.9 49.5 -69.4 -5.4 44.3 -37.4 -10.9 51 72 A F G < S+ 0 0 22 -3,-2.1 2,-0.2 2,-0.2 -2,-0.2 0.084 125.5 18.2-113.6 16.8 45.7 -40.7 -12.3 52 73 A A S < S- 0 0 34 -3,-1.8 -31,-0.1 1,-0.1 -30,-0.1 -0.595 113.0 -29.2-149.6-144.5 43.7 -42.8 -9.8 53 74 A H S S- 0 0 86 -33,-0.6 2,-0.6 -32,-0.3 -30,-0.2 -0.525 70.8 -98.2 -79.8 155.1 40.6 -42.4 -7.6 54 75 A P + 0 0 110 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.645 51.3 164.4 -78.0 114.1 39.8 -39.0 -6.1 55 76 A V - 0 0 10 -2,-0.6 2,-1.0 -9,-0.1 -28,-0.2 -0.997 38.2-135.3-129.4 135.9 41.1 -38.6 -2.6 56 77 A W E -c 27 0A 130 -30,-2.2 -28,-2.6 -2,-0.4 2,-0.6 -0.826 35.1-179.7 -83.8 100.2 41.5 -35.4 -0.5 57 78 A V E +c 28 0A 4 -2,-1.0 2,-0.3 -30,-0.2 -11,-0.2 -0.935 11.4 152.1-112.3 114.5 44.9 -36.1 1.0 58 79 A R E -c 29 0A 56 -30,-2.0 -28,-3.3 -2,-0.6 2,-0.5 -0.843 42.9-116.0-138.1 167.1 46.3 -33.5 3.3 59 80 A A E +c 30 0A 19 -2,-0.3 -28,-0.2 -30,-0.2 2,-0.2 -0.937 46.3 150.6-110.9 130.7 48.6 -32.9 6.2 60 83 A G E -c 31 0A 9 -30,-1.4 -28,-0.6 -2,-0.5 2,-0.2 -0.513 39.6 -92.7-135.4-159.8 47.0 -31.6 9.4 61 84 A S > - 0 0 37 -2,-0.2 3,-0.7 -30,-0.1 -1,-0.1 -0.478 53.0 -85.2-111.6-175.5 47.1 -31.4 13.2 62 85 A Y G > S+ 0 0 36 1,-0.2 3,-2.0 -2,-0.2 4,-0.1 0.898 126.6 57.7 -64.6 -39.3 45.4 -33.5 15.8 63 86 A G G > S+ 0 0 40 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.759 96.0 64.9 -61.0 -24.2 42.2 -31.5 15.6 64 87 A D G < S+ 0 0 59 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.410 81.1 78.8 -80.6 1.6 42.0 -32.2 11.9 65 88 A L G X + 0 0 0 -3,-2.0 3,-2.6 -4,-0.1 -1,-0.3 0.458 68.3 144.9 -84.5 -0.5 41.5 -35.9 12.7 66 89 A E T < S- 0 0 137 -3,-1.2 41,-0.2 1,-0.3 3,-0.1 -0.041 71.9 -0.1 -40.4 124.5 37.9 -34.9 13.5 67 90 A G T 3 S+ 0 0 53 39,-0.7 -65,-0.5 1,-0.2 2,-0.3 0.606 85.9 153.2 66.0 11.2 35.4 -37.6 12.6 68 91 A A < - 0 0 2 -3,-2.6 -1,-0.2 1,-0.2 -65,-0.2 -0.592 36.3-154.9 -65.5 130.1 38.1 -39.9 11.3 69 92 A R S S+ 0 0 120 -67,-1.8 42,-1.3 -2,-0.3 2,-0.3 0.488 79.4 24.3 -90.3 -1.8 36.7 -43.4 11.8 70 93 A A E -bd 3 111A 1 -68,-0.8 -66,-2.6 40,-0.2 2,-0.5 -0.915 61.5-166.8-160.0 133.0 40.2 -44.7 12.0 71 94 A V E -bd 4 112A 0 40,-2.1 42,-2.5 -2,-0.3 2,-0.5 -0.975 15.8-146.7-124.0 121.5 43.6 -43.4 12.9 72 95 A V E -bd 5 113A 1 -68,-2.9 -66,-2.8 -2,-0.5 2,-0.9 -0.714 10.4-147.9 -84.4 120.0 46.7 -45.4 12.0 73 96 A L E +bd 6 114A 0 40,-2.6 42,-3.2 -2,-0.5 43,-1.1 -0.823 35.6 150.1 -93.8 110.5 49.5 -44.9 14.5 74 97 A A + 0 0 11 -68,-3.6 -65,-0.5 -2,-0.9 -62,-0.2 -0.400 21.4 135.2-133.4 57.5 52.9 -45.2 12.8 75 98 A A + 0 0 28 -67,-0.1 42,-0.2 17,-0.1 -63,-0.1 0.167 15.5 159.9 -74.7-151.1 55.1 -43.0 14.9 76 99 A G - 0 0 40 16,-0.1 13,-0.1 40,-0.1 16,-0.0 0.305 36.8-130.8 124.0 91.6 58.6 -44.2 15.8 77 100 A V - 0 0 41 11,-0.2 2,-0.3 1,-0.1 15,-0.1 -0.378 37.4-101.3 -61.7 151.7 61.1 -41.6 16.8 78 101 A A - 0 0 79 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.660 42.3-101.5 -83.5 134.4 64.3 -42.2 14.9 79 102 A Q - 0 0 115 -2,-0.3 -1,-0.1 1,-0.1 6,-0.1 -0.148 37.2-134.1 -59.5 147.7 67.1 -43.9 16.9 80 103 A R > - 0 0 148 4,-0.1 3,-1.7 -3,-0.1 2,-0.3 -0.729 23.4 -95.4-105.7 150.2 69.9 -41.8 18.3 81 105 A P T 3 S+ 0 0 134 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.492 114.8 17.1 -58.8 120.0 73.7 -42.2 18.4 82 106 A G T 3 S+ 0 0 83 1,-0.3 2,-0.5 -2,-0.3 -3,-0.0 0.668 98.6 119.2 89.9 18.6 74.5 -43.8 21.7 83 107 A E < - 0 0 27 -3,-1.7 -1,-0.3 4,-0.0 2,-0.1 -0.965 56.1-137.3-118.6 131.8 71.0 -45.0 22.4 84 108 A T > - 0 0 71 -2,-0.5 4,-2.5 1,-0.1 5,-0.2 -0.481 25.4-111.5 -83.6 159.9 70.3 -48.7 22.9 85 109 A R H > S+ 0 0 145 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.922 120.2 57.4 -49.1 -49.6 67.2 -50.3 21.4 86 110 A L H > S+ 0 0 110 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.885 109.2 44.0 -53.0 -45.2 65.9 -50.8 24.9 87 111 A Q H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.886 111.8 52.3 -65.4 -44.1 66.1 -47.0 25.5 88 112 A L H X S+ 0 0 26 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.869 108.2 53.8 -60.2 -38.7 64.6 -46.2 22.1 89 113 A L H X S+ 0 0 17 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.873 109.9 44.3 -60.8 -47.3 61.7 -48.5 23.0 90 114 A D H X S+ 0 0 71 -4,-1.6 4,-0.8 -5,-0.2 -1,-0.2 0.868 114.8 52.8 -66.3 -33.3 60.9 -46.8 26.3 91 115 A R H X S+ 0 0 45 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.836 105.8 51.5 -72.5 -36.0 61.3 -43.5 24.4 92 116 A N H >X S+ 0 0 10 -4,-2.0 4,-1.7 1,-0.2 3,-0.6 0.870 104.8 56.6 -67.1 -39.4 58.8 -44.5 21.7 93 117 A A H 3X S+ 0 0 4 -4,-1.5 4,-1.9 1,-0.3 -1,-0.2 0.730 102.2 57.0 -67.6 -22.9 56.2 -45.5 24.2 94 118 A Q H 3X S+ 0 0 114 -4,-0.8 4,-0.6 2,-0.2 -1,-0.3 0.740 103.5 52.3 -80.2 -23.0 56.5 -42.0 25.6 95 119 A V H X S+ 0 0 7 -4,-3.1 4,-2.1 2,-0.1 3,-1.2 0.979 107.1 56.8 -62.6 -62.3 50.0 -39.2 20.7 100 124 A V H 3X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.3 5,-0.2 0.828 107.6 43.0 -45.3 -58.2 47.2 -41.5 21.9 101 125 A P H 34 S+ 0 0 63 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.756 115.4 53.2 -63.7 -23.2 45.1 -39.2 24.2 102 126 A R H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 3,-1.0 0.931 112.0 55.5 -64.8 -43.6 44.2 -38.3 18.7 104 128 A L H 3< S+ 0 0 22 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.633 102.8 57.4 -66.2 -13.1 41.3 -39.7 20.8 105 129 A E H 34 S+ 0 0 156 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.766 111.8 40.4 -84.3 -29.3 40.3 -36.2 21.8 106 130 A A H << S+ 0 0 21 -3,-1.0 -39,-0.7 -4,-0.8 -2,-0.2 0.862 134.2 21.5 -83.8 -42.2 39.8 -35.2 18.1 107 131 A A >< + 0 0 3 -4,-2.7 3,-2.4 -41,-0.2 -1,-0.2 -0.656 67.8 172.1-128.8 74.2 38.2 -38.5 17.1 108 132AA P T 3 S+ 0 0 75 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.590 83.9 48.6 -61.9 -8.2 36.9 -40.1 20.3 109 132BA E T 3 S+ 0 0 150 -41,-0.2 -5,-0.1 2,-0.1 -4,-0.0 0.401 84.6 121.7-111.7 0.6 35.2 -42.7 18.1 110 133 A A < - 0 0 0 -3,-2.4 2,-0.5 -7,-0.1 -40,-0.2 -0.295 62.2-126.3 -67.5 145.8 38.2 -43.6 16.0 111 134 A V E -d 70 0A 0 -42,-1.3 -40,-2.1 164,-0.1 2,-0.4 -0.847 28.0-130.2 -89.6 129.7 39.5 -47.1 15.8 112 135 A L E -de 71 137A 0 24,-2.2 26,-2.8 -2,-0.5 2,-0.7 -0.678 18.4-164.1 -86.8 126.5 43.3 -47.1 16.6 113 136 A L E -de 72 138A 0 -42,-2.5 -40,-2.6 -2,-0.4 2,-0.4 -0.863 10.2-150.3-119.1 102.4 45.5 -49.0 14.2 114 137 A V E +de 73 139A 0 24,-3.9 26,-2.8 -2,-0.7 27,-0.3 -0.560 30.9 154.0 -84.6 125.8 48.9 -49.7 15.6 115 138 A A + 0 0 9 -42,-3.2 -41,-0.2 -2,-0.4 4,-0.2 0.715 36.3 103.4-115.7 -38.5 51.8 -49.9 13.0 116 139 A T S S- 0 0 9 -43,-1.1 6,-0.3 2,-0.1 -40,-0.1 0.013 75.6 -67.4 -58.0 156.2 55.0 -49.0 14.9 117 140 A N S S+ 0 0 100 1,-0.2 -1,-0.1 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175.7 73.4 -41.6 -10.5 389 101 B A - 0 0 69 -2,-0.2 -1,-0.0 1,-0.1 -2,-0.0 -0.451 40.3-125.2 -72.4 134.5 74.7 -40.3 -7.2 390 102 B Q - 0 0 114 -2,-0.2 4,-0.2 2,-0.0 -1,-0.1 0.767 43.8-149.7 -53.1 -32.6 75.0 -36.5 -6.9 391 103 B R > - 0 0 151 2,-0.1 3,-0.9 1,-0.1 7,-0.0 0.827 29.7 -71.6 65.9 119.5 78.7 -36.9 -6.0 392 105 B P T 3 S+ 0 0 142 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.418 116.5 6.2 -5.5 -81.1 80.6 -34.4 -3.7 393 106 B G T 3 S+ 0 0 76 2,-0.0 2,-0.2 0, 0.0 -2,-0.1 -0.549 97.2 111.1-120.8 72.0 81.0 -31.2 -5.7 394 107 B E < + 0 0 26 -3,-0.9 -4,-0.0 -2,-0.4 0, 0.0 -0.851 22.8 159.7-141.8 179.8 79.1 -31.4 -9.1 395 108 B T S S+ 0 0 112 -2,-0.2 4,-0.1 0, 0.0 -1,-0.1 0.488 78.3 18.3-159.1 -77.2 76.2 -30.0 -11.0 396 109 B R S > S+ 0 0 179 2,-0.2 4,-1.2 1,-0.1 5,-0.1 0.461 119.1 66.1 -98.3 -16.0 75.6 -30.1 -14.8 397 111 B Q H > S+ 0 0 90 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.496 90.4 61.3 -86.3 -2.2 78.2 -32.8 -14.9 398 112 B L H > S+ 0 0 37 2,-0.2 4,-1.1 3,-0.1 -1,-0.2 0.775 104.6 51.6 -76.5 -34.2 75.8 -35.0 -13.0 399 113 B L H > S+ 0 0 36 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.841 107.6 49.1 -66.8 -38.7 73.7 -34.3 -16.1 400 114 B D H X S+ 0 0 81 -4,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.912 110.5 52.5 -62.7 -43.3 76.6 -35.5 -18.4 401 115 B R H X S+ 0 0 41 -4,-1.1 4,-0.7 1,-0.2 -2,-0.2 0.716 105.4 54.3 -68.1 -24.7 77.0 -38.6 -16.2 402 116 B N H X S+ 0 0 12 -4,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.857 106.9 49.2 -78.5 -36.4 73.3 -39.5 -16.6 403 117 B A H X S+ 0 0 5 -4,-1.3 4,-1.9 1,-0.2 -2,-0.2 0.824 105.7 60.3 -67.7 -30.9 73.4 -39.4 -20.3 404 118 B Q H X S+ 0 0 124 -4,-1.5 4,-0.6 1,-0.2 -1,-0.2 0.856 105.1 48.9 -60.1 -33.8 76.5 -41.6 -19.9 405 119 B V H >X S+ 0 0 38 -4,-0.7 4,-3.1 1,-0.2 3,-1.3 0.920 107.1 51.9 -75.7 -42.4 74.1 -44.0 -18.2 406 120 B F H 3X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.3 -1,-0.2 0.855 98.1 67.8 -61.9 -33.8 71.5 -44.0 -20.9 407 121 B A H 3< S+ 0 0 39 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.822 113.8 30.4 -54.2 -32.5 74.2 -44.7 -23.4 408 122 B Q H S+ 0 0 68 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.940 116.8 50.8 -66.7 -40.0 70.8 -50.4 -26.3 412 126 B R H X S+ 0 0 119 -4,-1.3 4,-0.8 1,-0.2 -2,-0.2 0.799 109.6 50.2 -66.7 -30.3 70.6 -53.1 -23.6 413 127 B V H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.883 114.7 43.0 -73.4 -38.9 66.9 -52.4 -23.0 414 128 B L H < S+ 0 0 23 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.783 104.3 65.5 -78.3 -25.4 66.1 -52.6 -26.7 415 129 B E H < S+ 0 0 162 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.852 114.5 31.7 -62.6 -32.9 68.3 -55.7 -27.2 416 130 B A H < S+ 0 0 21 -4,-0.8 -38,-0.5 -3,-0.2 -2,-0.2 0.803 136.3 24.3 -92.5 -36.2 65.9 -57.6 -24.9 417 131 B A >< + 0 0 2 -4,-2.0 3,-1.7 -40,-0.2 -1,-0.2 -0.582 68.0 166.1-132.8 72.3 62.7 -55.9 -25.7 418 132AB P T 3 S+ 0 0 69 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.633 75.9 52.3 -67.4 -18.6 63.0 -54.4 -29.2 419 132BB E T 3 S+ 0 0 153 -40,-0.2 -5,-0.1 2,-0.1 -39,-0.0 0.488 88.0 118.2 -96.3 -1.4 59.4 -53.7 -29.7 420 133 B A < - 0 0 0 -3,-1.7 2,-0.5 -7,-0.1 -39,-0.2 -0.216 64.4-125.0 -76.0 148.7 58.9 -51.8 -26.4 421 134 B V E -o 381 0C 1 -41,-2.0 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P T 4 S+ 0 0 81 0, 0.0 4,-0.2 0, 0.0 3,-0.1 0.714 118.6 56.1 -47.2 -23.0 18.8 -78.1 14.7 1135 223 D E T >> S+ 0 0 141 2,-0.2 3,-2.1 1,-0.2 4,-1.2 0.988 109.7 36.3 -72.0 -72.3 15.8 -75.8 14.4 1136 224 D D T 34 S+ 0 0 34 1,-0.3 -1,-0.2 2,-0.2 -3,-0.1 0.261 119.8 54.1 -71.2 18.1 17.3 -72.5 13.2 1137 225 D R T 3< S+ 0 0 59 -4,-0.5 4,-0.3 -3,-0.1 -1,-0.3 0.373 102.9 52.9-129.9 -9.2 19.8 -74.5 11.2 1138 226 D A T <> S+ 0 0 59 -3,-2.1 4,-1.8 -5,-0.3 -2,-0.2 0.550 107.2 54.4 -95.1 -15.5 17.2 -76.5 9.3 1139 227 D R T < S+ 0 0 139 -4,-1.2 -3,-0.1 2,-0.2 -2,-0.1 0.691 100.8 58.0 -86.8 -23.1 15.6 -73.2 8.4 1140 228 D I T >> S+ 0 0 1 -5,-0.2 4,-1.1 3,-0.1 3,-0.6 0.861 106.9 52.7 -65.6 -34.0 19.0 -72.1 7.0 1141 229 D D H >> S+ 0 0 32 -4,-0.3 4,-2.6 1,-0.3 2,-2.6 0.997 108.2 44.8 -65.1 -66.6 18.5 -75.2 4.8 1142 230 D E H 3< S+ 0 0 105 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.1 -0.349 112.7 55.2 -75.6 60.9 15.0 -74.4 3.4 1143 231 D G H <> S+ 0 0 26 -2,-2.6 4,-0.6 -3,-0.6 -1,-0.2 0.132 109.2 44.4-155.6 -34.4 16.2 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45.8 -60.7 -22.7 7.3 -67.1 -8.2 1154 242 D G H <45S+ 0 0 11 -3,-0.8 -2,-0.2 -5,-0.5 -1,-0.2 0.761 135.8 4.4 -95.6 -29.4 7.9 -63.3 -7.8 1155 243 D K H <5S- 0 0 32 -4,-3.0 -3,-0.2 -3,-0.2 2,-0.2 0.303 98.3-108.1-140.8 5.9 9.1 -62.2 -11.3 1156 244 D G S < + 0 0 18 -2,-0.5 4,-2.0 -218,-0.1 5,-0.2 0.554 52.3 66.1-142.4 -52.8 18.8 -64.1 -14.0 1160 248 D Y H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.819 107.4 45.6 -57.3 -33.9 20.7 -61.2 -12.3 1161 249 D G H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 3,-0.5 0.963 113.7 43.1 -76.8 -55.4 22.2 -63.5 -9.7 1162 250 D I H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.782 110.0 63.9 -61.5 -25.5 23.4 -66.5 -11.7 1163 251 D G H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.901 104.3 41.7 -65.4 -44.0 24.6 -63.9 -14.3 1164 252 D A H X S+ 0 0 0 -4,-1.2 4,-0.9 -3,-0.5 -1,-0.2 0.820 114.3 53.5 -73.5 -29.1 27.2 -62.4 -12.0 1165 253 D G H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.865 108.9 48.2 -74.0 -38.7 28.2 -65.8 -10.7 1166 254 D L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.957 109.3 53.6 -60.6 -49.7 28.8 -67.0 -14.2 1167 255 D A H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.761 108.9 50.6 -58.5 -23.4 30.8 -63.9 -14.9 1168 256 D R H X S+ 0 0 45 -4,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.897 109.1 48.6 -81.9 -43.1 32.9 -64.7 -11.9 1169 257 D L H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.858 112.0 51.3 -62.1 -34.0 33.5 -68.3 -13.0 1170 258 D V H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.901 107.9 51.6 -71.5 -39.8 34.5 -66.8 -16.4 1171 259 D R H X S+ 0 0 112 -4,-1.6 4,-2.2 -5,-0.2 -2,-0.2 0.901 108.4 52.1 -57.8 -44.3 36.9 -64.4 -14.7 1172 260 D A H X>S+ 0 0 0 -4,-2.4 5,-2.0 2,-0.2 4,-0.5 0.904 112.6 44.6 -58.4 -44.6 38.5 -67.4 -12.9 1173 261 D I H ><5S+ 0 0 3 -4,-1.9 3,-0.7 1,-0.2 -2,-0.2 0.920 114.6 48.6 -67.5 -46.0 38.9 -69.3 -16.2 1174 262 D L H 3<5S+ 0 0 4 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.853 116.6 40.8 -63.1 -37.8 40.3 -66.3 -18.1 1175 263 D T H 3<5S- 0 0 72 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.466 101.9-127.9 -92.4 -0.8 42.8 -65.3 -15.4 1176 264 D D T <<5 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