==== 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 OXIDOREDUCTASE 11-JUL-05 2A92 . COMPND 2 MOLECULE: L-LACTATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM VIVAX; . AUTHOR A.CHAIKUAD,V.FAIRWEATHER,R.CONNERS,T.JOSEPH-HORNE,D.TURGUT-B . 1264 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45314.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 957 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 9.8 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 94 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 136 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 449 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.7 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 4 0 2 1 0 0 11 0 0 4 8 0 6 1 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 12 4 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 . 8 12 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 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 18 A T 0 0 55 0, 0.0 1202,-0.0 0, 0.0 1201,-0.0 0.000 360.0 360.0 360.0 77.0 -21.5 4.6 0.0 2 19 A P - 0 0 122 0, 0.0 1200,-0.0 0, 0.0 1202,-0.0 0.453 360.0-113.5 -81.6 132.7 -22.1 2.5 -2.1 3 20 A K - 0 0 20 1,-0.1 25,-0.1 25,-0.1 24,-0.1 0.185 32.9-109.6 -28.3 126.0 -21.9 -0.4 0.5 4 21 A P - 0 0 34 0, 0.0 25,-2.2 0, 0.0 2,-0.5 -0.337 26.8-133.0 -58.9 149.2 -18.9 -2.8 -0.0 5 22 A K E -a 29 0A 49 66,-0.3 68,-2.7 23,-0.2 69,-1.9 -0.946 19.6-168.4-108.0 122.4 -19.7 -6.3 -1.3 6 23 A I E -ab 30 74A 2 23,-3.2 25,-2.5 -2,-0.5 2,-0.6 -0.942 3.4-161.7-112.9 117.3 -18.0 -9.2 0.5 7 24 A V E -ab 31 75A 1 67,-3.2 69,-2.6 -2,-0.5 2,-0.8 -0.909 4.4-156.9-103.7 120.6 -18.3 -12.6 -1.0 8 25 A L E -ab 32 76A 0 23,-3.1 25,-2.8 -2,-0.6 2,-1.1 -0.854 4.7-160.0 -93.0 104.5 -17.5 -15.7 1.2 9 26 A V E S+ab 33 77A 0 67,-2.4 69,-2.4 -2,-0.8 70,-1.6 -0.769 77.7 30.3 -86.9 97.8 -16.5 -18.5 -1.1 10 27 A G - 0 0 6 23,-2.7 24,-0.2 -2,-1.1 23,-0.2 0.176 66.3-159.0 110.1 115.7 -17.2 -21.3 1.4 11 28 A S + 0 0 0 21,-0.1 23,-0.1 4,-0.1 32,-0.1 -0.193 50.7 115.7-122.2 43.7 -19.9 -21.0 4.1 12 29 A G S > S- 0 0 28 3,-0.1 4,-2.2 4,-0.0 5,-0.2 0.335 87.9 -46.6 -86.8-139.9 -18.8 -23.6 6.6 13 30 A M H > S+ 0 0 89 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.917 141.3 38.9 -63.6 -50.9 -17.6 -23.1 10.2 14 31 A I H > S+ 0 0 29 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.937 114.3 56.7 -67.5 -46.2 -15.3 -20.1 9.5 15 32 A G H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.867 105.2 51.0 -50.2 -45.7 -17.7 -18.7 6.9 16 33 A G H X S+ 0 0 11 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.891 111.3 46.8 -64.1 -42.1 -20.5 -18.5 9.4 17 35 A V H X S+ 0 0 17 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.926 110.7 53.0 -67.5 -42.9 -18.4 -16.7 12.0 18 36 A M H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.936 108.2 49.3 -56.6 -48.1 -17.2 -14.2 9.4 19 37 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.901 112.1 50.7 -57.1 -41.5 -20.7 -13.3 8.2 20 38 A T H X S+ 0 0 6 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.936 112.4 44.5 -60.6 -49.9 -21.7 -12.8 11.9 21 39 A L H X S+ 0 0 2 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.830 108.6 57.1 -66.9 -37.6 -18.7 -10.5 12.6 22 40 A I H <>S+ 0 0 0 -4,-2.5 5,-2.4 -5,-0.2 4,-0.3 0.913 109.7 46.4 -58.7 -45.6 -19.2 -8.5 9.3 23 41 A V H ><5S+ 0 0 0 -4,-2.0 3,-1.2 3,-0.2 -2,-0.2 0.919 109.4 53.6 -59.9 -47.2 -22.8 -7.7 10.5 24 42 A Q H 3<5S+ 0 0 37 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.879 116.8 39.1 -53.7 -41.4 -21.6 -6.7 14.0 25 43 A K T 3<5S- 0 0 66 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.369 103.8-130.0 -93.5 3.9 -19.1 -4.3 12.4 26 44 A N T < 5 + 0 0 20 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.852 54.5 152.0 51.3 41.7 -21.5 -3.1 9.7 27 45 A L < - 0 0 10 -5,-2.4 2,-0.3 1,-0.2 -4,-0.1 0.765 54.1 -53.4 -80.5 -28.9 -18.7 -3.8 7.2 28 46 A G - 0 0 0 -6,-0.3 -1,-0.2 -25,-0.1 -23,-0.2 -0.939 66.0 -58.5 170.1 166.4 -20.6 -4.6 3.9 29 47 A D E -a 5 0A 39 -25,-2.2 -23,-3.2 -2,-0.3 2,-0.4 -0.478 56.2-145.6 -62.5 143.7 -23.2 -6.6 2.2 30 49 A V E -ac 6 60A 1 29,-3.3 31,-2.2 -25,-0.2 2,-0.5 -0.958 17.2-165.5-120.9 133.3 -22.3 -10.4 2.5 31 50 A V E -ac 7 61A 7 -25,-2.5 -23,-3.1 -2,-0.4 2,-0.8 -0.984 12.4-155.4-111.2 122.2 -22.9 -13.2 0.0 32 51 A M E -ac 8 62A 0 29,-3.4 31,-2.5 -2,-0.5 2,-0.4 -0.892 19.3-171.8 -95.5 107.9 -22.5 -16.6 1.7 33 52 A F E +ac 9 63A 9 -25,-2.8 -23,-2.7 -2,-0.8 2,-0.3 -0.827 13.6 154.7-101.7 138.9 -21.5 -19.0 -1.2 34 53 A D - 0 0 20 29,-2.1 4,-0.1 -2,-0.4 -2,-0.0 -0.987 47.3-131.4-149.5 160.1 -21.2 -22.8 -0.9 35 54 A V S S+ 0 0 99 -2,-0.3 2,-0.4 2,-0.1 -1,-0.1 0.747 87.3 93.9 -76.9 -24.4 -21.5 -25.8 -3.2 36 55 A V S S- 0 0 81 1,-0.1 -2,-0.1 -3,-0.1 -25,-0.0 -0.557 84.7-121.1 -72.2 124.1 -23.8 -27.4 -0.5 37 56 A K S S- 0 0 139 -2,-0.4 2,-2.1 1,-0.2 -2,-0.1 -0.326 81.1 -3.7 -68.2 145.0 -27.4 -26.7 -1.5 38 57 A N S > S+ 0 0 86 1,-0.2 4,-2.1 -4,-0.1 5,-0.2 -0.109 106.2 94.4 72.4 -40.6 -29.7 -24.7 1.0 39 58 A M H > S+ 0 0 34 -2,-2.1 4,-2.2 1,-0.2 5,-0.2 0.885 85.4 45.1 -50.2 -50.7 -27.2 -24.5 3.8 40 59 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.898 111.5 55.2 -66.3 -34.7 -25.7 -21.0 2.9 41 60 A Q H > S+ 0 0 55 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.904 109.6 45.8 -59.5 -40.3 -29.3 -19.7 2.4 42 61 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 821,-0.3 5,-0.2 0.913 113.4 48.6 -69.9 -44.7 -30.3 -20.8 5.9 43 62 A K H X S+ 0 0 15 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.916 112.3 49.4 -58.3 -45.4 -27.2 -19.4 7.6 44 63 A A H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.877 110.2 50.5 -62.6 -44.6 -27.7 -16.1 5.7 45 64 A L H X S+ 0 0 17 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.951 113.6 44.3 -56.5 -52.7 -31.4 -15.9 6.8 46 65 A D H >X S+ 0 0 1 -4,-2.2 3,-0.6 1,-0.2 4,-0.5 0.937 117.0 46.5 -57.1 -49.1 -30.5 -16.5 10.5 47 66 A T H >< S+ 0 0 2 -4,-2.7 3,-1.2 1,-0.2 4,-0.4 0.860 102.7 64.4 -65.9 -34.3 -27.5 -14.0 10.3 48 67 A S H >< S+ 0 0 5 -4,-2.5 3,-1.4 1,-0.3 4,-0.2 0.852 95.0 58.7 -61.7 -33.2 -29.6 -11.3 8.5 49 68 A H H XX S+ 0 0 0 -4,-1.1 3,-1.5 -3,-0.6 4,-0.6 0.769 89.8 73.0 -67.2 -24.1 -31.9 -10.9 11.5 50 69 A S H >S+ 0 0 0 -3,-1.4 5,-2.1 -4,-0.4 4,-0.9 0.857 88.1 56.7 -45.5 -42.2 -28.7 -6.6 11.8 52 71 A V H X45S+ 0 0 3 -3,-1.5 3,-1.1 -4,-0.2 -1,-0.2 0.973 110.3 41.0 -61.2 -55.9 -31.5 -5.4 14.3 53 72 A M H 3<5S+ 0 0 22 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.830 119.1 46.8 -60.0 -36.9 -29.5 -6.2 17.4 54 73AA A H 3<5S- 0 0 23 -4,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.584 102.8-129.1 -80.0 -9.8 -26.3 -4.8 15.8 55 73BA Y T <<5 + 0 0 46 -3,-1.1 -3,-0.2 -4,-0.9 2,-0.2 0.891 66.6 133.8 50.7 43.9 -27.9 -1.6 14.6 56 74 A S < - 0 0 3 -5,-2.1 748,-0.4 -6,-0.2 -1,-0.2 -0.544 54.7-147.9-109.6 177.0 -26.4 -2.5 11.2 57 75 A N + 0 0 12 -2,-0.2 2,-0.5 745,-0.1 -28,-0.1 -0.472 40.8 139.8-145.9 75.3 -27.6 -2.6 7.6 58 76 A C - 0 0 0 -10,-0.1 2,-0.2 -29,-0.1 -29,-0.1 -0.977 47.6-133.1-117.2 121.9 -25.8 -5.3 5.7 59 77 A K - 0 0 95 -2,-0.5 -29,-3.3 -8,-0.0 2,-0.5 -0.566 23.3-166.3 -65.7 131.2 -27.7 -7.5 3.2 60 78 A V E +c 30 0A 9 -2,-0.2 2,-0.3 -31,-0.2 -29,-0.2 -0.982 14.5 168.2-125.5 117.7 -26.8 -11.2 3.9 61 79 A T E -c 31 0A 67 -31,-2.2 -29,-3.4 -2,-0.5 2,-0.3 -0.890 27.1-132.6-131.2 156.4 -27.8 -13.6 1.3 62 80 A G E -c 32 0A 20 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.833 26.0-176.0-109.9 149.8 -27.0 -17.3 0.5 63 81 A S E -c 33 0A 6 -31,-2.5 -29,-2.1 -2,-0.3 -2,-0.0 -0.998 35.6-175.1-147.6 141.9 -25.9 -18.6 -2.9 64 83 A N S S+ 0 0 39 -2,-0.3 2,-0.4 -31,-0.2 -31,-0.1 0.107 73.7 90.3-109.3 17.8 -25.1 -21.8 -4.8 65 84 A S > - 0 0 44 1,-0.1 3,-1.3 0, 0.0 4,-0.1 -0.949 67.7-148.6-117.7 130.4 -24.2 -19.8 -7.9 66 85 A Y G > S+ 0 0 32 -2,-0.4 3,-1.8 1,-0.2 4,-0.2 0.628 89.3 85.5 -69.8 -9.3 -20.7 -18.4 -8.8 67 86 A D G > S+ 0 0 116 1,-0.3 3,-2.3 2,-0.2 -1,-0.2 0.817 72.7 72.4 -56.1 -34.8 -22.6 -15.5 -10.5 68 87 A D G < S+ 0 0 60 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.1 0.587 76.8 78.9 -66.5 -5.9 -22.8 -13.7 -7.1 69 88 A L G X + 0 0 3 -3,-1.8 3,-2.2 -4,-0.1 -1,-0.3 0.790 68.7 109.4 -64.8 -29.7 -19.0 -13.0 -7.5 70 89 A K T < S+ 0 0 146 -3,-2.3 46,-0.2 1,-0.2 45,-0.1 -0.283 87.2 9.7 -50.6 124.0 -20.0 -10.2 -9.8 71 90 A G T 3 S+ 0 0 46 44,-1.0 -66,-0.3 1,-0.3 -1,-0.2 0.435 87.7 156.2 87.5 -1.3 -19.3 -6.8 -8.1 72 91 A A < - 0 0 7 -3,-2.2 -1,-0.3 1,-0.2 -66,-0.2 -0.403 27.4-173.7 -63.4 132.2 -17.4 -8.3 -5.1 73 92 A D S S+ 0 0 68 -68,-2.7 47,-2.4 1,-0.3 2,-0.4 0.764 80.3 24.1 -86.5 -35.2 -14.9 -5.8 -3.4 74 93 A V E -bd 6 120A 0 -69,-1.9 -67,-3.2 45,-0.2 2,-0.5 -0.998 66.3-168.3-135.7 132.5 -13.6 -8.6 -1.2 75 94 A V E -bd 7 121A 0 45,-2.5 47,-2.5 -2,-0.4 2,-0.5 -0.995 4.8-166.4-122.2 125.8 -13.6 -12.3 -1.8 76 95 A I E -bd 8 122A 0 -69,-2.6 -67,-2.4 -2,-0.5 2,-0.7 -0.968 8.0-155.4-115.5 118.7 -12.6 -14.7 1.1 77 96 A V E +bd 9 123A 0 45,-3.0 47,-3.0 -2,-0.5 48,-1.3 -0.832 37.3 142.9-104.9 108.8 -11.9 -18.3 0.1 78 97 A T + 0 0 30 -69,-2.4 -68,-0.2 -2,-0.7 48,-0.2 0.311 36.6 129.4-113.7 -0.8 -12.4 -21.1 2.7 79 98 A A + 0 0 21 -70,-1.6 2,-0.3 -69,-0.1 46,-0.1 -0.329 32.2 120.1 -56.2 130.9 -13.7 -23.6 0.2 80 99 A G - 0 0 46 45,-0.1 2,-0.2 -2,-0.1 21,-0.1 -0.973 53.6 -91.4-178.7 172.5 -12.0 -27.0 0.4 81 100 A F + 0 0 105 -2,-0.3 2,-0.3 16,-0.2 16,-0.1 -0.601 35.7 163.4 -91.0 154.5 -12.0 -30.8 0.9 82 101 A T + 0 0 115 -2,-0.2 2,-0.0 0, 0.0 -2,-0.0 -0.970 35.7 44.0-162.4 167.4 -11.5 -32.8 4.0 83 102 A K - 0 0 172 -2,-0.3 10,-0.0 10,-0.1 -2,-0.0 -0.170 63.5-120.2 84.5 174.8 -12.1 -36.4 5.3 84 103AA A - 0 0 39 3,-0.1 8,-0.1 8,-0.1 2,-0.0 -0.971 10.2-120.7-152.5 163.5 -11.4 -39.7 3.5 85 103BA P S S- 0 0 102 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.016 78.7 -13.8 -92.4-163.3 -13.1 -42.9 2.3 86 103CA G S S+ 0 0 73 2,-0.0 3,-0.1 -2,-0.0 -2,-0.0 0.486 91.2 131.9 2.9 -59.6 -12.6 -46.6 3.0 87 103DA K - 0 0 114 1,-0.1 2,-0.4 4,-0.1 5,-0.1 0.402 59.2-116.4 -7.3 136.7 -9.3 -45.7 4.7 88 103EA S - 0 0 78 3,-0.1 -1,-0.1 1,-0.1 -2,-0.0 -0.943 53.0 -57.5-144.8 118.4 -9.1 -47.5 8.0 89 105AA D S S+ 0 0 134 -2,-0.4 -1,-0.1 -3,-0.1 3,-0.1 -0.973 109.1 3.2-139.9 3.8 -8.9 -45.9 10.4 90 105BA K S S+ 0 0 182 1,-0.0 -3,-0.0 -2,-0.0 -2,-0.0 0.251 96.0 92.0-135.9 3.7 -6.4 -43.2 11.4 91 106 A E + 0 0 134 2,-0.0 -3,-0.1 0, 0.0 -4,-0.1 0.003 46.4 157.1 -99.1 28.8 -4.3 -43.1 8.2 92 107 A W - 0 0 169 1,-0.1 -8,-0.1 -5,-0.1 -9,-0.0 -0.331 43.4-120.0 -53.3 125.4 -6.2 -40.3 6.4 93 108 A N - 0 0 83 3,-0.1 -10,-0.1 1,-0.1 -1,-0.1 -0.146 19.9-154.0 -79.4 174.4 -3.6 -38.9 4.0 94 109 A R S > S+ 0 0 183 2,-0.1 3,-0.6 3,-0.0 -1,-0.1 0.932 79.9 44.3 -82.4-101.0 -2.2 -35.4 3.6 95 110 A D G > S+ 0 0 39 1,-0.3 3,-0.6 2,-0.2 -1,-0.0 -0.229 95.9 69.1 98.2 -59.3 -1.1 -34.6 0.6 96 111 A D G 3 S+ 0 0 103 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.017 83.9 76.6-130.6 42.9 -3.7 -35.8 -1.8 97 112 A L G <> S+ 0 0 39 -3,-0.6 4,-2.3 -16,-0.1 -1,-0.2 0.396 83.4 72.4 7.0 -66.0 -5.8 -33.4 -0.5 98 113 A L H <> S+ 0 0 0 -3,-0.6 4,-2.2 1,-0.3 -2,-0.2 0.816 93.3 43.2-102.5 -42.2 -3.8 -31.3 -2.6 99 114 A P H > S+ 0 0 47 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.820 115.3 53.3 -64.9 -27.5 -4.9 -32.1 -6.2 100 115 A L H > S+ 0 0 74 -3,-0.2 4,-1.1 2,-0.2 -2,-0.3 0.911 111.4 43.7 -74.5 -41.5 -8.5 -32.0 -5.0 101 116 A N H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -3,-0.2 0.867 108.1 60.0 -72.0 -32.3 -8.1 -28.6 -3.5 102 117 A N H X S+ 0 0 14 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.880 101.8 53.1 -56.0 -42.2 -6.2 -27.4 -6.6 103 118 A K H X S+ 0 0 159 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.838 106.6 53.4 -64.7 -34.8 -9.3 -28.3 -8.8 104 119 A I H X S+ 0 0 29 -4,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.940 109.0 48.7 -61.4 -45.1 -11.4 -26.1 -6.5 105 120 A M H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.805 107.9 54.5 -64.5 -36.4 -9.0 -23.2 -7.0 106 121 A I H X S+ 0 0 84 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.938 111.7 44.5 -59.7 -48.8 -9.1 -23.6 -10.7 107 122 A E H X S+ 0 0 100 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.912 117.3 43.9 -63.9 -48.6 -12.9 -23.4 -10.7 108 123 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-0.3 0.934 112.2 52.5 -63.6 -48.3 -13.0 -20.4 -8.3 109 124 A G H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.853 104.9 55.5 -57.1 -42.8 -10.1 -18.5 -10.1 110 125 A G H X S+ 0 0 31 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.892 111.2 44.5 -56.6 -41.1 -11.8 -18.8 -13.5 111 126 A H H X S+ 0 0 59 -4,-1.3 4,-2.8 -3,-0.3 5,-0.4 0.872 112.0 51.6 -76.2 -34.1 -14.9 -17.1 -12.2 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2 -3,-1.5 7,-2.5 -17,-0.2 2,-0.3 -0.857 38.8 175.2 -96.3 128.3 8.6 -10.7 21.1 193 207 A T E -JK 174 198B 11 -19,-2.7 -19,-2.5 -2,-0.6 2,-0.4 -0.929 21.9-154.6-127.2 157.0 7.6 -7.5 23.0 194 208 A V E > S-JK 173 197B 0 3,-2.7 3,-1.6 -2,-0.3 -21,-0.3 -0.964 86.9 -17.0-131.2 111.7 5.2 -6.9 25.9 195 209AA G T 3 S- 0 0 8 -23,-3.6 -22,-0.1 -2,-0.4 -1,-0.1 0.828 130.9 -54.4 58.9 32.0 3.8 -3.3 26.1 196 209BA G T 3 S+ 0 0 1 -24,-0.5 -1,-0.3 1,-0.2 297,-0.1 0.443 115.7 120.5 84.1 1.5 6.7 -2.4 23.8 197 209CA I E < S-K 194 0B 0 -3,-1.6 -3,-2.7 295,-0.1 -1,-0.2 -0.858 73.1-102.8-104.4 129.8 9.3 -3.9 26.1 198 209DA P E >> -K 193 0B 47 0, 0.0 3,-1.5 0, 0.0 4,-0.6 -0.173 25.8-126.6 -50.8 136.0 11.6 -6.8 24.9 199 210AA L H >> S+ 0 0 4 -7,-2.5 4,-1.4 1,-0.3 3,-0.9 0.830 104.9 71.3 -51.5 -36.3 10.5 -10.2 26.2 200 210BA Q H 3> S+ 0 0 88 -8,-0.3 4,-2.7 1,-0.2 -1,-0.3 0.799 88.4 60.8 -53.2 -34.0 14.0 -10.8 27.6 201 211 A E H <> S+ 0 0 11 -3,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.885 104.8 48.8 -63.4 -38.1 13.5 -8.2 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321 A E H X S+ 0 0 49 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.902 109.2 50.1 -65.8 -40.3 8.0 -27.4 2.5 308 322 A T H X S+ 0 0 3 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.953 112.9 48.3 -58.5 -47.0 5.6 -25.0 0.6 309 323 A K H X S+ 0 0 99 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.821 108.9 54.0 -60.8 -39.5 7.7 -25.7 -2.5 310 324 A R H < S+ 0 0 101 -4,-2.1 4,-0.2 2,-0.2 3,-0.2 0.963 112.5 41.6 -59.2 -55.4 7.5 -29.5 -1.9 311 325 A M H >< S+ 0 0 28 -4,-2.3 3,-1.7 1,-0.2 4,-0.2 0.883 110.9 57.1 -64.7 -37.8 3.7 -29.5 -1.7 312 326 A K H >< S+ 0 0 53 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.884 100.3 59.3 -60.6 -38.5 3.4 -27.1 -4.6 313 327 A A T 3< S+ 0 0 70 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.488 91.3 68.7 -69.8 -6.2 5.4 -29.6 -6.8 314 328 A L T < S+ 0 0 58 -3,-1.7 2,-0.5 -4,-0.2 -1,-0.3 0.465 83.4 90.4 -88.2 -5.4 2.7 -32.3 -6.2 315 329 A I < 0 0 29 -3,-1.7 -217,-0.0 -4,-0.2 -3,-0.0 -0.834 360.0 360.0 -95.2 129.0 0.4 -30.3 -8.3 316 330 A H 0 0 209 -2,-0.5 -2,-0.1 -217,-0.0 -3,-0.0 -0.809 360.0 360.0-121.4 360.0 0.5 -31.1 -12.0 317 !* 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114.0 -26.3 120.5-167.6 7.4 17.9 30.2 500 197 B N T 3 S+ 0 0 90 1,-0.3 -1,-0.1 -2,-0.2 38,-0.1 0.612 130.2 54.3 -62.5 -17.1 10.7 19.1 28.6 501 198 B K T 3 S+ 0 0 109 -3,-0.1 -1,-0.3 120,-0.1 120,-0.1 0.233 75.4 141.2-103.7 14.0 12.9 16.5 30.3 502 199 B M < - 0 0 15 -3,-1.9 2,-0.8 -6,-0.1 -6,-0.2 -0.187 55.8-122.2 -48.2 139.9 10.8 13.5 29.2 503 200 B V E -X 495 0F 4 -8,-2.8 -8,-2.1 -6,-0.2 2,-0.7 -0.842 22.2-161.6 -99.8 110.8 13.0 10.5 28.3 504 201 B L E -X 494 0F 27 -2,-0.8 2,-1.1 -10,-0.2 -10,-0.2 -0.863 10.1-151.1 -93.3 111.2 12.4 9.5 24.7 505 202 B L > - 0 0 2 -12,-1.8 3,-1.4 -2,-0.7 -12,-0.4 -0.679 17.5-179.5 -94.4 92.6 13.8 5.9 24.4 506 203 B K G > S+ 0 0 68 -2,-1.1 3,-1.7 1,-0.3 10,-0.2 0.857 79.4 61.6 -55.5 -41.3 14.9 5.4 20.8 507 204 B R G 3 S+ 0 0 121 1,-0.3 -1,-0.3 9,-0.1 10,-0.1 0.763 101.9 51.9 -56.2 -31.5 16.0 1.8 21.6 508 205 B Y G < S+ 0 0 4 -3,-1.4 2,-0.4 -15,-0.2 -1,-0.3 0.346 79.9 116.8 -93.7 4.6 12.5 0.7 22.5 509 206 B I < + 0 0 2 -3,-1.7 7,-2.5 -4,-0.2 2,-0.3 -0.618 38.4 175.0 -80.9 132.8 10.7 2.0 19.4 510 207 B T E -VW 491 515E 10 -19,-2.4 -19,-2.7 -2,-0.4 2,-0.4 -0.938 22.9-153.7-131.5 157.2 9.0 -0.7 17.2 511 208 B V E > S-VW 490 514E 0 3,-2.6 3,-2.0 -2,-0.3 -21,-0.2 -0.991 89.1 -14.8-132.5 120.7 6.7 -0.6 14.1 512 209AB G T 3 S- 0 0 7 -23,-3.1 -22,-0.1 -2,-0.4 -1,-0.1 0.787 131.3 -54.3 48.4 32.9 4.4 -3.6 13.8 513 209BB G T 3 S+ 0 0 2 -24,-0.5 -1,-0.3 1,-0.3 -337,-0.1 0.398 115.6 121.7 84.7 -0.5 6.6 -5.3 16.4 514 209CB I E < S-W 511 0E 0 -3,-2.0 -3,-2.6 -339,-0.1 -1,-0.3 -0.790 72.9-103.8-100.0 132.5 9.7 -4.6 14.3 515 209DB P E >> -W 510 0E 48 0, 0.0 3,-1.7 0, 0.0 4,-0.6 -0.250 24.4-127.7 -56.7 137.6 12.6 -2.6 15.8 516 210AB L H >> S+ 0 0 4 -7,-2.5 4,-1.8 1,-0.3 3,-1.0 0.822 105.2 70.9 -51.9 -36.2 12.7 1.0 14.4 517 210BB Q H 3> S+ 0 0 86 -8,-0.3 4,-2.9 1,-0.2 -1,-0.3 0.738 88.0 62.0 -52.2 -30.9 16.4 0.4 13.4 518 211 B E H <> S+ 0 0 12 -3,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.890 105.4 47.4 -64.6 -37.2 15.4 -2.0 10.6 519 212 B F H <<>S+ 0 0 2 -3,-1.0 5,-2.8 -4,-0.6 6,-0.8 0.874 112.0 49.8 -73.0 -38.2 13.5 0.9 8.9 520 213 B I H ><5S+ 0 0 17 -4,-1.8 3,-2.1 3,-0.2 -2,-0.2 0.957 109.6 50.5 -59.0 -53.3 16.5 3.2 9.4 521 214 B N H 3<5S+ 0 0 90 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.793 112.0 48.7 -54.5 -34.4 18.8 0.5 7.9 522 215 B N T 3<5S- 0 0 75 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.270 114.7-120.6 -86.5 1.0 16.4 0.2 4.9 523 216 B K T < 5S+ 0 0 190 -3,-2.1 -3,-0.2 2,-0.3 3,-0.2 0.766 76.0 128.7 61.0 33.2 16.3 4.0 4.6 524 218 B K S - 0 0 44 -2,-0.3 4,-2.0 -3,-0.2 5,-0.1 -0.630 25.3-114.4 -99.0 163.3 16.9 8.6 8.7 527 221 B D H > S+ 0 0 65 -2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.879 119.9 52.9 -60.4 -39.7 18.5 9.1 12.1 528 222 B E H > S+ 0 0 140 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 106.9 52.0 -61.0 -45.5 18.1 12.9 11.5 529 223 B E H > S+ 0 0 76 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.889 108.9 50.6 -56.1 -43.0 14.4 12.5 10.7 530 225 B V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.915 109.6 51.4 -62.8 -44.1 14.0 10.5 14.0 531 226 B E H X S+ 0 0 95 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.893 109.5 48.8 -58.5 -43.5 15.8 13.4 15.9 532 227 B G H X S+ 0 0 39 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.842 110.1 52.4 -66.8 -34.9 13.5 16.0 14.4 533 228 B I H X S+ 0 0 20 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.895 108.5 51.0 -63.0 -43.5 10.5 13.8 15.4 534 229 B F H X S+ 0 0 19 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.957 111.3 47.3 -58.2 -51.7 11.9 13.7 18.9 535 230 B D H X S+ 0 0 97 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.909 112.7 49.4 -53.3 -46.7 12.2 17.5 19.0 536 231 B R H < S+ 0 0 106 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.915 110.1 51.6 -60.8 -44.1 8.7 17.8 17.6 537 232 B T H >< S+ 0 0 1 -4,-2.7 3,-1.1 1,-0.2 4,-0.3 0.940 110.8 46.6 -58.5 -49.6 7.4 15.4 20.3 538 233 B V H 3< S+ 0 0 35 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.908 119.5 41.5 -60.6 -38.1 9.0 17.3 23.2 539 234 B N T 3X S+ 0 0 73 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.257 79.5 108.1 -96.9 11.6 7.7 20.6 21.8 540 235 B T H <> S+ 0 0 0 -3,-1.1 4,-2.8 -4,-0.5 5,-0.2 0.870 76.7 52.7 -59.4 -44.7 4.1 19.7 20.7 541 236 B A H > S+ 0 0 45 -3,-0.3 4,-2.6 -4,-0.3 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15.0-177.0-101.3 96.2 -46.0 16.1 17.7 1141 203 D K G > S+ 0 0 72 -2,-1.0 3,-1.3 1,-0.2 10,-0.2 0.832 80.8 60.8 -57.8 -39.1 -47.3 14.5 20.9 1142 204 D R G 3 S+ 0 0 122 1,-0.2 -1,-0.2 9,-0.1 10,-0.2 0.800 101.6 53.6 -57.7 -34.7 -49.4 11.9 19.0 1143 205 D Y G < S+ 0 0 4 -3,-1.0 2,-0.3 -15,-0.2 -1,-0.2 0.420 80.7 113.4 -86.6 -0.0 -46.2 10.4 17.4 1144 206 D I < + 0 0 1 -3,-1.3 7,-2.5 -4,-0.3 8,-0.3 -0.581 40.5 176.0 -80.0 131.9 -44.2 9.8 20.7 1145 207 D T E -TU11261150K 11 -19,-2.3 -19,-2.6 -2,-0.3 2,-0.4 -0.947 22.7-152.7-131.5 155.2 -43.5 6.2 21.6 1146 208 D V E > S-TU11251149K 0 3,-2.9 3,-1.5 -2,-0.3 -21,-0.2 -0.963 89.0 -14.0-128.9 110.9 -41.5 4.5 24.4 1147 209AD G T 3 S- 0 0 8 -23,-3.6 -22,-0.1 -2,-0.4 -1,-0.1 0.846 131.1 -55.2 61.4 32.5 -40.1 1.1 23.5 1148 209BD G T 3 S+ 0 0 2 -24,-0.5 -1,-0.3 1,-0.3 -339,-0.1 0.390 115.9 121.7 83.9 -2.8 -42.5 1.2 20.5 1149 209CD I E < S-U 1146 0K 0 -3,-1.5 -3,-2.9 1,-0.1 -1,-0.3 -0.781 73.0-101.4 -98.2 131.3 -45.4 1.8 22.9 1150 209DD P E >> -U 1145 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221 D D H > S+ 0 0 84 1,-0.2 4,-1.9 -2,-0.2 -1,-0.1 0.851 119.3 51.3 -57.4 -38.1 -50.2 15.6 30.2 1163 222 D E H > S+ 0 0 121 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.836 106.7 51.6 -72.0 -36.2 -48.8 18.7 32.1 1164 223 D E H > S+ 0 0 62 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.876 109.9 51.2 -65.7 -34.9 -45.4 17.2 32.6 1165 225 D V H X S+ 0 0 2 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.919 109.7 49.5 -65.4 -43.4 -45.4 16.4 28.9 1166 226 D E H X S+ 0 0 139 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.882 109.5 51.4 -61.4 -39.7 -46.2 20.1 28.2 1167 227 D G H X S+ 0 0 43 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.818 110.3 49.3 -65.8 -33.0 -43.4 21.2 30.5 1168 228 D I H X S+ 0 0 20 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.863 107.2 54.8 -73.9 -38.2 -41.0 18.9 28.6 1169 229 D F H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.963 111.4 45.0 -56.3 -52.5 -42.2 20.3 25.2 1170 230 D D H X S+ 0 0 101 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.888 111.3 52.3 -55.5 -44.3 -41.4 23.8 26.5 1171 231 D R H < S+ 0 0 100 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.869 109.9 50.1 -63.9 -36.7 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116.7 38.8 -65.4 -20.0 -28.1 31.3 30.3 1182 242 D L H << S- 0 0 42 -4,-0.7 -823,-0.4 -3,-0.6 -1,-0.2 0.471 144.7 -45.0-100.7 -5.9 -25.8 28.8 32.1 1183 243 D L H << S- 0 0 78 -3,-0.9 -3,-0.2 -4,-0.7 -2,-0.2 0.459 84.5 -79.8 116.5 73.1 -22.7 29.1 29.8 1184 244 D A S < S+ 0 0 22 -4,-0.9 3,-0.2 -7,-0.1 -4,-0.1 0.866 72.0 22.5 59.2 146.3 -23.0 29.0 26.1 1185 245 D S - 0 0 28 1,-0.2 2,-0.6 2,-0.1 3,-0.3 0.811 52.9-129.0 40.8 99.6 -23.4 27.0 23.0 1186 246 D P + 0 0 19 0, 0.0 -1,-0.2 0, 0.0 -220,-0.1 -0.753 52.9 144.8 -62.9 123.3 -24.9 23.7 22.8 1187 247 D Y > + 0 0 31 -2,-0.6 4,-1.9 -3,-0.2 5,-0.1 0.524 54.6 60.1-128.9 -28.3 -22.0 22.1 20.8 1188 248 D V H > S+ 0 0 6 -3,-0.3 4,-2.2 2,-0.2 5,-0.2 0.973 111.3 38.7 -68.7 -55.6 -21.6 18.5 22.0 1189 249 D A H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.896 114.6 53.4 -64.7 -43.5 -25.1 17.3 21.1 1190 250 D P H > S+ 0 0 6 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.943 111.2 48.4 -51.8 -47.0 -25.3 19.3 17.8 1191 251 D A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.901 111.3 48.4 -62.0 -41.2 -22.0 17.7 16.7 1192 252 D A H X S+ 0 0 6 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.901 111.4 51.3 -67.2 -38.8 -23.2 14.2 17.6 1193 253 D A H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.909 110.9 47.4 -58.8 -45.6 -26.4 14.8 15.7 1194 254 D I H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.926 111.4 50.0 -65.4 -44.8 -24.5 15.9 12.6 1195 255 D I H X S+ 0 0 2 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.877 106.4 56.5 -63.3 -37.8 -22.1 13.0 12.7 1196 256 D E H X S+ 0 0 11 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.924 112.1 43.2 -55.1 -45.0 -25.2 10.7 13.0 1197 257 D M H X S+ 0 0 0 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.925 114.9 48.2 -64.0 -48.8 -26.4 12.2 9.7 1198 258 D A H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.899 110.8 51.0 -63.6 -42.6 -23.0 12.1 8.0 1199 259 D E H X S+ 0 0 28 -4,-2.9 4,-2.2 2,-0.2 6,-0.2 0.831 102.8 58.6 -62.0 -39.8 -22.4 8.5 9.0 1200 260 D S H <>S+ 0 0 0 -4,-1.5 5,-2.2 -5,-0.2 6,-0.7 0.879 112.6 42.1 -58.4 -40.0 -25.8 7.3 7.7 1201 261 D Y H ><5S+ 0 0 22 -4,-1.4 3,-1.7 3,-0.2 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