==== 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 20-APR-04 1T26 . COMPND 2 MOLECULE: L-LACTATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR A.CAMERON,J.READ,R.TRANTER,V.J.WINTER,R.B.SESSIONS,R.L.BRADY . 315 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14122.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 243 77.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 27 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 34.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 1 2 0 0 0 1 0 3 0 0 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 3 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 PARALLEL BRIDGES PER LADDER . 2 3 0 1 0 0 0 0 0 1 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 1 0 0 0 0 0 0 1 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 19 A P 0 0 181 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.7 46.1 40.9 20.4 2 20 A K - 0 0 79 1,-0.1 25,-0.1 25,-0.0 2,-0.1 -0.118 360.0-104.8 -56.4 148.4 44.8 38.6 17.7 3 21 A A - 0 0 19 23,-0.4 25,-2.1 69,-0.0 2,-0.5 -0.411 29.3-131.2 -67.4 151.6 41.7 36.6 18.2 4 22 A K E -a 28 0A 57 66,-0.3 68,-2.8 23,-0.2 69,-1.8 -0.954 22.4-168.3-108.7 121.2 42.3 32.8 18.8 5 23 A I E -ab 29 73A 2 23,-2.7 25,-2.3 -2,-0.5 2,-0.6 -0.939 2.6-162.4-116.3 115.8 40.0 30.6 16.6 6 24 A V E -ab 30 74A 1 67,-2.7 69,-2.6 -2,-0.6 2,-0.9 -0.859 5.5-157.0-103.8 122.1 39.9 26.9 17.3 7 25 A L E -ab 31 75A 0 23,-3.2 25,-2.5 -2,-0.6 2,-1.3 -0.848 6.4-157.7 -97.0 103.7 38.5 24.6 14.7 8 26 A V E S+ab 32 76A 2 67,-2.2 69,-2.1 -2,-0.9 70,-1.6 -0.740 77.7 34.0 -85.2 96.5 37.3 21.5 16.5 9 27 A G - 0 0 6 23,-2.6 24,-0.2 -2,-1.3 23,-0.2 0.154 66.4-157.5 118.1 119.3 37.5 19.1 13.6 10 28 A S + 0 0 0 21,-0.1 23,-0.1 4,-0.1 32,-0.1 -0.178 52.7 112.8-118.9 38.5 40.2 19.4 10.9 11 29 A G S > S- 0 0 30 3,-0.0 4,-2.1 4,-0.0 5,-0.1 0.303 88.6 -48.9 -86.8-142.0 38.5 17.6 7.9 12 30 A M H > S+ 0 0 105 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.933 138.7 40.8 -64.7 -49.4 37.3 19.1 4.6 13 31 A I H > S+ 0 0 31 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 113.8 54.9 -67.0 -41.5 35.4 22.0 6.0 14 32 A G H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.888 106.1 52.5 -57.0 -40.1 38.0 22.7 8.6 15 33 A G H X S+ 0 0 16 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.922 110.1 45.8 -64.9 -42.2 40.7 22.9 5.9 16 35 A V H X S+ 0 0 28 -4,-1.7 4,-2.5 1,-0.2 5,-0.2 0.912 111.5 54.1 -67.1 -40.4 38.8 25.5 3.8 17 36 A M H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.923 107.7 48.9 -58.4 -46.5 38.0 27.5 7.0 18 37 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.925 111.9 50.1 -60.2 -43.7 41.7 27.7 8.0 19 38 A T H X S+ 0 0 55 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.907 112.4 46.1 -59.2 -44.1 42.6 28.8 4.4 20 39 A L H X S+ 0 0 44 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.851 107.9 57.1 -72.6 -33.3 39.9 31.6 4.4 21 40 A I H <>S+ 0 0 2 -4,-2.5 5,-2.3 -5,-0.2 4,-0.4 0.915 109.6 45.0 -63.1 -42.2 40.9 32.8 7.8 22 41 A V H ><5S+ 0 0 0 -4,-1.9 3,-1.1 2,-0.2 -2,-0.2 0.914 110.1 55.0 -66.8 -42.6 44.5 33.4 6.7 23 42 A Q H 3<5S+ 0 0 106 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.853 117.1 36.9 -56.2 -38.0 43.3 35.0 3.4 24 43 A K T 3<5S- 0 0 92 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.373 104.0-129.5 -96.1 1.7 41.2 37.5 5.5 25 44 A N T < 5 + 0 0 79 -3,-1.1 -3,-0.2 -4,-0.4 -4,-0.1 0.857 53.3 153.7 50.5 43.0 43.8 37.8 8.3 26 45 A L < - 0 0 20 -5,-2.3 -23,-0.4 1,-0.2 2,-0.3 0.763 55.3 -63.4 -77.4 -27.4 41.0 37.1 10.9 27 46 A G - 0 0 0 -6,-0.3 -1,-0.2 -25,-0.1 -23,-0.2 -0.922 67.0 -47.4 163.0 174.1 43.1 35.6 13.7 28 47 A D E -a 4 0A 36 -25,-2.1 -23,-2.7 -2,-0.3 2,-0.4 -0.413 56.9-144.9 -65.3 146.8 45.4 32.8 14.9 29 49 A V E -ac 5 59A 1 29,-3.2 31,-2.6 -25,-0.2 2,-0.5 -0.955 16.6-166.9-123.0 134.6 44.1 29.3 14.0 30 50 A V E -ac 6 60A 12 -25,-2.3 -23,-3.2 -2,-0.4 2,-0.9 -0.983 10.3-156.2-114.8 121.0 44.2 26.0 15.8 31 51 A L E -ac 7 61A 0 29,-3.2 31,-2.0 -2,-0.5 2,-0.4 -0.863 21.3-174.2 -92.9 103.6 43.3 22.9 13.7 32 52 A F E +ac 8 62A 10 -25,-2.5 -23,-2.6 -2,-0.9 2,-0.3 -0.815 13.5 149.0-101.7 139.8 42.2 20.4 16.3 33 53 A D - 0 0 26 29,-2.0 4,-0.1 -2,-0.4 -2,-0.0 -0.977 51.4-125.3-159.5 161.9 41.3 16.7 15.5 34 54 A I S S+ 0 0 140 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.679 85.2 98.0 -83.9 -20.1 41.4 13.2 17.1 35 55 A V S S- 0 0 74 1,-0.1 -2,-0.1 2,-0.0 2,-0.1 -0.535 84.2-114.0 -70.0 126.7 43.4 12.0 14.0 36 56 A K S S- 0 0 147 -2,-0.3 2,-2.1 1,-0.2 -1,-0.1 -0.387 81.1 -15.1 -65.9 138.4 47.1 11.9 14.8 37 57 A N S >> S+ 0 0 94 1,-0.2 4,-1.8 -4,-0.1 3,-0.7 -0.102 104.7 100.1 67.9 -40.2 49.5 14.2 12.9 38 58 A M H 3> S+ 0 0 57 -2,-2.1 4,-2.4 1,-0.2 5,-0.2 0.867 81.4 51.0 -45.1 -49.6 47.0 15.2 10.1 39 59 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.877 108.4 53.4 -59.7 -36.8 46.1 18.5 11.6 40 60 A H H <> S+ 0 0 84 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.876 109.3 49.3 -63.2 -38.8 49.8 19.4 12.0 41 61 A G H X S+ 0 0 43 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.936 113.1 44.5 -66.7 -47.5 50.3 18.7 8.3 42 62 A K H X S+ 0 0 59 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.884 112.9 53.0 -63.2 -40.3 47.4 20.8 7.1 43 63 A A H X S+ 0 0 2 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.924 108.6 49.5 -61.0 -46.0 48.4 23.6 9.5 44 64 A L H X S+ 0 0 107 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.959 112.9 46.1 -58.3 -54.3 52.0 23.6 8.1 45 65 A D H >< S+ 0 0 114 -4,-2.2 3,-0.5 1,-0.2 4,-0.5 0.926 115.9 46.5 -50.8 -51.0 50.8 23.8 4.5 46 66 A T H >< S+ 0 0 13 -4,-2.6 3,-1.6 1,-0.2 4,-0.3 0.878 101.8 65.2 -65.2 -36.7 48.3 26.5 5.3 47 67 A S H >< S+ 0 0 30 -4,-2.8 3,-1.7 1,-0.3 4,-0.2 0.841 91.6 63.7 -57.9 -34.2 50.7 28.6 7.3 48 68 A H T XX S+ 0 0 103 -4,-1.2 3,-1.7 -3,-0.5 4,-0.6 0.773 86.3 72.9 -63.8 -25.0 52.9 29.3 4.3 49 69 A T H <> S+ 0 0 30 -3,-1.6 4,-2.5 -4,-0.5 -1,-0.3 0.608 73.2 83.8 -67.0 -12.1 50.0 31.2 2.6 50 70 A N H <>>S+ 0 0 24 -3,-1.7 5,-1.8 -4,-0.3 4,-0.9 0.862 89.7 53.9 -54.5 -35.7 50.6 34.1 5.0 51 71 A V H X45S+ 0 0 117 -3,-1.7 3,-0.9 -4,-0.2 -1,-0.2 0.980 111.8 39.9 -63.2 -56.8 53.3 35.1 2.6 52 72 A M H 3<5S+ 0 0 128 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.2 0.795 119.3 48.8 -61.3 -30.3 51.0 35.2 -0.5 53 73AA A H 3<5S- 0 0 16 -4,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.544 102.4-126.5 -90.4 -7.9 48.2 36.8 1.5 54 73BA Y T <<5 + 0 0 217 -3,-0.9 2,-0.2 -4,-0.9 -3,-0.2 0.831 68.2 131.3 61.5 35.7 50.1 39.6 3.2 55 74 A S < - 0 0 20 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.555 55.4-149.5-112.9 175.1 48.8 38.2 6.5 56 75 A N + 0 0 116 -2,-0.2 2,-0.5 -34,-0.1 -28,-0.1 -0.456 42.0 137.8-145.6 66.2 50.2 37.3 9.9 57 76 A C - 0 0 1 -10,-0.1 -29,-0.1 -30,-0.1 -7,-0.1 -0.967 47.5-131.6-115.2 124.1 48.1 34.5 11.4 58 77 A K - 0 0 146 -2,-0.5 -29,-3.2 -8,-0.0 2,-0.4 -0.455 19.5-163.5 -67.7 142.6 49.6 31.6 13.2 59 78 A V E +c 29 0A 16 -31,-0.2 2,-0.3 -2,-0.1 -29,-0.2 -0.960 16.4 168.7-130.9 115.5 48.3 28.2 12.1 60 79 A S E -c 30 0A 57 -31,-2.6 -29,-3.2 -2,-0.4 2,-0.2 -0.924 26.6-133.0-129.1 150.1 48.9 25.3 14.3 61 80 A G E -c 31 0A 12 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.587 24.5-170.0 -94.4 161.8 47.7 21.7 14.6 62 81 A S E +c 32 0A 2 -31,-2.0 -29,-2.0 -2,-0.2 3,-0.0 -0.978 34.0 177.5-155.9 141.7 46.5 20.0 17.8 63 83 A N + 0 0 51 -2,-0.3 2,-0.5 -31,-0.2 -31,-0.1 0.080 69.2 93.5-119.3 17.0 45.6 16.6 19.2 64 84 A T > - 0 0 81 1,-0.1 3,-2.1 2,-0.0 4,-0.1 -0.942 62.4-153.6-121.9 116.9 45.0 18.1 22.7 65 85 A Y G > S+ 0 0 41 -2,-0.5 3,-1.8 1,-0.3 -1,-0.1 0.800 91.9 67.7 -54.0 -35.0 41.6 19.3 24.0 66 86 A D G > S+ 0 0 79 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.601 76.2 83.9 -69.7 -6.0 43.1 21.7 26.4 67 87 A D G < S+ 0 0 69 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.533 71.5 80.9 -69.6 -1.0 44.4 23.8 23.5 68 88 A L G X + 0 0 3 -3,-1.8 3,-2.2 -4,-0.1 -1,-0.3 0.687 66.2 116.8 -73.1 -17.4 40.9 25.2 23.6 69 89 A A T < S+ 0 0 44 -3,-1.9 46,-0.2 1,-0.3 45,-0.1 -0.261 80.5 13.3 -53.3 132.6 42.2 27.4 26.4 70 90 A G T 3 S+ 0 0 55 44,-1.0 -66,-0.3 1,-0.2 -1,-0.3 0.491 87.8 158.6 80.6 3.2 42.0 31.1 25.5 71 91 A A < - 0 0 6 -3,-2.2 -1,-0.2 1,-0.2 -66,-0.2 -0.350 26.1-174.3 -63.1 133.9 39.7 30.5 22.5 72 92 A D S S+ 0 0 74 -68,-2.8 47,-2.4 1,-0.4 2,-0.4 0.790 78.6 19.8 -93.9 -36.3 37.7 33.5 21.3 73 93 A V E -bd 5 119A 0 -69,-1.8 -67,-2.7 45,-0.2 2,-0.4 -0.998 67.2-165.4-134.9 136.3 35.8 31.6 18.7 74 94 A V E -bd 6 120A 0 45,-2.5 47,-2.7 -2,-0.4 2,-0.5 -0.992 3.4-165.7-122.8 125.1 35.2 27.8 18.5 75 95 A I E -bd 7 121A 0 -69,-2.6 -67,-2.2 -2,-0.4 2,-0.7 -0.949 8.6-154.4-115.3 120.4 33.9 26.1 15.3 76 96 A V E +bd 8 122A 0 45,-3.0 47,-2.8 -2,-0.5 48,-1.4 -0.817 38.4 141.2-105.1 106.2 32.6 22.6 15.6 77 97 A T + 0 0 29 -69,-2.1 -68,-0.2 -2,-0.7 -1,-0.2 0.344 34.6 134.6-111.9 -2.3 32.7 20.3 12.5 78 98 A A + 0 0 20 -70,-1.6 2,-0.3 46,-0.1 46,-0.1 -0.202 42.6 54.7 -51.4 134.8 33.7 17.2 14.5 79 99 A G S S- 0 0 44 45,-0.1 2,-0.3 24,-0.1 21,-0.1 -0.923 85.7 -34.7 141.5-165.1 31.7 14.0 13.6 80 100 A F - 0 0 94 -2,-0.3 45,-0.3 16,-0.2 3,-0.1 -0.678 26.7-164.0 -96.7 148.9 30.6 11.7 10.8 81 101 A T S S+ 0 0 72 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.654 77.7 17.8-102.5 -22.6 29.7 12.7 7.2 82 102 A K S S- 0 0 106 13,-0.1 -1,-0.3 14,-0.1 5,-0.1 -0.963 82.8-102.1-155.7 139.0 27.9 9.5 6.3 83 103AA A > - 0 0 20 -2,-0.3 3,-2.8 9,-0.1 2,-1.3 -0.741 48.2-118.2 -53.7 108.6 26.3 6.5 8.0 84 103BA P T 3 S+ 0 0 111 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.351 104.4 31.6 -54.5 91.7 29.0 3.9 7.5 85 103CA G T 3 S+ 0 0 81 -2,-1.3 2,-0.4 1,-0.5 0, 0.0 0.147 92.1 105.5 145.0 -25.0 26.9 1.6 5.4 86 103DA K < - 0 0 89 -3,-2.8 -1,-0.5 1,-0.1 5,-0.0 -0.774 66.1-121.2 -94.7 138.1 24.5 3.8 3.5 87 103EA S - 0 0 58 -2,-0.4 -4,-0.1 -3,-0.1 -1,-0.1 0.019 25.0-110.2 -60.0 167.4 24.8 4.5 -0.2 88 105AA D S > S+ 0 0 74 1,-0.2 3,-0.7 2,-0.1 140,-0.1 0.785 116.3 62.1 -76.3 -26.4 25.2 8.1 -1.6 89 105BA K T 3 S+ 0 0 146 1,-0.2 2,-0.4 138,-0.1 -1,-0.2 0.888 107.2 44.1 -60.4 -41.5 21.7 7.9 -3.1 90 106 A E T 3 S+ 0 0 82 -3,-0.1 2,-0.7 2,-0.1 -1,-0.2 -0.440 81.8 141.7-107.2 56.4 20.1 7.5 0.4 91 107 A W < + 0 0 39 -3,-0.7 2,-0.6 -2,-0.4 3,-0.1 -0.722 17.2 166.8 -90.5 157.9 22.0 10.1 2.5 92 108 A N > - 0 0 46 -2,-0.7 3,-1.2 1,-0.1 4,-0.2 -0.968 42.1-131.6-174.3 134.8 20.3 11.8 4.7 93 109 A R G > S+ 0 0 12 -2,-0.6 3,-1.7 1,-0.3 4,-0.3 0.788 103.7 69.6 -63.8 -28.5 21.5 14.1 7.6 94 110 A D G > S+ 0 0 40 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.837 90.4 60.6 -59.2 -33.7 19.1 12.3 10.0 95 111 A D G < S+ 0 0 47 -3,-1.2 4,-0.3 1,-0.3 -1,-0.3 0.587 92.2 66.7 -72.8 -10.4 21.3 9.2 9.8 96 112 A L G <> S+ 0 0 6 -3,-1.7 4,-1.8 -4,-0.2 3,-0.5 0.596 78.4 89.9 -83.9 -11.4 24.3 11.1 11.2 97 113 A L H <> S+ 0 0 7 -3,-1.4 4,-1.3 -4,-0.3 3,-0.4 0.910 86.8 42.2 -50.8 -57.5 22.4 11.5 14.5 98 114 A P H 4 S+ 0 0 90 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.737 115.6 53.5 -65.9 -21.6 23.6 8.3 16.3 99 115 A L H 4 S+ 0 0 29 -3,-0.5 -2,-0.2 -4,-0.3 4,-0.1 0.786 115.9 33.5 -84.9 -29.8 27.1 8.9 15.0 100 116 A N H X S+ 0 0 0 -4,-1.8 4,-1.1 -3,-0.4 -3,-0.1 0.508 92.0 87.3-108.0 -6.3 27.6 12.5 16.2 101 117 A N H >X S+ 0 0 43 -4,-1.3 4,-1.1 1,-0.2 3,-0.8 0.941 88.5 46.0 -63.5 -53.7 25.7 12.8 19.5 102 118 A K H 3> S+ 0 0 144 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.766 106.2 64.4 -60.6 -28.1 28.3 11.6 22.1 103 119 A I H 3> S+ 0 0 44 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.863 98.1 52.5 -65.8 -39.4 30.9 13.9 20.4 104 120 A M H < + 0 0 7 -4,-2.2 3,-2.1 -5,-0.4 -1,-0.2 -0.311 58.6 158.8-147.7 60.6 36.9 28.6 27.2 116 132AA P T 3 S+ 0 0 57 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.683 80.4 54.3 -59.9 -17.7 33.4 29.3 28.8 117 132BA N T 3 S+ 0 0 131 -46,-0.1 -5,-0.1 -6,-0.1 2,-0.0 0.358 84.3 115.3 -99.5 6.9 33.5 32.9 27.3 118 133 A A < - 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0 0 48 -2,-0.3 4,-1.9 -3,-0.2 5,-0.1 -0.584 21.1-117.9 -99.2 162.3 8.4 32.2 -14.1 209 221 A D H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.890 117.7 53.1 -59.4 -40.5 6.7 30.6 -11.1 210 222 A A H > S+ 0 0 74 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.891 107.3 50.6 -63.6 -40.2 7.5 27.2 -12.6 211 223 A E H > S+ 0 0 67 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.878 110.3 51.0 -63.6 -37.3 11.1 28.1 -13.0 212 225 A L H X S+ 0 0 1 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.891 105.2 55.1 -69.4 -38.1 11.1 29.2 -9.3 213 226 A E H X S+ 0 0 97 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.895 109.1 48.4 -60.3 -39.0 9.6 25.9 -8.2 214 227 A A H X S+ 0 0 61 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.903 110.9 49.8 -68.6 -40.5 12.4 24.0 -9.9 215 228 A I H X S+ 0 0 24 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.901 109.0 53.8 -63.6 -40.2 15.0 26.3 -8.3 216 229 A F H X S+ 0 0 20 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.942 110.5 45.5 -59.3 -48.5 13.3 25.7 -4.9 217 230 A D H X S+ 0 0 100 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.906 112.0 51.7 -62.2 -39.9 13.6 21.9 -5.4 218 231 A R H < S+ 0 0 111 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.898 107.8 54.0 -64.3 -36.8 17.2 22.2 -6.5 219 232 A T H >< S+ 0 0 1 -4,-2.4 3,-1.2 1,-0.2 4,-0.3 0.943 108.9 45.9 -63.1 -49.7 18.0 24.3 -3.4 220 233 A V H 3< S+ 0 0 29 -4,-2.1 3,-0.3 1,-0.2 4,-0.2 0.894 119.6 42.1 -60.6 -40.1 16.6 21.7 -1.0 221 234 A N T 3X S+ 0 0 73 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.254 80.7 108.2 -93.4 13.5 18.4 18.9 -2.8 222 235 A T H <> S+ 0 0 2 -3,-1.2 4,-2.5 -4,-0.3 5,-0.2 0.911 77.1 51.6 -59.6 -47.3 21.8 20.6 -3.4 223 236 A A H > S+ 0 0 3 -3,-0.3 4,-2.1 -4,-0.3 -1,-0.2 0.934 113.9 46.6 -55.4 -44.1 23.8 18.6 -0.9 224 237 A L H > S+ 0 0 46 -4,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.896 108.6 54.6 -64.3 -41.1 22.5 15.5 -2.5 225 238 A E H < S+ 0 0 64 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.903 110.2 47.0 -59.8 -41.3 23.2 16.7 -6.0 226 239 A I H >X S+ 0 0 52 -4,-2.5 4,-2.7 1,-0.2 3,-1.0 0.895 110.9 50.4 -69.8 -41.3 26.8 17.4 -5.1 227 240 A V H 3< S+ 0 0 12 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.891 106.4 55.3 -63.1 -39.5 27.2 14.0 -3.5 228 241 A N T 3< S+ 0 0 101 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.585 120.9 33.0 -70.2 -6.7 25.8 12.3 -6.6 229 242 A L T <4 S- 0 0 139 -3,-1.0 -2,-0.2 -4,-0.2 -1,-0.2 0.628 141.8 -30.3-115.0 -26.4 28.5 14.1 -8.5 230 243 A H S < S- 0 0 118 -4,-2.7 2,-0.3 1,-0.1 -3,-0.2 0.223 92.0 -51.0-156.0 -81.1 31.4 14.2 -6.0 231 244 A A S S- 0 0 34 -5,-0.4 -1,-0.1 -8,-0.1 -2,-0.1 -0.968 72.9 -40.9-167.4 178.1 31.3 14.4 -2.2 232 245 A S S S- 0 0 40 -2,-0.3 -8,-0.1 -5,-0.1 -9,-0.0 -0.305 73.4-101.8 -54.1 134.8 29.9 16.0 0.9 233 246 A P + 0 0 20 0, 0.0 -220,-0.1 0, 0.0 -1,-0.1 -0.366 56.5 152.0 -58.8 137.7 29.8 19.8 0.3 234 247 A Y > + 0 0 62 -222,-0.1 4,-1.7 -3,-0.1 5,-0.1 0.542 55.9 62.8-139.8 -29.0 32.7 21.7 2.0 235 248 A V H > S+ 0 0 92 2,-0.2 4,-2.1 1,-0.1 5,-0.1 0.953 110.0 37.7 -70.7 -51.3 33.7 24.8 0.1 236 249 A A H > S+ 0 0 42 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.914 114.6 54.9 -68.7 -41.9 30.4 26.8 0.4 237 250 A P H > S+ 0 0 7 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.955 110.1 48.6 -51.3 -46.7 29.7 25.6 4.0 238 251 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.927 110.7 48.8 -61.7 -46.1 33.1 26.9 5.0 239 252 A A H X S+ 0 0 49 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.899 110.9 51.7 -61.4 -39.5 32.6 30.3 3.4 240 253 A A H X S+ 0 0 6 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.916 110.1 48.5 -62.1 -45.2 29.2 30.5 5.1 241 254 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.920 110.6 50.8 -62.2 -43.2 30.7 29.8 8.5 242 255 A I H X S+ 0 0 2 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.889 105.2 55.8 -65.0 -35.5 33.5 32.3 8.0 243 256 A E H X S+ 0 0 35 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.922 112.2 44.9 -61.1 -39.1 31.0 35.0 7.0 244 257 A M H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.943 114.3 47.0 -66.5 -49.5 29.3 34.3 10.4 245 258 A A H X S+ 0 0 3 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.896 111.2 52.9 -61.6 -40.4 32.6 34.3 12.4 246 259 A E H X S+ 0 0 25 -4,-3.1 4,-2.5 1,-0.2 6,-0.3 0.871 103.8 55.7 -63.0 -39.8 33.8 37.5 10.7 247 260 A S H <>S+ 0 0 0 -4,-1.6 5,-2.0 -5,-0.2 6,-0.7 0.888 112.9 43.2 -61.0 -38.9 30.6 39.3 11.6 248 261 A Y H ><5S+ 0 0 34 -4,-1.6 3,-1.1 3,-0.2 -2,-0.2 0.960 114.8 47.4 -67.7 -55.0 31.2 38.5 15.2 249 262 A L H 3<5S+ 0 0 48 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.857 121.8 34.7 -59.7 -38.7 34.9 39.2 15.3 250 263 A K T 3<5S- 0 0 108 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.259 105.2-120.7-101.8 9.4 34.7 42.6 13.5 251 264 A D T < 5 + 0 0 69 -3,-1.1 -3,-0.2 -4,-0.3 29,-0.1 0.914 55.9 155.2 51.7 49.5 31.3 43.7 15.0 252 265 A L < - 0 0 78 -5,-2.0 28,-0.2 -6,-0.3 -4,-0.1 0.761 40.1-145.9 -75.2 -27.8 29.7 44.0 11.6 253 266 A K + 0 0 92 26,-1.2 27,-0.2 -6,-0.7 2,-0.1 0.840 31.6 175.0 60.1 37.4 26.1 43.4 12.8 254 267 A K E - H 0 279A 56 25,-0.8 25,-2.1 -10,-0.1 2,-0.7 -0.441 35.7-122.1 -70.6 145.9 25.1 41.6 9.7 255 268 A V E + H 0 278A 86 23,-0.2 2,-0.3 -2,-0.1 23,-0.2 -0.833 46.4 165.5 -87.1 116.7 21.7 40.0 9.5 256 269 A L E - H 0 277A 13 21,-2.7 21,-2.1 -2,-0.7 2,-0.6 -0.999 39.0-119.6-138.6 137.2 22.3 36.3 8.9 257 270 A I E + H 0 276A 12 -2,-0.3 -106,-1.3 19,-0.3 -108,-0.4 -0.698 49.4 151.4 -84.3 120.7 20.0 33.3 9.2 258 271 A C E - H 0 275A 0 17,-2.0 17,-2.0 -2,-0.6 2,-0.5 -0.908 52.1 -90.5-141.7 164.2 21.3 30.9 11.7 259 272 A S E +FH 147 274A 1 -112,-2.3 -112,-1.7 -2,-0.3 2,-0.3 -0.687 57.4 159.6 -80.6 125.4 20.1 28.3 14.2 260 273 A T E - H 0 273A 5 13,-2.1 13,-2.1 -2,-0.5 2,-0.3 -0.944 47.5 -78.9-144.8 160.0 19.4 29.9 17.6 261 274 A L E - H 0 272A 26 -119,-0.4 2,-0.4 -116,-0.3 11,-0.2 -0.477 44.1-143.9 -65.5 123.2 17.5 29.3 20.8 262 275 A L E - H 0 271A 0 9,-2.8 8,-0.9 -2,-0.3 9,-0.6 -0.724 19.6-179.2 -89.0 136.3 13.8 30.2 20.3 263 276 A E E S- H 0 269A 103 -2,-0.4 6,-0.3 6,-0.2 -1,-0.1 -0.215 79.6 -39.7-128.2 42.6 12.0 31.7 23.2 264 277 A G S > S+ 0 0 36 4,-3.5 3,-2.2 1,-0.4 5,-0.2 0.154 93.4 138.0 121.4 -17.4 8.4 32.2 21.9 265 278 A Q G > S+ 0 0 31 3,-0.3 3,-2.3 1,-0.3 -1,-0.4 -0.376 83.4 5.8 -61.3 137.7 9.2 33.3 18.3 266 279 A Y G 3 S- 0 0 5 1,-0.3 -1,-0.3 24,-0.1 3,-0.1 0.636 133.7 -67.9 62.5 14.4 6.9 31.6 15.8 267 280 A G G < S+ 0 0 68 -3,-2.2 2,-0.4 1,-0.3 -1,-0.3 0.482 107.7 123.1 85.6 3.7 5.1 30.2 18.9 268 281 A H < + 0 0 26 -3,-2.3 -4,-3.5 3,-0.0 -3,-0.3 -0.816 31.3 169.0-108.3 142.3 8.1 28.0 19.8 269 282 A S E + H 0 263A 55 -2,-0.4 -6,-0.2 -6,-0.3 3,-0.1 -0.901 57.4 31.1-137.6 164.1 10.3 27.7 22.9 270 283 A D E S+ 0 0 128 -8,-0.9 2,-0.3 -2,-0.3 -7,-0.1 0.750 100.7 82.3 61.2 32.9 13.0 25.4 24.3 271 285 A I E S- H 0 262A 0 -9,-0.6 -9,-2.8 -3,-0.1 2,-0.4 -0.972 75.6-117.8-156.7 155.0 14.4 24.4 20.9 272 286 A F E + H 0 261A 0 -144,-0.4 2,-0.3 -2,-0.3 -11,-0.2 -0.843 38.7 163.4 -97.9 144.7 16.8 25.8 18.4 273 287 A G E - H 0 260A 0 -13,-2.1 -13,-2.1 -2,-0.4 2,-0.4 -0.976 41.0 -87.4-154.7 161.2 15.6 26.7 14.9 274 288 A G E +GH 178 259A 6 -96,-1.0 -96,-2.4 -2,-0.3 -15,-0.2 -0.571 57.4 137.2 -79.7 127.6 16.7 28.8 11.9 275 289 A T E - H 0 258A 0 -17,-2.0 -17,-2.0 -2,-0.4 14,-0.1 -0.976 59.0 -80.3-160.3 152.3 15.8 32.5 11.8 276 290 A P E + H 0 257A 1 0, 0.0 12,-2.3 0, 0.0 2,-0.3 -0.417 53.0 174.9 -58.1 132.4 17.5 35.8 10.9 277 291 A V E -IH 287 256A 0 -21,-2.1 -21,-2.7 10,-0.2 2,-0.6 -0.907 32.1-119.0-132.0 164.4 19.7 37.1 13.7 278 292 A V E -IH 286 255A 7 8,-2.2 7,-2.5 -2,-0.3 8,-0.9 -0.940 27.4-157.6-106.8 122.3 22.1 40.0 14.0 279 293 A L E +IH 284 254A 0 -25,-2.1 -26,-1.2 -2,-0.6 -25,-0.8 -0.890 31.0 129.0-106.9 120.7 25.7 39.0 14.7 280 294 A G E > S-I 283 0A 0 3,-2.2 3,-2.3 -2,-0.6 -32,-0.1 -0.715 71.8 -51.8-144.9-162.6 28.1 41.4 16.4 281 295 A A T 3 S+ 0 0 48 1,-0.3 3,-0.1 -2,-0.2 -33,-0.1 0.759 131.0 50.8 -52.1 -32.7 30.6 41.8 19.2 282 296 A N T 3 S- 0 0 113 1,-0.3 2,-0.4 -31,-0.0 -1,-0.3 0.159 111.3-122.0 -94.4 17.9 28.1 40.6 21.8 283 297 A G E < S+I 280 0A 0 -3,-2.3 -3,-2.2 -35,-0.1 2,-1.2 -0.674 87.5 17.7 84.0-129.6 27.2 37.5 19.8 284 298 A V E S+I 279 0A 15 -141,-2.4 -5,-0.2 -2,-0.4 3,-0.1 -0.701 71.9 172.4 -78.1 99.9 23.6 37.1 18.9 285 299 A E E + 0 0 53 -7,-2.5 2,-0.3 -2,-1.2 -1,-0.2 0.821 63.8 13.9 -83.3 -30.8 22.6 40.7 19.5 286 301 A Q E -I 278 0A 113 -8,-0.9 -8,-2.2 -3,-0.2 2,-0.6 -0.998 58.8-150.8-145.5 140.9 19.1 40.4 18.1 287 302 A V E -I 277 0A 46 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.2 -0.974 23.2-151.5-111.4 116.6 16.7 37.6 17.1 288 303 A I - 0 0 56 -12,-2.3 2,-0.7 -2,-0.6 -2,-0.0 -0.805 2.5-154.5 -94.3 125.5 14.4 38.7 14.3 289 304 A E - 0 0 99 -2,-0.5 2,-0.1 -14,-0.1 -14,-0.1 -0.870 14.0-138.6 -99.3 115.1 11.0 37.1 14.1 290 305 A L - 0 0 19 -2,-0.7 2,-1.9 1,-0.1 -24,-0.1 -0.472 19.7-121.4 -70.1 141.9 9.6 37.1 10.5 291 306 A Q - 0 0 172 -2,-0.1 -1,-0.1 -25,-0.0 -2,-0.0 -0.508 45.3-174.3 -86.2 70.0 5.9 37.9 10.5 292 307 A L - 0 0 20 -2,-1.9 2,-0.1 1,-0.1 -26,-0.0 -0.269 20.1-124.9 -65.7 147.6 4.9 34.7 8.8 293 308 A N > - 0 0 59 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.268 36.3 -94.4 -82.6 178.5 1.4 33.9 7.6 294 309 A S H > S+ 0 0 77 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.864 124.9 52.1 -67.6 -33.8 -0.4 30.7 8.7 295 310 A E H > S+ 0 0 128 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.908 113.2 44.5 -67.4 -40.9 0.6 28.7 5.7 296 311 A E H > S+ 0 0 22 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.895 111.7 54.0 -69.0 -40.8 4.3 29.6 6.3 297 312 A K H X S+ 0 0 75 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.860 102.6 57.6 -60.4 -38.0 3.9 28.9 10.0 298 313 A A H X S+ 0 0 46 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.904 108.4 46.0 -60.6 -40.9 2.6 25.5 9.3 299 314 A K H X S+ 0 0 110 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.875 110.0 53.6 -69.5 -37.1 5.7 24.6 7.4 300 315 A F H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.923 107.0 53.0 -61.1 -43.2 7.9 26.1 10.2 301 316 A D H X S+ 0 0 65 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.877 105.5 53.7 -60.2 -39.7 6.1 23.8 12.6 302 317 A E H X S+ 0 0 82 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.911 108.9 49.6 -61.9 -42.4 6.9 20.8 10.4 303 318 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 -120,-0.2 -2,-0.2 0.933 111.3 47.6 -61.6 -47.4 10.6 21.7 10.5 304 319 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.899 107.8 57.0 -62.2 -40.0 10.6 22.1 14.3 305 320 A A H X S+ 0 0 58 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.858 105.9 50.1 -60.1 -36.4 8.8 18.8 14.8 306 321 A E H X S+ 0 0 43 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.887 108.8 51.3 -70.5 -37.8 11.5 16.9 12.8 307 322 A T H X S+ 0 0 3 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.930 111.9 48.2 -62.2 -44.1 14.2 18.5 15.0 308 323 A K H X S+ 0 0 102 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.871 108.0 54.4 -63.3 -39.6 12.3 17.4 18.1 309 324 A R H X S+ 0 0 112 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.942 113.6 41.1 -60.0 -48.4 11.9 13.9 16.7 310 325 A M H X S+ 0 0 10 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.803 108.3 61.0 -70.9 -30.1 15.7 13.5 16.2 311 326 A K H X S+ 0 0 41 -4,-2.0 4,-0.6 1,-0.2 3,-0.3 0.912 103.7 51.4 -61.6 -41.7 16.5 15.2 19.5 312 327 A A H < S+ 0 0 68 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.842 108.4 50.3 -64.6 -36.2 14.6 12.4 21.2 313 328 A L H < S+ 0 0 118 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.726 102.6 61.2 -75.0 -22.8 16.5 9.7 19.4 314 329 A A H < 0 0 8 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.690 360.0 360.0 -76.8 -18.2 19.9 11.3 20.3 315 330 A H < 0 0 142 -4,-0.6 -2,-0.1 -3,-0.5 -3,-0.1 0.611 360.0 360.0 -95.7 360.0 19.0 10.8 24.0