==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-NOV-07 2VHZ . COMPND 2 MOLECULE: ALANINE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR D.AGREN,G.SCHNEIDER . 742 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26208.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 556 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 3.8 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 . 51 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 214 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.6 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 2 4 0 6 0 2 6 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 4 2 6 10 2 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 4 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 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 1 A M 0 0 64 0, 0.0 31,-2.6 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 177.2 6.3 -32.3 15.6 2 2 A R E -a 32 0A 84 65,-0.2 68,-2.3 29,-0.2 67,-1.7 -0.817 360.0-163.7 -90.6 123.5 9.9 -32.4 16.7 3 3 A V E -ab 33 70A 0 29,-3.6 31,-3.1 -2,-0.6 2,-0.4 -0.955 11.3-164.6-109.2 119.3 11.6 -29.0 16.5 4 4 A G E -ab 34 71A 0 66,-2.7 68,-2.7 -2,-0.6 31,-0.2 -0.856 14.3-173.5-109.8 140.9 15.4 -29.3 16.6 5 5 A I E -a 35 0A 0 29,-2.3 31,-2.0 -2,-0.4 34,-0.1 -0.908 11.5-167.8-131.9 106.4 18.0 -26.7 17.3 6 6 A P - 0 0 1 0, 0.0 11,-0.3 0, 0.0 2,-0.2 -0.391 34.7 -89.1 -86.6 168.4 21.6 -27.6 16.9 7 7 A T - 0 0 37 30,-0.1 2,-0.1 -2,-0.1 32,-0.1 -0.563 47.3-110.7 -71.5 136.6 24.6 -25.6 18.0 8 8 A E - 0 0 13 7,-0.4 -1,-0.1 31,-0.3 5,-0.1 -0.479 31.3-172.5 -67.1 145.1 25.9 -23.2 15.3 9 9 A T + 0 0 67 -2,-0.1 3,-0.1 2,-0.1 -1,-0.1 0.503 42.6 113.0-122.8 -11.1 29.2 -24.2 13.9 10 10 A K S > S- 0 0 50 1,-0.2 3,-1.8 66,-0.1 272,-0.0 -0.251 88.4 -68.0 -60.2 157.0 30.3 -21.4 11.6 11 11 A N T 3 S- 0 0 54 1,-0.3 272,-0.3 3,-0.0 -1,-0.2 -0.213 114.2 -12.3 -52.0 127.0 33.3 -19.5 12.9 12 12 A N T 3 S+ 0 0 38 1,-0.2 2,-1.2 -3,-0.1 -1,-0.3 0.770 86.3 162.2 53.5 30.2 32.7 -17.6 16.1 13 13 A E < + 0 0 15 -3,-1.8 -1,-0.2 1,-0.2 -5,-0.2 -0.695 7.1 165.0 -85.4 99.1 28.9 -18.1 15.7 14 14 A F + 0 0 36 -2,-1.2 -1,-0.2 289,-0.5 290,-0.1 0.517 41.1 100.4 -93.6 -6.3 27.5 -17.3 19.2 15 15 A R - 0 0 4 27,-0.1 -7,-0.4 28,-0.1 2,-0.3 -0.276 54.8-154.9 -72.7 165.0 23.9 -16.9 18.2 16 16 A V - 0 0 1 290,-0.2 298,-0.2 24,-0.1 57,-0.1 -0.980 20.9-126.9-136.7 151.2 21.2 -19.6 18.6 17 17 A A S S+ 0 0 0 -11,-0.3 2,-0.3 -2,-0.3 56,-0.1 0.405 87.5 31.3 -82.4 1.8 17.9 -20.0 16.7 18 18 A I - 0 0 0 54,-0.1 293,-0.0 -13,-0.0 296,-0.0 -0.992 62.8-148.4-152.9 155.6 15.5 -20.1 19.7 19 19 A T >> - 0 0 11 -2,-0.3 4,-2.2 295,-0.1 3,-0.6 -0.801 40.8 -97.5-117.0 165.8 15.2 -18.8 23.2 20 20 A P H 3> S+ 0 0 32 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.866 124.1 56.2 -47.5 -42.0 13.6 -20.3 26.4 21 21 A A H 3> S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.896 107.8 46.8 -61.9 -40.4 10.4 -18.3 25.7 22 22 A G H <> S+ 0 0 4 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.878 111.5 52.3 -65.3 -39.1 10.1 -19.8 22.1 23 23 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.932 109.3 49.6 -60.5 -47.3 10.7 -23.3 23.6 24 24 A A H X S+ 0 0 42 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.889 111.4 48.7 -60.9 -41.1 8.0 -22.8 26.1 25 25 A E H X S+ 0 0 49 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.884 110.9 50.4 -69.6 -37.7 5.5 -21.6 23.4 26 26 A L H <>S+ 0 0 0 -4,-2.4 5,-1.9 2,-0.2 3,-0.4 0.925 112.6 46.1 -62.8 -41.9 6.3 -24.6 21.2 27 27 A T H ><5S+ 0 0 45 -4,-2.3 3,-2.1 1,-0.3 -2,-0.2 0.889 105.6 59.8 -72.4 -37.5 5.8 -27.1 24.0 28 28 A R H 3<5S+ 0 0 172 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.802 104.2 53.7 -54.8 -30.6 2.6 -25.3 25.0 29 29 A R T 3<5S- 0 0 96 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.278 127.5 -97.0 -92.0 11.6 1.4 -26.2 21.5 30 30 A G T < 5S+ 0 0 65 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.624 77.9 138.8 85.8 16.7 2.1 -29.9 21.8 31 31 A H < - 0 0 22 -5,-1.9 2,-0.6 -6,-0.1 -1,-0.3 -0.654 52.2-129.6 -97.4 150.2 5.5 -29.9 20.1 32 32 A E E -a 2 0A 90 -31,-2.6 -29,-3.6 -2,-0.3 2,-0.6 -0.879 23.3-157.8 -95.1 119.9 8.7 -31.8 21.0 33 33 A V E -a 3 0A 3 -2,-0.6 23,-3.3 21,-0.4 2,-0.5 -0.901 8.5-172.2-106.0 120.0 11.7 -29.4 21.2 34 34 A L E +ac 4 56A 2 -31,-3.1 -29,-2.3 -2,-0.6 2,-0.4 -0.939 5.8 180.0-115.2 128.7 15.2 -31.0 20.9 35 35 A I E -ac 5 57A 0 21,-2.6 23,-2.6 -2,-0.5 2,-0.2 -0.992 30.1-115.3-137.1 132.4 18.3 -28.9 21.5 36 36 A Q E > - c 0 58A 35 -31,-2.0 3,-2.6 -2,-0.4 4,-0.2 -0.433 43.4-101.9 -65.4 129.6 22.0 -29.7 21.4 37 37 A A T 3 S+ 0 0 40 21,-2.8 -30,-0.1 1,-0.3 -1,-0.1 -0.306 110.4 19.5 -49.8 125.1 23.7 -29.5 24.7 38 38 A G T > S+ 0 0 19 7,-0.1 3,-1.0 -3,-0.1 4,-0.5 0.324 85.1 123.1 94.8 -5.5 25.6 -26.2 24.7 39 39 A A T < S+ 0 0 5 -3,-2.6 -31,-0.3 1,-0.3 3,-0.2 0.795 78.6 38.7 -63.7 -30.4 23.7 -24.5 21.8 40 40 A G T > >S+ 0 0 0 5,-0.3 5,-3.0 -4,-0.2 3,-1.0 0.459 87.6 95.3 -97.9 -5.3 22.6 -21.4 23.8 41 41 A E G X 5S+ 0 0 119 -3,-1.0 3,-2.2 1,-0.3 -1,-0.1 0.880 79.0 58.1 -62.2 -39.1 25.8 -20.8 25.8 42 42 A G G 3 5S+ 0 0 13 -4,-0.5 -1,-0.3 1,-0.3 265,-0.2 0.818 112.2 42.9 -55.5 -30.9 27.2 -18.3 23.3 43 43 A S G < 5S- 0 0 3 -3,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.189 123.3-107.4-100.4 14.5 24.1 -16.3 23.9 44 44 A A T < 5S+ 0 0 54 -3,-2.2 2,-0.7 1,-0.2 -3,-0.2 0.713 78.4 133.8 59.2 30.3 24.2 -16.9 27.7 45 45 A I < - 0 0 2 -5,-3.0 -5,-0.3 -7,-0.1 -1,-0.2 -0.926 46.7-149.6-104.7 107.5 21.3 -19.3 27.6 46 46 A T > - 0 0 62 -2,-0.7 4,-1.7 1,-0.1 3,-0.3 -0.319 25.5-111.2 -75.1 162.7 22.4 -22.3 29.7 47 47 A D H > S+ 0 0 43 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.885 122.5 57.2 -57.1 -36.9 21.3 -25.9 29.1 48 48 A A H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.865 102.7 52.5 -62.6 -39.2 19.4 -25.5 32.4 49 49 A D H > S+ 0 0 76 -3,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.885 113.6 43.4 -63.2 -42.6 17.5 -22.4 31.0 50 50 A F H X>S+ 0 0 0 -4,-1.7 5,-2.3 2,-0.2 4,-0.6 0.899 112.7 53.2 -69.6 -42.3 16.4 -24.5 28.0 51 51 A K H ><5S+ 0 0 151 -4,-2.9 3,-1.6 1,-0.2 -2,-0.2 0.936 107.3 51.1 -55.9 -49.5 15.6 -27.5 30.1 52 52 A A H 3<5S+ 0 0 93 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.776 106.0 56.0 -63.5 -26.0 13.3 -25.4 32.4 53 53 A A H 3<5S- 0 0 17 -4,-0.9 -1,-0.3 -3,-0.2 -26,-0.2 0.624 129.8 -92.7 -82.2 -11.1 11.5 -24.1 29.4 54 54 A G T <<5S+ 0 0 42 -3,-1.6 -21,-0.4 -4,-0.6 -3,-0.2 0.432 75.1 142.9 119.8 1.8 10.6 -27.7 28.2 55 55 A A < - 0 0 11 -5,-2.3 2,-0.7 -8,-0.1 -1,-0.3 -0.425 49.4-129.4 -76.8 148.0 13.4 -28.7 25.9 56 56 A Q E -c 34 0A 86 -23,-3.3 -21,-2.6 -2,-0.1 2,-0.5 -0.883 25.8-143.8 -87.3 113.3 15.0 -32.1 25.6 57 57 A L E -c 35 0A 52 -2,-0.7 2,-0.4 -23,-0.2 -21,-0.2 -0.731 18.6-165.9 -83.5 122.3 18.7 -31.6 25.8 58 58 A V E -c 36 0A 7 -23,-2.6 -21,-2.8 -2,-0.5 6,-0.1 -0.893 21.1-135.9-116.3 143.4 20.6 -34.0 23.5 59 59 A G S S+ 0 0 61 -2,-0.4 2,-0.3 -23,-0.2 -1,-0.1 0.786 78.9 41.9 -66.4 -33.6 24.3 -34.8 23.5 60 60 A T > - 0 0 74 1,-0.1 4,-1.2 -24,-0.0 3,-0.1 -0.845 65.3-133.9-124.5 156.2 25.1 -34.7 19.8 61 61 A A H > S+ 0 0 12 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.879 104.4 63.4 -66.1 -43.7 24.4 -32.7 16.7 62 62 A D H > S+ 0 0 93 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.842 102.8 49.5 -52.2 -39.7 23.7 -35.9 14.6 63 63 A Q H > S+ 0 0 76 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.931 108.6 51.4 -68.1 -45.4 20.7 -36.8 16.8 64 64 A V H X S+ 0 0 0 -4,-1.2 4,-2.1 1,-0.2 -2,-0.2 0.960 114.8 44.0 -54.1 -52.8 19.2 -33.3 16.6 65 65 A W H < S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.867 115.5 47.0 -61.1 -42.3 19.4 -33.5 12.8 66 66 A A H < S+ 0 0 52 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.888 119.1 38.7 -67.2 -40.0 18.2 -37.1 12.5 67 67 A D H < S+ 0 0 51 -4,-2.9 2,-0.3 -5,-0.1 -65,-0.2 0.718 91.3 100.5 -88.9 -23.6 15.2 -36.6 14.9 68 68 A A < - 0 0 0 -4,-2.1 3,-0.2 -5,-0.3 -65,-0.2 -0.457 42.0-174.6 -74.6 129.4 13.9 -33.1 13.9 69 69 A D S S+ 0 0 49 -67,-1.7 21,-2.7 1,-0.3 2,-0.5 0.817 91.0 33.4 -79.7 -35.8 10.9 -32.6 11.6 70 70 A L E S-bd 3 90A 0 -68,-2.3 -66,-2.7 19,-0.2 2,-0.7 -0.980 79.1-161.8-119.8 116.1 11.6 -28.9 11.7 71 71 A L E -bd 4 91A 0 19,-4.1 21,-2.6 -2,-0.5 2,-0.5 -0.901 5.2-163.8-104.8 116.4 15.3 -27.9 11.9 72 72 A L E + d 0 92A 0 -68,-2.7 -55,-0.3 -2,-0.7 2,-0.3 -0.859 19.0 157.6 -98.3 125.2 15.9 -24.3 13.1 73 73 A K - 0 0 1 19,-2.0 21,-0.1 -2,-0.5 -57,-0.1 -0.835 40.1-138.5-135.7 172.1 19.3 -22.7 12.6 74 74 A V S S+ 0 0 0 -2,-0.3 20,-1.8 19,-0.2 2,-0.2 0.848 84.2 31.7 -95.6 -53.1 20.8 -19.3 12.3 75 75 A K S S- 0 0 7 18,-0.2 -1,-0.1 1,-0.1 20,-0.1 -0.570 93.9 -82.1-107.4 170.1 23.3 -19.7 9.5 76 76 A E - 0 0 32 -2,-0.2 -1,-0.1 1,-0.1 19,-0.1 -0.234 57.5 -89.4 -64.5 149.8 23.5 -21.8 6.3 77 77 A P - 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.419 46.1-146.1 -57.0 134.2 24.7 -25.4 6.6 78 78 A I >> - 0 0 50 -3,-0.1 3,-2.5 -2,-0.1 4,-0.6 -0.548 32.2 -86.3 -96.7 173.9 28.5 -25.6 6.2 79 79 A A G >4 S+ 0 0 70 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.828 125.8 53.9 -47.6 -48.4 30.5 -28.5 4.5 80 80 A A G 34 S+ 0 0 86 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.620 111.2 48.8 -65.7 -12.3 30.8 -30.7 7.6 81 81 A E G X> S+ 0 0 2 -3,-2.5 3,-2.2 1,-0.1 4,-0.8 0.490 81.7 92.4-102.9 -8.8 27.0 -30.5 8.0 82 82 A Y G X< S+ 0 0 67 -3,-1.5 3,-0.6 -4,-0.6 -2,-0.1 0.831 83.5 57.3 -57.5 -32.3 26.1 -31.4 4.3 83 83 A G G 34 S+ 0 0 81 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.536 100.6 58.8 -75.2 -8.5 25.9 -35.0 5.3 84 84 A R G <4 S+ 0 0 69 -3,-2.2 -1,-0.2 2,-0.0 -2,-0.2 0.657 78.6 104.8 -95.0 -20.2 23.3 -34.2 7.9 85 85 A L << - 0 0 14 -4,-0.8 2,-0.4 -3,-0.6 -19,-0.0 -0.361 54.5-173.7 -59.9 137.2 20.8 -32.7 5.5 86 86 A R > - 0 0 72 -21,-0.1 3,-1.3 27,-0.1 27,-0.4 -0.995 29.9-110.1-142.7 145.3 17.9 -35.0 4.9 87 87 A H T 3 S+ 0 0 105 23,-0.6 25,-0.2 -2,-0.4 24,-0.1 -0.387 104.1 35.2 -56.5 143.7 14.8 -35.5 2.8 88 88 A G T 3 S+ 0 0 49 23,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.277 96.9 104.7 90.1 -9.9 11.6 -35.2 4.8 89 89 A Q < - 0 0 1 -3,-1.3 24,-2.3 -19,-0.0 2,-0.6 -0.816 65.0-135.4-106.4 143.1 13.0 -32.5 7.1 90 90 A I E -de 70 113A 10 -21,-2.7 -19,-4.1 -2,-0.3 2,-0.5 -0.884 16.8-161.1 -95.2 123.6 12.2 -28.8 7.0 91 91 A L E -de 71 114A 0 22,-3.2 24,-3.0 -2,-0.6 2,-0.5 -0.923 9.2-178.4-104.2 128.1 15.2 -26.5 7.3 92 92 A F E +de 72 115A 0 -21,-2.6 -19,-2.0 -2,-0.5 2,-0.3 -0.947 35.2 101.2-130.7 106.0 14.5 -22.9 8.4 93 93 A T E S- e 0 116A 0 22,-1.5 24,-2.1 -2,-0.5 2,-0.4 -0.944 79.4 -61.0-166.8 173.0 17.6 -20.7 8.5 94 94 A F + 0 0 4 -20,-1.8 22,-0.1 -2,-0.3 -2,-0.0 -0.667 53.6 171.6 -69.8 129.5 19.7 -18.0 6.7 95 95 A L - 0 0 1 -2,-0.4 -1,-0.1 -19,-0.1 -19,-0.1 0.820 19.1-168.1-110.8 -48.0 20.7 -19.6 3.4 96 96 A H > + 0 0 10 1,-0.1 3,-1.7 2,-0.1 4,-0.2 0.901 21.5 167.2 57.5 46.0 22.3 -17.1 1.0 97 97 A L G > + 0 0 5 1,-0.3 3,-2.0 2,-0.2 7,-0.3 0.823 64.6 66.5 -66.6 -32.7 22.1 -19.6 -1.9 98 98 A A G 3 S+ 0 0 3 1,-0.3 -1,-0.3 145,-0.3 147,-0.2 0.711 104.0 49.7 -60.7 -17.2 22.8 -17.1 -4.7 99 99 A A G < S+ 0 0 45 -3,-1.7 2,-0.3 1,-0.2 -1,-0.3 0.432 111.2 49.1-100.6 -3.0 26.3 -16.9 -3.1 100 100 A S <> + 0 0 39 -3,-2.0 4,-2.3 -4,-0.2 -1,-0.2 -0.771 42.7 175.9-148.1 99.6 27.0 -20.7 -2.8 101 101 A R H > S+ 0 0 120 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.886 91.9 56.3 -57.3 -41.0 26.7 -23.3 -5.5 102 102 A A H > S+ 0 0 55 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.889 109.3 43.4 -63.5 -42.2 28.1 -25.8 -3.1 103 103 A C H > S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.930 114.9 50.1 -68.1 -46.5 25.5 -25.1 -0.4 104 104 A T H X S+ 0 0 0 -4,-2.3 4,-2.6 -7,-0.3 -2,-0.2 0.923 110.1 50.1 -56.6 -47.8 22.7 -25.1 -3.0 105 105 A D H X S+ 0 0 47 -4,-3.1 4,-3.3 1,-0.2 5,-0.3 0.908 108.9 52.8 -58.5 -43.4 23.9 -28.4 -4.5 106 106 A A H X S+ 0 0 15 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.915 111.1 45.8 -60.6 -45.2 24.0 -30.0 -1.0 107 107 A L H X>S+ 0 0 0 -4,-2.1 5,-0.9 2,-0.2 4,-0.9 0.926 115.8 46.8 -60.8 -47.1 20.4 -29.0 -0.3 108 108 A L H ><5S+ 0 0 22 -4,-2.6 3,-0.6 1,-0.2 -2,-0.2 0.913 113.0 48.0 -62.4 -45.0 19.2 -30.2 -3.7 109 109 A D H 3<5S+ 0 0 139 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.818 109.9 53.0 -70.1 -29.5 21.1 -33.5 -3.5 110 110 A S H 3<5S- 0 0 25 -4,-1.8 -23,-0.6 -5,-0.3 -1,-0.2 0.705 100.4-136.1 -75.5 -22.2 19.7 -34.2 0.0 111 111 A G T <<5 + 0 0 9 -4,-0.9 236,-1.3 -3,-0.6 -23,-0.6 0.587 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53.5 8.0 12.0 415 43 B S G < 5S- 0 0 2 -3,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.216 123.0-106.6 -99.2 15.3 51.5 11.2 11.3 416 44 B A T < 5S+ 0 0 54 -3,-1.9 2,-0.7 1,-0.2 -3,-0.2 0.728 78.6 133.9 61.2 30.5 52.1 11.1 7.5 417 45 B I < - 0 0 2 -5,-2.8 -5,-0.3 -7,-0.1 -1,-0.2 -0.939 46.4-149.2-107.1 106.4 54.6 14.0 7.6 418 46 B T > - 0 0 63 -2,-0.7 4,-1.8 1,-0.1 5,-0.2 -0.317 25.2-112.3 -71.6 160.2 57.6 12.9 5.5 419 47 B D H > S+ 0 0 44 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.893 122.6 56.7 -56.1 -38.6 61.2 14.0 6.1 420 48 B A H > S+ 0 0 66 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.879 103.1 52.4 -60.6 -41.4 60.8 15.9 2.8 421 49 B D H > S+ 0 0 76 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.894 113.7 43.3 -60.0 -44.3 57.7 17.8 4.2 422 50 B F H X>S+ 0 0 0 -4,-1.8 5,-2.2 2,-0.2 4,-0.7 0.894 112.6 53.6 -69.2 -40.7 59.7 18.9 7.3 423 51 B K H ><5S+ 0 0 151 -4,-2.9 3,-1.4 1,-0.2 -2,-0.2 0.935 106.8 51.2 -58.0 -49.2 62.7 19.7 5.1 424 52 B A H 3<5S+ 0 0 95 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.777 106.3 55.9 -61.8 -27.7 60.6 22.0 2.8 425 53 B A H 3<5S- 0 0 17 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.669 129.1 -95.5 -79.2 -16.4 59.3 23.8 5.9 426 54 B G T <<5S+ 0 0 43 -3,-1.4 -21,-0.4 -4,-0.7 -3,-0.2 0.455 73.8 142.5 120.7 5.1 62.9 24.6 7.0 427 55 B A < - 0 0 9 -5,-2.2 2,-0.6 -8,-0.1 -1,-0.3 -0.401 50.1-127.4 -74.9 150.8 63.9 21.8 9.4 428 56 B Q E -s 406 0F 93 -23,-3.3 -21,-2.7 -2,-0.1 2,-0.6 -0.909 25.3-142.8 -90.8 117.3 67.3 20.2 9.7 429 57 B L E -s 407 0F 50 -2,-0.6 2,-0.4 -23,-0.2 -21,-0.2 -0.736 19.0-165.1 -84.3 120.0 66.8 16.5 9.5 430 58 B V E -s 408 0F 5 -23,-2.3 -21,-3.0 -2,-0.6 6,-0.1 -0.866 20.6-136.6-112.8 143.9 69.2 14.6 11.8 431 59 B G S S+ 0 0 61 -2,-0.4 2,-0.3 -23,-0.2 -1,-0.1 0.791 79.2 40.4 -66.9 -33.4 70.0 10.9 11.7 432 60 B T > - 0 0 76 1,-0.1 4,-1.1 -24,-0.0 3,-0.1 -0.865 64.8-134.1-127.0 154.9 69.9 10.1 15.4 433 61 B A H > S+ 0 0 11 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.866 104.0 64.2 -65.7 -41.6 68.0 10.9 18.6 434 62 B D H > S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.859 103.3 48.5 -53.8 -39.8 71.2 11.5 20.6 435 63 B Q H 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-4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.795 103.3 63.3 -71.1 -29.7 49.9 21.3 17.9 687 315 B N H 3< S+ 0 0 95 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.903 115.0 36.8 -52.0 -40.9 47.0 23.7 17.2 688 316 B A H << S+ 0 0 24 -4,-0.9 4,-0.4 -3,-0.5 -2,-0.2 0.892 120.2 43.0 -78.7 -45.3 47.0 24.2 21.0 689 317 B T H >X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 3,-1.3 0.817 92.6 80.8 -77.9 -30.3 50.8 24.0 21.9 690 318 B M H 3X S+ 0 0 23 -4,-1.9 4,-2.6 1,-0.3 5,-0.2 0.844 87.1 53.2 -53.7 -47.1 52.2 26.2 19.1 691 319 B P H 3> S+ 0 0 73 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.842 114.3 45.8 -55.2 -32.8 51.6 29.6 20.6 692 320 B Y H <> S+ 0 0 32 -3,-1.3 4,-2.0 -4,-0.4 -2,-0.2 0.839 109.8 53.6 -76.4 -37.4 53.3 28.4 23.8 693 321 B V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.907 108.2 51.2 -59.1 -45.1 56.2 26.9 21.8 694 322 B L H X S+ 0 0 20 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.872 109.4 48.7 -62.5 -41.7 56.8 30.2 20.0 695 323 B E H X S+ 0 0 73 -4,-1.3 4,-2.1 -5,-0.2 5,-0.3 0.887 112.3 49.1 -67.9 -38.7 56.9 32.2 23.2 696 324 B L H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.877 114.9 44.5 -64.9 -39.9 59.4 29.7 24.8 697 325 B A H < S+ 0 0 4 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.941 116.1 46.1 -71.9 -46.1 61.6 29.9 21.7 698 326 B D H < S+ 0 0 57 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.850 132.5 13.7 -62.0 -39.2 61.4 33.7 21.4 699 327 B H H X S- 0 0 103 -4,-2.1 4,-0.6 -5,-0.2 -3,-0.2 0.519 100.5-118.0-121.8 -12.1 62.1 34.6 25.0 700 328 B G H X - 0 0 18 -4,-1.7 4,-2.3 -5,-0.3 5,-0.2 0.009 43.3 -70.2 80.6 165.9 63.3 31.5 26.8 701 329 B W H > S+ 0 0 24 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.902 127.3 50.7 -63.5 -44.9 61.6 29.7 29.7 702 330 B R H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.934 116.9 38.6 -61.8 -50.8 62.1 32.4 32.5 703 331 B A H X S+ 0 0 31 -4,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.856 117.1 51.1 -68.4 -38.4 60.8 35.3 30.4 704 332 B A H X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 8,-0.2 0.960 114.4 43.0 -63.2 -48.9 58.0 33.3 28.8 705 333 B C H < S+ 0 0 3 -4,-3.1 7,-0.4 -5,-0.2 -2,-0.2 0.844 112.2 54.3 -66.2 -34.7 56.8 32.0 32.2 706 334 B R H < S+ 0 0 145 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.887 114.5 40.9 -63.1 -40.3 57.2 35.5 33.7 707 335 B S H < S+ 0 0 97 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.719 119.1 46.9 -79.2 -24.5 55.0 36.9 31.0 708 336 B N X - 0 0 50 -4,-1.7 4,-2.7 1,-0.1 -1,-0.2 -0.883 57.2-173.3-130.4 98.7 52.5 34.1 30.9 709 337 B P H > S+ 0 0 93 0, 0.0 4,-1.2 0, 0.0 -216,-0.2 0.819 90.6 56.9 -56.5 -36.4 51.0 32.8 34.3 710 338 B A H >4 S+ 0 0 8 2,-0.2 -217,-1.4 1,-0.2 3,-0.8 0.964 109.7 43.8 -60.7 -53.3 49.3 30.0 32.4 711 339 B L H >4 S+ 0 0 0 1,-0.2 3,-2.3 -219,-0.2 4,-0.4 0.932 109.2 58.2 -51.9 -51.6 52.6 28.8 30.9 712 340 B A H >< S+ 0 0 17 -4,-2.7 3,-1.1 -7,-0.4 -1,-0.2 0.749 95.0 65.3 -54.2 -27.4 54.3 29.2 34.3 713 341 B K T << S+ 0 0 121 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.666 94.1 60.2 -72.0 -16.5 51.8 26.8 35.9 714 342 B G T < S+ 0 0 0 -3,-2.3 -226,-3.0 -4,-0.4 -1,-0.3 0.611 75.0 122.8 -83.1 -14.7 53.2 24.0 33.7 715 343 B L E < +V 487 0F 3 -3,-1.1 -228,-0.2 -4,-0.4 3,-0.1 -0.249 27.4 160.1 -50.6 127.0 56.7 24.5 35.3 716 344 B S E + 0 0 4 -230,-2.8 7,-3.1 1,-0.4 8,-0.6 0.727 53.5 7.3-122.2 -49.7 57.7 21.1 36.8 717 345 B T E +VW 486 722F 0 -231,-1.3 -231,-1.8 5,-0.2 -1,-0.4 -0.964 48.1 171.6-137.5 157.4 61.5 20.9 37.4 718 346 B H E > S- W 0 721F 13 3,-1.5 3,-2.5 -2,-0.3 -233,-0.2 -0.791 74.0 -21.6-164.5 122.9 64.5 23.1 37.2 719 347 B E T 3 S- 0 0 115 -236,-1.4 -235,-0.1 1,-0.3 -239,-0.1 0.800 129.0 -43.7 45.3 43.7 68.1 22.2 38.4 720 348 B G T 3 S+ 0 0 41 -236,-0.4 2,-0.4 -241,-0.3 -1,-0.3 0.391 111.9 120.8 88.3 -1.8 66.9 19.5 40.7 721 349 B A E < -W 718 0F 19 -3,-2.5 -3,-1.5 -238,-0.1 2,-0.6 -0.815 57.4-140.3 -96.7 132.9 64.0 21.4 42.2 722 350 B L E -W 717 0F 3 -2,-0.4 14,-2.6 12,-0.4 -5,-0.2 -0.834 16.6-172.5 -92.4 121.7 60.5 20.1 41.9 723 351 B L + 0 0 5 -7,-3.1 2,-0.6 -2,-0.6 -6,-0.2 0.354 55.2 86.6-102.7 2.4 58.1 23.0 41.2 724 352 B S > - 0 0 22 -8,-0.6 4,-2.1 1,-0.1 5,-0.1 -0.931 56.0-161.8-109.0 122.5 54.7 21.4 41.4 725 353 B E H > S+ 0 0 121 -2,-0.6 4,-2.4 2,-0.2 5,-0.2 0.888 92.1 49.6 -66.4 -42.6 53.1 21.3 44.9 726 354 B R H > S+ 0 0 113 2,-0.2 4,-2.5 1,-0.2 -109,-0.2 0.912 112.3 47.5 -66.5 -43.9 50.6 18.6 44.0 727 355 B V H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.941 112.3 50.1 -58.1 -49.1 53.2 16.3 42.4 728 356 B A H X>S+ 0 0 4 -4,-2.1 5,-2.5 1,-0.2 4,-1.6 0.896 112.6 47.6 -58.6 -43.3 55.5 16.8 45.5 729 357 B T H <5S+ 0 0 98 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.926 112.6 47.8 -59.8 -51.2 52.7 15.9 47.8 730 358 B D H <5S+ 0 0 56 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.790 119.6 38.8 -65.2 -29.6 51.6 12.8 45.9 731 359 B L H <5S- 0 0 33 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.641 106.1-124.2 -95.4 -18.6 55.2 11.5 45.6 732 360 B G T <5 + 0 0 65 -4,-1.6 -3,-0.2 1,-0.3 -4,-0.1 0.950 66.3 132.8 73.3 52.5 56.3 12.6 49.2 733 361 B V < - 0 0 21 -5,-2.5 -1,-0.3 -6,-0.1 -2,-0.1 -0.940 64.2 -81.1-139.4 146.0 59.1 14.6 47.9 734 362 B P - 0 0 109 0, 0.0 -12,-0.4 0, 0.0 2,-0.4 -0.221 41.1-146.2 -60.2 142.1 60.3 18.1 48.7 735 363 B F - 0 0 67 -14,-0.1 2,-0.4 -12,-0.1 -12,-0.2 -0.868 9.8-166.1-106.6 135.9 58.6 21.1 47.0 736 364 B T - 0 0 44 -14,-2.6 -8,-0.1 -2,-0.4 5,-0.1 -0.986 30.6-109.3-120.5 137.6 60.2 24.4 46.0 737 365 B E >> - 0 0 110 -2,-0.4 4,-0.7 1,-0.1 3,-0.6 -0.375 15.5-140.9 -65.5 134.9 58.1 27.4 45.0 738 366 B P H >> S+ 0 0 32 0, 0.0 4,-1.3 0, 0.0 3,-0.7 0.839 100.5 64.4 -66.3 -34.3 58.1 28.4 41.3 739 367 B A H 3> S+ 0 0 63 1,-0.2 4,-2.6 2,-0.2 -2,-0.0 0.827 96.4 60.8 -56.2 -32.3 58.2 32.1 42.1 740 368 B S H <4 S+ 0 0 76 -3,-0.6 -1,-0.2 1,-0.2 -3,-0.0 0.864 108.8 39.3 -63.3 -40.1 61.7 31.4 43.7 741 369 B V H << S+ 0 0 20 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.639 118.4 50.4 -85.4 -14.1 63.2 30.2 40.4 742 370 B L H < 0 0 23 -4,-1.3 -2,-0.2 -37,-0.1 -3,-0.2 0.783 360.0 360.0 -92.8 -35.5 61.3 32.9 38.4 743 371 B A < 0 0 114 -4,-2.6 -3,-0.1 -5,-0.2 -37,-0.0 0.457 360.0 360.0 -78.7 360.0 62.3 35.9 40.5