==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-APR-04 1V1A . COMPND 2 MOLECULE: 2-KETO-3-DEOXYGLUCONATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR T.H.TAHIROV,E.INAGAKI . 602 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24385.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 437 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 67 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 9.0 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 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 1 0.2 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 . 44 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 0 1 2 1 0 0 3 2 1 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 7 2 3 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 . 0 0 1 1 4 3 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 . 2 0 0 1 1 0 1 1 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 0 146 0, 0.0 48,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 140.0 39.1 66.3 30.8 2 2 A L - 0 0 33 120,-0.2 125,-0.3 122,-0.2 48,-0.2 -0.369 360.0-170.1 -65.8 140.1 37.0 63.1 30.2 3 3 A E S S+ 0 0 54 46,-2.4 125,-1.9 1,-0.3 2,-0.3 0.687 73.2 23.7-102.0 -25.3 36.9 61.9 26.5 4 4 A V E -ab 50 128A 0 45,-2.1 47,-2.1 123,-0.2 2,-0.4 -0.990 59.2-164.0-142.6 145.7 34.2 59.3 27.0 5 5 A V E -ab 51 129A 0 123,-1.5 125,-2.8 -2,-0.3 2,-0.3 -0.992 12.9-170.2-132.2 125.1 31.4 58.7 29.5 6 6 A T E -ab 52 130A 0 45,-4.3 47,-1.9 -2,-0.4 2,-0.3 -0.795 5.9-179.4-112.0 157.4 29.8 55.3 29.7 7 7 A A E +a 53 0A 1 123,-1.1 125,-0.3 -2,-0.3 2,-0.3 -0.936 22.5 89.1-162.7 137.3 26.7 54.4 31.6 8 8 A G S S- 0 0 0 45,-1.2 47,-0.4 -2,-0.3 105,-0.1 -0.945 73.4 -32.3 173.3-154.8 24.4 51.4 32.4 9 9 A E - 0 0 4 -2,-0.3 28,-0.2 45,-0.1 26,-0.2 -0.830 51.5-140.5 -97.7 119.7 23.9 48.6 34.9 10 10 A P - 0 0 2 0, 0.0 77,-0.4 0, 0.0 2,-0.3 -0.408 27.1-169.2 -71.1 155.2 27.1 47.1 36.5 11 11 A L E -I 33 0B 9 22,-1.0 22,-3.4 75,-0.1 2,-0.5 -0.985 25.2-134.5-146.5 156.6 27.0 43.3 36.8 12 12 A V E -Ij 32 88B 0 75,-1.2 77,-2.8 -2,-0.3 2,-0.4 -0.966 25.3-152.4-112.9 124.3 28.8 40.4 38.4 13 13 A A E -Ij 31 89B 0 18,-2.6 18,-2.7 -2,-0.5 2,-0.5 -0.805 3.3-157.1 -99.0 136.0 29.3 37.4 36.2 14 14 A L E -Ij 30 90B 1 75,-2.4 77,-1.1 -2,-0.4 16,-0.2 -0.950 17.3-176.0-112.1 127.6 29.6 33.8 37.5 15 15 A V E -I 29 0B 2 14,-2.6 14,-3.6 -2,-0.5 77,-0.1 -0.975 27.4-126.8-134.3 132.3 31.4 31.3 35.2 16 16 A P - 0 0 0 0, 0.0 12,-0.2 0, 0.0 4,-0.1 -0.344 34.4-119.2 -64.0 153.2 32.1 27.6 35.3 17 17 A Q S S+ 0 0 66 10,-0.4 11,-0.1 2,-0.1 268,-0.0 0.763 90.8 7.4 -68.8 -22.4 35.8 27.0 34.8 18 18 A E S S- 0 0 101 1,-0.1 75,-0.2 2,-0.0 -1,-0.1 -0.935 97.7 -65.3-148.6 171.2 35.2 25.0 31.7 19 19 A P S S+ 0 0 67 0, 0.0 75,-0.2 0, 0.0 2,-0.2 -0.056 75.1 86.8 -57.8 161.4 32.4 24.0 29.3 20 20 A G S S- 0 0 11 73,-1.5 73,-0.5 -4,-0.1 2,-0.3 -0.700 81.8 -43.1 134.0 174.6 29.5 21.9 30.3 21 21 A H > - 0 0 96 -2,-0.2 3,-1.5 1,-0.1 4,-0.4 -0.580 45.4-135.8 -76.5 133.7 26.0 22.1 31.9 22 22 A L G > S+ 0 0 3 -2,-0.3 3,-2.5 1,-0.3 -1,-0.1 0.868 97.0 74.4 -55.9 -39.8 25.9 24.5 34.9 23 23 A R G 3 S+ 0 0 72 1,-0.3 -1,-0.3 3,-0.0 346,-0.1 0.728 101.2 44.0 -49.3 -24.7 23.9 22.0 36.9 24 24 A G G < S+ 0 0 46 -3,-1.5 -1,-0.3 2,-0.0 -2,-0.2 0.541 87.7 109.7 -98.9 -8.1 27.0 19.9 37.4 25 25 A K < - 0 0 28 -3,-2.5 3,-0.1 -4,-0.4 -5,-0.0 -0.462 39.6-178.1 -71.7 137.0 29.4 22.7 38.2 26 26 A R + 0 0 115 -2,-0.2 306,-2.2 1,-0.1 2,-0.3 0.485 69.0 46.7-110.3 -11.0 30.7 22.9 41.8 27 27 A L E - K 0 331B 38 304,-0.2 2,-0.4 289,-0.0 -10,-0.4 -0.976 64.1-161.6-133.3 146.9 32.8 26.0 41.4 28 28 A L E - K 0 330B 4 302,-2.2 302,-2.3 -2,-0.3 2,-0.3 -0.995 15.6-135.3-133.7 131.4 32.2 29.4 39.8 29 29 A E E -IK 15 329B 19 -14,-3.6 -14,-2.6 -2,-0.4 2,-0.5 -0.638 23.2-137.0 -81.7 141.5 34.6 32.0 38.7 30 30 A V E +I 14 0B 13 298,-1.6 2,-0.3 -2,-0.3 -16,-0.2 -0.889 28.2 171.6-105.1 124.1 33.7 35.6 39.7 31 31 A Y E -I 13 0B 32 -18,-2.7 -18,-2.6 -2,-0.5 2,-0.6 -0.932 34.7-120.2-132.7 155.1 34.0 38.5 37.2 32 32 A V E +I 12 0B 9 -2,-0.3 255,-0.3 -20,-0.2 256,-0.2 -0.843 48.9 156.0 -94.5 120.6 33.1 42.1 37.0 33 33 A G E +I 11 0B 0 -22,-3.4 -22,-1.0 -2,-0.6 4,-0.0 -0.250 18.7 137.1-123.1-149.8 30.9 42.7 34.0 34 34 A G > - 0 0 4 -24,-0.3 4,-3.3 3,-0.1 5,-0.2 0.345 56.8-112.1 102.5 121.9 28.2 45.0 32.6 35 35 A A H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.913 118.2 39.4 -48.7 -55.0 28.3 46.1 28.9 36 36 A E H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.766 114.6 55.0 -69.8 -27.0 29.2 49.7 29.6 37 37 A V H > S+ 0 0 0 -28,-0.2 4,-2.8 2,-0.2 5,-0.2 0.913 107.7 49.6 -70.4 -44.4 31.5 48.7 32.4 38 38 A N H X S+ 0 0 4 -4,-3.3 4,-2.3 2,-0.2 -2,-0.2 0.944 112.6 47.0 -58.6 -48.2 33.4 46.5 30.0 39 39 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.929 112.1 52.0 -58.7 -45.7 33.6 49.3 27.5 40 40 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.895 110.3 45.6 -60.0 -45.5 34.7 51.7 30.2 41 41 A V H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.975 110.1 54.5 -62.6 -53.5 37.6 49.5 31.5 42 42 A A H X S+ 0 0 1 -4,-2.3 4,-1.1 1,-0.3 -2,-0.2 0.917 112.6 43.4 -43.8 -54.7 38.8 48.7 28.0 43 43 A L H >X>S+ 0 0 0 -4,-2.4 5,-1.7 1,-0.2 3,-0.8 0.913 110.8 55.8 -59.8 -43.6 39.1 52.5 27.3 44 44 A A H ><5S+ 0 0 20 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.878 108.3 48.2 -55.8 -40.9 40.6 53.0 30.7 45 45 A R H 3<5S+ 0 0 18 -4,-2.9 249,-2.3 1,-0.2 -1,-0.3 0.704 106.9 58.5 -74.0 -19.0 43.4 50.5 29.8 46 46 A L H <<5S- 0 0 1 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.2 0.489 118.8-105.5 -89.6 -4.3 43.9 52.2 26.5 47 47 A G T <<5S+ 0 0 55 -3,-0.9 2,-0.3 -4,-0.6 -3,-0.2 0.379 76.8 134.5 96.8 -5.1 44.8 55.6 28.0 48 48 A V < - 0 0 4 -5,-1.7 2,-0.8 -6,-0.2 -1,-0.4 -0.616 62.5-118.7 -79.3 135.6 41.5 57.2 27.1 49 49 A K + 0 0 115 -2,-0.3 -46,-2.4 -48,-0.2 -45,-2.1 -0.654 45.6 176.4 -77.3 111.0 39.9 59.3 30.0 50 50 A V E -a 4 0A 3 -2,-0.8 25,-2.1 23,-0.3 2,-0.4 -0.926 21.2-159.5-126.2 144.9 36.6 57.5 30.7 51 51 A G E -ac 5 75A 0 -47,-2.1 -45,-4.3 -2,-0.4 2,-0.4 -0.948 6.0-155.9-121.0 139.4 33.8 58.0 33.2 52 52 A F E -a 6 0A 0 23,-2.1 2,-0.5 -2,-0.4 26,-0.4 -0.921 3.9-159.5-114.0 139.2 31.2 55.4 34.2 53 53 A V E +a 7 0A 0 -47,-1.9 -45,-1.2 -2,-0.4 2,-0.3 -0.974 39.4 101.5-120.0 119.0 27.9 56.4 35.6 54 54 A G E -p 79 0C 0 24,-0.5 26,-1.8 -2,-0.5 2,-0.4 -0.994 54.3-105.6-175.9 179.1 26.0 53.8 37.6 55 55 A R E -p 80 0C 58 -47,-0.4 2,-0.4 -2,-0.3 26,-0.2 -0.987 16.7-173.1-133.2 134.3 24.8 52.3 40.9 56 56 A V E -p 81 0C 0 24,-0.8 26,-2.4 -2,-0.4 30,-0.2 -0.908 36.7-105.5-117.0 145.8 25.8 49.2 42.8 57 57 A G - 0 0 0 -2,-0.4 2,-1.1 24,-0.2 28,-0.3 0.025 40.1 -95.4 -59.8 178.5 23.9 48.1 45.9 58 58 A E S S+ 0 0 97 26,-1.7 2,-0.2 24,-0.3 26,-0.2 -0.587 91.4 96.9 -98.3 69.7 25.4 48.6 49.4 59 59 A D S > S- 0 0 7 -2,-1.1 4,-1.7 24,-0.1 5,-0.1 -0.791 89.1 -82.3-142.3-175.5 26.8 45.1 49.5 60 60 A E H > S+ 0 0 7 -2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.875 122.5 45.9 -65.7 -42.0 30.0 43.0 49.0 61 61 A L H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.886 109.6 55.8 -69.4 -37.6 29.7 42.5 45.2 62 62 A G H > S+ 0 0 0 1,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.916 107.1 50.5 -58.5 -41.5 28.9 46.2 44.7 63 63 A A H X S+ 0 0 1 -4,-1.7 4,-2.8 1,-0.2 -1,-0.3 0.852 108.4 53.2 -63.2 -34.0 32.1 47.0 46.5 64 64 A M H X S+ 0 0 19 -4,-1.3 4,-1.5 2,-0.2 -1,-0.2 0.817 109.1 47.8 -70.1 -34.2 33.8 44.5 44.1 65 65 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 3,-0.2 0.952 114.2 47.7 -68.4 -50.9 32.4 46.4 41.1 66 66 A E H X S+ 0 0 45 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.887 111.4 49.9 -57.5 -43.2 33.6 49.6 42.7 67 67 A E H X S+ 0 0 104 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.822 110.5 49.2 -69.0 -31.5 37.0 48.3 43.5 68 68 A R H X S+ 0 0 72 -4,-1.5 4,-2.3 -3,-0.2 5,-0.2 0.939 111.0 50.8 -70.8 -45.3 37.6 47.0 40.0 69 69 A L H X>S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-1.8 0.932 113.3 44.7 -54.2 -50.0 36.5 50.3 38.5 70 70 A R H <5S+ 0 0 137 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.925 108.6 57.7 -63.0 -42.9 38.9 52.2 40.8 71 71 A A H <5S+ 0 0 73 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.905 111.5 42.4 -53.9 -42.7 41.6 49.7 40.0 72 72 A E H <5S- 0 0 30 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.895 115.0-112.3 -73.4 -40.8 41.3 50.5 36.3 73 73 A G T <5 + 0 0 55 -4,-2.5 2,-0.4 1,-0.3 -23,-0.3 0.588 57.2 156.8 115.9 17.0 41.0 54.2 36.6 74 74 A V < - 0 0 5 -5,-1.8 -1,-0.3 -6,-0.2 2,-0.3 -0.644 49.2-115.4 -76.4 123.8 37.4 54.7 35.5 75 75 A D B -c 51 0A 51 -25,-2.1 -23,-2.1 -2,-0.4 3,-0.3 -0.442 30.2-174.2 -62.5 122.2 36.1 58.0 37.0 76 76 A L > + 0 0 16 -2,-0.3 3,-3.1 1,-0.2 -1,-0.1 0.114 40.0 129.3-106.9 20.6 33.3 57.2 39.4 77 77 A T T 3 S+ 0 0 77 1,-0.3 -1,-0.2 -24,-0.0 -24,-0.1 0.862 90.1 26.3 -39.0 -48.3 32.4 60.8 40.1 78 78 A H T 3 S+ 0 0 34 -26,-0.4 -24,-0.5 -3,-0.3 2,-0.5 0.101 108.0 91.6-106.3 18.9 28.8 59.8 39.3 79 79 A F E < +p 54 0C 5 -3,-3.1 2,-0.3 -26,-0.2 -24,-0.2 -0.960 52.2 147.3-113.4 132.0 29.1 56.1 40.3 80 80 A R E -p 55 0C 144 -26,-1.8 -24,-0.8 -2,-0.5 2,-0.3 -0.990 49.3 -97.1-165.5 154.3 28.3 55.1 43.8 81 81 A R E +p 56 0C 68 -2,-0.3 -24,-0.2 -26,-0.2 -23,-0.2 -0.567 43.5 177.6 -74.4 130.3 26.9 52.5 46.1 82 82 A A - 0 0 34 -26,-2.4 -24,-0.3 -2,-0.3 27,-0.1 -0.977 41.6 -70.8-135.6 147.8 23.2 53.0 47.0 83 83 A P S S+ 0 0 94 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.122 97.5 50.6 -32.3 149.1 20.8 51.0 49.1 84 84 A G S S- 0 0 50 -26,-0.2 -26,-1.7 -27,-0.1 2,-0.2 -0.536 90.3 -60.1 108.4-176.1 19.8 47.7 47.5 85 85 A F - 0 0 53 22,-0.3 24,-3.2 -28,-0.3 25,-0.5 -0.691 37.6-114.9-110.7 161.5 21.7 44.9 45.9 86 86 A T - 0 0 2 -2,-0.2 2,-0.1 22,-0.2 -30,-0.1 -0.763 38.7-119.8 -90.5 133.8 24.1 44.6 43.0 87 87 A G - 0 0 0 -2,-0.4 -75,-1.2 -77,-0.4 2,-0.3 -0.411 32.1-172.7 -74.4 151.7 22.7 42.4 40.2 88 88 A L E -jL 12 104B 0 16,-2.7 16,-1.8 -77,-0.2 2,-0.3 -0.967 8.2-160.7-142.4 157.3 24.5 39.3 39.1 89 89 A Y E -jL 13 103B 20 -77,-2.8 -75,-2.4 -2,-0.3 14,-0.2 -1.000 10.7-139.0-144.0 143.8 24.2 36.7 36.3 90 90 A L E -jL 14 102B 2 12,-2.5 12,-1.7 -2,-0.3 2,-0.4 -0.547 16.6-148.5 -95.6 164.7 25.4 33.1 35.7 91 91 A R E - L 0 101B 7 -77,-1.1 2,-0.5 10,-0.2 10,-0.2 -0.987 9.4-168.6-143.0 128.7 26.8 31.7 32.4 92 92 A E E - L 0 100B 11 8,-3.0 8,-0.6 -2,-0.4 2,-0.6 -0.959 1.6-174.5-118.2 123.8 26.6 28.3 30.8 93 93 A Y E - L 0 99B 44 -2,-0.5 -73,-1.5 -73,-0.5 6,-0.2 -0.872 22.1-142.4-121.8 100.8 28.8 27.4 27.8 94 94 A L > - 0 0 27 4,-0.6 3,-2.1 -2,-0.6 -73,-0.0 -0.181 21.6-109.2 -64.8 148.5 27.9 23.9 26.4 95 95 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.802 119.1 48.5 -40.2 -44.5 30.3 21.2 25.0 96 96 A L T 3 S- 0 0 173 2,-0.2 2,-1.1 1,-0.1 -2,-0.1 -0.078 122.5-101.8 -94.2 34.6 29.0 21.8 21.5 97 97 A G S < S+ 0 0 50 -3,-2.1 -3,-0.2 -4,-0.1 -1,-0.1 -0.663 88.5 97.6 93.7 -88.5 29.2 25.6 21.6 98 98 A Q + 0 0 169 -2,-1.1 -4,-0.6 -5,-0.1 2,-0.2 -0.090 50.1 176.0 -47.6 129.1 25.9 27.2 22.3 99 99 A G E -L 93 0B 31 -6,-0.2 2,-0.3 -4,-0.1 -6,-0.2 -0.773 20.2-123.7-130.2 175.9 25.2 28.1 25.9 100 100 A R E -L 92 0B 111 -8,-0.6 -8,-3.0 -2,-0.2 2,-0.3 -0.821 11.3-143.7-123.8 160.7 22.6 29.9 28.1 101 101 A V E -L 91 0B 49 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.917 4.5-160.3-124.5 150.4 22.5 32.8 30.6 102 102 A F E -L 90 0B 27 -12,-1.7 -12,-2.5 -2,-0.3 2,-0.2 -0.939 12.1-150.1-136.2 114.5 20.6 33.3 33.8 103 103 A Y E +L 89 0B 46 -2,-0.4 -14,-0.2 -14,-0.2 2,-0.1 -0.492 22.2 176.0 -86.8 152.3 19.9 36.8 35.4 104 104 A Y E +L 88 0B 15 -16,-1.8 -16,-2.7 -2,-0.2 -1,-0.0 -0.647 58.3 98.1-147.9 69.9 19.5 37.8 39.0 105 105 A R > + 0 0 17 -18,-0.3 3,-2.3 3,-0.1 2,-0.3 0.443 37.3 124.3-139.3 -13.2 19.2 41.5 38.5 106 106 A K T 3 S+ 0 0 201 1,-0.3 32,-0.0 -3,-0.0 0, 0.0 -0.411 87.9 11.9 -62.1 118.4 15.5 42.4 38.5 107 107 A G T 3 S+ 0 0 59 -2,-0.3 -22,-0.3 1,-0.2 -1,-0.3 0.545 96.5 150.3 91.8 9.9 14.9 45.0 41.2 108 108 A S < - 0 0 7 -3,-2.3 -1,-0.2 -24,-0.1 -22,-0.2 -0.110 61.5-109.6 -69.0 171.1 18.6 45.7 41.7 109 109 A A S > S+ 0 0 12 -24,-3.2 3,-0.6 1,-0.2 4,-0.4 0.775 116.6 52.7 -72.9 -27.7 20.2 49.0 42.7 110 110 A G G > S+ 0 0 3 -25,-0.5 3,-0.6 1,-0.2 -1,-0.2 0.813 95.3 64.9 -79.4 -30.9 21.6 49.5 39.3 111 111 A S G 3 S+ 0 0 17 -6,-0.3 31,-0.3 1,-0.2 -1,-0.2 0.181 84.8 80.8 -78.8 18.1 18.4 49.0 37.2 112 112 A A G < + 0 0 55 -3,-0.6 -1,-0.2 -57,-0.1 -2,-0.1 0.912 55.4 138.0 -85.1 -52.5 17.1 52.1 38.9 113 113 A L < + 0 0 5 -3,-0.6 32,-0.5 -4,-0.4 33,-0.2 0.558 27.5 165.8 2.1 98.5 18.9 54.6 36.6 114 114 A A > - 0 0 40 1,-0.2 3,-0.7 31,-0.1 28,-0.1 -0.754 43.6 -57.3-124.0 172.1 16.4 57.3 35.8 115 115 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.2 0, 0.0 30,-0.1 -0.100 122.9 25.4 -50.3 142.3 16.6 60.8 34.3 116 116 A G T 3 S+ 0 0 48 29,-0.2 29,-0.0 2,-0.1 -3,-0.0 0.769 77.0 147.1 72.0 23.9 18.9 63.3 36.0 117 117 A A S < S+ 0 0 22 -3,-0.7 2,-0.3 28,-0.1 -63,-0.1 0.849 71.8 12.6 -59.7 -34.9 20.8 60.3 37.3 118 118 A F S S- 0 0 9 -65,-0.1 -2,-0.1 -39,-0.0 3,-0.0 -0.865 98.2 -84.7-136.1 168.5 23.9 62.4 37.1 119 119 A D > - 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x 0 520F 4 25,-2.6 27,-3.2 -2,-0.5 2,-0.3 -0.998 26.6-137.5-144.5 143.6 14.4 27.3 68.6 495 193 B S E > - x 0 521F 18 -2,-0.3 4,-2.0 25,-0.2 27,-0.2 -0.678 26.6-118.9 -97.5 156.0 17.9 28.7 69.0 496 194 B E H > S+ 0 0 36 25,-2.3 4,-1.6 -2,-0.3 5,-0.2 0.902 112.4 51.4 -61.0 -44.4 19.0 30.8 72.0 497 195 B E H > S+ 0 0 154 1,-0.2 4,-0.9 2,-0.2 3,-0.3 0.931 109.6 51.6 -57.7 -47.0 19.8 34.0 70.0 498 196 B E H >> S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 3,-1.0 0.912 106.0 54.6 -54.4 -48.0 16.3 33.8 68.3 499 197 B A H 3< S+ 0 0 0 -4,-2.0 4,-0.5 1,-0.3 5,-0.4 0.848 114.9 39.8 -56.4 -37.0 14.7 33.5 71.7 500 198 B E H 3< S+ 0 0 96 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.466 115.2 52.3 -92.7 -3.7 16.4 36.7 72.9 501 199 B L H << S+ 0 0 82 -3,-1.0 -2,-0.2 -4,-0.9 -3,-0.2 0.658 119.9 30.9-103.9 -21.5 16.0 38.6 69.5 502 200 B L S < S+ 0 0 3 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.1 0.438 141.8 16.7-111.6 -9.1 12.2 38.0 69.2 503 201 B F S S- 0 0 50 -4,-0.5 2,-0.7 -5,-0.3 -3,-0.2 0.506 92.7-129.1-135.2 -24.1 11.4 38.0 72.9 504 202 B G S S+ 0 0 39 -5,-0.4 2,-0.5 -6,-0.2 -4,-0.1 -0.467 86.7 45.0 103.0 -61.8 14.4 39.5 74.6 505 203 B R S > S- 0 0 158 -2,-0.7 4,-2.0 -6,-0.2 3,-0.3 -0.977 79.0-129.1-124.4 128.8 15.0 36.8 77.2 506 204 B V H > S+ 0 0 16 -2,-0.5 4,-2.5 1,-0.2 -1,-0.1 0.840 106.9 64.1 -34.3 -45.6 15.0 33.1 76.5 507 205 B E H >> S+ 0 0 98 1,-0.2 4,-0.9 2,-0.2 3,-0.6 0.943 103.5 39.4 -48.1 -69.9 12.6 32.9 79.5 508 206 B E H >> S+ 0 0 91 -3,-0.3 4,-2.1 1,-0.3 3,-1.3 0.898 112.7 59.4 -51.6 -40.9 9.7 34.9 78.1 509 207 B A H 3X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.3 -1,-0.3 0.936 104.5 51.3 -51.1 -47.8 10.3 33.3 74.8 510 208 B L H << S+ 0 0 43 -4,-2.5 -1,-0.3 -3,-0.6 -2,-0.2 0.590 110.7 46.3 -67.1 -17.3 9.7 29.9 76.5 511 209 B R H << S+ 0 0 192 -3,-1.3 3,-0.3 -4,-0.9 -2,-0.2 0.891 113.8 44.2 -91.1 -52.0 6.4 30.8 78.1 512 210 B A H < S+ 0 0 38 -4,-2.1 2,-1.6 1,-0.3 -2,-0.2 0.967 114.7 53.1 -54.0 -54.4 4.6 32.5 75.2 513 211 B L S < S+ 0 0 8 -4,-2.1 2,-0.8 -5,-0.4 -1,-0.3 -0.551 74.1 159.1 -85.1 75.5 5.8 29.7 72.9 514 212 B S + 0 0 81 -2,-1.6 -3,-0.1 -3,-0.3 -4,-0.1 -0.847 6.5 163.9-106.1 103.8 4.6 26.6 74.9 515 213 B A - 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0 0 110 -2,-0.4 2,-0.2 -13,-0.2 -13,-0.1 -0.624 27.1-128.7 -79.8 131.2 25.9 17.8 75.6 540 238 B A - 0 0 33 -16,-0.5 2,-0.5 -2,-0.3 38,-0.1 -0.542 23.4-110.5 -80.6 145.1 27.2 19.4 72.3 541 239 B F - 0 0 49 36,-0.4 2,-0.7 -2,-0.2 -1,-0.1 -0.629 31.5-127.0 -76.3 122.6 29.8 17.5 70.3 542 240 B A + 0 0 107 -2,-0.5 2,-0.3 3,-0.0 -1,-0.1 -0.607 52.0 138.7 -75.2 114.1 33.1 19.4 70.5 543 241 B V - 0 0 75 -2,-0.7 2,-0.4 41,-0.0 39,-0.0 -0.987 61.3 -90.3-153.4 151.7 34.4 19.9 67.0 544 242 B E - 0 0 175 -2,-0.3 2,-1.1 1,-0.1 -2,-0.0 -0.539 46.4-125.3 -67.9 119.0 36.0 22.7 65.0 545 243 B A + 0 0 67 -2,-0.4 40,-0.2 1,-0.2 -1,-0.1 -0.553 36.4 171.2 -73.8 97.1 33.1 24.7 63.4 546 244 B V S S- 0 0 61 38,-1.4 39,-0.2 -2,-1.1 -1,-0.2 0.999 76.3 -9.4 -67.1 -72.6 33.8 24.9 59.7 547 245 B D - 0 0 6 37,-1.3 39,-0.3 39,-0.9 -1,-0.3 -0.907 61.3-161.4-134.8 104.8 30.5 26.4 58.4 548 246 B P > + 0 0 86 0, 0.0 3,-1.0 0, 0.0 4,-0.4 0.450 57.6 115.6 -63.9 -1.9 27.8 26.6 61.1 549 247 B V T 3 S+ 0 0 44 1,-0.2 -2,-0.1 34,-0.1 -3,-0.0 -0.568 79.4 15.4 -76.0 129.9 25.2 26.9 58.4 550 248 B G T 3> S+ 0 0 10 -2,-0.3 4,-1.9 40,-0.1 -1,-0.2 0.232 92.3 113.2 94.4 -13.9 22.7 24.1 58.2 551 249 B A H <> S+ 0 0 19 -3,-1.0 4,-2.0 1,-0.2 32,-0.1 0.882 73.6 52.4 -57.4 -44.0 23.7 22.8 61.7 552 250 B G H > S+ 0 0 21 -4,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.859 108.9 48.9 -61.9 -38.2 20.3 23.7 63.2 553 251 B D H > S+ 0 0 5 2,-0.2 4,-3.2 -3,-0.2 -1,-0.2 0.871 110.7 50.1 -69.5 -38.1 18.4 21.8 60.6 554 252 B A H X S+ 0 0 2 -4,-1.9 4,-2.7 2,-0.2 26,-0.3 0.862 109.9 52.8 -66.0 -35.9 20.7 18.8 61.0 555 253 B F H X S+ 0 0 11 -4,-2.0 4,-1.9 24,-0.2 -2,-0.2 0.942 112.6 43.3 -62.2 -50.0 20.0 19.2 64.7 556 254 B A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.896 114.2 50.7 -62.7 -43.3 16.2 19.1 64.0 557 255 B A H X S+ 0 0 0 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.900 108.7 52.2 -63.2 -41.4 16.6 16.3 61.6 558 256 B G H X S+ 0 0 0 -4,-2.7 4,-1.3 18,-0.2 18,-0.3 0.873 110.4 48.3 -63.3 -38.0 18.6 14.3 64.1 559 257 B Y H >X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 3,-0.7 0.980 109.4 51.2 -65.6 -56.0 15.8 14.8 66.7 560 258 B L H 3X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.3 5,-0.2 0.834 108.3 52.0 -49.1 -40.3 13.0 13.8 64.4 561 259 B A H 3X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -1,-0.3 0.868 108.2 54.6 -66.6 -33.6 14.8 10.6 63.5 562 260 B G H <<>S+ 0 0 0 -4,-1.3 5,-1.8 -3,-0.7 -2,-0.2 0.964 113.6 38.7 -62.0 -53.5 15.1 10.0 67.2 563 261 B A H ><5S+ 0 0 16 -4,-2.2 3,-4.5 3,-0.2 -2,-0.2 0.978 113.3 54.4 -60.7 -59.6 11.4 10.3 67.8 564 262 B V H 3<5S+ 0 0 27 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.865 110.1 49.0 -43.1 -41.4 10.4 8.5 64.6 565 263 B W T 3<5S- 0 0 84 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.338 122.7-112.1 -83.2 9.5 12.6 5.6 65.8 566 264 B G T < 5 + 0 0 63 -3,-4.5 -3,-0.2 1,-0.2 -2,-0.2 0.965 55.5 175.4 59.4 58.1 10.8 5.9 69.2 567 265 B L < - 0 0 40 -5,-1.8 -1,-0.2 1,-0.1 2,-0.1 -0.731 36.0-105.2-102.0 145.4 13.9 7.1 71.1 568 266 B P >> - 0 0 59 0, 0.0 4,-1.9 0, 0.0 3,-1.1 -0.386 42.5-105.0 -62.4 138.5 14.2 8.2 74.7 569 267 B V H 3> S+ 0 0 14 1,-0.3 4,-0.8 2,-0.2 5,-0.1 0.661 121.7 53.3 -40.0 -23.2 14.4 12.0 75.0 570 268 B E H 3> S+ 0 0 80 2,-0.2 4,-3.3 1,-0.2 -1,-0.3 0.910 108.9 44.4 -81.3 -46.8 18.1 11.6 75.8 571 269 B E H <> S+ 0 0 75 -3,-1.1 4,-1.6 1,-0.2 -2,-0.2 0.712 112.3 55.5 -70.3 -20.6 19.0 9.5 72.7 572 270 B R H X S+ 0 0 22 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.790 112.4 42.0 -79.4 -31.8 16.9 11.9 70.7 573 271 B L H X S+ 0 0 2 -4,-0.8 4,-2.7 -5,-0.3 5,-0.3 0.924 112.6 52.2 -78.7 -48.1 19.1 14.8 71.9 574 272 B R H X S+ 0 0 126 -4,-3.3 4,-1.5 1,-0.2 -2,-0.2 0.935 112.7 47.3 -51.8 -49.0 22.4 12.9 71.6 575 273 B L H X S+ 0 0 16 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.909 110.9 51.3 -60.0 -45.0 21.4 12.1 68.0 576 274 B A H X S+ 0 0 0 -4,-1.4 4,-2.1 -18,-0.3 -18,-0.2 0.947 109.7 48.3 -58.3 -51.8 20.4 15.7 67.3 577 275 B N H X S+ 0 0 11 -4,-2.7 4,-1.3 1,-0.2 -36,-0.4 0.795 109.7 56.3 -60.3 -29.0 23.7 17.2 68.6 578 276 B L H X S+ 0 0 15 -4,-1.5 4,-1.7 -5,-0.3 3,-0.4 0.961 108.0 43.4 -69.0 -52.1 25.5 14.6 66.6 579 277 B L H X S+ 0 0 2 -4,-2.2 4,-2.0 1,-0.2 -24,-0.2 0.852 113.9 53.4 -62.1 -33.3 24.0 15.6 63.2 580 278 B G H X S+ 0 0 11 -4,-2.1 4,-1.6 -26,-0.3 -1,-0.2 0.790 107.0 50.8 -72.4 -27.4 24.5 19.2 64.1 581 279 B A H X S+ 0 0 15 -4,-1.3 4,-2.0 -3,-0.4 -1,-0.2 0.801 109.2 52.3 -78.0 -30.5 28.2 18.7 64.9 582 280 B S H < S+ 0 0 27 -4,-1.7 -2,-0.2 2,-0.2 4,-0.2 0.948 112.1 43.7 -68.9 -50.0 28.7 17.0 61.5 583 281 B V H >< S+ 0 0 2 -4,-2.0 3,-1.0 1,-0.2 -36,-0.4 0.879 116.2 48.0 -63.0 -39.5 27.1 19.8 59.5 584 282 B A H 3< S+ 0 0 14 -4,-1.6 -38,-1.4 1,-0.2 -37,-1.3 0.881 108.0 56.3 -68.6 -37.4 28.9 22.4 61.6 585 283 B A T 3< S+ 0 0 32 -4,-2.0 -1,-0.2 -40,-0.2 2,-0.2 0.380 109.8 52.9 -76.5 4.6 32.2 20.4 61.1 586 284 B S S < S- 0 0 43 -3,-1.0 -39,-0.9 -39,-0.3 2,-0.1 -0.773 83.9 -97.8-132.9 178.3 31.9 20.6 57.2 587 285 B R S > S+ 0 0 117 -2,-0.2 4,-0.5 -41,-0.1 5,-0.4 -0.438 79.0 31.2 -91.1 168.9 31.3 22.8 54.3 588 286 B G T 4 S- 0 0 1 1,-0.2 -39,-0.1 -2,-0.1 -2,-0.1 -0.121 98.7 -71.4 77.4-177.5 28.1 23.5 52.5 589 287 B D T 4 S- 0 0 2 -255,-0.4 -1,-0.2 1,-0.1 -254,-0.1 0.763 120.6 -5.5 -88.5 -28.1 24.6 23.6 54.0 590 288 B H T >4 S+ 0 0 2 -256,-0.2 3,-1.7 -3,-0.1 -2,-0.1 0.206 91.7 117.9-151.9 16.6 24.1 19.9 54.6 591 289 B E T 3< S+ 0 0 55 -4,-0.5 -3,-0.1 1,-0.3 -8,-0.1 0.892 75.8 57.4 -56.9 -40.1 27.1 18.2 53.1 592 290 B G T 3 S+ 0 0 17 -5,-0.4 -1,-0.3 -9,-0.2 -9,-0.1 0.362 72.5 131.7 -75.7 6.2 28.2 16.8 56.5 593 291 B A < - 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