==== 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 LIGASE 08-DEC-08 3FGN . COMPND 2 MOLECULE: DETHIOBIOTIN SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR S.DEY,J.C.SACCHETTINI . 907 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 665 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 159 17.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 67 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 297 32.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.2 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 3 1 4 4 5 1 7 0 3 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 7 14 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 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 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 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 -3 A F 0 0 191 0, 0.0 2,-0.5 0, 0.0 229,-0.1 0.000 360.0 360.0 360.0 131.3 -21.6 17.4 3.4 2 -2 A Q - 0 0 43 227,-0.4 104,-0.2 1,-0.1 4,-0.1 -0.767 360.0-158.4 -76.3 123.8 -18.1 17.7 1.8 3 -1 A S S S+ 0 0 64 -2,-0.5 2,-0.3 102,-0.2 -1,-0.1 0.375 75.1 38.2 -89.2 5.0 -15.6 18.6 4.6 4 0 A H S S- 0 0 119 100,-0.1 102,-1.5 103,-0.0 2,-0.1 -0.866 93.5 -85.7-139.1 178.5 -13.1 19.9 2.1 5 1 A M - 0 0 22 -2,-0.3 2,-0.5 100,-0.2 103,-0.2 -0.350 29.2-120.1 -84.7 162.0 -13.2 21.9 -1.1 6 2 A T E -a 108 0A 21 101,-3.1 103,-3.3 -2,-0.1 2,-0.5 -0.891 31.1-155.5 -94.8 130.1 -13.6 20.8 -4.7 7 3 A I E +a 109 0A 24 -2,-0.5 131,-1.6 129,-0.3 2,-0.4 -0.933 14.5 179.5-112.6 127.7 -10.6 21.8 -6.8 8 4 A L E -ab 110 138A 4 101,-3.0 103,-3.4 -2,-0.5 2,-0.4 -0.992 17.2-149.6-121.5 129.7 -10.7 22.3 -10.6 9 5 A V E -ab 111 139A 0 129,-2.6 131,-3.0 -2,-0.4 2,-0.6 -0.765 15.2-148.5 -86.1 140.3 -7.7 23.3 -12.6 10 6 A V E +ab 112 140A 0 101,-3.4 103,-2.4 -2,-0.4 2,-0.3 -0.967 24.8 170.5-118.5 113.4 -8.7 25.3 -15.6 11 7 A T E - b 0 141A 0 129,-2.1 131,-3.0 -2,-0.6 2,-0.3 -0.835 22.9-136.1-122.5 155.6 -6.5 24.8 -18.6 12 8 A G E - b 0 142A 0 -2,-0.3 105,-0.6 129,-0.2 131,-0.2 -0.819 16.3-132.7-110.8 158.0 -6.6 25.9 -22.3 13 9 A T S S- 0 0 2 129,-2.2 2,-0.3 -2,-0.3 130,-0.1 0.560 86.9 -24.7 -80.6 -8.6 -5.8 23.9 -25.4 14 10 A G S > S- 0 0 9 128,-0.3 3,-0.7 364,-0.0 101,-0.1 -0.959 95.8 -36.2-178.5-173.0 -3.8 26.8 -26.7 15 11 A T T 3 S+ 0 0 77 -2,-0.3 -2,-0.1 359,-0.3 101,-0.0 -0.417 114.7 0.3 -69.3 136.9 -3.2 30.6 -26.5 16 12 A G T 3 S+ 0 0 78 1,-0.1 -1,-0.2 -2,-0.1 0, 0.0 0.833 74.6 138.4 56.8 44.8 -6.2 32.8 -26.1 17 13 A V S < S- 0 0 11 -3,-0.7 156,-0.3 125,-0.1 -1,-0.1 0.427 80.0 -98.3 -92.1 -3.5 -9.0 30.3 -26.0 18 14 A G > + 0 0 26 124,-0.1 4,-1.7 155,-0.1 5,-0.1 0.803 65.1 156.9 92.4 36.0 -10.6 32.3 -23.3 19 15 A K H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.841 74.6 52.4 -53.7 -41.9 -9.6 30.6 -20.0 20 16 A T H > S+ 0 0 14 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 109.1 46.6 -68.9 -45.3 -10.1 33.7 -17.9 21 17 A V H > S+ 0 0 13 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.828 112.4 53.5 -65.3 -30.6 -13.7 34.4 -19.1 22 18 A V H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.2 5,-0.3 0.925 107.4 49.3 -68.6 -46.6 -14.5 30.7 -18.5 23 19 A C H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.919 114.6 46.3 -52.4 -48.2 -13.2 30.9 -14.9 24 20 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.911 112.4 49.2 -64.2 -45.6 -15.3 33.9 -14.4 25 21 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.934 114.9 44.0 -60.6 -48.4 -18.4 32.4 -16.0 26 22 A L H X S+ 0 0 0 -4,-3.1 4,-3.0 2,-0.2 5,-0.2 0.923 114.0 51.2 -60.0 -42.7 -18.1 29.2 -13.9 27 23 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.928 111.8 46.8 -60.0 -48.4 -17.4 31.2 -10.8 28 24 A S H X S+ 0 0 6 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.856 113.3 48.4 -61.9 -41.9 -20.5 33.4 -11.4 29 25 A A H X S+ 0 0 0 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.916 113.4 46.8 -65.8 -46.0 -22.7 30.3 -12.1 30 26 A A H <>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.2 3,-0.3 0.878 111.2 51.8 -63.9 -41.4 -21.4 28.5 -9.0 31 27 A R H ><5S+ 0 0 96 -4,-2.5 3,-1.7 -5,-0.2 -1,-0.2 0.888 106.7 53.2 -62.3 -38.9 -21.9 31.7 -6.8 32 28 A Q H 3<5S+ 0 0 99 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.725 104.4 57.2 -71.3 -20.3 -25.5 32.0 -8.1 33 29 A A T 3<5S- 0 0 42 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.324 126.6-102.3 -85.2 5.5 -26.0 28.4 -7.0 34 30 A G T < 5S+ 0 0 72 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.600 78.0 137.8 84.0 12.0 -25.0 29.3 -3.4 35 31 A I < - 0 0 17 -5,-2.4 2,-0.4 -6,-0.1 -1,-0.3 -0.781 55.0-126.1 -93.0 132.4 -21.5 27.9 -3.7 36 32 A D - 0 0 68 70,-0.4 72,-3.1 -2,-0.4 2,-0.5 -0.643 31.5-159.0 -74.4 126.2 -18.5 29.8 -2.3 37 33 A V E -c 108 0A 0 -2,-0.4 28,-0.5 70,-0.2 2,-0.4 -0.925 16.2-174.8-118.1 127.6 -15.9 30.2 -5.0 38 34 A A E -cd 109 65A 0 70,-2.4 72,-2.9 -2,-0.5 2,-0.4 -0.940 10.8-156.8-108.4 145.2 -12.2 30.9 -4.8 39 35 A V E -cd 110 66A 0 26,-2.8 28,-2.8 -2,-0.4 2,-0.4 -0.980 9.1-167.9-122.8 131.9 -10.0 31.5 -7.9 40 36 A C E -cd 111 67A 0 70,-3.3 72,-2.9 -2,-0.4 28,-0.2 -0.951 14.2-176.3-124.0 135.5 -6.3 31.0 -7.8 41 37 A K E - d 0 68A 7 26,-2.9 28,-0.7 -2,-0.4 29,-0.1 -0.793 3.5-177.3-132.1 89.1 -3.7 32.0 -10.4 42 38 A P E S+ 0 0 2 0, 0.0 28,-2.8 0, 0.0 2,-0.4 0.844 74.8 28.9 -57.8 -40.3 -0.3 30.6 -9.3 43 39 A V E - d 0 70A 1 69,-0.4 2,-0.5 26,-0.2 28,-0.2 -0.986 64.8-179.8-131.5 118.2 1.7 32.2 -12.2 44 40 A Q E - d 0 71A 10 26,-2.5 28,-2.6 -2,-0.4 3,-0.3 -0.975 7.6-178.9-118.1 113.6 0.7 35.4 -13.9 45 41 A T + 0 0 24 -2,-0.5 29,-0.1 26,-0.2 32,-0.1 -0.592 59.6 47.5 -99.2 173.4 2.9 36.7 -16.8 46 42 A G > > + 0 0 0 28,-1.5 5,-2.2 26,-0.4 3,-1.4 0.691 60.8 141.3 72.9 18.9 2.5 39.9 -18.8 47 43 A T G > 5 + 0 0 36 25,-2.1 3,-1.5 -3,-0.3 27,-0.1 0.829 67.8 60.6 -62.9 -30.5 1.9 42.1 -15.8 48 44 A A G 3 5S+ 0 0 79 25,-1.7 -1,-0.3 1,-0.3 26,-0.1 0.668 105.2 49.4 -71.1 -15.1 3.9 44.9 -17.4 49 45 A R G < 5S- 0 0 150 -3,-1.4 -1,-0.3 24,-0.5 -2,-0.2 0.246 129.0 -97.7-103.9 11.4 1.4 44.9 -20.2 50 46 A G T < 5 + 0 0 63 -3,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.384 69.5 155.5 91.8 -2.7 -1.6 45.1 -17.8 51 47 A D < + 0 0 35 -5,-2.2 -1,-0.3 22,-0.2 2,-0.2 -0.385 2.1 149.6 -60.8 123.2 -2.3 41.3 -17.8 52 48 A D > - 0 0 45 -2,-0.2 4,-2.1 1,-0.1 5,-0.1 -0.648 19.4-179.7-156.5 95.4 -4.1 40.4 -14.6 53 49 A D H > S+ 0 0 25 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.882 84.7 54.2 -67.5 -39.6 -6.5 37.4 -14.9 54 50 A L H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.918 108.6 49.2 -56.7 -47.7 -7.5 37.5 -11.2 55 51 A A H > S+ 0 0 36 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.917 111.5 50.9 -59.9 -42.8 -8.4 41.2 -11.5 56 52 A E H X S+ 0 0 51 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.893 108.9 49.9 -61.0 -44.3 -10.4 40.4 -14.6 57 53 A V H X>S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 6,-0.7 0.894 110.4 50.0 -61.9 -41.7 -12.3 37.5 -12.8 58 54 A G H X5S+ 0 0 17 -4,-2.2 4,-1.8 4,-0.2 -2,-0.2 0.929 112.0 49.6 -63.4 -44.8 -13.2 39.9 -9.9 59 55 A R H <5S+ 0 0 170 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.934 118.9 36.3 -53.4 -51.8 -14.4 42.4 -12.4 60 56 A L H <5S+ 0 0 18 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.904 132.6 21.6 -77.9 -43.2 -16.6 40.0 -14.3 61 57 A A H <5S- 0 0 14 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.577 94.8-120.4-107.7 -12.0 -18.0 37.7 -11.6 62 58 A G << + 0 0 40 -4,-1.8 -4,-0.2 -5,-0.5 2,-0.2 0.639 51.8 166.0 78.3 15.4 -17.6 39.8 -8.4 63 59 A V - 0 0 5 -6,-0.7 -1,-0.3 1,-0.1 -2,-0.1 -0.470 18.4-178.7 -66.6 130.5 -15.3 37.1 -6.9 64 60 A T + 0 0 107 -27,-0.3 2,-1.5 -2,-0.2 -1,-0.1 0.678 63.0 81.2-103.0 -27.5 -13.5 38.4 -3.8 65 61 A Q E +d 38 0A 64 -28,-0.5 -26,-2.8 2,-0.0 2,-0.5 -0.596 60.0 158.5 -87.0 86.4 -11.4 35.3 -3.0 66 62 A L E -d 39 0A 65 -2,-1.5 2,-0.6 -28,-0.2 -26,-0.2 -0.940 20.3-167.4-119.1 116.4 -8.6 35.8 -5.4 67 63 A A E +d 40 0A 13 -28,-2.8 -26,-2.9 -2,-0.5 2,-0.2 -0.898 12.0 167.3-116.7 114.3 -5.2 34.1 -4.8 68 64 A G E +d 41 0A 38 -2,-0.6 3,-0.1 -28,-0.2 -25,-0.1 -0.612 11.5 167.1-114.8 178.4 -2.0 34.9 -6.6 69 65 A L E + 0 0 67 -28,-0.7 2,-0.4 1,-0.3 -26,-0.2 0.206 60.9 37.2-152.4 -80.8 1.6 34.1 -6.1 70 66 A A E -d 43 0A 14 -28,-2.8 -26,-2.5 -29,-0.1 2,-0.4 -0.767 56.5-175.3 -97.0 132.6 4.2 34.8 -8.9 71 67 A R E -d 44 0A 116 -2,-0.4 -26,-0.2 -28,-0.2 -28,-0.0 -0.990 0.7-173.8-126.3 124.8 3.9 37.9 -11.2 72 68 A Y - 0 0 3 -28,-2.6 -25,-2.1 -2,-0.4 -26,-0.4 -0.960 20.7-142.1-120.8 132.7 6.3 38.4 -14.1 73 69 A P S S+ 0 0 48 0, 0.0 -25,-1.7 0, 0.0 -24,-0.5 0.880 76.3 76.8 -61.6 -45.1 6.3 41.6 -16.2 74 70 A Q S S- 0 0 59 7,-0.3 2,-1.9 -28,-0.2 -28,-1.5 -0.451 80.3-126.2 -77.8 137.7 6.9 40.2 -19.8 75 71 A P S S+ 0 0 34 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.476 73.1 96.7 -82.6 71.7 4.1 38.4 -21.7 76 72 A M S S- 0 0 11 -2,-1.9 -4,-0.1 1,-0.1 333,-0.0 -0.753 86.0 -48.0-135.0-173.4 5.9 35.2 -22.5 77 73 A A > - 0 0 21 -2,-0.2 4,-3.0 1,-0.1 3,-0.4 -0.336 60.5-112.2 -53.6 140.0 6.1 31.6 -21.1 78 74 A P H > S+ 0 0 3 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.879 116.1 51.6 -40.1 -54.7 6.6 31.7 -17.3 79 75 A A H > S+ 0 0 33 41,-0.4 4,-2.1 1,-0.2 5,-0.1 0.901 115.5 41.2 -56.2 -44.5 10.2 30.3 -17.5 80 76 A A H > S+ 0 0 11 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.873 115.5 50.2 -70.1 -41.5 11.2 32.9 -20.1 81 77 A A H X S+ 0 0 0 -4,-3.0 4,-1.3 2,-0.2 -7,-0.3 0.892 112.4 47.7 -63.5 -40.9 9.4 35.7 -18.3 82 78 A A H <>S+ 0 0 2 -4,-3.2 5,-3.2 -5,-0.3 3,-0.2 0.925 113.7 46.8 -65.9 -45.6 11.0 34.8 -15.0 83 79 A E H ><5S+ 0 0 146 -4,-2.1 3,-1.7 -5,-0.3 -2,-0.2 0.916 108.2 55.8 -64.6 -44.0 14.5 34.6 -16.6 84 80 A H H 3<5S+ 0 0 99 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.835 112.3 43.8 -52.5 -36.7 14.0 37.9 -18.3 85 81 A A T 3<5S- 0 0 42 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.344 113.0-116.4 -91.8 3.9 13.3 39.5 -14.9 86 82 A G T < 5S+ 0 0 75 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.814 76.0 131.9 57.3 30.6 16.1 37.7 -13.1 87 83 A M < - 0 0 88 -5,-3.2 -1,-0.2 -6,-0.2 2,-0.2 -0.773 55.6-121.5-110.8 157.0 13.4 36.0 -11.1 88 84 A A - 0 0 79 -2,-0.3 3,-0.1 -3,-0.1 -9,-0.0 -0.592 24.0-114.4 -90.4 155.2 12.9 32.4 -10.1 89 85 A L - 0 0 15 -2,-0.2 33,-0.2 1,-0.1 34,-0.1 -0.529 46.1 -97.1 -71.3 156.5 9.9 30.3 -10.9 90 86 A P - 0 0 7 0, 0.0 33,-0.8 0, 0.0 2,-0.2 -0.305 39.8-104.6 -70.1 164.4 8.0 29.2 -7.8 91 87 A A > - 0 0 46 31,-0.2 4,-1.6 1,-0.1 3,-0.4 -0.569 26.8-113.8 -81.9 153.2 8.6 25.8 -6.2 92 88 A R H > S+ 0 0 86 31,-0.5 4,-2.3 1,-0.2 3,-0.2 0.910 117.7 55.0 -46.6 -49.7 6.0 23.1 -6.6 93 89 A D H > S+ 0 0 130 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.843 102.2 54.8 -55.3 -42.5 5.3 23.2 -2.9 94 90 A Q H > S+ 0 0 98 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.898 110.2 47.2 -61.0 -41.4 4.6 26.9 -2.9 95 91 A I H X S+ 0 0 0 -4,-1.6 4,-1.6 -3,-0.2 -2,-0.2 0.920 113.3 46.8 -66.4 -46.0 1.9 26.3 -5.6 96 92 A V H X S+ 0 0 35 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.878 113.3 50.5 -63.6 -37.6 0.4 23.4 -3.7 97 93 A R H X S+ 0 0 175 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.892 104.9 55.9 -67.5 -40.6 0.5 25.5 -0.5 98 94 A L H < S+ 0 0 29 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.911 115.2 39.9 -56.5 -41.7 -1.2 28.5 -2.1 99 95 A I H >< S+ 0 0 0 -4,-1.6 3,-2.2 1,-0.2 4,-0.2 0.944 112.7 52.5 -73.8 -51.8 -4.1 26.1 -3.1 100 96 A A H >< S+ 0 0 54 -4,-2.8 3,-1.5 1,-0.3 -2,-0.2 0.812 100.4 63.1 -58.5 -30.2 -4.3 24.1 0.1 101 97 A D T 3< S+ 0 0 99 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.616 95.1 62.7 -70.7 -10.3 -4.6 27.3 2.2 102 98 A L T < S+ 0 0 24 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.484 75.3 131.9 -89.6 -5.1 -7.9 28.0 0.4 103 99 A D < + 0 0 53 -3,-1.5 -99,-0.0 -4,-0.2 -3,-0.0 -0.276 20.2 151.3 -57.4 125.3 -9.5 24.9 1.8 104 100 A R > - 0 0 124 -68,-0.1 3,-1.6 3,-0.1 2,-0.1 -0.947 55.4 -87.8-145.0 149.6 -13.0 25.4 3.3 105 101 A P T 3 S+ 0 0 82 0, 0.0 -100,-0.2 0, 0.0 -102,-0.2 -0.403 110.9 3.4 -61.8 130.3 -15.8 22.8 3.4 106 102 A G T 3 S+ 0 0 24 -102,-1.5 -70,-0.4 1,-0.2 2,-0.2 0.608 94.3 142.6 70.2 13.1 -18.0 23.0 0.2 107 103 A R < - 0 0 10 -3,-1.6 -101,-3.1 -72,-0.1 2,-0.6 -0.569 45.9-140.3 -76.0 147.5 -15.8 25.6 -1.5 108 104 A L E -ac 6 37A 0 -72,-3.1 -70,-2.4 -2,-0.2 2,-0.6 -0.948 19.2-167.4-104.3 116.8 -15.2 25.5 -5.2 109 105 A T E -ac 7 38A 0 -103,-3.3 -101,-3.0 -2,-0.6 2,-0.6 -0.902 4.8-161.8-106.8 123.9 -11.6 26.4 -6.0 110 106 A L E -ac 8 39A 0 -72,-2.9 -70,-3.3 -2,-0.6 2,-0.7 -0.895 3.1-160.5-104.7 119.8 -10.7 27.1 -9.7 111 107 A V E -ac 9 40A 0 -103,-3.4 -101,-3.4 -2,-0.6 2,-0.5 -0.889 10.1-154.8-103.6 106.8 -6.9 27.0 -10.4 112 108 A E E -a 10 0A 0 -72,-2.9 -69,-0.4 -2,-0.7 -101,-0.2 -0.701 9.8-146.3 -88.2 122.8 -6.2 28.9 -13.6 113 109 A G - 0 0 3 -103,-2.4 2,-0.3 -2,-0.5 4,-0.1 -0.000 17.0-111.6 -72.3-176.8 -3.1 27.8 -15.5 114 110 A A S S- 0 0 13 2,-0.3 -103,-0.1 5,-0.1 -1,-0.0 -0.645 80.1 -37.0-122.0 75.7 -0.7 29.9 -17.6 115 111 A G S S- 0 0 23 -2,-0.3 263,-0.2 -101,-0.1 2,-0.1 0.685 114.8 -11.4 95.9 23.2 -0.9 29.1 -21.3 116 112 A G S > S- 0 0 5 1,-0.1 3,-1.4 -102,-0.1 -2,-0.3 -0.353 76.5 -87.2 126.8 153.6 -1.5 25.3 -21.7 117 113 A L T 3 S+ 0 0 0 -105,-0.6 12,-0.9 1,-0.3 11,-0.8 0.852 122.0 42.4 -58.7 -44.2 -1.4 22.1 -19.7 118 114 A L T 3 S+ 0 0 3 9,-0.2 -1,-0.3 10,-0.1 2,-0.2 0.301 78.7 129.5 -94.3 9.6 2.4 21.4 -20.1 119 115 A V < - 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0 0 8 -5,-2.4 -1,-0.2 -6,-0.1 -27,-0.1 -0.891 43.0-127.5 -93.8 119.0 -6.1 13.5 -14.0 166 162 A S - 0 0 81 -2,-0.7 -27,-2.8 -29,-0.2 2,-0.6 -0.311 12.7-124.6 -67.2 143.1 -9.8 13.2 -14.6 167 163 A C E -e 139 0A 45 -29,-0.2 -27,-0.2 1,-0.1 28,-0.1 -0.820 15.3-166.0 -87.9 121.4 -11.4 15.5 -17.3 168 164 A A E - 0 0 14 -29,-2.4 2,-0.2 -2,-0.6 -28,-0.2 0.583 57.4 -91.4 -78.6 -13.0 -14.3 17.6 -15.7 169 165 A G E -e 140 0A 1 -30,-0.8 -28,-2.5 27,-0.1 -1,-0.3 -0.728 44.7 -65.2 130.1-176.3 -15.3 18.4 -19.3 170 166 A L E -ef 141 196A 0 25,-3.3 27,-2.7 -2,-0.2 28,-0.9 -0.788 27.8-163.3-109.8 148.4 -14.9 21.0 -22.0 171 167 A V E -ef 142 198A 0 -30,-2.5 -28,-2.7 -2,-0.3 2,-0.8 -0.980 16.5-142.6-128.6 122.7 -15.8 24.6 -22.3 172 168 A I E -ef 143 199A 0 26,-2.7 28,-2.5 -2,-0.4 -28,-0.2 -0.766 16.0-158.2 -78.6 112.6 -16.0 26.4 -25.7 173 169 A G E S+ 0 0 5 -30,-2.2 2,-0.3 -2,-0.8 31,-0.2 0.714 75.9 22.7 -70.3 -24.5 -14.6 29.8 -24.7 174 170 A S E - 0 0 63 -31,-0.4 -29,-0.4 28,-0.1 -1,-0.2 -0.922 66.8-173.2-146.9 115.9 -16.1 31.7 -27.6 175 171 A W E - 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0 0 108 -2,-0.1 4,-5.2 1,-0.1 5,-0.4 -0.407 32.7-111.9 -68.5 150.7 -5.5 -23.9 12.1 890 205 D A H > S+ 0 0 63 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.879 125.6 45.2 -48.3 -39.1 -5.8 -21.2 14.7 891 206 D G H > S+ 0 0 56 2,-0.2 4,-1.3 1,-0.1 -1,-0.2 0.935 117.8 40.7 -69.6 -49.8 -2.0 -21.3 14.6 892 207 D D H > S+ 0 0 91 2,-0.2 4,-2.7 1,-0.2 3,-0.2 0.904 113.2 55.0 -65.3 -43.2 -1.7 -21.5 10.8 893 208 D F H X S+ 0 0 0 -4,-5.2 4,-2.6 1,-0.2 -1,-0.2 0.892 106.4 52.1 -57.5 -40.8 -4.5 -18.9 10.4 894 209 D A H X S+ 0 0 23 -4,-1.4 4,-2.0 -5,-0.4 -1,-0.2 0.825 110.5 47.1 -67.1 -34.4 -2.5 -16.5 12.6 895 210 D A H X S+ 0 0 64 -4,-1.3 4,-1.4 -3,-0.2 -2,-0.2 0.898 113.1 49.2 -71.6 -42.1 0.6 -16.9 10.5 896 211 D M H X S+ 0 0 22 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.893 112.9 48.1 -61.4 -42.6 -1.4 -16.4 7.3 897 212 D S H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 3,-0.3 0.913 107.5 54.5 -65.0 -46.4 -3.0 -13.3 8.7 898 213 D A H < S+ 0 0 49 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.810 115.0 39.8 -59.6 -33.2 0.3 -11.8 9.9 899 214 D A H < S+ 0 0 87 -4,-1.4 -1,-0.2 1,-0.1 -2,-0.2 0.660 106.2 67.7 -89.9 -18.0 1.7 -12.1 6.4 900 215 D A H < S+ 0 0 24 -4,-1.2 -20,-0.3 -3,-0.3 2,-0.2 0.917 100.4 43.6 -69.5 -47.4 -1.5 -11.0 4.6 901 216 D F S < S- 0 0 10 -4,-1.5 2,-0.5 -195,-0.1 -22,-0.1 -0.641 89.6-106.5-100.0 156.1 -1.6 -7.4 5.7 902 217 D D > - 0 0 104 -24,-0.4 4,-2.0 -2,-0.2 3,-0.4 -0.727 26.5-146.2 -73.9 123.4 1.1 -4.7 6.0 903 218 D R H > S+ 0 0 59 -2,-0.5 4,-1.7 1,-0.2 -1,-0.1 0.751 97.4 59.1 -68.7 -21.9 1.7 -4.4 9.8 904 219 D N H > S+ 0 0 135 2,-0.2 4,-1.2 3,-0.2 -1,-0.2 0.861 106.3 47.0 -71.0 -38.3 2.3 -0.7 9.3 905 220 D W H 4 S+ 0 0 37 -3,-0.4 3,-0.3 2,-0.2 -2,-0.2 0.964 116.1 42.4 -67.0 -53.5 -1.1 -0.1 7.8 906 221 D V H >< S+ 0 0 2 -4,-2.0 3,-0.9 1,-0.2 4,-0.5 0.814 112.2 54.9 -67.0 -29.4 -3.0 -2.1 10.5 907 222 D A H >< S+ 0 0 49 -4,-1.7 3,-0.6 -5,-0.2 -1,-0.2 0.857 107.4 52.5 -66.1 -34.0 -0.9 -0.6 13.3 908 223 D G T 3< S+ 0 0 62 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.349 86.5 82.8 -87.0 4.8 -1.9 2.8 11.9 909 224 D L T < 0 0 36 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.872 360.0 360.0 -71.7 -38.0 -5.6 2.1 12.1 910 225 D V < 0 0 75 -3,-0.6 -123,-0.2 -4,-0.5 -2,-0.2 0.250 360.0 360.0-113.0 360.0 -5.8 3.0 15.8