==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-MAR-04 1SS9 . COMPND 2 MOLECULE: ALPHA-1,4-GALACTOSYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS; . AUTHOR L.L.LAIRSON,C.P.CHIU,H.D.LY,S.HE,W.W.WAKARCHUK, . 280 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12382.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 5.4 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 . 0 0.0 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 . 26 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 22.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 4 0 1 2 0 2 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 1 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 1 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 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 21 0, 0.0 31,-3.3 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 161.4 -8.8 30.8 21.0 2 2 A D E -a 32 0A 21 96,-0.3 98,-2.2 29,-0.2 2,-0.4 -0.898 360.0-167.0-102.9 116.8 -6.0 33.3 20.3 3 3 A I E -ab 33 100A 0 29,-2.7 31,-2.6 -2,-0.6 2,-0.4 -0.839 3.9-155.5-105.8 139.8 -2.8 31.7 19.0 4 4 A V E +ab 34 101A 0 96,-2.5 98,-2.9 -2,-0.4 2,-0.3 -0.959 13.9 173.9-121.3 131.1 0.5 33.5 18.7 5 5 A F E -a 35 0A 0 29,-1.9 31,-3.1 -2,-0.4 2,-0.4 -0.934 14.9-153.8-128.4 150.7 3.4 32.6 16.4 6 6 A A E +a 36 0A 8 96,-0.5 98,-0.3 -2,-0.3 2,-0.3 -0.997 29.5 142.3-128.9 130.4 6.6 34.5 15.8 7 7 A A E -a 37 0A 2 29,-2.4 31,-2.4 -2,-0.4 33,-0.3 -0.997 35.5-140.4-162.1 162.2 8.6 34.3 12.5 8 8 A D > - 0 0 31 -2,-0.3 3,-1.4 29,-0.2 4,-0.4 -0.656 53.6 -80.3-115.2 176.2 10.7 36.0 9.9 9 9 A D G > S+ 0 0 66 1,-0.3 3,-1.5 -2,-0.2 4,-0.3 0.836 124.3 62.5 -45.7 -41.8 10.6 35.5 6.1 10 10 A N G 3 S+ 0 0 96 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.827 109.3 39.3 -55.5 -37.5 12.7 32.3 6.3 11 11 A Y G <> S+ 0 0 45 -3,-1.4 4,-3.1 1,-0.2 -1,-0.3 0.291 82.6 108.9 -98.7 10.3 10.1 30.4 8.4 12 12 A A H <> S+ 0 0 0 -3,-1.5 4,-1.8 -4,-0.4 -1,-0.2 0.884 80.3 46.3 -55.1 -45.4 7.0 31.7 6.6 13 13 A A H > S+ 0 0 0 -4,-0.3 4,-1.6 -3,-0.3 -1,-0.2 0.855 115.0 48.3 -67.4 -33.7 6.2 28.5 4.8 14 14 A Y H > S+ 0 0 25 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.893 105.1 57.6 -73.5 -39.0 6.7 26.6 8.1 15 15 A L H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.925 105.3 54.0 -53.3 -43.1 4.5 29.1 9.9 16 16 A C H X S+ 0 0 0 -4,-1.8 4,-2.4 -5,-0.2 -1,-0.2 0.936 109.4 45.7 -56.4 -51.2 1.8 28.1 7.4 17 17 A V H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.917 113.8 46.9 -61.0 -47.9 2.1 24.4 8.2 18 18 A A H X S+ 0 0 2 -4,-2.6 4,-1.4 1,-0.2 90,-0.3 0.872 112.6 53.5 -61.8 -36.0 2.1 24.8 12.0 19 19 A A H X S+ 0 0 0 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.927 108.4 47.2 -65.1 -45.8 -0.8 27.2 11.6 20 20 A K H X S+ 0 0 34 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.878 105.6 58.8 -65.6 -37.8 -2.9 24.7 9.6 21 21 A S H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.887 104.0 53.4 -58.9 -38.2 -2.2 21.9 12.1 22 22 A V H < S+ 0 0 0 -4,-1.4 4,-0.4 1,-0.2 3,-0.3 0.918 109.3 47.7 -62.3 -44.4 -3.8 24.0 14.8 23 23 A E H >< S+ 0 0 12 -4,-1.5 3,-1.3 1,-0.2 -2,-0.2 0.902 108.5 54.2 -63.4 -42.2 -6.9 24.5 12.7 24 24 A A H 3< S+ 0 0 59 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.778 107.4 51.5 -63.1 -27.6 -7.1 20.8 11.9 25 25 A A T 3< S+ 0 0 15 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.509 114.6 44.9 -87.1 -5.8 -7.1 20.1 15.7 26 26 A H X + 0 0 3 -3,-1.3 3,-1.1 -4,-0.4 -1,-0.2 -0.475 61.9 162.1-137.3 66.6 -9.9 22.5 16.2 27 27 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.802 85.5 28.8 -54.5 -34.0 -12.6 22.0 13.6 28 28 A D T 3 S+ 0 0 158 2,-0.1 2,-0.5 -5,-0.0 -5,-0.0 0.256 101.5 95.7-114.6 12.4 -15.2 23.8 15.6 29 29 A T S < S- 0 0 43 -3,-1.1 2,-0.8 -6,-0.2 -3,-0.1 -0.887 76.0-121.7-107.6 135.5 -13.1 26.3 17.5 30 30 A E - 0 0 120 -2,-0.5 2,-0.6 1,-0.0 -2,-0.1 -0.614 29.4-160.9 -74.4 107.5 -12.5 29.9 16.3 31 31 A I - 0 0 2 -2,-0.8 2,-0.7 -5,-0.2 -29,-0.2 -0.815 4.3-165.1 -94.7 116.1 -8.7 30.2 16.0 32 32 A R E -a 2 0A 75 -31,-3.3 -29,-2.7 -2,-0.6 2,-0.4 -0.892 10.7-152.1-104.4 112.1 -7.5 33.8 15.9 33 33 A F E -ac 3 59A 6 25,-3.4 27,-2.1 -2,-0.7 2,-0.5 -0.711 14.0-175.6 -88.4 129.3 -3.9 34.0 14.7 34 34 A H E -ac 4 60A 2 -31,-2.6 -29,-1.9 -2,-0.4 2,-0.5 -0.980 12.8-164.5-122.9 112.0 -1.6 36.8 15.8 35 35 A V E -ac 5 61A 0 25,-2.5 27,-4.3 -2,-0.5 2,-1.1 -0.886 17.6-143.7-107.8 126.8 1.8 36.6 14.1 36 36 A L E -ac 6 62A 0 -31,-3.1 -29,-2.4 -2,-0.5 2,-0.7 -0.778 27.8-156.2 -86.4 102.6 4.8 38.5 15.3 37 37 A D E +ac 7 63A 0 25,-3.0 27,-2.3 -2,-1.1 -29,-0.2 -0.747 24.3 176.4 -91.7 115.0 6.3 39.4 11.9 38 38 A A S S- 0 0 13 -31,-2.4 -29,-0.2 -2,-0.7 -30,-0.1 -0.099 82.7 -33.3-105.7 33.5 10.1 40.1 11.8 39 39 A G S S+ 0 0 48 -32,-0.2 2,-0.5 1,-0.2 -30,-0.2 0.678 76.9 162.9 124.5 30.7 10.3 40.6 8.0 40 40 A I - 0 0 10 -33,-0.3 -1,-0.2 -32,-0.1 5,-0.1 -0.667 40.3-120.4 -80.2 126.8 7.9 38.4 6.2 41 41 A S > - 0 0 46 -2,-0.5 4,-2.5 1,-0.1 5,-0.3 -0.195 18.7-113.9 -63.9 158.5 7.4 39.6 2.6 42 42 A E H > S+ 0 0 147 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.813 120.2 53.7 -61.3 -31.8 3.9 40.6 1.4 43 43 A A H > S+ 0 0 60 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.929 110.2 47.6 -69.1 -43.1 4.0 37.7 -0.9 44 44 A N H > S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.862 112.3 46.0 -68.0 -38.0 4.8 35.4 1.9 45 45 A R H X S+ 0 0 66 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.805 111.9 54.4 -75.1 -24.3 2.1 36.7 4.3 46 46 A A H X S+ 0 0 48 -4,-1.5 4,-1.7 -5,-0.3 -2,-0.2 0.904 109.0 46.2 -73.2 -41.2 -0.4 36.5 1.4 47 47 A A H X S+ 0 0 9 -4,-2.1 4,-1.2 2,-0.2 225,-0.2 0.869 111.7 53.5 -68.0 -36.1 0.4 32.9 0.7 48 48 A V H >< S+ 0 0 0 -4,-1.7 3,-1.3 1,-0.2 4,-0.5 0.986 110.9 43.3 -60.9 -59.9 0.2 32.0 4.4 49 49 A A H >< S+ 0 0 16 -4,-2.0 3,-1.2 1,-0.3 -1,-0.2 0.830 108.5 61.8 -55.2 -34.9 -3.3 33.6 4.9 50 50 A A H 3< S+ 0 0 37 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.839 100.3 53.4 -62.5 -32.9 -4.4 32.0 1.7 51 51 A N T << S+ 0 0 1 -3,-1.3 -1,-0.2 -4,-1.2 -2,-0.2 0.510 103.1 70.2 -81.7 -5.0 -3.7 28.4 3.1 52 52 A L S X S- 0 0 15 -3,-1.2 3,-0.9 -4,-0.5 4,-0.1 -0.407 95.6 -66.8-104.8-177.7 -5.9 29.0 6.2 53 53 A R G >>>S+ 0 0 81 1,-0.2 3,-1.5 2,-0.2 4,-1.4 -0.309 114.1 22.5 -68.4 150.6 -9.6 29.3 6.9 54 54 A G G 345S- 0 0 73 1,-0.3 -1,-0.2 2,-0.2 -4,-0.0 0.716 128.4 -73.4 66.4 21.9 -11.6 32.3 5.7 55 55 A G G <45S- 0 0 62 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.804 106.4 -38.5 61.2 26.5 -9.0 32.9 3.0 56 56 A G T X45S+ 0 0 17 -3,-1.5 3,-0.6 -4,-0.1 -2,-0.2 0.796 99.3 143.9 91.2 35.2 -6.9 34.1 5.9 57 57 A G T 3<5 + 0 0 57 -4,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.837 66.4 50.3 -75.3 -33.7 -9.7 35.8 7.8 58 58 A N T 3 - 0 0 77 -2,-0.3 3,-1.8 1,-0.2 4,-0.3 -0.847 14.1-165.5-101.5 111.0 11.7 45.1 14.9 66 66 A P G > S+ 0 0 43 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.825 87.8 69.6 -61.5 -28.6 14.3 42.4 15.0 67 67 A E G > S+ 0 0 133 1,-0.3 3,-1.1 2,-0.2 4,-0.2 0.694 81.7 78.8 -62.1 -15.5 17.0 45.1 15.7 68 68 A D G < S+ 0 0 51 -3,-1.8 -1,-0.3 1,-0.2 3,-0.2 0.788 99.4 37.4 -62.8 -28.1 15.3 45.5 19.1 69 69 A F G X S+ 0 0 1 -3,-1.8 3,-3.1 -4,-0.3 -1,-0.2 0.282 77.1 122.8-109.0 9.8 17.1 42.4 20.4 70 70 A A T < S+ 0 0 68 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.678 73.3 55.2 -45.3 -25.6 20.4 42.9 18.6 71 71 A G T 3 S+ 0 0 55 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.585 85.8 99.7 -88.6 -9.9 22.2 42.8 22.0 72 72 A F S < S- 0 0 22 -3,-3.1 12,-0.1 1,-0.1 -3,-0.0 -0.557 84.5 -97.5 -80.3 139.9 20.8 39.4 23.1 73 73 A P - 0 0 29 0, 0.0 115,-0.2 0, 0.0 3,-0.1 -0.229 31.9-172.5 -57.2 138.3 23.0 36.3 22.7 74 74 A L + 0 0 88 1,-0.1 7,-0.1 113,-0.1 5,-0.1 -0.480 31.1 139.7-130.3 59.4 22.4 34.2 19.6 75 75 A N + 0 0 91 1,-0.1 2,-0.9 2,-0.0 -1,-0.1 0.862 48.9 83.0 -73.7 -37.6 24.6 31.1 20.2 76 76 A I S > S- 0 0 45 1,-0.2 3,-1.7 -3,-0.1 -1,-0.1 -0.611 71.7-152.1 -75.7 107.4 22.3 28.4 19.0 77 77 A R T 3 S+ 0 0 238 -2,-0.9 -1,-0.2 1,-0.3 -2,-0.0 0.809 86.3 54.8 -46.2 -51.3 22.8 28.4 15.2 78 78 A H T 3 S+ 0 0 60 2,-0.0 2,-0.4 0, 0.0 -1,-0.3 0.478 97.8 79.8 -71.5 1.0 19.4 27.2 13.9 79 79 A I < - 0 0 40 -3,-1.7 2,-0.2 -5,-0.1 0, 0.0 -0.905 67.3-153.4-112.2 136.2 17.6 30.0 15.8 80 80 A S > - 0 0 49 -2,-0.4 3,-2.6 1,-0.1 4,-0.2 -0.552 37.7 -93.1-102.6 170.4 17.4 33.6 14.6 81 81 A I G > S+ 0 0 33 1,-0.3 3,-2.1 -2,-0.2 4,-0.2 0.748 114.6 79.8 -52.7 -24.2 16.9 36.9 16.4 82 82 A T G > S+ 0 0 9 1,-0.3 3,-1.7 2,-0.2 4,-0.4 0.731 72.7 79.9 -59.0 -18.7 13.2 36.5 16.0 83 83 A T G < S+ 0 0 16 -3,-2.6 3,-0.4 1,-0.3 -1,-0.3 0.728 88.6 54.7 -61.7 -21.6 13.2 34.1 18.9 84 84 A Y G X S+ 0 0 0 -3,-2.1 3,-1.2 1,-0.2 -1,-0.3 0.438 80.8 89.6 -92.7 -0.4 13.3 37.1 21.4 85 85 A A G X S+ 0 0 0 -3,-1.7 3,-2.3 1,-0.3 -1,-0.2 0.830 73.0 70.2 -65.5 -32.6 10.2 38.8 20.0 86 86 A R G > S+ 0 0 10 -4,-0.4 3,-1.6 -3,-0.4 -1,-0.3 0.749 83.2 74.7 -57.2 -21.8 7.9 36.9 22.4 87 87 A L G < S+ 0 0 0 -3,-1.2 -1,-0.3 1,-0.3 3,-0.3 0.743 95.2 49.6 -63.5 -23.3 9.5 39.0 25.1 88 88 A K G X> S+ 0 0 23 -3,-2.3 4,-1.9 -4,-0.2 3,-1.5 -0.001 71.2 122.3-105.4 28.5 7.4 42.0 23.9 89 89 A L H <> S+ 0 0 0 -3,-1.6 4,-1.7 1,-0.3 3,-0.3 0.932 71.2 57.9 -53.3 -50.5 4.1 40.2 23.9 90 90 A G H 34 S+ 0 0 17 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.677 111.9 42.9 -55.4 -18.9 2.6 42.7 26.3 91 91 A E H <4 S+ 0 0 118 -3,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.753 112.8 49.1 -98.4 -30.4 3.4 45.4 23.8 92 92 A Y H < S+ 0 0 37 -4,-1.9 2,-0.4 -3,-0.3 -2,-0.2 0.639 109.4 50.0 -85.8 -16.1 2.4 43.8 20.5 93 93 A I < + 0 0 5 -4,-1.7 -1,-0.2 -5,-0.2 3,-0.1 -0.969 45.1 155.3-132.7 123.7 -1.1 42.5 21.5 94 94 A A + 0 0 78 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.774 65.6 71.5-109.1 -40.6 -3.9 44.5 23.1 95 95 A D S S+ 0 0 82 2,-0.1 2,-0.3 0, 0.0 -1,-0.1 0.179 93.7 66.4 -68.1 20.3 -7.1 42.8 22.2 96 96 A C - 0 0 7 -2,-0.3 3,-0.1 1,-0.1 -3,-0.1 -1.000 49.1-169.5-144.5 144.0 -6.4 39.8 24.5 97 97 A D S S+ 0 0 82 -2,-0.3 65,-1.3 1,-0.3 2,-0.3 0.484 91.9 24.8-101.3 -8.6 -6.1 39.1 28.2 98 98 A K + 0 0 61 62,-0.2 -1,-0.3 63,-0.2 2,-0.3 -0.951 65.1 171.8-158.6 134.0 -4.7 35.7 27.3 99 99 A V E - D 0 159A 0 60,-1.5 60,-2.5 -2,-0.3 2,-0.6 -0.929 28.7-128.2-138.2 160.6 -2.9 34.1 24.3 100 100 A L E -bD 3 158A 0 -98,-2.2 -96,-2.5 -2,-0.3 2,-0.4 -0.933 23.9-151.3-116.1 106.8 -1.2 30.8 23.6 101 101 A Y E -bD 4 157A 4 56,-3.3 56,-3.1 -2,-0.6 2,-0.4 -0.639 15.0-173.7 -81.2 131.5 2.3 31.2 22.2 102 102 A L E - D 0 156A 0 -98,-2.9 -96,-0.5 -2,-0.4 54,-0.2 -0.971 23.0-125.4-127.1 138.6 3.6 28.4 19.9 103 103 A D > - 0 0 26 52,-2.4 3,-0.9 -2,-0.4 -96,-0.1 -0.460 27.8-119.4 -74.6 153.0 7.0 27.9 18.4 104 104 A I T 3 S+ 0 0 10 -98,-0.3 2,-0.7 1,-0.3 -86,-0.1 0.890 108.8 65.1 -61.3 -37.7 7.0 27.5 14.6 105 105 A D T 3 S+ 0 0 11 2,-0.0 139,-2.2 -87,-0.0 -1,-0.3 -0.025 82.4 108.0 -78.0 33.2 8.5 24.0 14.8 106 106 A V E < -G 243 0B 4 -3,-0.9 2,-0.4 -2,-0.7 137,-0.2 -0.720 53.2-155.8-108.8 162.2 5.4 22.5 16.6 107 107 A L E -G 242 0B 1 135,-2.4 135,-2.7 -2,-0.3 2,-0.7 -0.890 13.2-148.3-140.9 101.9 2.8 20.1 15.3 108 108 A V E +G 241 0B 0 -2,-0.4 133,-0.3 -90,-0.3 -83,-0.1 -0.637 23.2 169.7 -75.7 109.8 -0.5 20.3 17.1 109 109 A R + 0 0 84 131,-1.8 2,-0.3 -2,-0.7 132,-0.2 0.660 59.3 25.3 -96.8 -17.4 -2.1 16.9 17.0 110 110 A D S S- 0 0 61 130,-1.8 -1,-0.1 1,-0.1 -85,-0.1 -0.978 97.5 -61.3-148.0 158.7 -5.0 17.3 19.5 111 111 A S - 0 0 31 -2,-0.3 -85,-0.1 1,-0.1 -1,-0.1 0.092 34.0-162.4 -35.5 143.3 -7.4 19.9 21.0 112 112 A L >> + 0 0 0 -90,-0.1 4,-2.8 -87,-0.1 3,-0.6 0.388 65.9 98.1-112.3 -2.1 -5.6 22.6 23.0 113 113 A T H 3> S+ 0 0 40 1,-0.2 4,-4.0 2,-0.2 5,-0.1 0.793 75.9 58.5 -60.8 -32.6 -8.6 23.8 24.9 114 114 A P H 34 S+ 0 0 69 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.898 114.9 38.9 -65.2 -33.8 -7.9 21.8 28.0 115 115 A L H X4 S+ 0 0 6 -3,-0.6 3,-1.2 2,-0.2 -2,-0.2 0.882 117.3 50.6 -76.2 -43.6 -4.6 23.7 28.2 116 116 A W H 3< S+ 0 0 48 -4,-2.8 -3,-0.2 1,-0.3 -1,-0.1 0.941 103.4 58.6 -59.3 -50.4 -6.2 26.9 27.1 117 117 A D T 3< S+ 0 0 112 -4,-4.0 -1,-0.3 -5,-0.1 -2,-0.2 0.491 80.0 125.6 -62.8 0.7 -8.9 26.6 29.7 118 118 A T < - 0 0 45 -3,-1.2 2,-0.8 -5,-0.1 -3,-0.1 -0.349 61.6-134.5 -63.3 140.8 -6.3 26.6 32.4 119 119 A D - 0 0 136 1,-0.1 3,-0.1 -2,-0.0 -1,-0.1 -0.879 17.2-170.8 -99.1 106.6 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34,-3.6 -3,-0.5 -3,-0.1 -0.610 14.8 173.3 -76.1 108.8 6.0 16.6 23.5 210 210 A M > - 0 0 7 -2,-0.8 4,-2.9 32,-0.2 5,-0.2 -0.568 48.1 -93.7-110.9 174.8 9.7 16.9 22.7 211 211 A P H > S+ 0 0 61 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.923 126.0 50.1 -52.5 -47.2 12.5 14.4 21.8 212 212 A T H > S+ 0 0 29 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.866 110.2 50.1 -60.4 -37.9 13.6 14.2 25.4 213 213 A N H > S+ 0 0 6 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.947 112.8 48.0 -65.2 -45.8 10.0 13.5 26.5 214 214 A Y H >X S+ 0 0 125 -4,-2.9 3,-2.5 1,-0.2 4,-0.5 0.976 107.7 53.4 -55.6 -61.4 9.7 10.8 23.8 215 215 A A H >< S+ 0 0 57 -4,-3.4 3,-1.4 1,-0.3 -1,-0.2 0.820 104.4 57.8 -43.7 -38.7 13.0 9.2 24.8 216 216 A F H >< S+ 0 0 56 -4,-1.6 3,-1.1 1,-0.3 -1,-0.3 0.791 85.5 76.0 -66.8 -27.2 11.7 9.0 28.3 217 217 A M H << S+ 0 0 110 -3,-2.5 2,-0.3 -4,-0.9 -1,-0.3 0.777 90.7 62.0 -53.5 -23.8 8.7 7.0 27.1 218 218 A A T << 0 0 85 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.1 -0.286 360.0 360.0 -97.3 46.0 11.3 4.2 27.0 219 219 A N < 0 0 160 -3,-1.1 -3,-0.0 -2,-0.3 -2,-0.0 -0.260 360.0 360.0 -62.6 360.0 12.0 4.4 30.7 220 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 221 222 A A 0 0 94 0, 0.0 -5,-0.0 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 70.5 14.3 8.1 35.4 222 223 A S - 0 0 39 1,-0.1 8,-0.1 11,-0.1 7,-0.0 0.852 360.0-132.3 35.2 113.6 12.5 11.3 36.7 223 224 A R S S+ 0 0 82 6,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.598 88.0 30.3 -64.2 -10.2 14.8 14.0 37.9 224 225 A H - 0 0 22 2,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.922 59.5-144.1-145.6 169.4 12.7 14.3 41.0 225 226 A T + 0 0 126 -2,-0.3 -1,-0.1 4,-0.0 -2,-0.0 0.553 61.7 124.5-107.4 -18.9 10.4 12.4 43.4 226 227 A D > - 0 0 53 1,-0.2 4,-2.1 2,-0.1 5,-0.3 -0.184 63.1-137.8 -44.6 122.0 8.1 15.4 43.9 227 228 A P H > S+ 0 0 100 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.847 100.4 55.6 -56.2 -34.9 4.6 14.1 43.0 228 229 A L H > S+ 0 0 66 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.949 108.1 46.8 -64.1 -48.7 3.8 17.3 41.0 229 230 A Y H > S+ 0 0 3 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.945 114.0 47.4 -57.0 -53.0 6.8 17.0 38.8 230 231 A R H < S+ 0 0 138 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.868 111.6 52.1 -57.6 -37.9 6.2 13.3 38.0 231 232 A D H < S+ 0 0 92 -4,-2.1 -1,-0.2 -5,-0.3 3,-0.2 0.908 116.0 40.1 -65.6 -41.2 2.6 14.1 37.4 232 233 A R H < S+ 0 0 63 -4,-2.5 -27,-2.3 1,-0.2 -2,-0.2 0.907 113.8 49.6 -75.5 -44.9 3.5 16.9 34.9 233 234 A T S < S+ 0 0 26 -4,-3.4 2,-0.9 -29,-0.2 -1,-0.2 0.475 91.4 93.1 -75.3 -1.9 6.4 15.2 33.1 234 235 A N S S- 0 0 104 -4,-0.5 2,-0.2 -5,-0.3 -28,-0.2 -0.837 80.8-136.0 -94.2 106.5 4.2 12.2 32.7 235 236 A T - 0 0 19 -2,-0.9 2,-0.9 -30,-0.2 4,-0.1 -0.461 8.2-145.7 -65.4 125.7 2.6 12.6 29.3 236 237 A V - 0 0 80 -2,-0.2 -1,-0.1 -4,-0.1 -32,-0.0 -0.851 43.9 -90.7 -94.1 105.1 -1.1 11.8 29.4 237 238 A M S S+ 0 0 102 -2,-0.9 2,-0.1 2,-0.1 -31,-0.1 -0.154 98.9 59.6 -54.4 150.9 -1.8 10.3 26.0 238 239 A P S S- 0 0 74 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.578 83.2-123.5 -85.4 159.3 -2.6 11.2 23.4 239 240 A V - 0 0 7 1,-0.2 3,-0.1 -2,-0.1 -32,-0.1 -0.443 26.8-176.2 -62.2 129.1 0.1 13.7 22.5 240 241 A A S S+ 0 0 0 -34,-1.8 -131,-1.8 1,-0.3 -130,-1.8 0.737 70.0 28.8 -98.3 -31.3 -1.5 17.1 21.8 241 242 A V E -G 108 0B 0 -35,-2.3 -32,-3.6 -133,-0.3 2,-0.5 -0.956 62.5-160.7-138.5 119.5 1.6 19.0 20.7 242 243 A S E -Gh 107 209B 1 -135,-2.7 -135,-2.4 -2,-0.4 2,-0.6 -0.844 12.0-166.1 -94.1 125.0 4.7 17.7 19.1 243 244 A H E -G 106 0B 4 -34,-3.6 2,-2.3 -2,-0.5 -137,-0.2 -0.917 12.5-155.0-117.9 108.0 7.6 20.1 19.6 244 245 A Y - 0 0 9 -139,-2.2 -34,-0.1 -2,-0.6 -138,-0.1 -0.227 27.7-178.3 -78.6 52.2 10.6 19.4 17.3 245 246 A C + 0 0 46 -2,-2.3 3,-0.3 2,-0.1 -2,-0.0 -0.029 41.8 27.8 -46.4 148.0 13.0 21.1 19.7 246 247 A G S S- 0 0 22 1,-0.2 -2,-0.0 -35,-0.0 0, 0.0 -0.242 110.9 -44.2 90.3-177.9 16.6 21.2 18.6 247 248 A P S S+ 0 0 100 0, 0.0 2,-0.7 0, 0.0 -1,-0.2 0.707 110.7 82.8 -63.2 -24.9 18.5 21.2 15.2 248 249 A A - 0 0 55 -3,-0.3 6,-0.0 4,-0.1 7,-0.0 -0.767 60.7-177.3 -92.1 112.4 16.4 18.4 13.6 249 250 A K > - 0 0 7 -2,-0.7 3,-2.6 1,-0.1 8,-0.1 -0.784 38.4-118.3-109.5 151.1 13.1 19.7 12.2 250 251 A P T 3 S+ 0 0 10 0, 0.0 5,-0.2 0, 0.0 14,-0.1 0.639 116.5 56.7 -59.5 -14.0 10.2 17.7 10.5 251 252 A W T 3 S+ 0 0 28 2,-0.1 2,-0.0 12,-0.1 -3,-0.0 0.460 93.5 92.7 -96.3 -2.5 10.9 19.7 7.3 252 253 A H S X S- 0 0 92 -3,-2.6 3,-0.5 1,-0.1 2,-0.3 -0.235 87.1 -90.2 -82.4 176.5 14.5 18.6 7.3 253 254 A R T 3 S+ 0 0 213 1,-0.2 -1,-0.1 -2,-0.0 -4,-0.1 -0.694 105.4 10.9 -89.9 138.5 16.1 15.7 5.4 254 255 A D T 3 S+ 0 0 142 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.936 79.5 178.8 63.5 46.5 16.3 12.4 7.3 255 256 A C < + 0 0 37 -3,-0.5 -1,-0.2 -5,-0.2 5,-0.0 -0.749 13.8 175.8 -85.1 122.6 14.1 13.4 10.1 256 257 A T + 0 0 141 -2,-0.6 -1,-0.2 2,-0.0 3,-0.1 0.432 36.4 126.2-102.5 -4.8 13.7 10.5 12.5 257 258 A A S > S- 0 0 25 1,-0.1 3,-1.6 2,-0.1 -13,-0.1 -0.290 71.7 -93.1 -58.9 136.9 11.7 12.5 15.1 258 259 A W T 3 S+ 0 0 85 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 -0.086 104.0 7.8 -49.7 146.0 8.4 10.9 16.1 259 260 A G T > S+ 0 0 4 1,-0.1 3,-1.4 -3,-0.1 4,-0.3 0.536 81.8 136.7 57.8 10.7 5.2 11.9 14.2 260 261 A A T X> + 0 0 10 -3,-1.6 3,-0.8 1,-0.3 4,-0.6 0.616 56.2 73.9 -63.8 -12.7 7.3 13.9 11.7 261 262 A E H 3> S+ 0 0 130 1,-0.2 4,-2.5 2,-0.2 3,-0.4 0.810 79.9 70.6 -70.7 -30.8 5.1 12.6 8.8 262 263 A R H <> S+ 0 0 42 -3,-1.4 4,-1.8 1,-0.2 -1,-0.2 0.768 89.8 64.4 -57.6 -25.1 2.1 14.8 9.7 263 264 A F H <> S+ 0 0 8 -3,-0.8 4,-2.2 -4,-0.3 3,-0.3 0.969 108.1 37.9 -61.5 -53.4 4.2 17.7 8.5 264 265 A T H X S+ 0 0 88 -4,-0.6 4,-3.8 -3,-0.4 5,-0.2 0.912 111.4 59.7 -63.4 -44.2 4.2 16.4 5.0 265 266 A E H < S+ 0 0 124 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.858 114.8 37.0 -51.7 -37.5 0.6 15.2 5.3 266 267 A L H >< S+ 0 0 11 -4,-1.8 3,-0.6 -3,-0.3 4,-0.3 0.759 113.9 55.6 -86.3 -30.3 -0.3 18.8 6.0 267 268 A A H >< S+ 0 0 19 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.928 107.8 49.5 -67.5 -44.6 2.2 20.2 3.5 268 269 A G T 3< S+ 0 0 78 -4,-3.8 -1,-0.2 1,-0.2 -2,-0.2 0.469 107.6 57.3 -74.3 0.5 0.7 18.1 0.8 269 270 A S T < S+ 0 0 60 -3,-0.6 -1,-0.2 -5,-0.2 -2,-0.2 0.421 77.8 125.7-108.8 -2.1 -2.8 19.4 1.8 270 271 A L < - 0 0 23 -3,-1.4 3,-0.2 -4,-0.3 -219,-0.1 -0.171 55.4-144.2 -57.7 150.6 -2.1 23.1 1.4 271 272 A T S S+ 0 0 105 1,-0.3 2,-0.5 -220,-0.1 -1,-0.1 0.930 86.1 25.3 -79.7 -50.8 -4.4 25.2 -0.8 272 273 A T + 0 0 59 -225,-0.2 -1,-0.3 -224,-0.1 -221,-0.1 -0.966 61.9 179.0-124.6 121.3 -1.7 27.5 -2.2 273 274 A V - 0 0 38 -2,-0.5 5,-0.1 -3,-0.2 2,-0.0 -0.939 21.8-142.0-124.5 107.5 2.0 26.7 -2.5 274 275 A P >> - 0 0 39 0, 0.0 3,-2.9 0, 0.0 4,-0.9 -0.337 25.8-113.3 -64.4 144.8 4.3 29.4 -4.1 275 276 A E G >4 S+ 0 0 140 1,-0.3 3,-1.4 2,-0.2 4,-0.5 0.892 117.9 58.4 -46.3 -46.0 7.1 28.2 -6.3 276 277 A E G 34 S+ 0 0 161 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.561 102.1 55.2 -63.6 -8.9 9.6 29.5 -3.8 277 278 A W G <> S+ 0 0 2 -3,-2.9 4,-1.7 2,-0.1 -1,-0.3 0.671 81.0 89.6 -95.4 -21.2 8.1 27.2 -1.2 278 279 A R T << S+ 0 0 142 -3,-1.4 3,-0.2 -4,-0.9 -2,-0.2 0.865 91.7 44.6 -42.3 -48.8 8.5 24.0 -3.3 279 280 A G T 4 S+ 0 0 67 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.997 106.7 54.2 -59.7 -72.6 11.9 23.4 -1.8 280 281 A K T 4 0 0 67 -4,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.707 360.0 360.0 -32.8 -31.7 11.3 24.1 1.9 281 282 A L < 0 0 65 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.1 -0.407 360.0 360.0-111.6 360.0 8.5 21.5 1.6