==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-NOV-11 3USR . COMPND 2 MOLECULE: GLYCOGENIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR F.M.ISSOGLIO,M.E.CARRIZO,J.M.ROMERO,J.A.CURTINO . 259 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11775.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 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 . 15 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 1 0 2 2 1 0 1 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 0 A M > 0 0 110 0, 0.0 3,-0.9 0, 0.0 33,-0.7 0.000 360.0 360.0 360.0 94.7 21.0 -33.1 62.0 2 1 A T T 3 + 0 0 109 1,-0.2 31,-0.0 31,-0.1 92,-0.0 0.675 360.0 56.2 -78.0 -23.3 20.2 -29.5 62.9 3 2 A D T 3 S+ 0 0 53 92,-0.1 93,-3.2 93,-0.0 94,-1.2 0.259 99.3 73.1 -96.8 12.5 16.5 -29.4 62.2 4 3 A Q E < +a 97 0A 16 -3,-0.9 30,-2.9 91,-0.2 2,-0.3 -0.984 61.2 169.2-125.5 141.2 15.8 -32.3 64.5 5 4 A A E -ab 98 34A 0 92,-1.4 94,-1.9 -2,-0.4 2,-0.5 -0.977 38.6-124.6-145.4 152.5 15.9 -32.2 68.3 6 5 A F E -ab 99 35A 3 28,-2.7 30,-3.4 -2,-0.3 2,-0.4 -0.868 39.4-162.1 -88.3 139.0 15.1 -34.0 71.5 7 6 A V E +ab 100 36A 1 92,-2.8 94,-3.0 -2,-0.5 2,-0.2 -0.986 15.0 170.3-128.5 133.6 12.9 -31.7 73.4 8 7 A T E - b 0 37A 1 28,-2.0 30,-3.1 -2,-0.4 2,-0.4 -0.730 19.8-133.7-130.5-175.2 12.1 -31.8 77.1 9 8 A L E - b 0 38A 15 92,-0.4 94,-0.6 28,-0.2 2,-0.4 -0.999 13.9-176.3-145.3 135.3 10.5 -29.6 79.6 10 9 A T E + b 0 39A 1 28,-2.7 30,-0.9 -2,-0.4 33,-0.2 -0.979 9.3 174.8-133.2 128.1 11.2 -28.3 83.1 11 10 A T S S+ 0 0 33 -2,-0.4 2,-0.3 28,-0.2 31,-0.2 0.527 73.6 17.6 -99.8 -12.4 8.8 -26.1 85.1 12 11 A N S > S- 0 0 60 31,-0.1 4,-1.2 1,-0.1 31,-0.2 -0.852 85.2 -93.9-148.7-174.3 10.9 -26.2 88.3 13 12 A D H > S+ 0 0 58 29,-0.3 4,-1.2 -2,-0.3 5,-0.1 0.825 116.9 56.3 -79.9 -33.4 14.3 -26.8 89.7 14 13 A A H > S+ 0 0 33 1,-0.2 4,-1.1 2,-0.2 3,-0.5 0.934 111.7 42.5 -64.2 -46.5 13.7 -30.4 90.7 15 14 A Y H > S+ 0 0 73 1,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.767 104.2 66.8 -72.1 -23.3 12.7 -31.4 87.1 16 15 A A H X S+ 0 0 0 -4,-1.2 4,-3.0 2,-0.2 -1,-0.2 0.874 98.0 54.2 -61.9 -34.6 15.6 -29.3 85.8 17 16 A K H X S+ 0 0 65 -4,-1.2 4,-2.5 -3,-0.5 -1,-0.2 0.937 110.3 45.4 -62.7 -46.9 17.8 -31.9 87.5 18 17 A G H X S+ 0 0 0 -4,-1.1 4,-3.4 2,-0.2 -2,-0.2 0.949 113.4 49.5 -57.3 -50.8 15.9 -34.6 85.5 19 18 A A H X S+ 0 0 0 -4,-3.4 4,-2.9 1,-0.2 -2,-0.2 0.887 111.3 50.0 -57.8 -40.3 16.2 -32.5 82.3 20 19 A L H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.896 113.0 45.5 -66.0 -40.6 19.9 -32.1 83.0 21 20 A V H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.940 114.2 49.3 -67.6 -44.4 20.4 -35.8 83.5 22 21 A L H X S+ 0 0 2 -4,-3.4 4,-2.4 81,-0.3 85,-0.2 0.949 112.5 46.7 -56.4 -53.2 18.3 -36.6 80.4 23 22 A G H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.906 113.8 48.8 -57.5 -43.9 20.2 -34.1 78.3 24 23 A S H X S+ 0 0 16 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.909 109.4 52.7 -62.0 -41.6 23.5 -35.5 79.6 25 24 A S H X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.888 108.7 50.1 -64.4 -37.9 22.3 -39.1 78.9 26 25 A L H <>S+ 0 0 5 -4,-2.4 5,-1.7 2,-0.2 -1,-0.2 0.904 113.2 45.5 -65.5 -42.1 21.5 -38.1 75.3 27 26 A K H ><5S+ 0 0 100 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.894 109.2 57.0 -63.9 -42.6 24.9 -36.6 74.8 28 27 A Q H 3<5S+ 0 0 99 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.858 107.3 47.3 -57.6 -38.3 26.5 -39.6 76.5 29 28 A H T 3<5S- 0 0 51 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.115 119.0-114.5 -97.9 21.8 24.9 -41.9 73.9 30 29 A R T < 5 - 0 0 208 -3,-1.8 -3,-0.2 1,-0.2 2,-0.1 0.849 37.9-168.5 57.8 52.2 26.1 -39.6 71.1 31 30 A T < - 0 0 24 -5,-1.7 -1,-0.2 1,-0.1 4,-0.0 -0.476 16.6-153.7 -63.4 141.2 22.9 -38.2 69.6 32 31 A S S S+ 0 0 64 -2,-0.1 2,-0.2 2,-0.1 -1,-0.1 0.276 70.1 90.3 -94.3 6.6 23.5 -36.4 66.4 33 32 A R S S- 0 0 54 1,-0.1 -28,-0.2 -30,-0.1 -31,-0.1 -0.523 84.5 -96.3-101.6 168.2 20.4 -34.3 67.0 34 33 A R E -b 5 0A 98 -30,-2.9 -28,-2.7 -33,-0.7 2,-0.5 -0.410 29.6-137.3 -77.9 157.8 19.9 -31.0 68.8 35 34 A L E +b 6 0A 3 -30,-0.2 22,-2.0 -2,-0.1 21,-1.4 -0.985 24.6 179.3-118.7 122.2 18.8 -30.9 72.4 36 35 A A E -bc 7 57A 0 -30,-3.4 -28,-2.0 -2,-0.5 2,-0.4 -0.957 9.0-165.1-124.7 140.9 16.1 -28.4 73.3 37 36 A V E -bc 8 58A 0 20,-2.7 22,-3.2 -2,-0.4 2,-0.4 -0.994 13.7-144.0-126.6 129.5 14.5 -27.7 76.7 38 37 A L E -bc 9 59A 0 -30,-3.1 -28,-2.7 -2,-0.4 2,-0.3 -0.754 29.3-177.1 -80.8 133.9 11.4 -25.8 77.4 39 38 A T E -bc 10 60A 0 20,-3.7 22,-3.9 -2,-0.4 -28,-0.2 -0.932 18.0-143.5-131.5 157.2 11.8 -23.9 80.7 40 39 A T > - 0 0 6 -30,-0.9 3,-1.8 -2,-0.3 22,-0.2 -0.736 34.2-107.0-110.3 164.5 9.5 -21.7 82.7 41 40 A P T 3 S+ 0 0 54 0, 0.0 21,-0.1 0, 0.0 4,-0.1 0.682 115.5 73.5 -63.3 -15.9 10.5 -18.6 84.7 42 41 A Q T 3 S+ 0 0 105 -31,-0.2 2,-0.5 2,-0.1 -29,-0.3 0.619 75.4 94.2 -74.3 -11.5 10.1 -20.7 87.9 43 42 A V S < S- 0 0 1 -3,-1.8 -31,-0.1 -31,-0.2 -4,-0.0 -0.725 85.9-121.1 -78.2 125.9 13.3 -22.4 86.9 44 43 A S > - 0 0 34 -2,-0.5 4,-2.6 1,-0.1 3,-0.2 -0.199 18.3-108.9 -70.4 161.6 16.1 -20.6 88.8 45 44 A D H > S+ 0 0 113 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.827 116.5 53.2 -62.7 -35.6 19.0 -18.9 87.0 46 45 A T H > S+ 0 0 73 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.893 112.2 44.8 -68.3 -38.6 21.6 -21.5 88.1 47 46 A M H > S+ 0 0 18 -3,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.918 113.7 51.5 -66.5 -42.7 19.5 -24.4 86.7 48 47 A R H X S+ 0 0 35 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.908 109.5 49.4 -59.0 -43.9 18.8 -22.3 83.6 49 48 A K H X S+ 0 0 108 -4,-2.7 4,-0.8 2,-0.2 -1,-0.2 0.861 112.0 47.7 -66.5 -38.2 22.6 -21.7 83.2 50 49 A A H >X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 3,-0.8 0.912 110.9 52.1 -64.8 -43.4 23.3 -25.4 83.6 51 50 A L H 3X S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.2 -2,-0.2 0.859 103.3 58.3 -60.5 -36.3 20.5 -26.1 81.1 52 51 A E H 3< S+ 0 0 113 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.746 109.8 44.8 -65.8 -25.3 22.2 -23.7 78.6 53 52 A I H << S+ 0 0 81 -4,-0.8 -2,-0.2 -3,-0.8 -1,-0.2 0.898 119.1 39.2 -82.2 -46.0 25.3 -25.8 78.8 54 53 A V H < S+ 0 0 6 -4,-2.3 2,-0.3 -5,-0.1 -2,-0.2 0.928 115.3 55.7 -70.3 -44.9 23.6 -29.2 78.5 55 54 A F < - 0 0 7 -4,-3.1 -19,-0.2 -5,-0.2 3,-0.1 -0.670 69.4-143.7 -97.4 144.3 21.0 -28.1 75.9 56 55 A D S S+ 0 0 66 -21,-1.4 2,-0.4 -2,-0.3 -20,-0.2 0.785 93.8 26.8 -69.5 -29.1 21.6 -26.5 72.5 57 56 A E E -c 36 0A 68 -22,-2.0 -20,-2.7 -6,-0.1 2,-0.5 -0.990 61.6-168.1-141.2 129.2 18.5 -24.5 73.0 58 57 A V E -c 37 0A 30 -2,-0.4 2,-0.5 -22,-0.2 -20,-0.2 -0.977 15.0-167.0-113.1 117.6 16.7 -23.3 76.2 59 58 A I E -c 38 0A 33 -22,-3.2 -20,-3.7 -2,-0.5 2,-0.5 -0.915 11.3-143.3-110.1 126.6 13.3 -21.9 75.4 60 59 A T E -c 39 0A 78 -2,-0.5 2,-0.4 -22,-0.2 -20,-0.2 -0.776 17.2-173.7 -92.4 128.0 11.5 -20.0 78.0 61 60 A V - 0 0 6 -22,-3.9 2,-0.4 -2,-0.5 3,-0.1 -0.989 8.0-179.0-120.6 129.6 7.7 -20.5 78.2 62 61 A D > + 0 0 49 -2,-0.4 3,-1.6 -22,-0.2 6,-0.3 -0.734 9.5 170.3-129.6 85.1 5.6 -18.4 80.5 63 62 A I T 3 S+ 0 0 12 -2,-0.4 11,-0.2 1,-0.3 -1,-0.1 0.663 77.6 68.9 -69.9 -14.8 2.0 -19.4 80.2 64 63 A L T 3 S+ 0 0 101 -3,-0.1 2,-0.4 10,-0.1 -1,-0.3 0.654 84.5 90.5 -73.5 -18.4 1.2 -17.2 83.3 65 64 A D S X S- 0 0 85 -3,-1.6 3,-2.1 1,-0.1 6,-0.2 -0.697 80.7-136.4 -81.5 130.8 2.0 -14.3 81.0 66 65 A S T 3 S+ 0 0 102 -2,-0.4 6,-0.2 1,-0.3 -1,-0.1 0.698 102.3 67.8 -49.3 -30.5 -1.0 -12.8 79.1 67 66 A G T 3 S+ 0 0 70 -5,-0.1 2,-0.4 4,-0.1 -1,-0.3 0.595 79.8 99.8 -71.3 -11.9 1.2 -12.7 76.0 68 67 A D S X S- 0 0 29 -3,-2.1 3,-1.6 -6,-0.3 4,-0.5 -0.627 73.3-139.4 -81.8 132.9 1.3 -16.5 75.8 69 68 A S T 3 S+ 0 0 71 -2,-0.4 4,-0.3 1,-0.3 3,-0.3 0.765 105.6 50.2 -57.1 -28.7 -1.1 -18.1 73.4 70 69 A A T 3> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.562 86.4 91.9 -86.1 -8.0 -1.9 -20.8 76.0 71 70 A H H <> S+ 0 0 21 -3,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.880 82.5 49.5 -59.8 -45.9 -2.6 -18.3 78.7 72 71 A L H > S+ 0 0 139 -4,-0.5 4,-2.0 -3,-0.3 -1,-0.2 0.884 111.3 51.1 -59.9 -39.3 -6.4 -18.0 78.1 73 72 A T H > S+ 0 0 12 -4,-0.3 4,-3.1 -3,-0.2 -1,-0.2 0.871 106.0 56.4 -65.5 -36.9 -6.7 -21.7 78.2 74 73 A L H < S+ 0 0 11 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.936 106.0 49.4 -58.3 -47.8 -4.7 -21.8 81.4 75 74 A M H < S+ 0 0 103 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.916 115.0 45.4 -58.6 -43.1 -7.3 -19.4 83.0 76 75 A K H < S+ 0 0 108 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.907 132.4 19.4 -63.6 -44.1 -10.1 -21.7 81.8 77 76 A R >< + 0 0 57 -4,-3.1 3,-1.7 -5,-0.1 -1,-0.3 -0.712 67.9 172.0-133.8 80.7 -8.2 -24.9 82.9 78 77 A P G > S+ 0 0 87 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.724 76.7 64.6 -68.7 -23.4 -5.6 -24.0 85.5 79 78 A E G 3 S+ 0 0 111 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.658 92.6 65.7 -69.9 -18.3 -4.9 -27.7 86.3 80 79 A L G <> + 0 0 0 -3,-1.7 4,-3.3 -6,-0.2 5,-0.3 0.250 65.6 115.0 -89.2 12.5 -3.6 -28.0 82.7 81 80 A G H <> S+ 0 0 15 -3,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.901 79.1 42.7 -46.6 -53.9 -0.6 -25.6 83.3 82 81 A V H > S+ 0 0 79 -3,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.916 115.5 50.5 -62.8 -44.1 2.0 -28.3 82.8 83 82 A T H > S+ 0 0 2 -4,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.932 110.8 48.4 -55.5 -50.2 0.2 -29.7 79.8 84 83 A L H X S+ 0 0 0 -4,-3.3 4,-0.5 1,-0.2 -1,-0.2 0.847 112.4 48.6 -67.0 -35.2 -0.1 -26.2 78.2 85 84 A T H >< S+ 0 0 5 -4,-2.2 3,-1.3 -5,-0.3 -1,-0.2 0.935 111.8 49.3 -66.0 -46.3 3.5 -25.5 78.8 86 85 A K H >< S+ 0 0 2 -4,-2.8 3,-2.7 1,-0.3 -2,-0.2 0.904 100.2 65.4 -61.2 -43.2 4.5 -28.9 77.3 87 86 A L H >< S+ 0 0 1 -4,-2.9 3,-2.1 1,-0.3 -1,-0.3 0.715 82.3 77.9 -50.3 -26.3 2.3 -28.3 74.2 88 87 A H G X< S+ 0 0 14 -3,-1.3 3,-1.7 -4,-0.5 -1,-0.3 0.585 70.8 84.0 -62.1 -10.1 4.7 -25.4 73.4 89 88 A C G X S+ 0 0 0 -3,-2.7 3,-1.2 1,-0.3 -1,-0.3 0.851 84.6 58.6 -59.5 -30.5 7.0 -28.2 72.1 90 89 A W G < S+ 0 0 0 -3,-2.1 52,-1.9 1,-0.2 56,-0.3 0.613 93.4 66.4 -71.3 -13.2 4.9 -27.9 69.0 91 90 A S G < S+ 0 0 41 -3,-1.7 2,-2.2 50,-0.2 -1,-0.2 0.533 72.2 97.0 -82.6 -8.2 5.9 -24.3 68.7 92 91 A L X + 0 0 6 -3,-1.2 3,-2.6 -4,-0.3 -1,-0.2 -0.302 41.4 155.5 -83.3 57.9 9.5 -25.3 68.0 93 92 A T T 3 + 0 0 81 -2,-2.2 -1,-0.2 1,-0.3 -2,-0.1 0.497 56.2 83.6 -69.4 -4.6 9.1 -25.0 64.3 94 93 A Q T 3 S+ 0 0 84 -3,-0.2 2,-0.4 2,-0.0 -1,-0.3 0.687 91.3 65.4 -65.8 -17.6 12.9 -24.4 63.9 95 94 A Y < - 0 0 9 -3,-2.6 -91,-0.2 1,-0.1 3,-0.1 -0.894 69.6-158.9-107.3 140.9 12.8 -28.2 64.0 96 95 A S S S+ 0 0 46 -93,-3.2 2,-0.3 -2,-0.4 -92,-0.2 0.733 83.5 6.4 -83.4 -25.5 11.2 -30.4 61.4 97 96 A K E -a 4 0A 28 -94,-1.2 -92,-1.4 43,-0.2 2,-0.3 -0.975 69.3-176.0-159.5 141.4 10.8 -33.3 63.8 98 97 A C E -aD 5 139A 0 41,-2.7 41,-2.8 -2,-0.3 2,-0.6 -0.945 25.1-137.9-139.0 157.2 11.4 -33.9 67.5 99 98 A V E -aD 6 138A 0 -94,-1.9 -92,-2.8 -2,-0.3 2,-0.4 -0.989 26.3-151.5-107.6 114.7 11.3 -36.5 70.1 100 99 A F E -aD 7 137A 0 37,-3.2 37,-2.2 -2,-0.6 2,-0.4 -0.758 16.6-177.4 -81.2 134.9 9.7 -35.1 73.1 101 100 A M E - D 0 136A 1 -94,-3.0 -92,-0.4 -2,-0.4 35,-0.2 -0.987 26.5-120.9-133.2 126.9 10.9 -36.7 76.3 102 101 A D > - 0 0 25 33,-2.8 3,-1.5 -2,-0.4 -92,-0.1 -0.277 29.6-113.3 -59.3 152.1 9.7 -35.8 79.8 103 102 A A T 3 S+ 0 0 4 -94,-0.6 -81,-0.3 1,-0.3 -82,-0.2 0.644 114.4 64.8 -65.4 -13.8 12.3 -34.6 82.2 104 103 A D T 3 S+ 0 0 10 -83,-0.1 109,-3.1 -86,-0.1 -1,-0.3 0.060 85.2 95.5 -98.1 26.0 11.9 -37.7 84.3 105 104 A T E < -G 212 0B 0 -3,-1.5 2,-0.4 107,-0.2 107,-0.2 -0.721 58.8-153.5-107.4 166.8 13.1 -40.0 81.5 106 105 A L E -G 211 0B 0 105,-2.0 105,-2.8 -2,-0.3 2,-0.4 -0.979 11.5-134.5-144.9 125.5 16.6 -41.3 81.1 107 106 A V E +G 210 0B 0 -2,-0.4 103,-0.3 -85,-0.2 3,-0.1 -0.687 23.4 172.7 -86.5 127.8 18.3 -42.4 77.9 108 107 A L + 0 0 37 101,-4.1 2,-0.3 -2,-0.4 102,-0.2 0.514 68.6 13.3-108.4 -12.5 20.2 -45.7 78.1 109 108 A A S S- 0 0 30 100,-1.2 -1,-0.3 -80,-0.0 -80,-0.1 -0.972 98.4 -72.1-159.0 156.6 21.2 -46.1 74.5 110 109 A N + 0 0 64 -2,-0.3 3,-0.1 1,-0.1 -80,-0.1 -0.355 43.0 179.8 -55.2 132.8 21.2 -44.0 71.3 111 110 A I > + 0 0 1 1,-0.1 3,-2.3 -85,-0.1 4,-0.2 0.055 40.7 121.7-128.5 23.9 17.6 -43.5 70.2 112 111 A D G > + 0 0 15 1,-0.3 3,-1.7 2,-0.2 4,-0.1 0.675 62.0 76.8 -60.6 -19.7 18.2 -41.4 67.1 113 112 A D G > S+ 0 0 59 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.652 75.9 78.3 -68.0 -13.4 16.4 -44.1 65.2 114 113 A L G X S+ 0 0 0 -3,-2.3 3,-2.1 1,-0.2 -1,-0.3 0.793 78.6 70.7 -56.8 -28.8 13.2 -42.5 66.6 115 114 A F G < S+ 0 0 7 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.556 84.1 68.2 -73.8 -4.6 13.6 -39.8 64.0 116 115 A E G < S+ 0 0 150 -3,-1.5 -1,-0.3 -4,-0.1 -2,-0.2 0.654 89.5 88.5 -77.3 -17.9 12.6 -42.3 61.4 117 116 A R S < S- 0 0 26 -3,-2.1 2,-0.3 -4,-0.2 64,-0.1 -0.324 72.9-129.1 -83.9 164.0 9.2 -42.3 63.0 118 117 A E - 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0 0 3 -5,-1.3 2,-0.4 -4,-0.5 -1,-0.2 -0.368 46.1 -50.7 67.0-153.9 -9.6 -30.5 78.6 158 157 A S > - 0 0 18 1,-0.1 3,-1.6 -5,-0.1 7,-0.1 -0.977 35.3-141.2-122.5 130.5 -7.7 -33.7 79.5 159 158 A F T 3 S+ 0 0 131 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.685 109.2 35.5 -63.5 -15.9 -9.5 -36.9 80.6 160 159 A D T 3 S- 0 0 72 2,-0.3 -1,-0.3 -3,-0.0 3,-0.1 0.247 110.2-116.0-119.0 11.2 -6.6 -37.5 83.0 161 160 A G S < S+ 0 0 35 -3,-1.6 -78,-0.2 1,-0.2 2,-0.2 0.498 88.3 88.7 69.5 2.5 -5.9 -33.8 84.0 162 161 A G S > S- 0 0 20 -80,-0.1 4,-1.3 -79,-0.1 -2,-0.3 -0.616 96.1 -95.7-122.5-179.5 -2.5 -34.3 82.4 163 162 A D H > S+ 0 0 22 1,-0.2 4,-2.8 -2,-0.2 5,-0.2 0.821 117.4 63.6 -67.5 -27.9 -0.8 -33.9 79.0 164 163 A Q H > S+ 0 0 29 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.914 101.1 49.0 -66.4 -43.1 -1.3 -37.6 78.3 165 164 A G H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.953 114.5 45.5 -56.8 -52.0 -5.1 -37.4 78.3 166 165 A L H X S+ 0 0 0 -4,-1.3 4,-2.9 1,-0.2 -2,-0.2 0.926 114.1 47.9 -59.1 -48.8 -5.0 -34.4 75.9 167 166 A L H X S+ 0 0 0 -4,-2.8 4,-3.3 2,-0.2 -1,-0.2 0.893 112.5 48.6 -64.1 -39.6 -2.5 -36.0 73.6 168 167 A N H < S+ 0 0 11 -4,-2.5 -1,-0.2 -5,-0.2 6,-0.2 0.921 111.7 50.4 -66.5 -40.5 -4.3 -39.3 73.4 169 168 A T H >< S+ 0 0 34 -4,-2.6 3,-0.6 -5,-0.2 -2,-0.2 0.931 117.5 39.6 -59.9 -47.6 -7.6 -37.4 72.8 170 169 A F H 3< S+ 0 0 51 -4,-2.9 2,-1.5 1,-0.3 -2,-0.2 0.978 122.0 40.2 -68.5 -55.4 -6.0 -35.4 70.0 171 170 A F T >< S+ 0 0 29 -4,-3.3 3,-0.9 -5,-0.2 -1,-0.3 -0.512 79.3 150.2 -89.9 67.1 -3.9 -38.2 68.5 172 171 A N T < + 0 0 124 -2,-1.5 3,-0.3 -3,-0.6 4,-0.2 0.440 53.8 68.6 -89.0 0.6 -6.7 -40.8 69.0 173 172 A S T >> S+ 0 0 61 1,-0.2 4,-1.2 -3,-0.2 3,-0.7 0.508 72.1 98.5 -94.3 0.3 -6.0 -43.1 66.1 174 173 A W T <4 S+ 0 0 7 -3,-0.9 3,-0.5 1,-0.2 -1,-0.2 0.865 79.1 50.1 -53.1 -46.3 -2.8 -44.4 67.8 175 174 A A T 34 S+ 0 0 32 -45,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.816 123.3 28.7 -65.4 -33.5 -4.3 -47.5 69.3 176 175 A T T <4 S+ 0 0 122 -3,-0.7 2,-0.4 -4,-0.2 -1,-0.2 0.337 112.3 70.2-112.1 1.8 -5.9 -48.8 66.1 177 176 A T S < S- 0 0 67 -4,-1.2 4,-0.2 -3,-0.5 -1,-0.1 -0.975 92.7 -8.7-138.8 125.0 -3.7 -47.3 63.4 178 177 A D > - 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0 0 78 1,-0.1 3,-0.6 0, 0.0 4,-0.3 -0.927 360.0-173.4-114.3 99.0 15.3 -52.6 91.4 237 242 A P T 3> + 0 0 42 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.524 51.1 99.3 -83.1 -9.9 17.8 -49.7 91.7 238 243 A Q H 3> S+ 0 0 95 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.788 88.6 43.7 -51.6 -37.9 20.0 -50.1 88.6 239 244 A F H <> S+ 0 0 24 -3,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.908 114.0 49.5 -74.8 -43.5 18.1 -47.4 86.5 240 245 A L H > S+ 0 0 18 -4,-0.3 4,-3.3 1,-0.2 -2,-0.2 0.904 111.2 52.5 -55.4 -42.6 18.0 -45.0 89.5 241 246 A N H X S+ 0 0 28 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.823 107.5 49.6 -67.0 -34.6 21.7 -45.7 89.9 242 247 A V H X S+ 0 0 52 -4,-1.5 4,-2.4 -5,-0.2 5,-0.3 0.955 112.6 48.5 -64.1 -49.4 22.3 -44.9 86.2 243 248 A W H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.943 114.7 44.9 -53.9 -51.7 20.4 -41.7 86.7 244 249 A W H X S+ 0 0 31 -4,-3.3 4,-3.3 2,-0.2 5,-0.2 0.843 109.1 55.6 -65.4 -34.4 22.3 -40.8 89.9 245 250 A D H X S+ 0 0 67 -4,-2.2 4,-3.7 2,-0.2 5,-0.3 0.946 111.4 44.1 -63.1 -49.2 25.7 -41.7 88.4 246 251 A I H X>S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 5,-1.6 0.938 115.0 49.7 -56.3 -48.5 25.1 -39.2 85.5 247 252 A F H <>S+ 0 0 15 -4,-2.6 5,-3.2 -5,-0.3 4,-0.2 0.924 118.5 38.6 -57.3 -47.3 23.8 -36.7 88.0 248 253 A T H <5S+ 0 0 46 -4,-3.3 -2,-0.2 3,-0.2 -1,-0.2 0.908 123.3 39.7 -67.7 -49.0 26.9 -37.2 90.2 249 254 A T H <5S+ 0 0 85 -4,-3.7 -3,-0.2 -5,-0.2 -2,-0.2 0.910 135.7 8.5 -70.7 -44.1 29.4 -37.5 87.5 250 255 A S T X5S+ 0 0 50 -4,-2.9 4,-0.7 -5,-0.3 -3,-0.2 0.787 125.5 45.4-114.2 -38.1 28.2 -34.9 85.0 251 256 A V H > S+ 0 0 63 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.843 110.0 53.7 -55.3 -31.9 30.0 -30.7 88.8 254 259 A L H >< S+ 0 0 23 -4,-0.7 3,-0.7 1,-0.2 -2,-0.2 0.931 110.6 43.5 -66.8 -46.0 28.3 -28.7 86.1 255 260 A L H >< S+ 0 0 37 -4,-2.2 3,-1.0 1,-0.2 4,-0.2 0.736 105.8 65.5 -70.5 -25.1 26.1 -26.8 88.6 256 261 A Q H >< S+ 0 0 144 -4,-2.1 3,-1.1 1,-0.2 4,-0.3 0.769 88.0 66.3 -67.6 -28.5 29.1 -26.3 91.0 257 262 A Q T << S+ 0 0 105 -4,-0.8 3,-0.3 -3,-0.7 -1,-0.2 0.531 88.2 69.9 -75.8 -3.7 31.1 -24.1 88.6 258 263 A F T < S+ 0 0 55 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.666 82.2 70.8 -86.2 -19.5 28.4 -21.4 88.9 259 264 A G < 0 0 75 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.1 0.705 360.0 360.0 -67.7 -21.6 29.3 -20.5 92.5 260 265 A L 0 0 185 -3,-0.3 -1,-0.1 -4,-0.3 -3,-0.0 -0.569 360.0 360.0 -76.3 360.0 32.6 -18.9 91.4