==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN/CELL ADHESION 10-NOV-08 3F7P . COMPND 2 MOLECULE: PLECTIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.DE PEREDA . 1069 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49075.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 674 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 230 21.5 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 . 9 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 0.8 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 . 2 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 . 80 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 85 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 211 19.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.1 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 2 0 0 0 0 2 2 2 2 0 2 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 4 5 3 12 9 3 0 6 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 3 2 5 0 0 0 0 0 1 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 60 A V 0 0 68 0, 0.0 623,-2.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 118.0 -51.8 48.6 -8.7 2 61 A I E +A 623 0A 15 621,-0.2 2,-0.2 623,-0.1 621,-0.2 -0.824 360.0 179.8-116.6 154.3 -51.7 45.4 -10.7 3 62 A R E -A 622 0A 56 619,-2.3 619,-0.9 -2,-0.3 2,-0.1 -0.818 40.0 -66.1-140.7-179.0 -54.2 43.9 -13.2 4 63 A I - 0 0 15 -2,-0.2 3,-0.2 1,-0.1 617,-0.1 -0.467 64.4 -88.3 -74.1 142.2 -54.6 40.9 -15.4 5 64 A A - 0 0 31 615,-0.2 -1,-0.1 -2,-0.1 5,-0.1 -0.098 65.4 -80.4 -43.4 146.7 -52.2 40.5 -18.4 6 65 A D >> - 0 0 57 1,-0.1 4,-1.4 -3,-0.1 3,-1.3 -0.249 30.3-129.6 -61.6 140.4 -53.8 42.3 -21.4 7 66 A E H 3> S+ 0 0 85 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.822 108.5 65.3 -57.3 -31.0 -56.4 40.4 -23.2 8 67 A R H 3> S+ 0 0 107 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.822 98.9 51.0 -62.9 -32.3 -54.5 41.2 -26.4 9 68 A D H <> S+ 0 0 15 -3,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.850 107.6 53.5 -74.7 -31.9 -51.6 39.0 -25.2 10 69 A R H X S+ 0 0 106 -4,-1.4 4,-1.4 2,-0.2 -2,-0.2 0.913 113.7 42.4 -63.7 -40.0 -53.9 36.2 -24.5 11 70 A V H X S+ 0 0 9 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.875 111.8 53.2 -77.4 -36.7 -55.2 36.4 -28.1 12 71 A Q H X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.905 108.7 51.5 -62.5 -40.5 -51.8 36.9 -29.6 13 72 A K H X S+ 0 0 51 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.879 112.3 45.4 -63.3 -37.3 -50.6 33.8 -27.8 14 73 A K H X S+ 0 0 52 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.935 113.5 49.1 -75.7 -42.8 -53.6 31.8 -29.2 15 74 A T H X S+ 0 0 1 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.957 112.3 47.7 -55.2 -53.1 -53.1 33.2 -32.7 16 75 A F H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.842 112.1 51.5 -61.4 -31.3 -49.4 32.4 -32.7 17 76 A T H X S+ 0 0 18 -4,-1.5 4,-2.7 -5,-0.2 5,-0.2 0.957 109.0 47.6 -70.2 -50.0 -50.1 28.9 -31.4 18 77 A K H X S+ 0 0 59 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.865 113.9 50.2 -59.0 -37.4 -52.7 28.1 -34.0 19 78 A W H X S+ 0 0 0 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.926 109.8 48.5 -64.6 -48.5 -50.3 29.4 -36.7 20 79 A V H >X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 3,-0.6 0.910 112.2 49.6 -59.7 -43.3 -47.3 27.3 -35.4 21 80 A N H 3X S+ 0 0 24 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.849 99.3 66.1 -65.0 -36.0 -49.5 24.2 -35.3 22 81 A K H 3< S+ 0 0 66 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.869 114.7 31.3 -50.0 -39.9 -50.7 24.8 -38.9 23 82 A H H X< S+ 0 0 12 -4,-1.1 3,-1.2 -3,-0.6 4,-0.4 0.855 114.1 58.5 -89.3 -40.5 -47.1 24.2 -39.9 24 83 A L H ><>S+ 0 0 0 -4,-2.7 3,-2.1 1,-0.3 5,-2.0 0.845 95.0 64.1 -62.9 -34.5 -46.0 21.6 -37.3 25 84 A I G ><5S+ 0 0 117 -4,-2.3 3,-1.6 1,-0.3 -1,-0.3 0.775 90.0 68.5 -62.0 -22.6 -48.7 19.1 -38.2 26 85 A K G < 5S+ 0 0 130 -3,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.775 107.9 38.7 -62.6 -24.8 -47.0 18.9 -41.6 27 86 A A G < 5S- 0 0 27 -3,-2.1 -1,-0.3 -4,-0.4 -2,-0.2 0.139 124.8-105.8-108.8 16.0 -44.2 17.2 -39.6 28 87 A Q T < 5S+ 0 0 155 -3,-1.6 2,-0.3 1,-0.2 -3,-0.3 0.835 81.2 126.0 63.7 35.2 -46.6 15.3 -37.3 29 88 A R < - 0 0 117 -5,-2.0 2,-0.3 -8,-0.1 -1,-0.2 -0.866 36.0-175.8-123.4 159.1 -45.9 17.7 -34.4 30 89 A H - 0 0 129 -2,-0.3 2,-0.3 -6,-0.1 -9,-0.0 -0.957 12.1-152.0-158.0 129.5 -48.1 19.8 -32.1 31 90 A I - 0 0 0 -2,-0.3 3,-0.1 -14,-0.2 -10,-0.1 -0.785 7.5-175.4-102.3 152.2 -47.6 22.2 -29.3 32 91 A S S S+ 0 0 102 1,-0.3 2,-0.5 -2,-0.3 -1,-0.1 0.759 76.8 31.2-113.6 -44.8 -50.1 22.8 -26.5 33 92 A D >> - 0 0 28 1,-0.1 4,-3.3 -16,-0.0 3,-2.1 -0.964 64.1-157.4-122.1 113.8 -48.6 25.7 -24.5 34 93 A L T 34 S+ 0 0 1 -2,-0.5 4,-0.3 1,-0.3 -1,-0.1 0.746 94.4 57.5 -59.8 -25.1 -46.6 28.2 -26.5 35 94 A Y T 34 S+ 0 0 19 1,-0.1 -1,-0.3 2,-0.1 64,-0.0 0.451 122.7 21.7 -88.3 2.8 -44.7 29.3 -23.4 36 95 A E T X4 S+ 0 0 41 -3,-2.1 3,-1.6 62,-0.0 4,-0.4 0.601 108.5 66.6-129.8 -44.6 -43.5 25.7 -22.7 37 96 A D T 3< S+ 0 0 53 -4,-3.3 6,-0.3 1,-0.3 -3,-0.1 0.447 102.1 50.7 -77.7 5.0 -43.5 23.6 -25.8 38 97 A L T > S+ 0 0 2 -4,-0.3 3,-1.2 -5,-0.3 -1,-0.3 0.476 83.9 90.0-110.2 -4.7 -40.8 25.6 -27.5 39 98 A R T < S+ 0 0 16 -3,-1.6 32,-0.2 1,-0.3 -2,-0.1 0.795 82.4 54.5 -67.8 -30.0 -38.2 25.6 -24.7 40 99 A D T 3 S- 0 0 59 -4,-0.4 -1,-0.3 1,-0.1 30,-0.2 0.555 102.0-131.9 -83.3 -6.9 -36.4 22.4 -25.7 41 100 A G S <> S+ 0 0 0 -3,-1.2 4,-2.5 29,-0.1 5,-0.2 0.051 80.0 105.4 87.0 -28.2 -35.8 23.8 -29.2 42 101 A H H > S+ 0 0 43 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.907 82.2 46.0 -53.7 -47.5 -36.9 20.7 -31.0 43 102 A N H > S+ 0 0 22 -6,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.881 110.2 53.0 -66.5 -39.4 -40.2 22.3 -32.1 44 103 A L H > S+ 0 0 1 -6,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 111.1 48.1 -58.6 -45.4 -38.5 25.5 -33.2 45 104 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.975 113.2 46.5 -60.7 -52.2 -36.2 23.5 -35.3 46 105 A S H X S+ 0 0 6 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.884 110.0 54.4 -57.4 -40.8 -39.0 21.5 -36.9 47 106 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.932 110.8 45.6 -58.6 -45.8 -41.0 24.6 -37.5 48 107 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 6,-0.5 0.861 109.2 55.4 -66.3 -37.3 -38.1 26.1 -39.4 49 108 A E H X S+ 0 0 53 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.927 112.1 43.7 -60.9 -43.9 -37.5 22.9 -41.3 50 109 A V H < S+ 0 0 42 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.888 115.2 48.5 -67.4 -41.0 -41.2 23.0 -42.5 51 110 A L H < S+ 0 0 38 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.887 125.9 24.4 -70.8 -40.8 -41.1 26.7 -43.3 52 111 A S H < S- 0 0 39 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.622 94.4-130.0-100.3 -17.5 -37.9 26.9 -45.3 53 112 A G < + 0 0 66 -4,-1.7 -4,-0.1 -5,-0.4 -3,-0.1 0.509 66.3 132.8 75.2 4.2 -37.8 23.2 -46.5 54 113 A D - 0 0 70 -6,-0.5 2,-0.5 -5,-0.1 -1,-0.2 -0.224 58.9-119.2 -78.8 174.1 -34.2 23.2 -45.2 55 114 A S - 0 0 115 -3,-0.1 -9,-0.0 -2,-0.0 -1,-0.0 -0.968 29.6-165.4-122.4 118.0 -32.6 20.5 -43.0 56 115 A L - 0 0 14 -2,-0.5 18,-0.0 -11,-0.1 -7,-0.0 -0.796 19.6-114.5-110.9 146.9 -31.3 21.5 -39.6 57 116 A P - 0 0 87 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.242 27.0-153.2 -64.7 157.5 -28.9 19.8 -37.1 58 117 A R - 0 0 92 15,-0.0 2,-1.3 2,-0.0 12,-0.1 -0.958 13.6-144.3-142.2 123.4 -30.2 18.7 -33.7 59 118 A E - 0 0 85 -2,-0.4 2,-1.1 7,-0.2 11,-0.2 -0.709 24.1-153.4 -81.7 95.2 -28.3 18.3 -30.4 60 119 A K + 0 0 193 -2,-1.3 2,-0.2 10,-0.0 7,-0.1 -0.605 41.2 126.9 -78.8 100.8 -30.2 15.3 -29.0 61 120 A G - 0 0 29 -2,-1.1 3,-0.0 2,-0.1 -2,-0.0 -0.621 54.9-136.4-135.7-164.0 -29.7 15.6 -25.3 62 121 A R S S+ 0 0 163 -2,-0.2 2,-0.1 0, 0.0 -1,-0.1 0.533 74.2 69.0-134.0 -25.8 -31.8 15.7 -22.1 63 122 A M S > S- 0 0 91 1,-0.0 4,-1.5 4,-0.0 3,-0.2 -0.172 92.2 -93.1 -96.0-172.9 -30.4 18.4 -19.9 64 123 A R H > S+ 0 0 79 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.882 118.4 63.3 -70.9 -40.3 -30.3 22.2 -20.1 65 124 A F H > S+ 0 0 138 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.860 109.1 44.3 -50.9 -36.8 -26.9 22.4 -21.8 66 125 A H H > S+ 0 0 69 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.823 108.1 55.7 -81.6 -35.0 -28.6 20.6 -24.7 67 126 A K H X S+ 0 0 63 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.979 110.0 47.0 -55.1 -55.4 -31.8 22.7 -24.7 68 127 A L H X S+ 0 0 29 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.868 111.1 52.6 -55.7 -40.5 -29.6 25.8 -25.0 69 128 A Q H X S+ 0 0 75 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.952 111.2 46.0 -60.4 -50.6 -27.7 24.1 -27.8 70 129 A N H X S+ 0 0 1 -4,-2.7 4,-1.5 -11,-0.2 -2,-0.2 0.883 113.0 48.5 -61.1 -43.7 -30.9 23.3 -29.7 71 130 A V H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.922 107.8 55.9 -63.2 -42.0 -32.4 26.7 -29.3 72 131 A Q H X S+ 0 0 49 -4,-2.4 4,-3.1 -5,-0.3 5,-0.2 0.860 102.2 57.6 -58.2 -36.9 -29.1 28.3 -30.5 73 132 A I H X S+ 0 0 29 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.945 109.0 44.8 -56.3 -49.3 -29.4 26.2 -33.6 74 133 A A H X S+ 0 0 2 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.931 114.9 47.3 -60.6 -48.8 -32.8 27.8 -34.4 75 134 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.898 111.6 50.6 -62.7 -42.6 -31.6 31.3 -33.6 76 135 A D H X S+ 0 0 80 -4,-3.1 4,-2.9 2,-0.2 5,-0.3 0.921 105.2 56.7 -62.9 -43.5 -28.5 30.9 -35.7 77 136 A Y H X S+ 0 0 34 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.929 111.6 43.6 -51.0 -48.0 -30.4 29.7 -38.6 78 137 A L H <>S+ 0 0 1 -4,-1.8 5,-2.7 2,-0.2 -1,-0.2 0.920 112.2 51.9 -65.7 -44.5 -32.5 32.8 -38.5 79 138 A R H ><5S+ 0 0 95 -4,-2.6 3,-1.3 1,-0.2 -2,-0.2 0.887 109.7 49.1 -63.3 -38.1 -29.5 35.1 -37.9 80 139 A H H 3<5S+ 0 0 165 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.837 103.5 60.7 -70.0 -31.8 -27.7 33.6 -40.9 81 140 A R T 3<5S- 0 0 142 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.156 126.5-106.5 -77.1 19.6 -30.9 34.2 -43.0 82 141 A Q T < 5S+ 0 0 169 -3,-1.3 2,-0.7 1,-0.2 -3,-0.2 0.668 71.4 150.5 64.3 19.8 -30.3 37.8 -42.1 83 142 A V < - 0 0 13 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.2 -0.750 44.4-134.2 -84.7 112.7 -33.2 37.8 -39.6 84 143 A K - 0 0 193 -2,-0.7 2,-0.6 -3,-0.1 -5,-0.0 -0.539 23.8-177.7 -70.9 119.7 -32.4 40.3 -36.9 85 144 A L > - 0 0 12 -2,-0.4 3,-0.7 3,-0.1 2,-0.3 -0.836 14.4-172.2-115.2 88.6 -33.1 38.9 -33.5 86 145 A V T 3 + 0 0 113 -2,-0.6 3,-0.1 1,-0.2 -2,-0.0 -0.621 62.1 0.0 -89.2 142.8 -32.4 41.7 -31.1 87 146 A N T 3 S+ 0 0 73 -2,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.772 99.5 120.5 58.7 30.4 -32.3 41.4 -27.3 88 147 A I < - 0 0 16 -3,-0.7 2,-0.2 15,-0.0 -1,-0.1 -0.951 39.5-174.2-130.9 113.6 -33.1 37.7 -27.5 89 148 A R >> - 0 0 132 -2,-0.4 4,-1.0 1,-0.1 3,-0.6 -0.658 36.3-114.8-101.3 159.9 -30.8 35.0 -26.1 90 149 A N H 3> S+ 0 0 31 1,-0.2 4,-2.5 -2,-0.2 3,-0.3 0.834 116.1 56.0 -61.6 -34.1 -31.1 31.2 -26.3 91 150 A D H 3> S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.779 98.6 63.6 -71.0 -25.1 -31.6 30.9 -22.6 92 151 A D H <4>S+ 0 0 3 -3,-0.6 5,-2.7 2,-0.2 -1,-0.2 0.880 111.4 35.7 -62.8 -40.5 -34.6 33.3 -22.9 93 152 A I H ><5S+ 0 0 2 -4,-1.0 3,-0.7 -3,-0.3 -2,-0.2 0.887 117.9 51.0 -78.8 -42.8 -36.4 30.8 -25.1 94 153 A A H 3<5S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.806 114.9 43.2 -65.8 -31.2 -35.2 27.7 -23.3 95 154 A D T 3<5S- 0 0 9 -4,-2.2 485,-2.5 -5,-0.2 -1,-0.3 0.447 117.1-117.4 -95.3 -2.5 -36.2 29.1 -19.9 96 155 A G T < 5 - 0 0 1 -3,-0.7 -3,-0.2 483,-0.2 482,-0.1 0.869 37.1-178.0 74.4 42.8 -39.5 30.3 -21.3 97 156 A N >< - 0 0 0 -5,-2.7 4,-1.8 1,-0.2 -1,-0.2 -0.672 20.6-150.6 -66.3 114.4 -39.7 34.1 -21.0 98 157 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.858 87.6 46.1 -65.8 -44.3 -43.2 34.5 -22.5 99 158 A K H > S+ 0 0 17 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.955 115.3 46.1 -63.9 -50.5 -42.9 38.0 -24.0 100 159 A L H > S+ 0 0 5 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.823 112.8 52.5 -63.0 -28.0 -39.5 37.2 -25.7 101 160 A T H X S+ 0 0 3 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.917 108.0 49.7 -73.5 -44.7 -41.0 33.9 -26.9 102 161 A L H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.946 110.8 52.1 -51.8 -50.6 -43.9 35.7 -28.4 103 162 A G H X S+ 0 0 23 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.863 105.9 52.7 -56.4 -42.8 -41.4 38.0 -30.1 104 163 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.954 111.8 46.0 -60.1 -49.4 -39.4 35.2 -31.5 105 164 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.899 110.5 53.0 -61.1 -42.1 -42.5 33.7 -33.1 106 165 A W H X S+ 0 0 34 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.958 108.5 50.8 -58.4 -48.9 -43.6 37.1 -34.4 107 166 A T H X S+ 0 0 30 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.912 110.2 49.8 -50.5 -48.4 -40.2 37.5 -36.0 108 167 A I H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.2 5,-0.3 0.904 111.5 48.4 -60.2 -42.7 -40.5 34.1 -37.6 109 168 A I H X>S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-1.8 0.921 111.0 50.8 -64.7 -44.7 -44.0 34.9 -38.9 110 169 A L H <>S+ 0 0 59 -4,-2.9 5,-1.6 3,-0.2 4,-0.3 0.953 113.6 44.4 -55.0 -54.0 -42.8 38.2 -40.3 111 170 A H H <5S+ 0 0 64 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.848 125.4 28.5 -65.4 -40.0 -39.9 36.7 -42.2 112 171 A F H <5S+ 0 0 37 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.788 134.8 17.6 -94.7 -31.1 -41.7 33.7 -43.7 113 172 A Q T <5S+ 0 0 12 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.800 125.9 37.4-112.2 -39.2 -45.3 34.7 -44.1 114 173 A I T > - 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0 0 69 -6,-0.5 2,-0.5 -5,-0.1 -1,-0.2 -0.228 59.1-118.8 -79.0 174.1 7.2 32.9 -30.0 287 114 B S - 0 0 114 -3,-0.1 -9,-0.0 -2,-0.0 -1,-0.0 -0.970 29.5-165.2-121.9 118.6 4.4 34.7 -28.4 288 115 B L - 0 0 15 -2,-0.5 18,-0.0 -11,-0.1 -7,-0.0 -0.794 19.8-113.8-110.5 147.2 1.3 32.7 -27.3 289 116 B P - 0 0 88 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.251 27.0-152.2 -65.5 157.9 -2.3 33.8 -26.3 290 117 B R - 0 0 94 15,-0.0 2,-1.2 2,-0.0 12,-0.1 -0.963 12.8-145.5-141.3 121.8 -3.5 33.2 -22.7 291 118 B E - 0 0 85 -2,-0.4 2,-1.1 7,-0.2 11,-0.2 -0.717 24.0-153.8 -82.3 95.4 -7.1 32.7 -21.5 292 119 B K + 0 0 193 -2,-1.2 2,-0.2 10,-0.0 7,-0.1 -0.612 40.9 127.1 -79.1 100.2 -6.9 34.5 -18.2 293 120 B G - 0 0 27 -2,-1.1 3,-0.0 2,-0.1 -2,-0.0 -0.625 54.8-136.8-135.2-164.6 -9.5 32.8 -16.0 294 121 B R S S+ 0 0 192 -2,-0.2 -1,-0.1 0, 0.0 2,-0.0 0.545 74.2 68.7-132.9 -26.6 -9.9 31.2 -12.6 295 122 B M S > S- 0 0 122 1,-0.0 4,-1.4 4,-0.0 3,-0.2 -0.148 92.3 -92.9 -95.9-172.5 -12.1 28.1 -13.1 296 123 B R H > S+ 0 0 85 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.880 118.5 63.2 -71.3 -40.1 -11.6 24.8 -14.9 297 124 B F H > S+ 0 0 143 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.862 109.1 44.3 -51.0 -36.8 -13.2 25.9 -18.2 298 125 B H H > S+ 0 0 67 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.820 108.1 55.6 -81.6 -34.5 -10.2 28.4 -18.4 299 126 B K H X S+ 0 0 66 -4,-1.4 4,-2.9 2,-0.2 5,-0.3 0.976 110.2 46.8 -55.7 -55.3 -7.6 25.8 -17.3 300 127 B L H X S+ 0 0 29 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.879 111.1 52.6 -55.1 -42.2 -8.7 23.6 -20.2 301 128 B Q H X S+ 0 0 77 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.951 111.5 45.7 -58.5 -50.3 -8.6 26.6 -22.5 302 129 B N H X S+ 0 0 1 -4,-2.6 4,-1.5 -11,-0.2 -2,-0.2 0.879 113.1 48.4 -62.6 -42.8 -5.1 27.5 -21.5 303 130 B V H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.918 107.9 56.0 -64.6 -40.3 -3.8 23.9 -21.8 304 131 B Q H X S+ 0 0 49 -4,-2.5 4,-3.2 -5,-0.3 5,-0.2 0.870 102.1 57.4 -59.4 -37.7 -5.4 23.6 -25.2 305 132 B I H X S+ 0 0 28 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.941 109.1 44.9 -55.5 -49.2 -3.5 26.6 -26.3 306 133 B A H X S+ 0 0 2 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.934 114.9 47.3 -61.1 -47.7 -0.2 24.9 -25.4 307 134 B L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.894 111.7 50.5 -63.4 -42.1 -1.3 21.6 -27.1 308 135 B D H X S+ 0 0 80 -4,-3.2 4,-2.8 2,-0.2 5,-0.3 0.909 105.6 56.3 -64.0 -42.5 -2.4 23.3 -30.2 309 136 B Y H X S+ 0 0 34 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.928 111.7 43.8 -52.2 -47.8 0.9 25.2 -30.5 310 137 B L H <>S+ 0 0 1 -4,-1.9 5,-2.7 1,-0.2 -2,-0.2 0.922 112.4 51.3 -64.9 -45.1 2.7 21.9 -30.5 311 138 B R H ><5S+ 0 0 95 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.871 109.8 49.5 -63.2 -37.3 0.3 20.2 -32.9 312 139 B H H 3<5S+ 0 0 166 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.832 103.2 60.7 -71.3 -31.5 0.6 23.0 -35.4 313 140 B R T 3<5S- 0 0 141 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.176 126.6-106.4 -76.9 19.2 4.3 22.8 -35.1 314 141 B Q T < 5S+ 0 0 167 -3,-1.2 2,-0.7 1,-0.2 -3,-0.2 0.671 71.5 150.2 64.2 20.0 3.8 19.2 -36.4 315 142 B V < - 0 0 13 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.2 -0.753 44.6-134.2 -85.2 112.7 4.4 17.7 -32.9 316 143 B K - 0 0 192 -2,-0.7 2,-0.6 -3,-0.1 -5,-0.0 -0.530 21.3-173.6 -70.6 119.6 2.4 14.5 -32.6 317 144 B L > - 0 0 12 -2,-0.4 3,-0.7 3,-0.1 2,-0.2 -0.839 14.6-165.3-114.3 91.0 0.6 14.4 -29.2 318 145 B V T 3 - 0 0 118 -2,-0.6 3,-0.1 1,-0.2 -2,-0.0 -0.548 62.9 -7.9 -81.4 137.3 -0.9 10.9 -29.1 319 146 B N T 3 S+ 0 0 78 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.782 99.7 124.5 56.1 31.9 -3.6 9.9 -26.7 320 147 B I < - 0 0 16 -3,-0.7 2,-0.2 15,-0.0 -1,-0.2 -0.951 37.3-174.3-131.0 113.5 -3.2 13.2 -24.7 321 148 B R >> - 0 0 129 -2,-0.4 4,-1.0 1,-0.1 3,-0.7 -0.671 36.4-114.5-102.3 161.5 -6.1 15.5 -24.0 322 149 B N H 3> S+ 0 0 31 1,-0.2 4,-2.4 -2,-0.2 3,-0.2 0.827 116.0 55.9 -63.5 -34.1 -6.1 18.9 -22.4 323 150 B D H 3> S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.775 98.8 63.5 -69.6 -25.5 -8.1 17.7 -19.4 324 151 B D H <4>S+ 0 0 2 -3,-0.7 5,-2.8 2,-0.2 -1,-0.2 0.887 111.4 35.7 -63.3 -41.2 -5.5 15.0 -18.8 325 152 B I H ><5S+ 0 0 1 -4,-1.0 3,-0.6 -3,-0.2 -2,-0.2 0.888 118.0 51.0 -77.6 -42.1 -2.9 17.8 -18.2 326 153 B A H 3<5S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.794 114.8 43.5 -67.1 -30.6 -5.3 20.2 -16.4 327 154 B D T 3<5S- 0 0 10 -4,-2.2 456,-2.6 -5,-0.2 -1,-0.3 0.439 117.4-117.1 -95.6 -2.5 -6.5 17.4 -14.1 328 155 B G T < 5 - 0 0 0 -3,-0.6 -3,-0.2 454,-0.2 453,-0.1 0.862 37.4-178.0 74.5 42.4 -2.9 16.2 -13.6 329 156 B N >< - 0 0 0 -5,-2.8 4,-1.9 1,-0.2 -1,-0.2 -0.661 19.9-151.5 -66.4 112.9 -2.5 12.7 -14.9 330 157 B P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.870 87.4 46.1 -64.2 -46.4 1.1 12.2 -13.9 331 158 B K H > S+ 0 0 14 491,-0.3 4,-2.6 2,-0.2 5,-0.1 0.958 115.7 45.7 -63.0 -49.4 2.2 9.7 -16.6 332 159 B L H > S+ 0 0 17 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.817 112.9 52.7 -62.7 -28.7 0.5 11.7 -19.4 333 160 B T H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.926 108.2 49.2 -71.6 -47.4 2.1 14.8 -17.9 334 161 B L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.943 111.0 52.1 -50.1 -50.8 5.5 13.2 -18.0 335 162 B G H X S+ 0 0 22 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.884 106.2 52.3 -56.6 -44.8 4.8 12.2 -21.6 336 163 B L H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.947 112.0 46.0 -57.4 -49.6 3.9 15.8 -22.6 337 164 B I H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.893 110.4 53.2 -61.1 -41.5 7.1 17.1 -21.2 338 165 B W H X S+ 0 0 36 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.953 108.3 50.8 -59.0 -48.1 9.1 14.4 -22.8 339 166 B T H X S+ 0 0 30 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.907 110.0 50.1 -52.3 -47.0 7.6 15.3 -26.1 340 167 B I H X S+ 0 0 1 -4,-2.3 4,-2.0 1,-0.2 5,-0.3 0.879 111.5 48.2 -61.4 -40.5 8.5 18.9 -25.5 341 168 B I H X>S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-1.8 0.937 111.0 50.6 -66.4 -47.9 12.1 18.0 -24.7 342 169 B L H <>S+ 0 0 59 -4,-3.0 5,-1.7 3,-0.2 4,-0.3 0.949 113.8 44.7 -49.6 -55.6 12.4 15.7 -27.8 343 170 B H H <5S+ 0 0 65 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.854 125.6 27.6 -65.2 -40.6 11.1 18.4 -30.1 344 171 B F H <5S+ 0 0 38 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.802 135.2 18.1 -94.2 -32.3 13.1 21.4 -28.8 345 172 B Q T <5S+ 0 0 13 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.808 125.8 37.2-110.6 -40.3 16.3 19.9 -27.3 346 173 B I T > - 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0 0 174 -2,-0.3 2,-0.6 7,-0.2 13,-0.1 -0.977 25.8-154.6-160.0 133.6 32.2 1.9 -24.6 380 207 B C + 0 0 4 -2,-0.3 -11,-0.1 1,-0.1 3,-0.1 -0.862 29.8 149.3-121.0 100.0 28.8 3.3 -25.1 381 208 B D - 0 0 77 -2,-0.6 2,-0.2 1,-0.1 -1,-0.1 0.677 67.6 -1.1-101.8 -21.9 26.1 0.7 -25.9 382 209 B N - 0 0 41 2,-0.1 -1,-0.1 -17,-0.1 0, 0.0 -0.821 67.1-105.2-150.8-174.1 23.0 2.3 -24.5 383 210 B F S S+ 0 0 2 -2,-0.2 68,-0.3 3,-0.1 69,-0.3 -0.078 106.6 43.7-112.4 31.0 21.6 5.3 -22.6 384 211 B T S > S+ 0 0 17 67,-0.1 3,-2.0 65,-0.0 4,-0.3 0.256 117.5 17.5-133.0 -99.6 21.2 3.3 -19.4 385 212 B S G > S+ 0 0 53 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.798 113.8 70.9 -55.3 -32.8 23.8 0.9 -17.9 386 213 B S G 3 S+ 0 0 21 1,-0.3 6,-0.4 2,-0.1 -1,-0.3 0.746 101.8 44.4 -55.5 -25.2 26.6 2.4 -20.1 387 214 B W G X S+ 0 0 0 -3,-2.0 3,-1.4 1,-0.2 -1,-0.3 0.449 82.8 101.9-102.5 1.9 26.5 5.6 -18.0 388 215 B R T < S+ 0 0 91 -3,-1.6 -1,-0.2 -4,-0.3 31,-0.1 0.838 81.1 46.5 -57.3 -41.0 26.3 4.1 -14.5 389 216 B D T 3 S- 0 0 54 -4,-0.3 -1,-0.3 -3,-0.2 29,-0.2 0.476 102.6-125.3 -87.9 -1.0 30.0 4.5 -13.5 390 217 B G S <> S+ 0 0 0 -3,-1.4 4,-1.7 28,-0.1 5,-0.1 0.414 78.2 116.2 77.6 -0.6 30.3 8.1 -14.7 391 218 B R H > S+ 0 0 64 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.904 71.8 51.3 -71.8 -40.1 33.3 7.4 -16.9 392 219 B L H > S+ 0 0 4 -6,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.874 107.7 54.8 -59.2 -40.0 31.6 8.3 -20.2 393 220 B F H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.927 111.1 44.6 -61.6 -45.8 30.4 11.6 -18.8 394 221 B N H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.895 112.3 51.1 -64.0 -43.1 34.0 12.5 -17.8 395 222 B A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.854 108.0 53.1 -64.0 -38.1 35.5 11.3 -21.2 396 223 B I H X S+ 0 0 0 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.950 112.1 43.8 -63.8 -49.1 32.9 13.4 -23.1 397 224 B I H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.868 112.6 55.4 -61.6 -36.7 33.8 16.6 -21.2 398 225 B H H < S+ 0 0 44 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.942 101.8 54.8 -62.0 -48.8 37.5 15.6 -21.6 399 226 B R H < S+ 0 0 109 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.837 114.6 41.7 -53.4 -35.0 37.3 15.4 -25.4 400 227 B H H < S+ 0 0 63 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.885 137.0 9.1 -81.6 -39.7 35.9 18.9 -25.5 401 228 B K >< - 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