==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ACTIN-BINDING PROTEIN 01-JUN-11 2YLE . COMPND 2 MOLECULE: PROTEIN SPIRE HOMOLOG 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.ZETH,M.PECHLIVANIS,C.VONRHEIN,E.KERKHOFF . 192 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10970.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 6.2 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 . 1 0.5 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 . 6 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 40.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 0 1 0 1 1 1 0 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 34 A G 0 0 84 0, 0.0 2,-0.4 0, 0.0 169,-0.2 0.000 360.0 360.0 360.0 159.6 32.1 22.8 38.8 2 35 A S - 0 0 94 167,-0.1 2,-0.3 0, 0.0 169,-0.1 -0.958 360.0-112.3-121.5 139.1 32.4 19.5 36.9 3 36 A S + 0 0 78 -2,-0.4 2,-0.2 167,-0.1 164,-0.0 -0.555 46.8 152.4 -77.3 128.6 33.6 19.0 33.3 4 37 A R - 0 0 104 -2,-0.3 166,-0.1 2,-0.1 3,-0.1 -0.688 50.9-105.8-136.7-170.5 31.1 17.9 30.7 5 38 A D S S+ 0 0 90 -2,-0.2 54,-2.2 1,-0.1 2,-0.3 0.397 91.9 42.6-109.6 0.4 30.5 18.2 26.9 6 39 A A E -A 58 0A 13 52,-0.2 2,-0.3 53,-0.1 52,-0.2 -0.997 52.1-172.1-144.3 147.5 27.6 20.7 26.8 7 40 A L E -A 57 0A 1 50,-2.1 50,-3.4 -2,-0.3 2,-0.1 -0.979 28.1-120.2-128.3 148.3 26.5 23.9 28.4 8 41 A S E > -A 56 0A 11 -2,-0.3 4,-2.3 48,-0.2 48,-0.2 -0.456 23.7-117.8 -79.0 158.1 23.1 25.7 28.0 9 42 A L H > S+ 0 0 0 46,-2.3 4,-2.7 43,-1.0 44,-0.2 0.874 117.3 58.1 -64.0 -35.0 22.9 29.2 26.6 10 43 A E H > S+ 0 0 80 42,-1.0 4,-2.3 45,-0.3 -1,-0.2 0.912 107.3 46.4 -54.7 -47.6 21.4 30.2 29.9 11 44 A E H > S+ 0 0 50 2,-0.2 4,-2.6 41,-0.2 -2,-0.2 0.914 110.4 54.1 -62.7 -43.5 24.5 28.9 31.7 12 45 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.940 110.7 45.5 -55.7 -49.5 26.7 30.7 29.2 13 46 A L H X>S+ 0 0 9 -4,-2.7 4,-2.3 1,-0.2 5,-0.6 0.910 113.1 50.1 -62.1 -43.3 25.0 34.0 29.9 14 47 A R H <5S+ 0 0 154 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.880 113.2 46.1 -62.2 -40.7 25.1 33.5 33.6 15 48 A L H <5S+ 0 0 41 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 117.2 42.3 -71.9 -43.1 28.8 32.7 33.6 16 49 A Y H <5S- 0 0 29 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.821 87.8-153.9 -66.4 -35.9 29.8 35.6 31.3 17 50 A N T <5S+ 0 0 132 -4,-2.3 -3,-0.2 -5,-0.3 -4,-0.1 0.802 71.4 78.2 54.1 30.1 27.4 38.0 33.2 18 51 A Q S - 0 0 44 -2,-0.1 4,-1.8 1,-0.1 3,-0.1 -0.410 29.7-100.2 -87.5 171.9 28.7 39.1 20.8 22 55 A E H > S+ 0 0 47 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.899 120.7 52.8 -61.8 -42.6 27.4 39.5 17.3 23 56 A E H > S+ 0 0 56 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.883 108.3 51.8 -62.8 -35.7 29.5 36.7 15.8 24 57 A Q H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.860 107.7 53.2 -66.5 -37.7 28.2 34.3 18.4 25 58 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.936 110.1 45.9 -61.3 -51.2 24.6 35.3 17.6 26 59 A W H X S+ 0 0 5 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.902 115.2 49.8 -54.0 -41.7 25.1 34.5 13.9 27 60 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 -5,-0.2 5,-0.3 0.913 109.3 47.4 -69.8 -42.1 26.8 31.2 14.9 28 61 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.927 113.3 51.1 -67.5 -39.5 24.2 29.9 17.3 29 62 A C H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.950 114.5 41.8 -59.6 -53.3 21.5 30.7 14.7 30 63 A Y H X S+ 0 0 28 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.919 118.5 44.2 -60.1 -50.7 23.3 28.9 11.9 31 64 A Q H X S+ 0 0 29 -4,-2.9 4,-2.2 2,-0.2 32,-0.3 0.906 114.8 48.0 -65.4 -43.1 24.3 25.8 14.0 32 65 A C H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.922 111.3 50.5 -66.6 -41.2 21.0 25.4 15.8 33 66 A C H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.894 109.1 52.5 -63.8 -37.0 19.1 25.7 12.5 34 67 A G H X S+ 0 0 15 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.938 110.8 46.7 -62.0 -44.7 21.4 23.0 11.0 35 68 A S H X S+ 0 0 38 -4,-2.2 4,-2.4 28,-0.4 -2,-0.2 0.918 113.7 48.7 -62.5 -42.8 20.6 20.7 13.9 36 69 A L H X S+ 0 0 20 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.868 109.5 52.0 -65.8 -39.0 16.9 21.3 13.6 37 70 A R H X S+ 0 0 91 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.902 112.6 45.5 -63.1 -42.5 16.9 20.7 9.9 38 71 A A H X S+ 0 0 56 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.881 110.3 53.6 -69.8 -39.3 18.6 17.4 10.3 39 72 A A H <>S+ 0 0 25 -4,-2.4 5,-2.5 1,-0.2 -2,-0.2 0.892 109.0 49.6 -62.5 -39.1 16.3 16.4 13.2 40 73 A A H ><5S+ 0 0 15 -4,-2.0 3,-1.5 1,-0.2 -1,-0.2 0.852 106.5 55.5 -67.3 -38.2 13.2 17.0 11.0 41 74 A R H 3<5S+ 0 0 215 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.790 106.9 50.3 -66.1 -29.1 14.7 15.0 8.2 42 75 A R T 3<5S- 0 0 205 -4,-1.4 -1,-0.3 -3,-0.1 -2,-0.2 0.133 121.6-111.5 -94.9 19.0 15.0 12.1 10.6 43 76 A R T < 5 + 0 0 168 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.719 63.1 151.7 58.6 31.1 11.4 12.6 11.6 44 77 A Q < - 0 0 112 -5,-2.5 -1,-0.2 1,-0.1 -2,-0.1 -0.730 54.9-100.9 -80.5 139.7 11.9 13.8 15.2 45 78 A P - 0 0 108 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.286 33.3-117.2 -67.6 148.2 9.0 16.0 16.1 46 79 A R + 0 0 27 30,-0.2 2,-0.3 -6,-0.1 29,-0.1 -0.571 36.5 174.1 -77.6 144.7 9.4 19.8 16.0 47 80 A H - 0 0 44 -2,-0.2 2,-0.1 31,-0.0 29,-0.1 -0.980 29.3 -99.9-147.5 163.2 9.1 21.8 19.2 48 81 A R - 0 0 64 -2,-0.3 2,-0.9 1,-0.1 33,-0.1 -0.423 27.9-115.5 -84.9 149.9 9.6 25.5 20.3 49 82 A V + 0 0 6 32,-0.3 39,-0.1 1,-0.2 3,-0.1 -0.789 35.3 177.8 -79.6 108.5 12.5 27.0 22.0 50 83 A R - 0 0 176 -2,-0.9 2,-0.3 1,-0.2 -1,-0.2 0.765 61.3 -10.2 -84.2 -28.3 10.9 28.1 25.3 51 84 A S S > S- 0 0 43 1,-0.0 3,-1.6 0, 0.0 4,-0.3 -0.976 71.7 -96.1-163.6 164.2 14.0 29.5 27.0 52 85 A A G > S+ 0 0 17 -2,-0.3 3,-1.1 1,-0.3 -43,-1.0 0.741 113.7 73.4 -61.7 -23.5 17.8 29.8 26.7 53 86 A A G 3 S+ 0 0 41 1,-0.2 -1,-0.3 -44,-0.2 -42,-0.1 0.712 91.9 57.0 -62.7 -21.2 18.1 26.8 29.1 54 87 A Q G < S+ 0 0 34 -3,-1.6 12,-2.9 -46,-0.1 2,-0.6 0.630 86.4 88.0 -85.0 -17.1 16.9 24.6 26.2 55 88 A I E < - B 0 65A 0 -3,-1.1 -46,-2.3 -4,-0.3 2,-0.5 -0.777 64.5-162.4 -87.6 122.2 19.7 25.6 23.8 56 89 A R E -AB 8 64A 108 8,-3.0 8,-2.2 -2,-0.6 2,-0.5 -0.902 7.8-160.1-110.6 125.3 22.8 23.4 24.2 57 90 A V E -AB 7 63A 0 -50,-3.4 -50,-2.1 -2,-0.5 6,-0.2 -0.904 20.7-148.2-104.0 131.6 26.3 24.4 23.0 58 91 A W E > -A 6 0A 78 4,-3.0 3,-2.0 -2,-0.5 -52,-0.2 -0.563 24.2-112.1-107.2 162.9 28.7 21.4 22.6 59 92 A R T 3 S+ 0 0 111 -54,-2.2 104,-0.1 1,-0.3 -53,-0.1 0.806 118.5 49.3 -57.3 -35.3 32.4 20.8 22.9 60 93 A D T 3 S- 0 0 95 -55,-0.2 -1,-0.3 102,-0.1 99,-0.2 0.317 126.2 -97.8 -91.2 6.5 32.7 20.1 19.2 61 94 A G S < S+ 0 0 0 -3,-2.0 97,-0.2 1,-0.3 98,-0.2 0.412 76.9 140.2 94.8 -1.6 30.8 23.3 18.3 62 95 A A - 0 0 29 96,-0.1 -4,-3.0 -5,-0.1 2,-0.4 -0.366 36.4-156.8 -65.9 150.0 27.3 21.8 17.7 63 96 A V E +B 57 0A 0 -32,-0.3 -28,-0.4 -6,-0.2 2,-0.3 -0.990 20.1 170.6-130.4 125.8 24.2 23.7 18.9 64 97 A T E -B 56 0A 40 -8,-2.2 -8,-3.0 -2,-0.4 2,-0.5 -0.839 34.6-119.9-130.7 164.0 21.1 21.7 19.6 65 98 A L E -B 55 0A 20 -2,-0.3 -10,-0.2 -10,-0.2 3,-0.1 -0.952 35.8-122.3-104.9 124.2 17.7 22.1 21.2 66 99 A A - 0 0 13 -12,-2.9 -12,-0.0 -2,-0.5 -13,-0.0 -0.379 37.6 -95.0 -66.3 140.1 17.1 19.8 24.1 67 100 A P 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -20,-0.0 -0.107 360.0 360.0 -54.8 155.4 14.0 17.5 23.8 68 101 A A 0 0 123 -3,-0.1 -2,-0.0 0, 0.0 -20,-0.0 0.227 360.0 360.0 -35.2 360.0 10.6 18.6 25.3 69 ! 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 70 114 A K 0 0 137 0, 0.0 3,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 158.7 7.1 14.7 4.3 71 115 A L + 0 0 46 1,-0.2 3,-0.0 -31,-0.2 -30,-0.0 -0.263 360.0 131.9 -97.5 46.4 6.6 16.3 7.7 72 116 A G S S+ 0 0 38 -2,-0.3 2,-0.4 1,-0.2 6,-0.3 0.866 71.6 39.1 -63.6 -39.8 5.9 19.8 6.2 73 117 A Y S S+ 0 0 201 -3,-0.4 2,-0.3 4,-0.1 -1,-0.2 -0.962 76.3 129.3-116.9 130.6 2.8 20.3 8.3 74 118 A S S S- 0 0 46 -2,-0.4 3,-0.1 -3,-0.0 -3,-0.0 -0.875 74.2 -69.2-156.2-172.8 2.5 19.2 11.9 75 119 A Q S S+ 0 0 187 -2,-0.3 2,-0.3 1,-0.2 -2,-0.0 0.522 125.7 40.7 -68.0 -5.7 1.6 20.5 15.4 76 120 A C S S- 0 0 4 -29,-0.1 -30,-0.2 -28,-0.0 -1,-0.2 -0.891 80.4-151.9-145.3 110.8 4.7 22.7 15.2 77 121 A M >> - 0 0 56 -2,-0.3 4,-1.5 -3,-0.1 3,-1.0 -0.524 25.7-115.8 -81.6 151.4 5.7 24.5 12.0 78 122 A E H 3> S+ 0 0 48 -6,-0.3 4,-2.8 1,-0.2 5,-0.2 0.871 114.9 55.9 -49.5 -44.5 9.3 25.5 11.1 79 123 A T H 3> S+ 0 0 57 52,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.814 104.0 54.8 -64.5 -27.1 8.6 29.2 11.2 80 124 A E H <> S+ 0 0 67 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.903 109.7 45.4 -69.9 -43.0 7.3 28.8 14.8 81 125 A V H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -32,-0.3 0.940 113.3 51.0 -62.2 -46.2 10.6 27.2 15.9 82 126 A I H X S+ 0 0 4 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.913 110.2 50.3 -59.0 -42.0 12.5 30.0 14.0 83 127 A E H X S+ 0 0 52 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.942 110.7 47.6 -61.1 -50.0 10.5 32.7 15.7 84 128 A S H X S+ 0 0 16 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.880 113.9 48.2 -62.8 -36.5 11.1 31.2 19.1 85 129 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.909 108.9 53.7 -66.7 -44.6 14.9 30.9 18.4 86 130 A G H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.920 108.8 49.0 -54.8 -47.1 15.0 34.5 17.1 87 131 A I H X S+ 0 0 19 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.919 111.5 48.6 -60.4 -46.2 13.5 35.8 20.3 88 132 A I H X S+ 0 0 14 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.884 109.5 52.5 -64.3 -38.5 15.9 33.9 22.5 89 133 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.899 109.3 49.5 -63.8 -41.1 18.9 35.0 20.4 90 134 A Y H X S+ 0 0 4 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.928 108.5 52.8 -65.2 -42.2 17.9 38.7 20.9 91 135 A K H < S+ 0 0 85 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.892 108.4 51.3 -55.8 -41.6 17.5 38.1 24.6 92 136 A A H >< S+ 0 0 1 -4,-2.0 -72,-1.3 1,-0.2 3,-0.5 0.864 110.9 47.5 -61.6 -39.6 21.1 36.8 24.7 93 137 A L H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 -74,-0.2 -2,-0.2 0.732 116.5 44.6 -71.4 -24.1 22.3 39.9 22.8 94 138 A D T >< S+ 0 0 32 -4,-1.7 3,-2.4 -5,-0.2 -1,-0.2 0.389 82.7 146.1 -98.8 1.5 20.4 42.1 25.2 95 139 A Y T < S- 0 0 80 -3,-0.5 3,-0.1 -4,-0.4 -3,-0.1 -0.127 74.2 -3.0 -53.9 121.5 21.4 40.2 28.4 96 140 A G T 3 S+ 0 0 73 1,-0.3 -1,-0.3 -78,-0.1 2,-0.1 0.406 94.8 136.1 82.3 -1.8 21.8 42.5 31.4 97 141 A L < - 0 0 21 -3,-2.4 -1,-0.3 1,-0.1 -3,-0.0 -0.487 60.2-105.2 -77.5 149.6 21.1 45.7 29.6 98 142 A K > - 0 0 137 -2,-0.1 3,-1.7 1,-0.1 -1,-0.1 -0.348 29.1-112.7 -70.6 155.3 18.8 48.3 31.2 99 143 A E T 3 S+ 0 0 163 1,-0.3 -1,-0.1 -2,-0.0 -2,-0.1 0.797 117.2 52.7 -61.6 -29.6 15.3 48.6 29.9 100 144 A N T 3 S+ 0 0 122 81,-0.1 82,-2.0 2,-0.0 2,-0.3 0.427 99.9 77.3 -88.3 0.6 16.0 52.1 28.5 101 145 A E E < -C 181 0B 37 -3,-1.7 2,-0.4 80,-0.2 -4,-0.0 -0.805 59.7-167.5-106.8 153.7 19.1 51.0 26.6 102 146 A E E -C 180 0B 2 78,-2.5 78,-3.2 -2,-0.3 2,-0.3 -0.999 24.0-116.2-140.3 139.5 19.2 49.2 23.3 103 147 A R E -C 179 0B 10 -2,-0.4 2,-1.2 76,-0.2 76,-0.2 -0.546 22.3-130.3 -76.7 136.5 22.1 47.5 21.6 104 148 A E - 0 0 81 74,-2.1 2,-0.2 -2,-0.3 74,-0.1 -0.730 33.5-170.4 -88.9 95.1 23.2 48.9 18.3 105 149 A L - 0 0 10 -2,-1.2 74,-0.0 1,-0.1 -3,-0.0 -0.541 32.4 -95.3 -84.8 152.4 23.4 45.8 16.1 106 150 A S >> - 0 0 35 -2,-0.2 4,-2.5 1,-0.1 3,-0.8 -0.392 42.4-113.6 -59.2 140.5 24.8 45.7 12.6 107 151 A P H 3> S+ 0 0 104 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.850 114.0 52.2 -48.4 -43.0 22.0 46.2 10.1 108 152 A P H 3> S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.850 111.9 45.9 -67.5 -31.6 22.2 42.7 8.6 109 153 A L H <> S+ 0 0 0 -3,-0.8 4,-2.4 2,-0.2 5,-0.2 0.895 112.9 50.0 -71.4 -43.5 22.0 41.0 12.1 110 154 A E H X S+ 0 0 50 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.932 112.1 49.0 -58.7 -44.0 19.1 43.3 13.1 111 155 A Q H X S+ 0 0 42 -4,-2.7 4,-2.2 -5,-0.3 5,-0.2 0.896 108.6 52.3 -62.0 -45.6 17.4 42.4 9.8 112 156 A L H X S+ 0 0 3 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.947 114.1 43.3 -53.5 -49.3 17.9 38.6 10.3 113 157 A I H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.902 109.9 55.3 -68.5 -41.5 16.4 38.8 13.8 114 158 A D H <>S+ 0 0 21 -4,-2.7 5,-2.6 1,-0.2 6,-0.8 0.900 114.4 41.8 -54.9 -44.0 13.5 41.1 12.7 115 159 A H H <5S+ 0 0 14 -4,-2.2 3,-0.4 3,-0.2 15,-0.2 0.863 113.9 50.9 -77.3 -36.5 12.5 38.5 10.1 116 160 A M H <5S+ 0 0 1 -4,-2.5 -2,-0.2 -5,-0.2 -30,-0.2 0.944 115.7 42.5 -60.1 -47.9 13.1 35.4 12.3 117 161 A A T <5S- 0 0 0 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.477 107.2-125.1 -83.3 -2.5 11.0 36.9 15.1 118 162 A N T 5S+ 0 0 82 -3,-0.4 -3,-0.2 -4,-0.4 -4,-0.1 0.886 72.8 127.8 57.2 42.4 8.2 38.2 12.7 119 163 A T < + 0 0 2 -5,-2.6 -4,-0.2 -6,-0.2 2,-0.2 0.359 28.0 130.1-104.4 2.2 8.6 41.7 14.1 120 164 A V 0 0 55 -6,-0.8 6,-0.0 -9,-0.1 -9,-0.0 -0.378 360.0 360.0 -67.0 126.1 9.1 43.3 10.7 121 165 A E 0 0 165 -2,-0.2 -2,-0.1 0, 0.0 -1,-0.0 -0.670 360.0 360.0-111.9 360.0 6.8 46.4 10.1 122 ! 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 0.0 123 186 A E 0 0 102 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -14.9 17.9 43.6 0.7 124 187 A K + 0 0 112 1,-0.1 3,-0.1 2,-0.1 0, 0.0 0.715 360.0 21.9 -65.7 -26.2 18.6 47.2 1.9 125 188 A R S S- 0 0 79 1,-0.4 2,-0.3 0, 0.0 -1,-0.1 0.819 135.9 -10.1-102.8 -57.3 14.9 47.9 2.9 126 189 A K - 0 0 133 -6,-0.0 -1,-0.4 3,-0.0 2,-0.2 -0.995 60.0-140.3-147.2 142.4 13.3 44.4 3.4 127 190 A I - 0 0 33 -2,-0.3 3,-0.1 1,-0.2 -3,-0.0 -0.550 40.8 -82.9 -96.1 164.2 14.4 40.8 2.7 128 191 A S - 0 0 110 -2,-0.2 -1,-0.2 1,-0.1 2,-0.1 -0.255 61.8 -87.5 -60.1 153.3 12.1 37.9 1.5 129 192 A A - 0 0 79 1,-0.1 2,-0.5 -3,-0.1 -1,-0.1 -0.425 41.9-114.9 -69.2 141.6 10.1 36.2 4.2 130 193 A I + 0 0 17 -15,-0.2 -1,-0.1 1,-0.2 3,-0.1 -0.653 41.5 165.8 -77.5 122.7 11.9 33.4 6.0 131 194 A R + 0 0 210 -2,-0.5 2,-0.3 1,-0.2 -52,-0.3 0.568 56.6 19.3-110.5 -15.7 10.1 30.1 5.3 132 195 A S S > S- 0 0 30 -54,-0.1 4,-1.5 1,-0.1 -1,-0.2 -0.952 75.9-101.4-153.2 162.9 12.6 27.4 6.4 133 196 A Y H > S+ 0 0 1 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.891 121.3 57.0 -54.9 -40.2 15.7 26.5 8.4 134 197 A R H > S+ 0 0 135 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.888 101.0 56.7 -62.7 -37.5 17.7 26.6 5.1 135 198 A D H > S+ 0 0 52 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.901 109.2 45.7 -58.9 -44.5 16.5 30.3 4.6 136 199 A V H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.925 112.1 51.1 -64.3 -46.4 18.0 31.3 8.0 137 200 A M H X S+ 0 0 10 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.888 107.7 52.9 -60.8 -38.0 21.3 29.3 7.3 138 201 A K H X S+ 0 0 103 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.891 108.1 50.5 -66.9 -38.6 21.7 31.1 3.9 139 202 A L H < S+ 0 0 53 -4,-1.6 4,-0.5 2,-0.2 -1,-0.2 0.887 111.2 48.7 -64.3 -39.4 21.3 34.5 5.5 140 203 A C H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.877 109.7 51.9 -66.9 -37.1 24.0 33.6 8.2 141 204 A A H >< S+ 0 0 12 -4,-2.2 3,-2.0 1,-0.2 -2,-0.2 0.889 101.0 62.5 -66.5 -34.8 26.3 32.3 5.4 142 205 A A T 3< S+ 0 0 54 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.665 86.9 72.8 -65.2 -18.4 25.8 35.6 3.6 143 206 A H T < S+ 0 0 64 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.714 90.0 76.5 -62.8 -20.8 27.5 37.4 6.7 144 207 A L S < S- 0 0 19 -3,-2.0 3,-0.2 -4,-0.3 6,-0.1 -0.711 82.6-133.2 -98.9 143.8 30.8 35.9 5.4 145 208 A P S S+ 0 0 135 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.827 108.3 36.4 -59.8 -33.8 32.9 37.2 2.5 146 209 A T S > S- 0 0 72 1,-0.1 3,-2.0 -5,-0.1 4,-0.1 -0.937 78.3-163.8-123.0 102.7 33.2 33.6 1.2 147 210 A E G > S+ 0 0 107 -2,-0.5 3,-2.1 1,-0.3 -1,-0.1 0.781 83.2 68.2 -65.0 -30.6 29.9 31.9 2.0 148 211 A S G 3 S+ 0 0 104 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.591 88.7 69.2 -65.2 -8.6 31.2 28.4 1.5 149 212 A D G <> S+ 0 0 88 -3,-2.0 4,-2.8 1,-0.2 -1,-0.3 0.574 74.6 94.9 -77.9 -10.9 33.3 29.0 4.7 150 213 A A H <> S+ 0 0 1 -3,-2.1 4,-2.7 1,-0.2 5,-0.4 0.863 77.3 50.0 -55.2 -49.1 30.1 29.0 6.8 151 214 A P H > S+ 0 0 64 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.942 119.5 37.7 -59.0 -47.4 29.9 25.3 8.0 152 215 A N H > S+ 0 0 127 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.900 118.1 50.7 -67.4 -42.7 33.5 25.4 9.3 153 216 A H H X S+ 0 0 58 -4,-2.8 4,-2.3 2,-0.2 -3,-0.2 0.932 110.0 45.6 -65.2 -48.7 33.4 28.9 10.6 154 217 A Y H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.856 112.2 52.6 -71.5 -29.7 30.2 28.7 12.6 155 218 A Q H X S+ 0 0 79 -4,-1.4 4,-2.6 -5,-0.4 -1,-0.2 0.934 109.9 49.6 -63.3 -45.4 31.4 25.4 14.2 156 219 A A H X S+ 0 0 53 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.863 108.2 53.6 -62.3 -38.0 34.7 27.1 15.1 157 220 A V H X S+ 0 0 24 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.937 113.4 41.0 -61.4 -49.8 32.8 30.1 16.7 158 221 A C H X S+ 0 0 0 -4,-1.9 4,-2.5 -97,-0.2 -97,-0.3 0.840 110.7 58.2 -70.6 -33.0 30.7 27.8 19.0 159 222 A R H X S+ 0 0 151 -4,-2.6 4,-2.3 -99,-0.2 -1,-0.2 0.914 110.5 43.6 -57.9 -45.2 33.8 25.6 19.7 160 223 A A H X S+ 0 0 63 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.893 111.3 53.5 -68.4 -39.7 35.6 28.7 21.1 161 224 A L H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.905 111.5 46.8 -62.0 -42.1 32.5 29.8 23.0 162 225 A F H X S+ 0 0 3 -4,-2.5 4,-2.7 -104,-0.2 -2,-0.2 0.950 112.5 48.5 -62.6 -50.6 32.2 26.4 24.7 163 226 A A H X S+ 0 0 55 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.916 113.2 47.9 -59.5 -44.3 36.0 26.3 25.5 164 227 A E H X S+ 0 0 90 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.905 117.9 39.0 -63.4 -44.3 35.9 29.8 27.0 165 228 A T H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 3,-0.2 0.804 105.4 66.6 -81.2 -25.5 32.8 29.3 29.1 166 229 A M H X S+ 0 0 11 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.862 98.6 54.0 -65.0 -32.6 33.7 25.7 30.2 167 230 A E H X S+ 0 0 119 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.848 110.5 45.6 -68.2 -33.5 36.6 27.1 32.1 168 231 A L H X S+ 0 0 46 -4,-0.7 4,-2.5 -3,-0.2 -2,-0.2 0.883 113.3 51.0 -72.2 -39.1 34.3 29.5 34.0 169 232 A H H < S+ 0 0 34 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.933 115.6 40.6 -62.0 -46.3 31.8 26.6 34.5 170 233 A T H < S+ 0 0 28 -4,-2.7 -1,-0.2 -169,-0.2 -2,-0.2 0.841 130.3 24.7 -70.1 -33.5 34.5 24.3 36.0 171 234 A F H < S+ 0 0 159 -4,-1.5 2,-0.2 -5,-0.2 -2,-0.2 0.560 85.0 108.0-121.3 -16.4 36.3 26.9 38.0 172 235 A L < 0 0 103 -4,-2.5 -4,-0.0 -5,-0.1 -157,-0.0 -0.521 360.0 360.0 -65.1 133.2 34.2 29.9 39.1 173 236 A T 0 0 185 -2,-0.2 -1,-0.1 -172,-0.0 -4,-0.0 0.171 360.0 360.0-124.9 360.0 33.2 30.0 42.8 174 !* 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 0.0 175 1702 B S 0 0 46 0, 0.0 -153,-0.2 0, 0.0 -157,-0.0 0.000 360.0 360.0 360.0 114.4 30.5 41.5 24.6 176 1703 B L + 0 0 58 1,-0.1 2,-0.6 -155,-0.1 -72,-0.2 0.862 360.0 148.6 -97.2 -49.6 28.0 44.4 24.3 177 1704 B Y + 0 0 220 -74,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.303 53.7 59.0 45.5 -94.4 30.0 47.6 23.9 178 1705 B K + 0 0 142 -2,-0.6 -74,-2.1 -74,-0.1 2,-0.3 -0.477 62.7 167.8 -80.1 119.3 27.9 50.0 21.7 179 1706 B I E -C 103 0B 64 -2,-0.4 -76,-0.2 -76,-0.2 -78,-0.0 -0.931 14.1-167.4-126.9 149.2 24.5 51.0 23.0 180 1707 B K E -C 102 0B 69 -78,-3.2 -78,-2.5 -2,-0.3 2,-0.2 -0.777 42.1 -79.1-121.9 167.0 21.9 53.6 22.0 181 1708 B P E -C 101 0B 113 0, 0.0 2,-0.3 0, 0.0 -80,-0.2 -0.528 60.5 -97.1 -65.2 140.4 18.8 55.0 23.7 182 1709 B R - 0 0 82 -82,-2.0 2,-0.2 -2,-0.2 -81,-0.0 -0.438 38.6-139.6 -63.8 116.6 15.9 52.5 23.2 183 1710 B H > - 0 0 106 -2,-0.3 3,-0.7 1,-0.1 6,-0.4 -0.546 11.7-127.0 -80.7 147.4 13.7 53.7 20.3 184 1711 B D T 3 S+ 0 0 132 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 0.698 106.7 28.6 -68.6 -24.1 9.9 53.4 20.7 185 1712 B S T 3 S+ 0 0 75 4,-0.1 -1,-0.2 5,-0.0 5,-0.0 0.304 98.7 112.6-117.8 6.3 9.4 51.4 17.5 186 1713 B G S <> S- 0 0 17 -3,-0.7 4,-2.3 1,-0.1 5,-0.2 0.014 84.6 -85.3 -78.8-176.2 12.7 49.6 17.2 187 1714 B I H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.870 126.1 51.4 -62.4 -39.0 13.6 45.9 17.5 188 1715 B K H > S+ 0 0 10 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.942 110.6 50.9 -62.5 -45.0 13.9 45.9 21.3 189 1716 B A H > S+ 0 0 10 -6,-0.4 4,-1.0 1,-0.2 -2,-0.2 0.939 113.9 43.7 -54.2 -51.2 10.5 47.5 21.6 190 1717 B K H < S+ 0 0 29 -4,-2.3 3,-0.4 1,-0.2 4,-0.3 0.904 113.8 48.7 -65.3 -43.8 8.9 45.0 19.3 191 1718 B I H >< S+ 0 0 4 -4,-2.8 3,-1.3 1,-0.2 -1,-0.2 0.848 103.1 61.7 -66.5 -33.5 10.6 41.9 20.8 192 1719 B S H >< S+ 0 0 47 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.841 99.5 56.8 -61.9 -32.4 9.7 42.9 24.4 193 1720 B M T 3< S+ 0 0 161 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.518 103.2 51.1 -81.0 -6.2 6.0 42.7 23.5 194 1721 B K T < 0 0 84 -3,-1.3 -1,-0.3 1,-0.4 -2,-0.2 0.311 360.0 360.0 -97.5 6.2 6.3 39.1 22.4 195 1722 B T < 0 0 119 -3,-1.2 -1,-0.4 -4,-0.1 -2,-0.0 -0.608 360.0 360.0 56.1 360.0 7.9 38.6 25.8