==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 05-MAR-12 4E17 . COMPND 2 MOLECULE: VINCULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR H.-J.CHOI,S.POKUTTA,G.W.CADWELL,L.A.BANKSTON,R.C.LIDDINGTON, . 274 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15272.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 226 82.5 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 . 2 0.7 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 . 6 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 205 74.8 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 0 1 2 0 0 0 2 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 I 0 0 225 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.9 -2.3 -27.2 7.6 2 0 A Q - 0 0 175 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.274 360.0-121.8 -76.5 140.8 -4.2 -24.1 8.7 3 1 A M - 0 0 92 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.547 39.3-110.0 -71.3 135.9 -2.9 -20.7 9.8 4 2 A P - 0 0 107 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.188 33.9 -92.4 -68.3 159.9 -4.0 -19.7 13.3 5 3 A V - 0 0 87 1,-0.1 176,-0.1 2,-0.1 177,-0.0 -0.474 53.0 -98.2 -65.9 139.7 -6.5 -17.0 14.1 6 4 A F - 0 0 15 -2,-0.1 175,-0.1 1,-0.1 -1,-0.1 -0.286 31.3-120.0 -63.1 152.7 -4.7 -13.6 14.7 7 5 A H S S+ 0 0 40 173,-0.1 174,-1.2 -3,-0.1 2,-0.3 0.852 84.5 15.4 -70.2 -41.9 -4.2 -12.8 18.4 8 6 A T B > S-A 180 0A 3 172,-0.2 4,-2.4 173,-0.1 172,-0.2 -0.867 75.7-110.4-130.6 166.8 -6.1 -9.5 18.7 9 7 A R H > S+ 0 0 126 170,-2.6 4,-2.4 -2,-0.3 5,-0.1 0.835 116.7 54.3 -65.7 -34.6 -8.7 -7.6 16.8 10 8 A T H > S+ 0 0 24 2,-0.2 4,-1.6 169,-0.2 -1,-0.2 0.954 111.4 43.1 -62.0 -52.0 -6.2 -4.9 15.9 11 9 A I H > S+ 0 0 8 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.901 113.5 54.1 -61.6 -41.3 -3.7 -7.3 14.4 12 10 A E H X S+ 0 0 68 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.916 106.7 50.2 -56.8 -47.8 -6.6 -9.1 12.7 13 11 A S H < S+ 0 0 75 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.829 116.5 42.2 -64.3 -32.6 -7.8 -5.9 11.0 14 12 A I H < S+ 0 0 0 -4,-1.6 4,-0.3 -5,-0.1 -2,-0.2 0.901 126.1 27.4 -78.9 -43.3 -4.3 -5.1 9.8 15 13 A L H X S+ 0 0 3 -4,-2.8 4,-2.7 -5,-0.2 3,-0.5 0.772 100.7 75.4 -99.7 -29.7 -3.1 -8.5 8.6 16 14 A E H X S+ 0 0 86 -4,-2.2 4,-2.1 -5,-0.4 5,-0.2 0.875 95.9 50.8 -54.3 -44.9 -6.2 -10.5 7.6 17 15 A P H > S+ 0 0 50 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.860 113.0 48.0 -63.5 -31.6 -6.8 -8.7 4.3 18 16 A V H > S+ 0 0 3 -3,-0.5 4,-2.2 -4,-0.3 -2,-0.2 0.933 110.3 50.8 -69.0 -47.2 -3.1 -9.3 3.4 19 17 A A H X S+ 0 0 9 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.847 112.5 47.5 -59.2 -35.9 -3.4 -13.0 4.3 20 18 A Q H X S+ 0 0 116 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.912 109.7 50.6 -74.4 -44.6 -6.5 -13.4 2.2 21 19 A Q H X S+ 0 0 25 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.872 110.1 51.4 -61.7 -37.8 -5.1 -11.6 -0.9 22 20 A I H X S+ 0 0 6 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.910 107.2 52.7 -64.6 -43.2 -1.9 -13.8 -0.7 23 21 A S H X S+ 0 0 63 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.905 109.1 50.3 -57.7 -42.3 -4.1 -16.9 -0.6 24 22 A H H X S+ 0 0 100 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.928 110.5 49.5 -60.0 -48.5 -5.9 -15.7 -3.7 25 23 A L H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.907 109.6 51.2 -57.6 -45.9 -2.5 -15.1 -5.4 26 24 A V H X S+ 0 0 18 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.904 109.2 50.9 -59.4 -43.4 -1.3 -18.6 -4.5 27 25 A I H X S+ 0 0 98 -4,-2.2 4,-1.3 1,-0.2 5,-0.3 0.903 109.0 51.0 -61.9 -42.6 -4.5 -20.1 -5.9 28 26 A M H < S+ 0 0 52 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.896 110.8 50.4 -58.4 -41.3 -4.0 -18.2 -9.2 29 27 A H H < S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.921 113.4 43.0 -64.0 -46.7 -0.4 -19.5 -9.3 30 28 A E H < S+ 0 0 145 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.654 126.5 30.1 -76.5 -16.7 -1.4 -23.2 -8.8 31 29 A E S < S- 0 0 157 -4,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.831 118.9 -6.6-106.4 -80.0 -4.3 -23.0 -11.2 32 30 A G 0 0 67 -4,-0.5 -4,-0.1 -5,-0.3 -3,-0.1 0.877 360.0 360.0 -96.3 -95.5 -4.5 -20.7 -14.2 33 31 A E 0 0 167 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.779 360.0 360.0-136.0 360.0 -2.1 -18.0 -15.3 34 ! 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 35 37 A I 0 0 104 0, 0.0 240,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 111.2 1.2 -7.2 -16.4 36 38 A P - 0 0 66 0, 0.0 2,-0.6 0, 0.0 238,-0.0 -0.130 360.0 -77.1 -68.8 169.3 2.0 -3.5 -15.6 37 39 A D > - 0 0 89 1,-0.1 3,-0.5 57,-0.0 53,-0.1 -0.592 42.3-167.2 -69.6 113.1 5.5 -2.3 -14.5 38 40 A L T 3> + 0 0 5 -2,-0.6 4,-1.3 52,-0.2 5,-0.2 0.239 62.0 99.1 -89.4 14.4 5.7 -3.3 -10.8 39 41 A T H 3> S+ 0 0 52 51,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.910 82.9 45.1 -68.4 -43.3 8.7 -1.2 -10.2 40 42 A A H <> S+ 0 0 69 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.924 112.7 46.7 -70.2 -47.5 6.8 1.8 -8.6 41 43 A P H > S+ 0 0 12 0, 0.0 4,-1.4 0, 0.0 230,-0.2 0.830 111.3 54.2 -67.8 -26.6 4.4 -0.1 -6.3 42 44 A V H X S+ 0 0 6 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.900 106.6 51.5 -65.7 -41.4 7.4 -2.2 -5.1 43 45 A S H X S+ 0 0 57 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.833 106.3 54.9 -62.8 -33.3 9.2 1.0 -4.2 44 46 A A H X S+ 0 0 50 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.852 108.5 48.2 -67.9 -35.9 6.2 2.2 -2.3 45 47 A V H X S+ 0 0 1 -4,-1.4 4,-2.8 222,-0.2 5,-0.2 0.900 109.9 52.0 -69.0 -42.5 6.4 -1.1 -0.3 46 48 A Q H X S+ 0 0 83 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.918 110.6 48.6 -57.7 -45.3 10.1 -0.5 0.3 47 49 A A H X S+ 0 0 49 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.926 112.2 47.8 -61.3 -47.6 9.3 3.0 1.6 48 50 A A H X S+ 0 0 9 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.907 113.9 46.8 -60.7 -44.9 6.6 1.8 3.9 49 51 A V H X S+ 0 0 3 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.887 109.9 54.2 -65.7 -39.6 8.7 -1.0 5.3 50 52 A S H X S+ 0 0 72 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.925 109.9 47.1 -59.6 -45.6 11.6 1.4 5.8 51 53 A N H X S+ 0 0 75 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.876 111.4 51.4 -64.0 -39.8 9.4 3.7 7.8 52 54 A L H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.932 110.8 47.0 -62.3 -47.6 8.1 0.8 9.9 53 55 A V H X S+ 0 0 6 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.868 110.8 54.3 -62.5 -36.8 11.6 -0.4 10.7 54 56 A R H X S+ 0 0 173 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.947 111.1 43.0 -61.7 -51.0 12.6 3.2 11.5 55 57 A V H X S+ 0 0 12 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.859 112.9 54.9 -63.8 -35.5 9.7 3.5 14.0 56 58 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.887 106.8 49.6 -64.3 -39.9 10.5 0.1 15.3 57 59 A K H X S+ 0 0 116 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.875 109.9 50.5 -67.9 -38.3 14.1 1.0 16.0 58 60 A E H X S+ 0 0 102 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.847 111.0 50.1 -66.0 -34.8 13.1 4.2 17.9 59 61 A T H < S+ 0 0 0 -4,-1.8 4,-0.2 2,-0.2 -2,-0.2 0.869 112.2 47.9 -69.4 -37.9 10.7 2.0 19.9 60 62 A V H >< S+ 0 0 14 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.929 112.6 46.7 -68.4 -46.6 13.6 -0.4 20.6 61 63 A Q H 3< S+ 0 0 148 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.826 117.4 42.2 -67.2 -32.6 16.1 2.2 21.7 62 64 A T T 3< S+ 0 0 93 -4,-1.5 -1,-0.2 -5,-0.2 2,-0.2 0.222 94.1 99.6-104.6 14.0 13.7 4.1 23.9 63 65 A T < - 0 0 18 -3,-0.9 -3,-0.0 -4,-0.2 -4,-0.0 -0.620 57.0-153.5 -98.0 160.4 12.0 1.2 25.7 64 66 A E + 0 0 167 -2,-0.2 2,-1.0 4,-0.0 3,-0.1 0.379 68.8 103.0-108.7 -1.0 12.7 -0.2 29.1 65 67 A D > - 0 0 14 1,-0.2 4,-1.6 2,-0.1 3,-0.2 -0.750 53.1-168.6 -85.4 103.1 11.4 -3.7 28.3 66 68 A Q H > S+ 0 0 125 -2,-1.0 4,-1.1 1,-0.2 -1,-0.2 0.789 86.5 55.6 -65.2 -29.8 14.6 -5.7 27.8 67 69 A I H > S+ 0 0 57 2,-0.2 4,-2.5 1,-0.2 3,-0.3 0.890 105.8 51.4 -68.0 -39.9 12.7 -8.6 26.3 68 70 A L H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.852 105.7 56.6 -64.1 -34.6 11.2 -6.3 23.7 69 71 A K H < S+ 0 0 55 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.821 114.1 39.3 -64.2 -32.6 14.7 -5.1 22.9 70 72 A R H < S+ 0 0 154 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.863 119.0 42.5 -85.0 -39.8 15.7 -8.7 22.1 71 73 A D H < S+ 0 0 59 -4,-2.5 4,-0.2 1,-0.1 -3,-0.2 0.756 106.5 56.2 -87.7 -27.9 12.6 -10.0 20.3 72 74 A M S >X S+ 0 0 0 -4,-1.7 3,-2.6 -5,-0.2 4,-0.7 0.927 90.9 66.1 -75.2 -46.9 11.7 -7.2 18.0 73 75 A P H >> S+ 0 0 44 0, 0.0 4,-1.4 0, 0.0 3,-0.9 0.780 91.8 62.4 -52.4 -34.0 14.8 -6.5 15.9 74 76 A P H 3> S+ 0 0 69 0, 0.0 4,-1.5 0, 0.0 -2,-0.1 0.708 97.2 61.0 -64.7 -14.1 14.7 -9.9 14.1 75 77 A A H <> S+ 0 0 3 -3,-2.6 4,-1.9 -4,-0.2 5,-0.2 0.792 98.9 56.6 -75.0 -29.6 11.4 -8.8 12.7 76 78 A F H < - 0 0 75 -4,-2.9 3,-2.2 -5,-0.1 -1,-0.3 -0.819 53.7-165.9-150.0 103.7 10.1 -11.6 -18.8 97 99 A P T 3 S+ 0 0 63 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.646 97.1 56.6 -60.1 -15.8 6.4 -11.1 -17.9 98 100 A Y T 3 S+ 0 0 164 -5,-0.1 2,-0.3 -3,-0.1 -5,-0.1 0.214 76.4 138.8 -99.6 12.1 6.1 -14.9 -18.0 99 101 A S <> - 0 0 14 -3,-2.2 4,-0.8 1,-0.2 -6,-0.1 -0.423 35.0-168.9 -64.5 120.8 8.8 -15.4 -15.4 100 102 A V H > S+ 0 0 82 -2,-0.3 4,-2.2 2,-0.2 3,-0.5 0.904 86.5 53.9 -75.3 -45.3 7.8 -18.2 -13.0 101 103 A P H > S+ 0 0 72 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.845 105.0 57.6 -58.4 -30.6 10.6 -17.5 -10.4 102 104 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.878 106.2 48.9 -63.5 -38.1 9.3 -13.9 -10.4 103 105 A R H X S+ 0 0 28 -4,-0.8 4,-1.8 -3,-0.5 -1,-0.2 0.906 109.8 50.1 -68.1 -42.7 5.9 -15.2 -9.3 104 106 A D H X S+ 0 0 68 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.838 111.3 51.3 -62.9 -32.2 7.4 -17.4 -6.6 105 107 A Y H X S+ 0 0 84 -4,-1.8 4,-3.0 -5,-0.2 5,-0.3 0.888 105.9 52.5 -72.3 -41.4 9.3 -14.3 -5.4 106 108 A L H X S+ 0 0 3 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.872 115.1 43.8 -61.2 -37.5 6.1 -12.1 -5.3 107 109 A I H X S+ 0 0 9 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.934 116.3 44.5 -72.2 -49.7 4.5 -14.8 -3.2 108 110 A D H X S+ 0 0 67 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.897 115.1 48.8 -63.9 -41.7 7.5 -15.5 -0.9 109 111 A G H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.894 111.3 49.9 -64.1 -42.1 8.2 -11.7 -0.4 110 112 A S H X S+ 0 0 0 -4,-1.5 4,-2.4 -5,-0.3 -2,-0.2 0.942 112.5 46.8 -60.7 -49.7 4.5 -11.1 0.4 111 113 A R H X S+ 0 0 121 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.825 110.0 55.2 -60.1 -33.9 4.4 -13.9 2.9 112 114 A G H X S+ 0 0 17 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.898 108.7 46.3 -68.3 -41.7 7.7 -12.6 4.4 113 115 A I H X S+ 0 0 2 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.919 115.2 47.7 -64.4 -44.1 6.2 -9.1 4.9 114 116 A L H X S+ 0 0 17 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.951 114.5 45.3 -60.3 -50.8 3.1 -10.6 6.5 115 117 A S H X S+ 0 0 50 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.862 117.0 45.2 -63.7 -37.4 5.1 -13.0 8.7 116 118 A G H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.882 112.2 49.2 -75.0 -41.4 7.5 -10.2 9.8 117 119 A T H X S+ 0 0 4 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.881 111.8 52.0 -64.9 -36.2 4.8 -7.6 10.4 118 120 A S H X S+ 0 0 30 -4,-2.4 4,-2.7 -5,-0.3 5,-0.2 0.915 108.7 49.6 -62.4 -45.5 3.0 -10.2 12.4 119 121 A D H X S+ 0 0 59 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.924 111.4 48.8 -60.1 -45.8 6.1 -10.9 14.5 120 122 A L H X S+ 0 0 2 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.883 113.8 46.2 -63.0 -40.9 6.6 -7.2 15.2 121 123 A L H X S+ 0 0 11 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.900 114.6 46.6 -69.6 -42.1 2.9 -6.7 16.2 122 124 A L H X S+ 0 0 52 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.915 109.9 53.0 -66.5 -43.1 2.9 -9.7 18.4 123 125 A T H X S+ 0 0 9 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.846 112.3 45.5 -64.6 -32.1 6.2 -8.9 20.1 124 126 A F H X S+ 0 0 15 -4,-1.4 4,-2.0 -5,-0.2 -1,-0.2 0.843 110.8 54.1 -75.5 -34.2 4.8 -5.4 20.9 125 127 A D H X S+ 0 0 14 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.847 105.2 53.4 -67.4 -35.2 1.6 -6.9 22.1 126 128 A E H X S+ 0 0 76 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.818 108.3 50.9 -67.8 -31.0 3.5 -9.2 24.5 127 129 A A H X S+ 0 0 9 -4,-0.9 4,-1.2 2,-0.2 -2,-0.2 0.879 107.6 52.0 -72.2 -39.9 5.2 -6.1 25.9 128 130 A E H X S+ 0 0 37 -4,-2.0 4,-1.1 1,-0.2 3,-0.2 0.875 109.6 50.7 -62.0 -38.3 1.8 -4.4 26.4 129 131 A V H X S+ 0 0 10 -4,-1.8 4,-2.3 1,-0.2 3,-0.2 0.882 102.9 59.1 -67.1 -39.1 0.6 -7.5 28.3 130 132 A R H X S+ 0 0 43 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.811 101.4 55.8 -61.8 -30.1 3.7 -7.4 30.5 131 133 A K H X S+ 0 0 92 -4,-1.2 4,-1.4 -3,-0.2 -1,-0.2 0.892 108.2 47.2 -67.4 -40.5 2.7 -4.0 31.7 132 134 A I H X S+ 0 0 13 -4,-1.1 4,-2.4 -3,-0.2 -2,-0.2 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63.8-161.6-116.0 115.7 -11.0 -15.7 21.7 183 185 A Q H > S+ 0 0 112 -2,-0.6 4,-2.2 1,-0.2 5,-0.2 0.870 87.8 56.5 -65.5 -42.6 -14.4 -15.5 23.5 184 186 A E H > S+ 0 0 143 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.832 107.3 51.3 -58.7 -34.3 -13.6 -17.9 26.3 185 187 A H H > S+ 0 0 24 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.879 107.8 51.6 -71.0 -38.9 -10.6 -15.8 27.3 186 188 A R H X S+ 0 0 80 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.893 111.5 48.7 -61.7 -40.0 -12.8 -12.7 27.3 187 189 A V H X S+ 0 0 51 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.933 110.6 48.2 -67.1 -47.9 -15.2 -14.5 29.6 188 190 A M H X S+ 0 0 66 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.868 113.6 48.9 -61.9 -38.4 -12.6 -15.7 32.1 189 191 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.933 114.9 43.3 -65.3 -47.8 -11.0 -12.3 32.3 190 192 A V H X S+ 0 0 47 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.916 114.1 49.6 -67.1 -44.6 -14.3 -10.5 32.9 191 193 A N H X S+ 0 0 92 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.889 113.8 46.2 -61.1 -41.4 -15.6 -13.0 35.4 192 194 A S H X S+ 0 0 8 -4,-1.7 4,-2.1 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-4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.931 114.4 45.4 -63.5 -47.1 -12.0 -3.5 53.4 205 207 A S H X S+ 0 0 59 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.838 109.2 58.0 -66.6 -33.7 -15.0 -4.1 55.7 206 208 A A H X S+ 0 0 10 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.924 111.0 39.6 -62.9 -46.6 -13.4 -7.3 57.0 207 209 A M H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.679 108.6 62.3 -80.8 -16.8 -10.3 -5.7 58.2 208 210 A K H X S+ 0 0 113 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.915 107.6 44.5 -66.5 -44.1 -12.2 -2.7 59.5 209 211 A I H X S+ 0 0 90 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.912 112.9 51.9 -62.9 -43.8 -13.9 -5.1 61.9 210 212 A F H X S+ 0 0 19 -4,-1.8 4,-1.5 10,-0.2 -2,-0.2 0.897 111.2 46.6 -60.7 -43.6 -10.6 -6.7 62.7 211 213 A V H < S+ 0 0 16 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.947 117.2 42.2 -64.2 -49.2 -9.0 -3.4 63.5 212 214 A T H < S+ 0 0 92 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.891 113.9 50.6 -67.2 -41.9 -11.9 -2.2 65.7 213 215 A T H < 0 0 60 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.808 360.0 360.0 -67.7 -29.8 -12.4 -5.5 67.4 214 216 A K < 0 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