==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE PROTEIN 02-JUL-02 1M46 . COMPND 2 MOLECULE: MYOSIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.TERRAK,R.DOMINGUEZ . 173 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11467.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 72.3 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 . 8 4.6 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 0.6 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 . 4 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 48.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 1 0 1 1 1 3 2 1 0 0 0 0 0 0 0 0 0 0 0 1 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 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A S 0 0 99 0, 0.0 2,-0.2 0, 0.0 67,-0.0 0.000 360.0 360.0 360.0-159.7 12.4 75.2 -4.8 2 3 A A > - 0 0 60 1,-0.2 4,-2.6 4,-0.1 5,-0.2 -0.247 360.0-160.2 -50.4 105.2 9.7 76.3 -7.3 3 4 A T H > S+ 0 0 80 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.829 86.7 64.8 -61.6 -32.8 9.6 80.0 -6.8 4 5 A R H > S+ 0 0 213 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.956 110.8 34.4 -54.4 -57.6 6.1 80.1 -8.4 5 6 A A H > S+ 0 0 48 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.970 119.3 51.9 -59.9 -55.4 4.6 78.1 -5.5 6 7 A N H X S+ 0 0 11 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.887 113.0 46.1 -48.3 -44.9 6.9 79.6 -2.8 7 8 A K H X S+ 0 0 115 -4,-3.5 4,-1.9 2,-0.2 -1,-0.2 0.904 111.7 49.5 -69.6 -44.4 5.9 83.1 -4.0 8 9 A D H X S+ 0 0 90 -4,-2.3 4,-1.2 -5,-0.3 3,-0.3 0.948 111.8 48.6 -58.4 -47.0 2.2 82.4 -4.1 9 10 A I H X S+ 0 0 43 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.822 105.9 59.6 -62.9 -33.2 2.2 80.9 -0.7 10 11 A F H >X S+ 0 0 8 -4,-1.5 4,-1.7 -5,-0.3 3,-0.6 0.906 99.6 55.9 -63.9 -41.7 4.1 83.9 0.5 11 12 A T H 3< S+ 0 0 78 -4,-1.9 3,-0.3 -3,-0.3 -1,-0.2 0.916 102.7 54.5 -58.8 -37.0 1.4 86.3 -0.5 12 13 A L H 3< S+ 0 0 132 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.767 111.2 46.7 -71.7 -24.5 -1.3 84.4 1.6 13 14 A F H << S+ 0 0 64 -4,-1.1 2,-1.8 -3,-0.6 -1,-0.3 0.788 97.8 77.4 -83.1 -24.7 1.0 84.9 4.7 14 15 A D >< + 0 0 27 -4,-1.7 3,-0.9 -3,-0.3 -1,-0.2 -0.469 51.5 154.3 -91.4 74.2 1.6 88.5 3.8 15 16 A K T 3 + 0 0 192 -2,-1.8 -1,-0.2 1,-0.2 6,-0.1 0.857 68.5 58.6 -69.7 -33.3 -1.7 90.0 5.1 16 17 A K T 3 S- 0 0 177 -3,-0.2 -1,-0.2 4,-0.2 -2,-0.1 0.636 100.9-134.1 -68.3 -10.0 -0.4 93.6 5.7 17 18 A G < + 0 0 62 -3,-0.9 -2,-0.1 -6,-0.2 -1,-0.1 0.801 68.7 128.1 61.1 26.0 0.5 93.7 2.0 18 19 A Q S S- 0 0 116 2,-0.3 -1,-0.1 41,-0.0 3,-0.1 0.321 80.5-111.9 -96.2 11.0 3.9 95.1 3.2 19 20 A G S S+ 0 0 36 -5,-0.2 41,-0.7 1,-0.1 2,-0.3 0.685 89.8 78.2 71.9 17.0 6.0 92.6 1.3 20 21 A A E -A 59 0A 9 39,-0.2 -2,-0.3 40,-0.1 2,-0.3 -0.993 63.9-143.0-152.8 151.5 7.2 90.9 4.5 21 22 A I E -A 58 0A 8 37,-2.6 37,-2.9 -2,-0.3 -7,-0.1 -0.838 39.9 -83.4-119.4 156.3 6.0 88.4 7.1 22 23 A A E > -A 57 0A 51 -2,-0.3 3,-2.0 35,-0.2 35,-0.2 -0.210 35.6-126.7 -49.4 134.9 6.5 88.2 10.8 23 24 A K G > S+ 0 0 50 33,-1.4 3,-0.9 1,-0.3 4,-0.3 0.745 109.5 63.0 -60.5 -20.4 9.8 86.6 11.7 24 25 A D G 3 S+ 0 0 157 32,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.548 95.6 59.3 -80.2 -12.6 7.8 84.2 13.9 25 26 A S G <> S+ 0 0 31 -3,-2.0 4,-2.5 1,-0.1 -1,-0.2 0.379 76.2 96.2 -90.7 2.3 5.9 82.9 11.0 26 27 A L H <> S+ 0 0 2 -3,-0.9 4,-2.8 1,-0.2 5,-0.2 0.944 82.4 51.4 -62.1 -45.2 9.1 81.7 9.2 27 28 A G H > S+ 0 0 8 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.933 111.7 47.2 -56.0 -45.4 8.7 78.1 10.6 28 29 A D H > S+ 0 0 87 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.890 112.1 49.6 -62.5 -42.2 5.0 78.0 9.3 29 30 A Y H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.906 110.4 50.0 -62.5 -47.5 6.0 79.3 5.9 30 31 A L H <>S+ 0 0 4 -4,-2.8 5,-2.5 -5,-0.2 4,-0.3 0.863 114.1 46.1 -60.3 -32.8 8.9 76.8 5.6 31 32 A R H ><5S+ 0 0 93 -4,-2.1 3,-1.2 -5,-0.2 -2,-0.2 0.911 107.9 56.6 -74.9 -40.4 6.4 73.9 6.5 32 33 A A H 3<5S+ 0 0 58 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.819 106.5 49.3 -61.3 -32.5 3.8 75.2 4.2 33 34 A I T 3<5S- 0 0 28 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.496 132.2 -84.9 -89.9 -1.9 6.1 75.0 1.2 34 35 A G T < 5S+ 0 0 43 -3,-1.2 -3,-0.2 1,-0.4 2,-0.2 0.436 87.7 113.7 126.1 -0.7 7.2 71.5 2.0 35 36 A Y < - 0 0 13 -5,-2.5 -1,-0.4 43,-0.0 40,-0.1 -0.497 47.4-150.2 -97.2 169.9 10.0 71.4 4.6 36 37 A N + 0 0 100 38,-0.4 2,-0.1 -2,-0.2 -5,-0.1 -0.453 27.3 167.2-137.8 65.5 9.9 70.0 8.1 37 38 A P - 0 0 6 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.406 33.6-123.5 -79.9 154.0 12.4 71.9 10.3 38 39 A T > - 0 0 92 1,-0.1 4,-2.0 -2,-0.1 5,-0.1 -0.495 33.7-106.3 -81.2 167.4 12.5 71.7 14.2 39 40 A N H > S+ 0 0 112 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.847 122.1 59.7 -59.4 -33.2 12.2 75.1 16.0 40 41 A Q H > S+ 0 0 108 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.953 104.4 45.5 -62.3 -50.6 15.8 74.7 16.7 41 42 A L H > S+ 0 0 39 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.901 112.7 51.5 -57.7 -45.8 16.9 74.6 13.0 42 43 A V H X S+ 0 0 13 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.958 113.1 44.7 -59.5 -50.2 14.6 77.6 12.2 43 44 A Q H X S+ 0 0 105 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.888 113.3 51.0 -58.4 -38.7 16.1 79.7 15.0 44 45 A D H X S+ 0 0 80 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.873 107.4 53.4 -69.8 -35.8 19.7 78.5 14.0 45 46 A I H < S+ 0 0 5 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.923 112.9 44.4 -61.1 -45.7 19.1 79.5 10.3 46 47 A I H >< S+ 0 0 9 -4,-2.0 3,-1.6 1,-0.2 7,-0.3 0.932 113.6 47.5 -65.3 -52.1 18.1 83.0 11.4 47 48 A N H 3< S+ 0 0 76 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.782 98.0 70.2 -64.3 -26.8 20.8 83.6 14.0 48 49 A A T 3< S+ 0 0 84 -4,-1.6 2,-0.5 -5,-0.2 -1,-0.3 0.510 95.9 64.4 -66.4 -3.0 23.5 82.4 11.5 49 50 A D X> - 0 0 58 -3,-1.6 4,-3.1 1,-0.1 3,-1.1 -0.911 66.4-166.4-127.5 102.6 22.7 85.7 9.7 50 51 A S H 3> S+ 0 0 81 -2,-0.5 4,-0.7 1,-0.3 -1,-0.1 0.868 91.2 56.8 -54.4 -40.0 23.5 88.9 11.5 51 52 A S H 34 S+ 0 0 83 1,-0.2 -1,-0.3 2,-0.1 -4,-0.1 0.804 118.7 30.6 -61.2 -31.3 21.4 90.9 9.0 52 53 A L H X4 S+ 0 0 4 -3,-1.1 3,-1.6 -6,-0.3 -2,-0.2 0.721 97.4 92.4 -97.4 -27.9 18.3 88.8 9.8 53 54 A R H 3< S+ 0 0 109 -4,-3.1 -2,-0.1 -7,-0.3 -3,-0.1 0.758 102.1 19.2 -34.6 -50.8 19.1 88.1 13.4 54 55 A D T 3< S+ 0 0 141 -4,-0.7 -1,-0.3 -8,-0.1 -2,-0.1 0.292 93.1 126.9-114.5 10.9 17.3 91.0 14.9 55 56 A A < - 0 0 28 -3,-1.6 3,-0.1 1,-0.1 -3,-0.1 -0.340 52.8-145.4 -71.5 151.9 14.9 91.9 12.1 56 57 A S S S+ 0 0 109 1,-0.2 -33,-1.4 -34,-0.1 2,-0.3 0.612 78.9 11.1 -91.5 -24.1 11.3 92.2 12.9 57 58 A S E S-A 22 0A 33 -35,-0.2 2,-0.4 -34,-0.1 -35,-0.2 -0.963 70.4-134.5-148.6 165.2 9.9 90.8 9.6 58 59 A L E -A 21 0A 0 -37,-2.9 -37,-2.6 -2,-0.3 2,-0.1 -0.988 11.7-140.2-134.6 138.1 11.3 89.1 6.5 59 60 A T E > -A 20 0A 54 -2,-0.4 4,-2.4 -39,-0.3 5,-0.2 -0.343 31.2-104.4 -86.4 169.8 10.8 89.7 2.9 60 61 A L H > S+ 0 0 33 -41,-0.7 4,-2.5 1,-0.2 5,-0.2 0.874 120.9 50.4 -57.6 -43.7 10.5 87.1 0.1 61 62 A D H > S+ 0 0 134 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 110.0 50.1 -63.4 -43.9 14.0 87.8 -1.2 62 63 A Q H > S+ 0 0 65 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.926 113.6 45.7 -61.0 -44.4 15.5 87.4 2.3 63 64 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.883 110.9 52.3 -67.0 -41.7 13.7 84.1 2.8 64 65 A T H X S+ 0 0 36 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.897 110.9 48.2 -58.7 -44.8 14.6 82.8 -0.6 65 66 A G H X S+ 0 0 34 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.910 109.4 53.2 -60.4 -44.0 18.3 83.6 0.2 66 67 A L H X S+ 0 0 8 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.887 109.7 48.7 -57.6 -42.0 18.0 81.8 3.6 67 68 A I H >< S+ 0 0 7 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.894 109.8 51.1 -63.9 -45.7 16.6 78.7 1.8 68 69 A E H >< S+ 0 0 131 -4,-1.9 3,-0.7 1,-0.2 -2,-0.2 0.835 111.3 47.0 -65.9 -32.9 19.4 78.6 -0.8 69 70 A V H 3< S+ 0 0 106 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.524 122.7 34.9 -90.0 -5.2 22.2 78.9 1.8 70 71 A N T S+ 0 0 79 -3,-0.7 4,-2.7 1,-0.2 5,-0.2 0.835 71.7 47.9 -61.0 -38.5 19.3 74.0 1.1 72 73 A K H > S+ 0 0 175 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.929 111.4 48.3 -68.5 -48.0 20.9 70.8 2.2 73 74 A E H > S+ 0 0 91 2,-0.2 4,-0.6 1,-0.2 -2,-0.2 0.918 116.3 45.8 -58.6 -42.8 19.9 70.9 5.8 74 75 A L H >< S+ 0 0 2 -4,-2.2 3,-1.0 1,-0.2 -38,-0.4 0.908 110.8 51.0 -69.0 -44.8 16.3 71.8 4.8 75 76 A D H >< S+ 0 0 74 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.867 103.0 62.4 -56.3 -33.9 16.1 69.1 2.1 76 77 A A H >< S+ 0 0 38 -4,-2.0 3,-1.3 1,-0.3 -1,-0.2 0.760 91.0 66.1 -68.5 -20.0 17.3 66.6 4.7 77 78 A T T << S+ 0 0 43 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.532 102.2 49.1 -77.8 -11.4 14.2 67.2 6.9 78 79 A T T < S+ 0 0 67 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.248 83.8 127.0-105.8 8.7 12.1 65.7 4.2 79 80 A K < - 0 0 142 -3,-1.3 -3,-0.0 -4,-0.1 -4,-0.0 -0.439 68.6 -99.6 -72.3 142.1 14.2 62.5 3.7 80 81 A A - 0 0 30 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.222 38.6-145.4 -51.5 138.3 12.6 59.1 3.8 81 82 A K >> - 0 0 132 1,-0.1 3,-1.2 -3,-0.1 4,-0.8 -0.859 20.5-120.0-110.0 151.1 13.0 57.4 7.1 82 83 A T H >> S+ 0 0 23 -2,-0.3 3,-2.0 1,-0.3 4,-1.4 0.934 114.6 58.9 -47.1 -51.9 13.5 53.6 7.7 83 84 A E H 3> S+ 0 0 132 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.729 93.5 65.2 -52.8 -31.7 10.3 53.8 9.9 84 85 A D H <4 S+ 0 0 90 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.846 112.1 34.4 -62.0 -32.2 8.3 55.0 6.9 85 86 A F H XX S+ 0 0 10 -3,-2.0 3,-1.7 -4,-0.8 4,-0.5 0.760 94.4 80.3 -94.3 -29.6 8.9 51.7 5.1 86 87 A V H >X S+ 0 0 6 -4,-1.4 4,-2.9 1,-0.3 3,-1.3 0.779 83.8 69.7 -52.9 -30.0 8.9 49.1 7.8 87 88 A K H 3X S+ 0 0 110 -4,-0.6 4,-1.6 1,-0.3 -1,-0.3 0.837 87.7 62.3 -58.4 -39.7 5.0 49.2 7.8 88 89 A A H <4 S+ 0 0 0 -3,-1.7 -1,-0.3 -4,-0.2 4,-0.3 0.867 115.7 33.1 -56.5 -30.5 4.9 47.5 4.5 89 90 A F H XX S+ 0 0 4 -3,-1.3 3,-1.0 -4,-0.5 4,-0.8 0.858 111.0 60.9 -90.2 -42.0 6.7 44.5 6.2 90 91 A Q H >< S+ 0 0 92 -4,-2.9 3,-0.8 1,-0.2 6,-0.2 0.841 93.1 64.5 -56.2 -42.4 5.2 44.6 9.7 91 92 A V T 3< S+ 0 0 84 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.852 112.3 37.1 -49.1 -39.1 1.6 44.2 8.5 92 93 A F T <4 S+ 0 0 128 -3,-1.0 2,-1.3 -4,-0.3 -1,-0.2 0.558 97.2 83.1 -93.1 -6.9 2.6 40.7 7.2 93 94 A D X< + 0 0 21 -3,-0.8 3,-1.4 -4,-0.8 -1,-0.1 -0.665 56.3 173.9-100.9 80.4 5.0 39.8 10.1 94 95 A K T 3 S+ 0 0 190 -2,-1.3 -1,-0.2 1,-0.3 -2,-0.0 0.888 78.0 40.9 -56.1 -46.6 2.4 38.6 12.5 95 96 A E T 3 S- 0 0 148 -3,-0.2 -1,-0.3 1,-0.0 -2,-0.1 0.396 108.1-122.5 -82.7 -1.1 4.8 37.3 15.2 96 97 A S < + 0 0 86 -3,-1.4 -2,-0.1 -6,-0.2 -6,-0.1 0.931 55.5 154.2 59.6 49.8 7.2 40.4 14.7 97 98 A T - 0 0 83 2,-0.2 3,-0.1 1,-0.0 -1,-0.1 0.754 52.3-131.6 -75.3 -25.2 10.2 38.2 13.9 98 99 A G S S+ 0 0 20 1,-0.3 40,-1.3 -5,-0.1 41,-0.5 0.609 72.7 106.4 82.6 6.7 11.7 41.2 12.0 99 100 A K E -B 137 0B 75 38,-0.2 2,-0.4 39,-0.1 -1,-0.3 -0.932 48.5-168.8-122.5 152.9 12.3 38.8 9.0 100 101 A V E -B 136 0B 16 36,-2.1 36,-2.7 -2,-0.3 2,-0.1 -0.991 29.8-114.0-132.1 140.5 10.8 38.2 5.6 101 102 A S E > -B 135 0B 38 -2,-0.4 4,-2.3 34,-0.2 34,-0.2 -0.378 22.6-121.3 -73.2 149.0 11.5 35.2 3.3 102 103 A V H > S+ 0 0 41 32,-2.8 4,-2.6 1,-0.2 5,-0.3 0.922 114.4 55.9 -56.9 -34.6 13.2 35.9 0.1 103 104 A G H > S+ 0 0 45 31,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.894 109.4 44.5 -61.3 -41.8 10.2 34.4 -1.7 104 105 A D H > S+ 0 0 97 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.903 113.0 50.6 -72.1 -42.2 7.7 36.8 -0.0 105 106 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.918 111.8 47.1 -58.2 -45.4 9.9 39.8 -0.7 106 107 A R H X S+ 0 0 66 -4,-2.6 4,-2.5 -5,-0.2 5,-0.4 0.936 113.0 50.9 -66.3 -38.7 10.3 38.9 -4.4 107 108 A Y H X S+ 0 0 161 -4,-1.9 4,-2.5 -5,-0.3 5,-0.3 0.944 112.7 44.5 -59.5 -52.8 6.5 38.3 -4.5 108 109 A M H X S+ 0 0 17 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.848 117.3 44.9 -58.5 -42.5 5.7 41.7 -2.9 109 110 A L H < S+ 0 0 0 -4,-2.4 7,-3.2 -5,-0.2 -2,-0.2 0.806 124.6 31.5 -75.2 -30.0 8.3 43.6 -5.0 110 111 A T H < S+ 0 0 36 -4,-2.5 -2,-0.2 5,-0.2 -3,-0.2 0.665 123.1 44.2-104.7 -15.3 7.4 42.0 -8.4 111 112 A G H < S+ 0 0 30 -4,-2.5 2,-0.2 -5,-0.4 -3,-0.2 0.693 108.3 50.5-103.1 -18.8 3.7 41.3 -7.9 112 113 A L S < S- 0 0 58 -4,-1.0 4,-0.2 -5,-0.3 40,-0.0 -0.718 98.5 -9.1-121.3 171.1 2.3 44.5 -6.4 113 114 A G S S- 0 0 41 -2,-0.2 2,-1.5 1,-0.2 40,-0.1 -0.160 127.7 -3.9 51.5-130.5 2.3 48.3 -6.8 114 115 A E S S- 0 0 80 1,-0.0 -1,-0.2 41,-0.0 -2,-0.1 -0.711 98.6-132.3 -94.7 81.7 4.7 49.6 -9.5 115 116 A K - 0 0 135 -2,-1.5 -5,-0.2 -4,-0.1 2,-0.1 -0.023 16.4-150.2 -49.4 127.9 6.0 46.1 -10.1 116 117 A L - 0 0 4 -7,-3.2 2,-0.3 -4,-0.2 -1,-0.1 -0.466 24.3-117.5 -84.1 167.2 9.8 45.5 -10.3 117 118 A T >> - 0 0 73 -2,-0.1 4,-2.6 1,-0.1 3,-0.6 -0.729 21.1-108.3-102.1 164.7 11.0 42.6 -12.5 118 119 A D H 3> S+ 0 0 87 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.842 121.1 56.9 -48.8 -39.7 12.8 39.5 -11.4 119 120 A A H 3> S+ 0 0 71 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.876 107.3 45.7 -69.1 -36.0 15.8 40.9 -13.1 120 121 A E H <> S+ 0 0 46 -3,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.884 114.6 49.6 -66.8 -39.8 15.8 44.1 -10.9 121 122 A V H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.933 108.3 53.2 -66.9 -43.7 15.2 42.0 -7.8 122 123 A D H X S+ 0 0 84 -4,-2.9 4,-0.7 -5,-0.2 -2,-0.2 0.914 110.9 46.6 -55.3 -46.8 18.1 39.7 -8.8 123 124 A E H >< S+ 0 0 71 -4,-1.8 3,-0.9 1,-0.2 4,-0.3 0.921 112.7 49.6 -59.7 -48.4 20.4 42.7 -9.0 124 125 A L H >< S+ 0 0 4 -4,-2.4 3,-1.8 1,-0.2 -2,-0.2 0.893 102.3 61.4 -54.5 -44.6 19.2 44.2 -5.7 125 126 A L H >< S+ 0 0 27 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.709 84.8 77.4 -63.2 -19.0 19.6 40.9 -3.8 126 127 A K T << S+ 0 0 144 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.780 99.7 44.3 -60.1 -22.1 23.4 40.9 -4.6 127 128 A G T < S+ 0 0 43 -3,-1.8 2,-0.4 -4,-0.3 -1,-0.3 0.172 102.3 88.8-107.7 19.1 23.7 43.5 -1.8 128 129 A V S < S- 0 0 28 -3,-1.9 2,-0.5 16,-0.0 13,-0.0 -0.959 73.2-126.1-129.3 137.4 21.5 41.7 0.6 129 130 A E - 0 0 155 -2,-0.4 2,-0.5 8,-0.1 8,-0.4 -0.606 25.5-169.4 -82.5 116.8 22.1 39.1 3.3 130 131 A V - 0 0 52 -2,-0.5 6,-0.2 6,-0.1 -29,-0.1 -0.961 16.2-132.0-108.9 122.8 20.0 36.0 2.9 131 132 A D > - 0 0 52 4,-2.8 3,-1.7 -2,-0.5 5,-0.0 -0.148 28.0-107.0 -52.6 168.5 19.9 33.3 5.8 132 133 A S T 3 S+ 0 0 123 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.694 125.9 59.4 -76.2 -18.7 20.3 29.7 5.3 133 134 A N T 3 S- 0 0 128 2,-0.1 -1,-0.3 -32,-0.0 3,-0.1 0.507 123.3-109.7 -82.6 0.8 16.6 29.7 6.0 134 135 A G S < S+ 0 0 21 -3,-1.7 -32,-2.8 1,-0.3 2,-0.3 0.644 74.5 139.7 82.8 17.4 16.0 31.9 3.1 135 136 A E E -B 101 0B 67 -34,-0.2 -4,-2.8 -33,-0.1 2,-0.4 -0.727 38.0-157.4-105.6 150.8 15.2 34.9 5.4 136 137 A I E -B 100 0B 2 -36,-2.7 -36,-2.1 -2,-0.3 2,-0.8 -0.957 23.7-124.3-125.8 136.9 16.1 38.6 5.3 137 138 A D E > -B 99 0B 79 -8,-0.4 4,-1.8 -2,-0.4 -38,-0.2 -0.716 27.7-160.3 -76.0 112.0 16.2 41.1 8.1 138 139 A Y H > S+ 0 0 3 -40,-1.3 4,-2.5 -2,-0.8 5,-0.2 0.838 83.1 53.0 -75.6 -27.4 13.9 43.7 6.6 139 140 A K H > S+ 0 0 94 -41,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.917 112.3 47.0 -70.2 -40.2 14.9 46.8 8.7 140 141 A K H > S+ 0 0 105 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.909 111.6 51.2 -63.4 -39.1 18.5 46.1 7.7 141 142 A F H X S+ 0 0 7 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.904 113.2 44.5 -62.6 -49.9 17.4 45.7 4.1 142 143 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.924 110.7 54.5 -62.3 -46.0 15.4 49.1 4.2 143 144 A E H X S+ 0 0 94 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.929 110.4 47.6 -52.1 -47.0 18.3 50.9 6.0 144 145 A D H < S+ 0 0 58 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.821 109.1 51.3 -65.2 -39.1 20.7 49.8 3.2 145 146 A V H < S+ 0 0 12 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.852 115.4 43.4 -63.6 -36.7 18.5 50.8 0.4 146 147 A L H < S+ 0 0 37 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.760 91.1 105.2 -82.1 -29.5 18.1 54.3 2.0 147 148 A R < 0 0 181 -4,-2.0 -3,-0.0 1,-0.2 -4,-0.0 -0.241 360.0 360.0 -57.9 142.2 21.8 54.8 2.9 148 149 A Q 0 0 186 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.650 360.0 360.0 109.6 360.0 23.9 57.2 0.7 149 !* 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 0.0 150 854 B S > 0 0 65 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -27.1 -1.5 53.0 2.7 151 855 B V H > + 0 0 40 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.945 360.0 43.6 -67.0 -50.1 0.2 49.6 2.4 152 856 B L H > S+ 0 0 99 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.803 114.4 52.0 -67.0 -28.6 0.3 49.6 -1.5 153 857 B R H > S+ 0 0 164 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.903 109.2 48.5 -74.6 -43.1 1.5 53.2 -1.5 154 858 B T H X S+ 0 0 14 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.887 112.9 48.2 -57.4 -47.0 4.3 52.4 1.0 155 859 B I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.933 111.6 51.5 -59.5 -42.8 5.3 49.4 -1.2 156 860 B T H X S+ 0 0 30 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.892 109.6 48.5 -61.7 -42.2 5.1 51.7 -4.3 157 861 B N H X S+ 0 0 81 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.858 110.2 52.2 -67.1 -36.3 7.4 54.3 -2.7 158 862 B L H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.919 106.9 52.8 -65.3 -40.2 9.8 51.6 -1.7 159 863 B Q H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.903 107.7 52.5 -59.3 -43.0 9.9 50.4 -5.4 160 864 B K H X S+ 0 0 98 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.944 109.5 47.5 -57.0 -50.8 10.7 54.0 -6.5 161 865 B K H X S+ 0 0 97 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.858 111.8 51.2 -61.1 -40.3 13.7 54.2 -4.0 162 866 B I H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.944 107.5 52.2 -58.8 -47.8 14.9 50.8 -5.2 163 867 B R H X S+ 0 0 54 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.888 111.2 47.2 -57.5 -42.9 14.7 51.9 -8.9 164 868 B K H X S+ 0 0 132 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.895 109.4 53.2 -62.6 -44.6 16.8 54.9 -8.0 165 869 B E H X S+ 0 0 21 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.909 110.5 49.8 -52.6 -42.0 19.3 52.8 -6.1 166 870 B L H X S+ 0 0 21 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.882 109.3 48.2 -66.6 -43.2 19.6 50.6 -9.2 167 871 B K H X S+ 0 0 104 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.866 109.4 55.1 -67.6 -36.0 20.2 53.4 -11.7 168 872 B Q H X S+ 0 0 89 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.941 106.2 50.3 -58.7 -55.6 22.9 54.8 -9.3 169 873 B R H X S+ 0 0 82 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.835 109.5 52.9 -49.0 -40.1 24.7 51.4 -9.3 170 874 B Q H >X S+ 0 0 96 -4,-1.5 4,-1.0 1,-0.2 3,-1.0 0.875 102.1 57.6 -68.9 -38.5 24.6 51.5 -13.1 171 875 B L H 3< S+ 0 0 114 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.848 102.2 56.6 -60.4 -34.6 26.2 55.0 -13.3 172 876 B K H 3< S+ 0 0 189 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.663 104.4 51.0 -71.1 -20.2 29.2 53.7 -11.4 173 877 B Q H << 0 0 116 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.689 360.0 360.0 -87.8 -20.0 29.9 50.9 -14.0 174 878 B E < 0 0 187 -4,-1.0 -3,-0.2 -3,-0.3 -2,-0.1 0.350 360.0 360.0-147.0 360.0 29.8 53.4 -16.9