==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 10-APR-07 2YVA . COMPND 2 MOLECULE: DNAA INITIATOR-ASSOCIATING PROTEIN DIAA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.KEYAMURA,N.FUJIKAWA,T.ISHIDA,S.OZAKI,M.SUETSUGU,W.KAGAWA, . 386 2 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16340.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 76.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 24 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 181 46.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 0 1 3 0 1 0 0 2 0 2 0 2 0 0 0 0 2 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 4 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 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 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 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 M > 0 0 94 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -43.0 21.1 -3.9 -3.8 2 2 A Q H > + 0 0 54 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.927 360.0 44.8 -54.3 -50.7 18.4 -1.6 -5.1 3 3 A E H > S+ 0 0 164 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.901 112.7 51.6 -61.5 -43.7 16.1 -4.6 -5.9 4 4 A R H > S+ 0 0 99 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.934 110.3 49.0 -60.2 -45.8 16.8 -6.2 -2.6 5 5 A I H X S+ 0 0 1 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.905 111.0 49.7 -60.9 -43.2 15.9 -2.9 -0.8 6 6 A K H X S+ 0 0 105 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.907 109.7 50.5 -62.8 -42.2 12.7 -2.6 -2.8 7 7 A A H X S+ 0 0 61 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.832 109.0 54.5 -63.5 -32.9 11.8 -6.2 -1.9 8 8 A a H X S+ 0 0 11 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.954 111.5 41.8 -66.0 -52.0 12.5 -5.3 1.7 9 9 A F H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.889 113.6 54.2 -64.5 -37.6 10.1 -2.3 1.7 10 10 A T H X S+ 0 0 65 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.908 106.1 50.4 -64.3 -42.5 7.5 -4.3 -0.2 11 11 A E H X S+ 0 0 56 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.915 113.2 48.5 -61.8 -40.0 7.4 -7.2 2.2 12 12 A S H X S+ 0 0 1 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.946 111.5 47.5 -64.7 -49.5 7.0 -4.6 5.0 13 13 A I H X S+ 0 0 22 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.915 112.4 50.2 -58.9 -43.5 4.2 -2.7 3.2 14 14 A Q H X S+ 0 0 123 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.887 110.6 49.9 -62.9 -39.2 2.4 -6.0 2.5 15 15 A T H X S+ 0 0 14 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.931 110.6 49.4 -65.7 -44.2 2.7 -7.0 6.1 16 16 A Q H X S+ 0 0 3 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.898 110.0 50.9 -62.9 -39.9 1.3 -3.7 7.3 17 17 A I H X S+ 0 0 86 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.900 111.6 47.8 -64.2 -39.9 -1.7 -3.9 4.9 18 18 A A H X S+ 0 0 46 -4,-2.0 4,-1.5 1,-0.2 3,-0.3 0.894 114.4 47.5 -66.2 -39.1 -2.4 -7.5 6.1 19 19 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.884 102.3 61.6 -69.2 -40.3 -2.1 -6.2 9.7 20 20 A A H < S+ 0 0 13 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.809 110.7 42.4 -57.0 -29.6 -4.3 -3.2 9.2 21 21 A E H < S+ 0 0 159 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.832 123.2 33.9 -86.3 -34.8 -7.2 -5.5 8.3 22 22 A A H < S+ 0 0 69 -4,-1.5 4,-0.3 -5,-0.1 -2,-0.2 0.725 114.3 50.2 -96.2 -23.6 -6.7 -8.2 11.0 23 23 A L S X S+ 0 0 9 -4,-3.0 4,-2.8 1,-0.1 5,-0.3 0.610 75.5 92.3 -96.8 -13.6 -5.4 -6.3 14.1 24 24 A P H > S+ 0 0 8 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.872 90.0 47.8 -49.0 -44.7 -7.7 -3.4 14.8 25 25 A D H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.908 114.4 45.2 -65.5 -42.0 -10.0 -5.3 17.2 26 26 A A H > S+ 0 0 12 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.903 113.3 50.5 -68.2 -39.9 -7.2 -6.8 19.2 27 27 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.905 110.3 50.3 -64.8 -38.6 -5.4 -3.4 19.4 28 28 A S H X S+ 0 0 12 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.921 111.9 47.2 -64.9 -43.5 -8.6 -1.7 20.5 29 29 A R H X S+ 0 0 118 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.901 111.4 51.1 -63.9 -41.8 -9.1 -4.3 23.3 30 30 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.916 110.4 49.6 -61.8 -42.3 -5.5 -4.0 24.4 31 31 A A H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.890 109.2 51.3 -63.9 -40.4 -5.8 -0.2 24.6 32 32 A M H X S+ 0 0 106 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.902 111.1 49.0 -62.7 -41.2 -9.0 -0.5 26.6 33 33 A T H X S+ 0 0 31 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.941 113.8 44.8 -63.2 -50.6 -7.2 -2.9 29.0 34 34 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.938 114.1 49.3 -61.8 -47.0 -4.2 -0.6 29.4 35 35 A V H X S+ 0 0 13 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.927 112.0 48.4 -58.7 -46.3 -6.4 2.5 29.8 36 36 A Q H X S+ 0 0 100 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.895 110.6 50.8 -63.2 -40.7 -8.6 0.9 32.5 37 37 A S H <>S+ 0 0 6 -4,-2.3 5,-2.5 2,-0.2 3,-0.2 0.953 113.1 46.1 -61.5 -47.7 -5.5 -0.4 34.4 38 38 A L H ><5S+ 0 0 21 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.904 110.0 53.7 -61.4 -41.8 -4.0 3.1 34.4 39 39 A L H 3<5S+ 0 0 105 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.826 105.0 55.1 -62.5 -31.9 -7.4 4.7 35.4 40 40 A N T 3<5S- 0 0 107 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.384 123.6-105.5 -82.4 3.5 -7.5 2.3 38.3 41 41 A G T < 5S+ 0 0 69 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.593 77.6 133.3 84.5 11.0 -4.1 3.6 39.5 42 42 A N < - 0 0 29 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.252 46.2-126.4 -86.9 178.1 -2.3 0.4 38.4 43 43 A K - 0 0 31 65,-0.1 69,-2.0 31,-0.1 2,-0.5 -0.804 7.8-125.1-125.1 166.6 1.0 0.1 36.4 44 44 A I E -ab 76 112A 0 31,-2.3 33,-2.7 -2,-0.3 2,-0.5 -0.953 17.2-163.1-116.4 119.3 2.3 -1.7 33.3 45 45 A L E -ab 77 113A 0 67,-2.6 69,-2.9 -2,-0.5 2,-0.4 -0.870 14.9-163.3 -99.4 133.1 5.3 -3.9 33.6 46 46 A C E +ab 78 114A 0 31,-3.3 33,-3.4 -2,-0.5 2,-0.3 -0.911 11.8 174.0-122.0 146.0 6.9 -4.7 30.2 47 47 A C E + b 0 115A 0 67,-2.4 69,-2.5 -2,-0.4 2,-0.3 -0.999 9.8 141.2-151.6 149.4 9.3 -7.3 29.1 48 48 A G E - b 0 116A 0 -2,-0.3 2,-0.3 67,-0.2 69,-0.1 -0.944 37.1-116.1-174.1 160.8 11.0 -8.6 25.9 49 49 A N S > S- 0 0 48 67,-0.5 3,-1.9 -2,-0.3 4,-0.2 -0.845 71.8 -24.0-111.3 149.9 14.3 -10.0 24.7 50 50 A G T >> S+ 0 0 60 -2,-0.3 4,-1.5 1,-0.3 3,-0.7 -0.282 137.9 1.5 56.1-127.2 16.6 -8.5 22.1 51 51 A T H 3> S+ 0 0 19 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.855 135.0 58.5 -60.2 -33.3 14.8 -6.2 19.7 52 52 A S H <> S+ 0 0 5 -3,-1.9 4,-2.0 1,-0.2 -1,-0.3 0.835 100.1 56.7 -65.5 -30.3 11.6 -7.0 21.7 53 53 A A H <> S+ 0 0 15 -3,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.911 107.5 48.9 -65.1 -40.1 13.5 -5.5 24.8 54 54 A A H X S+ 0 0 7 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.900 109.4 50.9 -65.9 -40.9 13.9 -2.3 22.8 55 55 A N H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.852 108.8 52.4 -66.4 -32.5 10.3 -2.3 21.8 56 56 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.916 109.1 49.1 -67.2 -43.7 9.3 -2.7 25.5 57 57 A Q H X S+ 0 0 61 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.849 106.2 57.7 -63.5 -35.6 11.5 0.3 26.4 58 58 A H H X S+ 0 0 4 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.912 108.9 45.1 -62.6 -40.9 9.9 2.3 23.7 59 59 A F H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.951 113.0 51.0 -66.2 -47.7 6.5 1.7 25.3 60 60 A A H X S+ 0 0 10 -4,-2.5 4,-3.3 1,-0.2 5,-0.3 0.915 112.0 46.1 -55.0 -48.0 7.9 2.5 28.8 61 61 A A H X>S+ 0 0 43 -4,-2.9 4,-2.6 1,-0.2 5,-1.1 0.869 108.3 56.2 -64.4 -37.9 9.4 5.8 27.7 62 62 A S H <5S+ 0 0 4 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.831 117.1 36.8 -64.0 -31.2 6.3 6.8 25.8 63 63 A M H <5S+ 0 0 0 -4,-1.7 11,-2.6 -3,-0.2 -2,-0.2 0.937 121.4 42.3 -83.6 -55.5 4.4 6.4 29.0 64 64 A I H <5S+ 0 0 80 -4,-3.3 -3,-0.2 9,-0.3 -2,-0.2 0.836 136.1 12.7 -61.4 -39.8 6.9 7.6 31.6 65 65 A N T <5S- 0 0 109 -4,-2.6 6,-0.3 -5,-0.3 2,-0.3 0.786 116.5 -71.3-101.6 -79.5 8.0 10.6 29.5 66 66 A R < - 0 0 120 -5,-1.1 -1,-0.2 1,-0.1 -3,-0.1 -0.965 20.0-154.2-174.8 161.6 5.7 11.3 26.6 67 67 A F S S- 0 0 25 2,-0.4 -1,-0.1 -2,-0.3 -4,-0.1 0.720 85.3 -38.4-107.9 -71.8 4.5 10.1 23.2 68 68 A E S S+ 0 0 61 1,-0.2 2,-0.3 115,-0.1 294,-0.0 0.462 118.7 54.6-135.3 -9.6 3.2 13.2 21.4 69 69 A T S S- 0 0 25 124,-0.0 2,-0.7 2,-0.0 -2,-0.4 -0.925 81.1-104.6-132.1 156.1 1.5 15.4 23.9 70 70 A E + 0 0 161 -2,-0.3 -4,-0.1 -4,-0.1 -5,-0.0 -0.689 63.5 124.5 -80.6 115.5 2.2 17.1 27.2 71 71 A R - 0 0 10 -2,-0.7 3,-0.1 -6,-0.3 120,-0.0 -0.944 64.0 -59.0-157.8 168.9 0.5 15.2 30.0 72 72 A P - 0 0 80 0, 0.0 2,-0.2 0, 0.0 -7,-0.0 -0.132 60.4 -94.0 -58.6 153.3 1.5 13.5 33.3 73 73 A S - 0 0 84 -7,-0.0 -9,-0.3 1,-0.0 -8,-0.1 -0.478 42.5-144.3 -64.7 133.9 4.0 10.7 33.4 74 74 A L - 0 0 15 -11,-2.6 2,-1.0 -2,-0.2 -31,-0.1 -0.838 22.8-102.3-104.6 141.7 2.1 7.3 33.3 75 75 A P + 0 0 61 0, 0.0 -31,-2.3 0, 0.0 2,-0.4 -0.491 61.7 137.6 -70.5 97.1 3.4 4.3 35.3 76 76 A A E -a 44 0A 2 -2,-1.0 2,-0.4 -33,-0.2 -31,-0.2 -0.998 26.3-171.6-138.6 136.9 5.1 1.8 33.0 77 77 A I E -a 45 0A 74 -33,-2.7 -31,-3.3 -2,-0.4 2,-0.4 -0.997 16.9-142.3-134.1 130.6 8.4 -0.1 33.7 78 78 A A E -a 46 0A 9 -2,-0.4 3,-0.4 -33,-0.2 -31,-0.2 -0.776 6.9-158.0 -89.3 134.0 10.5 -2.2 31.4 79 79 A L S S+ 0 0 1 -33,-3.4 -32,-0.1 -2,-0.4 -1,-0.1 0.327 82.4 70.2 -94.4 8.3 11.9 -5.2 33.2 80 80 A N S S+ 0 0 13 -34,-0.3 -1,-0.2 -27,-0.2 -23,-0.1 -0.139 80.7 76.1-116.0 38.1 14.8 -5.7 30.7 81 81 A T + 0 0 74 -3,-0.4 2,-1.2 1,-0.1 -1,-0.1 0.691 62.3 85.9-121.3 -26.8 16.9 -2.6 31.6 82 82 A D > - 0 0 74 1,-0.2 4,-2.9 -3,-0.1 5,-0.2 -0.675 52.7-171.6 -84.1 99.0 18.8 -3.1 34.8 83 83 A N H > S+ 0 0 83 -2,-1.2 4,-2.4 1,-0.2 5,-0.2 0.745 83.5 55.9 -60.4 -27.2 22.0 -4.9 33.6 84 84 A V H > S+ 0 0 96 2,-0.2 4,-1.4 3,-0.2 -1,-0.2 0.952 111.8 41.6 -70.8 -49.9 23.1 -5.5 37.2 85 85 A V H > S+ 0 0 50 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.939 118.0 48.9 -61.2 -47.0 19.9 -7.3 38.0 86 86 A L H X S+ 0 0 39 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.926 114.0 41.4 -61.0 -51.6 19.9 -9.1 34.7 87 87 A T H < S+ 0 0 94 -4,-2.4 -1,-0.2 1,-0.2 4,-0.2 0.712 114.6 55.0 -72.2 -18.5 23.4 -10.4 34.7 88 88 A A H < S+ 0 0 51 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.893 110.9 42.4 -79.0 -42.9 23.2 -11.3 38.4 89 89 A I H >< S+ 0 0 16 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.927 113.6 51.4 -68.4 -45.0 20.1 -13.5 38.0 90 90 A A T 3< S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.3 5,-0.2 0.660 92.8 77.9 -65.5 -14.7 21.5 -15.1 34.8 91 91 A N T 3 S+ 0 0 127 -4,-0.2 -1,-0.3 -5,-0.2 2,-0.3 -0.025 94.8 67.4 -83.4 32.2 24.6 -15.7 36.9 92 92 A D S X S- 0 0 98 -3,-0.6 3,-0.6 1,-0.1 -3,-0.0 -0.870 94.8-102.6-143.5 176.1 22.5 -18.6 38.4 93 93 A R T 3 S+ 0 0 221 1,-0.3 2,-0.7 -2,-0.3 3,-0.2 0.846 117.7 53.5 -70.8 -36.3 20.9 -22.0 37.7 94 94 A L T > + 0 0 91 1,-0.2 3,-1.7 -5,-0.1 -1,-0.3 -0.370 67.3 148.1 -96.5 54.0 17.4 -20.5 37.4 95 95 A H G X + 0 0 88 -2,-0.7 3,-1.0 -3,-0.6 -1,-0.2 0.676 60.8 69.6 -62.5 -19.2 18.5 -17.9 34.8 96 96 A D G 3 S+ 0 0 44 -3,-0.2 4,-0.4 1,-0.2 3,-0.3 0.411 83.3 74.0 -81.7 5.3 15.1 -18.0 33.1 97 97 A E G <> + 0 0 34 -3,-1.7 4,-2.7 1,-0.2 5,-0.3 0.268 58.8 112.1 -99.1 11.2 13.6 -16.3 36.1 98 98 A V H <> S+ 0 0 11 -3,-1.0 4,-0.7 1,-0.2 -1,-0.2 0.881 90.7 27.3 -50.9 -44.4 15.0 -12.9 35.3 99 99 A Y H > S+ 0 0 11 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.881 116.8 59.5 -87.5 -40.6 11.6 -11.4 34.5 100 100 A A H > S+ 0 0 0 -4,-0.4 4,-2.8 1,-0.2 5,-0.2 0.887 102.4 54.5 -54.6 -43.1 9.5 -13.6 36.8 101 101 A K H X S+ 0 0 105 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.920 110.1 46.4 -58.9 -44.3 11.4 -12.5 39.9 102 102 A Q H X S+ 0 0 32 -4,-0.7 4,-2.8 -5,-0.3 5,-0.4 0.894 112.2 50.0 -66.7 -39.8 10.7 -8.8 39.1 103 103 A V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.935 110.8 49.1 -65.0 -45.4 7.0 -9.5 38.4 104 104 A R H < S+ 0 0 81 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.916 116.4 43.6 -59.4 -42.0 6.6 -11.4 41.6 105 105 A A H < S+ 0 0 80 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.900 128.7 24.2 -70.3 -42.4 8.3 -8.6 43.6 106 106 A L H < S+ 0 0 74 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.750 93.7 104.3 -97.8 -29.9 6.6 -5.6 41.9 107 107 A G < - 0 0 4 -4,-2.9 2,-0.3 -5,-0.4 -63,-0.0 -0.274 42.2-175.6 -65.4 139.3 3.3 -6.8 40.5 108 108 A H > - 0 0 115 -65,-0.1 3,-2.2 28,-0.0 -65,-0.1 -0.905 41.0 -81.8-128.1 157.6 -0.1 -6.0 42.1 109 109 A A T 3 S+ 0 0 63 -2,-0.3 28,-0.2 1,-0.3 27,-0.2 -0.335 118.3 30.6 -58.1 133.0 -3.6 -7.2 41.2 110 110 A G T 3 S+ 0 0 30 26,-1.9 -1,-0.3 1,-0.4 -68,-0.2 0.195 91.8 119.7 102.6 -19.2 -4.9 -5.0 38.4 111 111 A D < - 0 0 2 -3,-2.2 27,-2.2 24,-0.3 -1,-0.4 -0.300 56.9-131.9 -73.4 166.1 -1.5 -4.3 36.8 112 112 A V E -bc 44 138A 2 -69,-2.0 -67,-2.6 25,-0.2 2,-0.6 -0.947 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55.4-141.6 -51.5 124.6 11.3 -17.8 25.2 123 123 A R H > S+ 0 0 136 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.838 99.4 54.9 -59.4 -36.6 11.3 -19.4 28.7 124 124 A D H > S+ 0 0 26 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.886 110.2 47.2 -67.3 -32.6 11.9 -16.1 30.5 125 125 A I H > S+ 0 0 2 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.919 111.4 50.8 -71.2 -43.2 8.9 -14.6 28.8 126 126 A V H X S+ 0 0 18 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.924 110.9 48.6 -58.7 -45.8 6.7 -17.6 29.6 127 127 A K H X S+ 0 0 27 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.807 106.7 56.8 -65.9 -30.4 7.8 -17.5 33.3 128 128 A A H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.896 108.1 47.5 -67.0 -39.1 7.0 -13.7 33.4 129 129 A V H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.918 110.6 51.5 -66.5 -44.3 3.4 -14.5 32.3 130 130 A E H X S+ 0 0 123 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.926 112.1 47.1 -57.7 -45.7 3.1 -17.3 34.9 131 131 A A H X S+ 0 0 3 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.920 108.9 53.8 -63.2 -44.0 4.3 -14.9 37.6 132 132 A A H ><>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 3,-1.0 0.903 106.6 52.6 -57.6 -41.6 1.9 -12.1 36.4 133 133 A V H ><5S+ 0 0 80 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.891 104.3 55.9 -61.1 -38.8 -1.0 -14.6 36.7 134 134 A T H 3<5S+ 0 0 89 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.653 109.0 49.0 -67.5 -15.3 0.1 -15.4 40.3 135 135 A R T <<5S- 0 0 82 -3,-1.0 -24,-0.3 -4,-0.7 -1,-0.3 0.202 117.7-112.8-108.1 14.0 -0.2 -11.6 40.9 136 136 A D T < 5 + 0 0 122 -3,-1.8 -26,-1.9 1,-0.2 2,-0.3 0.887 66.0 151.2 56.4 42.0 -3.7 -11.3 39.4 137 137 A M < - 0 0 10 -5,-2.3 2,-0.3 -28,-0.2 -25,-0.2 -0.687 44.1-123.9-100.6 157.9 -2.3 -9.2 36.5 138 138 A T E -c 112 0A 33 -27,-2.2 -25,-2.8 -2,-0.3 2,-0.4 -0.706 24.9-133.7 -97.8 152.9 -3.8 -9.1 33.0 139 139 A I E -c 113 0A 0 -2,-0.3 20,-2.9 -27,-0.2 2,-0.5 -0.902 19.7-175.3-116.4 137.4 -1.6 -9.9 30.0 140 140 A V E -cd 114 159A 0 -27,-2.7 -25,-2.5 -2,-0.4 2,-0.5 -0.990 18.7-168.3-124.1 115.9 -1.2 -8.1 26.7 141 141 A A E -cd 115 160A 0 18,-2.7 20,-3.1 -2,-0.5 2,-0.7 -0.940 15.0-159.7-113.9 126.2 1.1 -10.1 24.4 142 142 A L E +cd 116 161A 0 -27,-2.7 -25,-2.3 -2,-0.5 2,-0.2 -0.920 34.9 160.1-100.8 117.0 2.6 -8.7 21.1 143 143 A T E - d 0 162A 0 18,-2.3 20,-2.6 -2,-0.7 2,-0.2 -0.637 25.4-165.1-129.9-175.8 3.5 -11.8 19.1 144 144 A G > + 0 0 0 -26,-0.6 3,-2.5 -27,-0.3 22,-0.2 -0.832 58.5 32.7-153.7-169.7 4.3 -13.1 15.7 145 145 A Y T 3 S- 0 0 31 20,-2.2 20,-0.2 1,-0.3 -26,-0.1 -0.271 130.3 -27.7 49.5-124.9 4.7 -16.4 13.7 146 146 A D T 3 S- 0 0 104 -27,-0.2 -1,-0.3 18,-0.1 -27,-0.1 0.340 89.0-104.7-102.2 8.2 2.2 -18.8 15.3 147 147 A G <> - 0 0 0 -3,-2.5 4,-2.0 -29,-0.3 3,-0.3 0.183 49.2-147.0 91.7 -17.7 2.2 -17.2 18.8 148 148 A G H > - 0 0 19 1,-0.2 4,-0.8 2,-0.2 3,-0.4 -0.017 56.0 -31.4 51.8-157.6 4.3 -20.0 20.2 149 149 A E H >4 S+ 0 0 117 -29,-0.2 3,-0.8 1,-0.2 -1,-0.2 0.875 135.3 65.2 -58.2 -39.7 3.8 -21.1 23.8 150 150 A L H >4 S+ 0 0 0 -30,-3.0 3,-1.9 -3,-0.3 -1,-0.2 0.874 95.5 54.3 -52.5 -46.3 2.9 -17.6 24.8 151 151 A A H >< S+ 0 0 19 -4,-2.0 3,-0.8 -3,-0.4 -1,-0.3 0.823 106.0 55.0 -60.8 -31.2 -0.3 -17.5 22.8 152 152 A G T << S+ 0 0 66 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.394 100.2 60.3 -84.5 4.9 -1.5 -20.6 24.5 153 153 A L T < S+ 0 0 71 -3,-1.9 2,-0.4 -4,-0.2 -1,-0.2 0.269 81.0 104.7-113.5 11.4 -1.1 -19.1 28.0 154 154 A L < - 0 0 37 -3,-0.8 6,-0.1 -4,-0.2 -16,-0.0 -0.787 55.7-150.4-100.3 133.5 -3.5 -16.3 27.6 155 155 A G > - 0 0 34 -2,-0.4 3,-1.2 1,-0.0 -16,-0.1 -0.224 38.6 -87.5 -87.8-177.5 -7.0 -16.3 29.2 156 156 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.772 127.3 50.8 -64.0 -26.9 -10.2 -14.6 28.0 157 157 A Q T 3 S+ 0 0 155 2,-0.1 2,-0.2 -124,-0.0 -19,-0.0 0.509 98.3 82.9 -88.4 -6.1 -9.3 -11.3 29.7 158 158 A D S < S- 0 0 26 -3,-1.2 2,-0.4 -20,-0.1 -18,-0.2 -0.542 73.2-137.7 -91.3 165.2 -5.8 -11.2 28.3 159 159 A V E -d 140 0A 4 -20,-2.9 -18,-2.7 -2,-0.2 2,-0.5 -0.980 11.4-164.3-131.7 125.6 -5.2 -9.8 24.8 160 160 A E E -d 141 0A 42 -2,-0.4 2,-0.6 -20,-0.2 -18,-0.2 -0.900 2.7-168.1-106.7 135.3 -2.9 -11.2 22.1 161 161 A I E -d 142 0A 0 -20,-3.1 -18,-2.3 -2,-0.5 2,-0.7 -0.907 14.9-170.9-120.0 96.5 -1.9 -9.0 19.1 162 162 A R E -d 143 0A 101 -2,-0.6 -18,-0.2 -20,-0.2 -20,-0.1 -0.819 18.5-135.6 -97.0 112.4 -0.3 -11.5 16.7 163 163 A I - 0 0 0 -20,-2.6 2,-2.3 -2,-0.7 -18,-0.2 -0.433 21.6-122.8 -64.3 131.6 1.4 -9.9 13.7 164 164 A P S S+ 0 0 58 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.470 77.5 93.6 -76.9 74.0 0.5 -11.8 10.5 165 165 A S - 0 0 15 -2,-2.3 -20,-2.2 -20,-0.2 -2,-0.0 -0.989 59.6-154.9-161.5 155.6 4.1 -12.6 9.6 166 166 A H S S+ 0 0 126 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.0 -0.184 73.0 93.3-125.4 35.3 6.8 -15.3 9.9 167 167 A R > - 0 0 99 1,-0.1 4,-2.3 -49,-0.1 3,-0.4 -0.957 65.0-149.5-131.9 113.6 9.7 -12.9 9.5 168 168 A S H > S+ 0 0 28 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.851 95.3 53.7 -49.8 -46.8 11.2 -11.5 12.7 169 169 A A H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.918 112.6 44.3 -57.5 -44.0 12.4 -8.2 11.3 170 170 A R H > S+ 0 0 9 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.871 112.8 52.1 -68.6 -39.0 8.9 -7.5 9.9 171 171 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.910 109.5 49.0 -63.6 -42.9 7.2 -8.6 13.2 172 172 A Q H X S+ 0 0 22 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.871 110.9 50.3 -65.3 -37.6 9.5 -6.3 15.2 173 173 A E H X S+ 0 0 5 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.906 111.6 48.5 -65.2 -42.6 8.7 -3.4 12.9 174 174 A M H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.796 106.2 57.6 -69.0 -28.6 5.0 -4.1 13.3 175 175 A H H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.909 105.6 50.0 -68.4 -39.0 5.4 -4.3 17.1 176 176 A M H X S+ 0 0 1 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.939 112.6 46.4 -63.5 -45.0 6.8 -0.7 17.1 177 177 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.913 112.0 52.3 -61.3 -43.1 3.9 0.5 15.0 178 178 A T H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.924 109.0 48.8 -59.1 -46.5 1.5 -1.4 17.3 179 179 A V H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.928 112.3 50.5 -59.9 -43.5 3.0 0.2 20.4 180 180 A N H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.880 110.1 47.0 -64.9 -38.6 2.6 3.6 18.7 181 181 A b H X S+ 0 0 1 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.901 113.5 51.3 -70.0 -35.0 -1.0 3.1 17.7 182 182 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.927 110.2 47.6 -63.9 -46.2 -1.6 1.9 21.3 183 183 A C H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.3 0.899 109.6 53.5 -62.3 -40.2 0.1 5.0 22.7 184 184 A D H X S+ 0 0 22 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.897 111.5 46.3 -60.7 -40.2 -1.9 7.2 20.4 185 185 A L H X S+ 0 0 3 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.874 110.5 52.0 -70.2 -39.5 -5.1 5.6 21.7 186 186 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.965 115.3 41.0 -61.4 -50.8 -4.1 5.8 25.3 187 187 A D H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.803 112.6 54.3 -68.6 -30.8 -3.4 9.6 25.1 188 188 A N H < S+ 0 0 55 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.876 114.1 42.5 -71.1 -34.1 -6.4 10.3 22.9 189 189 A T H < S+ 0 0 77 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.908 129.7 25.2 -76.3 -44.0 -8.7 8.7 25.5 190 190 A L H < S+ 0 0 38 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.832 139.9 15.7 -91.3 -36.1 -7.0 10.2 28.6 191 191 A F S < S- 0 0 64 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 -0.503 77.0-167.8-140.4 68.3 -5.5 13.4 27.3 192 192 A P 0 0 90 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.184 360.0 360.0 -58.9 147.5 -6.8 14.3 23.8 193 193 A H 0 0 129 -124,-0.0 -124,-0.0 0, 0.0 -2,-0.0 -0.912 360.0 360.0-148.7 360.0 -5.1 17.0 21.8 194 !* 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 0.0 195 1 B M > 0 0 92 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -39.0 -10.8 3.7 18.2 196 2 B Q H > + 0 0 59 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.927 360.0 42.4 -52.8 -52.2 -11.3 1.5 15.2 197 3 B E H > S+ 0 0 168 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.892 113.5 52.3 -64.6 -41.3 -11.0 4.4 12.8 198 4 B R H > S+ 0 0 83 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.929 109.8 49.0 -61.6 -45.0 -8.1 5.9 14.7 199 5 B I H X S+ 0 0 1 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.900 111.9 49.4 -61.9 -39.4 -6.2 2.7 14.5 200 6 B K H X S+ 0 0 101 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.863 109.4 50.5 -68.5 -34.8 -6.9 2.4 10.8 201 7 B A H X S+ 0 0 61 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.842 108.8 54.8 -69.8 -31.4 -5.7 6.0 10.3 202 8 B b H X S+ 0 0 10 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.959 112.2 40.8 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