==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 09-APR-13 4BI8 . COMPND 2 MOLECULE: RAP1A; . SOURCE 2 ORGANISM_SCIENTIFIC: SERRATIA MARCESCENS; . AUTHOR V.SRIKANNATHASAN,S.J.COULTHURST,W.N.HUNTER . 257 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12699.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 2 2 0 2 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 1 1 1 1 0 0 1 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 0 0 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 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 30 A S 0 0 137 0, 0.0 2,-0.4 0, 0.0 15,-0.0 0.000 360.0 360.0 360.0 168.3 -26.8 18.5 -32.8 2 31 A I - 0 0 39 1,-0.1 3,-0.1 7,-0.0 7,-0.0 -0.816 360.0-144.3 -97.0 136.8 -28.3 15.1 -33.8 3 32 A A S S- 0 0 98 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.934 76.0 -10.6 -68.6 -50.1 -32.1 14.6 -33.2 4 33 A H S S- 0 0 98 24,-0.0 2,-0.3 16,-0.0 -1,-0.2 -0.980 83.2 -88.4-151.5 156.3 -32.0 10.9 -32.3 5 34 A L + 0 0 14 -2,-0.3 2,-0.3 -3,-0.1 26,-0.0 -0.486 47.5 166.8 -78.1 126.5 -29.4 8.1 -32.5 6 35 A T > - 0 0 53 -2,-0.3 3,-2.0 4,-0.0 -2,-0.0 -0.909 50.3-107.9-129.7 163.6 -29.2 6.1 -35.7 7 36 A S T 3 S+ 0 0 124 -2,-0.3 -2,-0.1 1,-0.3 3,-0.0 0.585 116.2 64.3 -65.5 -10.5 -26.6 3.7 -37.2 8 37 A D T 3 S+ 0 0 134 1,-0.1 2,-2.0 2,-0.1 -1,-0.3 0.487 71.0 102.8 -87.9 -5.1 -25.6 6.4 -39.7 9 38 A D < + 0 0 39 -3,-2.0 3,-0.4 3,-0.0 -1,-0.1 -0.292 52.1 170.9 -83.5 58.9 -24.4 8.8 -37.0 10 39 A V + 0 0 125 -2,-2.0 -2,-0.1 1,-0.2 -4,-0.0 -0.178 62.7 29.7 -60.7 157.5 -20.6 8.1 -37.6 11 40 A N S S- 0 0 100 1,-0.2 -1,-0.2 67,-0.0 -2,-0.0 0.885 88.4-163.6 52.0 43.5 -18.1 10.4 -35.8 12 41 A L - 0 0 0 -3,-0.4 67,-3.6 66,-0.1 68,-0.3 -0.392 13.1-127.9 -62.0 118.2 -20.7 10.7 -33.0 13 42 A P B > -A 78 0A 35 0, 0.0 4,-2.4 0, 0.0 65,-0.2 -0.335 15.6-118.1 -67.4 151.1 -19.8 13.7 -30.8 14 43 A G H > S+ 0 0 0 63,-2.7 4,-2.7 61,-0.4 62,-0.2 0.874 113.1 55.4 -53.9 -41.5 -19.6 13.2 -27.0 15 44 A S H > S+ 0 0 37 60,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.893 109.7 44.8 -62.3 -42.3 -22.4 15.7 -26.4 16 45 A D H > S+ 0 0 8 59,-0.3 4,-2.2 -3,-0.2 5,-0.2 0.946 114.3 48.8 -68.6 -47.9 -24.8 13.9 -28.6 17 46 A F H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.928 111.1 50.5 -52.7 -49.6 -23.9 10.4 -27.3 18 47 A F H X S+ 0 0 10 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.812 108.2 52.9 -65.0 -32.0 -24.3 11.7 -23.7 19 48 A R H < S+ 0 0 97 -4,-1.6 3,-0.3 -5,-0.2 -1,-0.2 0.941 114.2 41.0 -64.9 -49.3 -27.7 13.1 -24.4 20 49 A F H >< S+ 0 0 5 -4,-2.2 3,-1.4 1,-0.2 12,-0.3 0.867 109.5 60.5 -66.3 -37.4 -29.0 9.8 -25.9 21 50 A Y H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.809 111.0 40.4 -59.3 -33.2 -27.3 7.9 -23.1 22 51 A R T 3< S+ 0 0 123 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.347 88.1 142.5 -96.4 5.3 -29.4 9.8 -20.5 23 52 A S < - 0 0 31 -3,-1.4 6,-0.2 -4,-0.2 -3,-0.1 -0.129 51.9-144.5 -58.2 140.3 -32.6 9.7 -22.5 24 53 A A S S+ 0 0 101 4,-0.1 2,-0.7 5,-0.1 -1,-0.1 0.649 84.2 91.2 -71.4 -18.7 -36.0 9.2 -20.7 25 54 A D S > S- 0 0 90 1,-0.2 4,-2.5 -5,-0.1 5,-0.2 -0.733 73.1-152.0 -78.9 116.9 -37.0 7.2 -23.8 26 55 A K H > S+ 0 0 123 -2,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.823 93.9 51.4 -63.1 -31.5 -36.0 3.6 -22.9 27 56 A Q H > S+ 0 0 146 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.865 111.3 47.9 -73.2 -35.9 -35.5 2.6 -26.5 28 57 A E H > S+ 0 0 20 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.909 111.7 49.3 -67.7 -44.8 -33.2 5.6 -27.1 29 58 A K H X S+ 0 0 28 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.892 110.9 51.1 -60.5 -41.4 -31.2 4.9 -23.9 30 59 A E H X S+ 0 0 103 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.891 107.2 52.6 -63.9 -42.0 -30.8 1.3 -25.0 31 60 A K H X S+ 0 0 92 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.900 110.6 47.9 -60.0 -41.7 -29.6 2.4 -28.5 32 61 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 -12,-0.3 -2,-0.2 0.896 110.0 51.9 -65.7 -40.9 -26.9 4.6 -26.8 33 62 A R H X S+ 0 0 28 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.743 108.1 52.9 -66.5 -24.0 -25.9 1.7 -24.5 34 63 A I H X S+ 0 0 88 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.844 105.2 52.6 -78.4 -37.0 -25.6 -0.5 -27.7 35 64 A Y H X S+ 0 0 60 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.943 111.3 49.1 -55.6 -47.2 -23.2 2.1 -29.3 36 65 A L H X S+ 0 0 0 -4,-2.2 4,-3.3 1,-0.2 -2,-0.2 0.912 105.9 56.1 -57.1 -46.2 -21.3 1.8 -26.0 37 66 A L H X S+ 0 0 84 -4,-1.7 4,-3.0 1,-0.2 -1,-0.2 0.896 106.1 50.5 -54.1 -45.2 -21.4 -2.0 -26.3 38 67 A G H X S+ 0 0 44 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.926 112.7 46.4 -58.6 -46.6 -19.7 -1.8 -29.7 39 68 A V H X S+ 0 0 15 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.919 112.6 50.7 -62.1 -45.1 -17.0 0.5 -28.3 40 69 A L H >X S+ 0 0 7 -4,-3.3 4,-3.0 1,-0.2 3,-0.9 0.954 111.9 46.2 -56.1 -53.7 -16.6 -1.9 -25.3 41 70 A D H 3< S+ 0 0 102 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.830 111.9 52.8 -60.9 -32.4 -16.2 -5.0 -27.5 42 71 A A H 3< S+ 0 0 63 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.725 123.1 26.5 -73.6 -22.6 -13.7 -3.1 -29.7 43 72 A T H XX>S+ 0 0 12 -4,-1.2 3,-1.9 -3,-0.9 4,-1.9 0.614 88.2 112.9-118.0 -21.0 -11.5 -2.0 -26.9 44 73 A E B 3<5S+b 48 0B 50 -4,-3.0 5,-0.2 1,-0.3 40,-0.0 -0.336 86.7 17.9 -62.9 136.8 -11.9 -4.6 -24.1 45 74 A G T 345S+ 0 0 44 3,-2.8 -1,-0.3 1,-0.1 4,-0.2 0.423 126.4 60.4 80.8 -0.2 -8.8 -6.7 -23.4 46 75 A K T <45S+ 0 0 171 -3,-1.9 47,-0.2 2,-0.5 -2,-0.2 0.671 120.6 6.3-118.9 -68.6 -6.7 -4.1 -25.3 47 76 A S T <5S+ 0 0 31 -4,-1.9 2,-0.3 1,-0.2 46,-0.3 0.650 135.4 20.1 -94.9 -17.7 -6.9 -0.7 -23.7 48 77 A W B > - 0 0 75 -2,-0.3 3,-1.1 4,-0.1 4,-1.1 0.718 3.2-173.3-160.6 165.3 -11.9 -6.8 -18.4 51 80 A Y T 34 S+ 0 0 39 1,-0.2 3,-0.4 2,-0.2 174,-0.2 0.840 102.3 58.8 -56.9 -38.6 -15.3 -8.4 -18.7 52 81 A S T 34 S+ 0 0 37 1,-0.2 173,-2.1 172,-0.2 -1,-0.2 0.814 115.0 37.1 -61.9 -28.0 -14.7 -11.2 -16.2 53 82 A Q T <4 S+ 0 0 70 -3,-1.1 2,-0.4 1,-0.2 -1,-0.2 0.558 115.0 55.7 -99.8 -13.3 -13.9 -8.5 -13.5 54 83 A L < - 0 0 3 -4,-1.1 -1,-0.2 -3,-0.4 -4,-0.1 -0.969 69.2-138.5-136.7 121.1 -16.5 -5.8 -14.4 55 84 A Q > - 0 0 4 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.306 28.4-116.5 -65.8 154.8 -20.3 -5.9 -14.8 56 85 A T H > S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.878 118.5 53.5 -61.7 -37.3 -22.0 -4.1 -17.6 57 86 A V H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.859 108.4 51.2 -64.1 -35.2 -23.8 -1.8 -15.0 58 87 A T H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.943 111.1 46.4 -64.1 -50.0 -20.4 -1.0 -13.6 59 88 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.912 113.7 49.9 -57.8 -43.8 -19.0 -0.1 -17.0 60 89 A Q H X S+ 0 0 21 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.866 110.0 50.1 -64.1 -40.0 -22.1 2.0 -17.7 61 90 A E H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.934 112.5 45.6 -64.0 -48.7 -21.8 3.8 -14.3 62 91 A F H X S+ 0 0 10 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.849 111.8 52.0 -68.1 -35.2 -18.1 4.7 -14.8 63 92 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.937 111.2 48.7 -62.1 -46.8 -18.7 5.9 -18.3 64 93 A F H X S+ 0 0 19 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.918 110.9 49.7 -57.2 -45.9 -21.6 8.1 -17.1 65 94 A E H X S+ 0 0 27 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.880 110.3 50.2 -65.2 -39.6 -19.4 9.6 -14.3 66 95 A F H >X S+ 0 0 39 -4,-2.1 4,-0.6 2,-0.2 3,-0.6 0.954 114.8 43.1 -59.6 -53.5 -16.5 10.3 -16.7 67 96 A F H >< S+ 0 0 3 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.881 111.5 56.0 -60.8 -38.1 -18.9 12.1 -19.1 68 97 A N H 3< S+ 0 0 85 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.763 112.9 39.8 -68.1 -25.9 -20.7 13.9 -16.3 69 98 A K H << S+ 0 0 109 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.407 89.4 120.6-102.1 -2.1 -17.4 15.4 -14.9 70 99 A L S << S- 0 0 20 -3,-0.8 5,-0.1 -4,-0.6 2,-0.1 -0.392 72.7-110.4 -66.2 134.4 -16.0 16.2 -18.4 71 100 A P >> - 0 0 80 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.440 31.0-116.6 -60.1 142.9 -15.3 19.9 -19.2 72 101 A A G >4 S+ 0 0 76 1,-0.3 3,-0.9 2,-0.2 4,-0.2 0.770 112.1 64.3 -54.3 -31.8 -17.8 21.1 -21.8 73 102 A A G >4 S+ 0 0 77 1,-0.2 3,-1.1 2,-0.2 -1,-0.3 0.848 97.7 54.9 -60.3 -36.4 -15.0 21.7 -24.3 74 103 A R G X4 S+ 0 0 66 -3,-1.4 3,-1.6 1,-0.2 -1,-0.2 0.627 86.1 80.4 -76.8 -13.4 -14.1 18.0 -24.4 75 104 A L G << S+ 0 0 35 -3,-0.9 -60,-2.2 -4,-0.5 -61,-0.4 0.622 80.9 68.6 -69.3 -11.9 -17.7 17.0 -25.3 76 105 A H G < S+ 0 0 150 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.647 82.6 95.9 -77.2 -16.4 -16.9 18.0 -28.9 77 106 A E S < S- 0 0 76 -3,-1.6 -63,-2.7 1,-0.1 -62,-0.2 -0.340 94.9 -82.3 -70.3 156.1 -14.6 15.0 -29.1 78 107 A R B > -A 13 0A 128 -65,-0.2 4,-1.4 1,-0.1 -1,-0.1 -0.318 35.6-128.8 -61.8 138.9 -15.8 11.7 -30.6 79 108 A A H > S+ 0 0 0 -67,-3.6 4,-2.5 1,-0.2 5,-0.2 0.901 100.0 58.3 -57.7 -46.7 -17.8 9.6 -28.2 80 109 A A H > S+ 0 0 23 -68,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.910 107.0 44.1 -56.1 -52.3 -15.9 6.3 -28.7 81 110 A P H > S+ 0 0 61 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.863 112.9 53.9 -63.9 -31.4 -12.4 7.5 -27.7 82 111 A L H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.923 109.6 47.2 -62.7 -45.9 -13.9 9.4 -24.7 83 112 A I H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 5,-0.2 0.917 112.2 50.6 -58.3 -46.0 -15.6 6.1 -23.5 84 113 A E H X S+ 0 0 69 -4,-2.5 4,-3.0 -5,-0.2 3,-0.3 0.918 109.4 50.3 -59.5 -45.0 -12.2 4.3 -24.1 85 114 A E H X S+ 0 0 65 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.907 104.6 59.0 -59.0 -45.7 -10.4 7.0 -22.0 86 115 A A H < S+ 0 0 4 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.868 117.4 30.9 -49.9 -43.7 -13.0 6.6 -19.2 87 116 A L H X S+ 0 0 0 -4,-1.5 4,-3.5 -3,-0.3 3,-0.3 0.843 114.1 58.6 -90.6 -35.3 -12.1 2.9 -18.8 88 117 A A H < S+ 0 0 30 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.847 108.1 48.4 -61.9 -35.6 -8.4 2.9 -19.8 89 118 A T T < S+ 0 0 93 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.716 123.4 30.6 -80.6 -23.1 -7.6 5.3 -17.1 90 119 A R T 4 S+ 0 0 69 -4,-0.4 -2,-0.2 -3,-0.3 -3,-0.1 0.757 129.9 30.9-102.8 -33.1 -9.5 3.4 -14.3 91 120 A F S < S+ 0 0 6 -4,-3.5 -42,-2.8 -44,-0.1 -2,-0.1 -0.477 76.0 175.2-128.5 62.5 -9.2 -0.2 -15.4 92 121 A P - 0 0 66 0, 0.0 2,-0.4 0, 0.0 -44,-0.2 -0.213 39.0-103.7 -66.8 157.9 -5.9 -0.7 -17.3 93 122 A a 0 0 49 -46,-0.3 -2,-0.0 -47,-0.2 -43,-0.0 -0.719 360.0 360.0 -80.2 131.5 -4.8 -4.1 -18.5 94 123 A K 0 0 210 -2,-0.4 -1,-0.1 -3,-0.1 -46,-0.0 -0.157 360.0 360.0-125.9 360.0 -2.0 -5.4 -16.2 95 !* 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 96 1 B M 0 0 198 0, 0.0 97,-0.1 0, 0.0 96,-0.1 0.000 360.0 360.0 360.0 160.0 -38.2 -9.2 11.0 97 2 B K - 0 0 73 95,-0.4 2,-0.1 1,-0.1 161,-0.1 -0.194 360.0-131.0 -55.9 124.9 -38.7 -8.9 7.2 98 3 B P - 0 0 17 0, 0.0 160,-0.3 0, 0.0 -1,-0.1 -0.372 21.6-104.3 -77.1 153.4 -38.7 -5.3 5.8 99 4 B L > - 0 0 112 158,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.404 31.2-117.8 -66.2 152.9 -41.4 -4.0 3.4 100 5 B Y H > S+ 0 0 0 158,-3.0 4,-3.0 1,-0.2 5,-0.2 0.938 112.1 50.4 -60.4 -49.8 -40.2 -3.6 -0.2 101 6 B R H > S+ 0 0 131 157,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.861 110.0 50.1 -59.9 -39.4 -40.7 0.2 -0.3 102 7 B Q H > S+ 0 0 109 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.947 113.1 46.1 -63.4 -48.1 -38.7 0.8 3.0 103 8 B L H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.931 113.1 49.5 -61.6 -45.2 -35.8 -1.4 1.7 104 9 B K H >< S+ 0 0 45 -4,-3.0 3,-2.0 1,-0.2 -1,-0.2 0.917 106.7 56.2 -57.7 -44.1 -35.9 0.4 -1.7 105 10 B S H 3< S+ 0 0 83 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.729 109.4 46.6 -62.1 -22.9 -35.8 3.8 0.0 106 11 B S T << S+ 0 0 15 -4,-1.1 2,-0.5 -3,-0.8 -1,-0.3 0.243 97.9 93.8 -99.6 11.1 -32.6 2.7 1.9 107 12 B H < - 0 0 6 -3,-2.0 2,-0.8 -5,-0.1 42,-0.1 -0.920 65.5-145.5-114.7 121.5 -31.0 1.4 -1.3 108 13 B Y - 0 0 58 -2,-0.5 9,-0.2 40,-0.3 2,-0.1 -0.764 21.2-138.8 -84.0 111.8 -28.7 3.5 -3.6 109 14 B S B -c 117 0C 0 7,-1.5 9,-2.3 -2,-0.8 134,-0.1 -0.400 7.4-154.7 -64.3 142.6 -29.2 2.5 -7.2 110 15 B S + 0 0 4 7,-0.2 2,-0.7 -2,-0.1 133,-0.1 0.313 66.1 107.7 -98.8 4.0 -26.1 2.1 -9.3 111 16 B D > - 0 0 25 131,-0.3 3,-2.0 1,-0.1 6,-0.2 -0.776 65.3-149.5 -81.7 113.4 -28.1 2.9 -12.5 112 17 B Y T 3 S+ 0 0 16 -2,-0.7 -1,-0.1 1,-0.3 5,-0.1 0.689 95.6 53.4 -57.0 -22.1 -27.1 6.4 -13.5 113 18 B S T 3 S+ 0 0 43 -92,-0.0 -1,-0.3 3,-0.0 -2,-0.0 0.454 87.9 102.5 -93.7 -3.3 -30.6 7.0 -15.0 114 19 B S S X S- 0 0 21 -3,-2.0 3,-1.6 1,-0.1 128,-0.0 -0.569 73.8-134.0 -83.4 142.7 -32.5 6.0 -11.8 115 20 B P T 3 S+ 0 0 144 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.738 110.2 55.3 -64.5 -18.6 -34.0 8.6 -9.5 116 21 B G T 3 S+ 0 0 27 126,-0.2 -7,-1.5 -5,-0.1 -4,-0.1 0.272 84.2 138.3 -94.1 12.0 -32.4 6.6 -6.7 117 22 B Y B < +c 109 0C 47 -3,-1.6 2,-0.3 -9,-0.2 -7,-0.2 -0.257 23.6 170.5 -64.6 136.9 -28.9 6.8 -8.1 118 23 B L - 0 0 50 -9,-2.3 -2,-0.0 -10,-0.0 2,-0.0 -0.950 32.3-119.3-141.7 133.1 -25.7 7.4 -6.1 119 24 B A >> - 0 0 15 -2,-0.3 4,-2.0 1,-0.1 3,-0.5 -0.300 24.7-113.0 -69.8 151.4 -22.2 7.1 -7.6 120 25 B A H 3> S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.791 113.8 58.2 -53.3 -37.9 -19.7 4.5 -6.2 121 26 B E H 3> S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 110.3 43.1 -60.7 -46.0 -17.3 7.3 -4.8 122 27 B A H <> S+ 0 0 42 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.865 112.8 53.6 -67.1 -37.7 -20.1 8.7 -2.7 123 28 B V H X S+ 0 0 0 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.954 113.6 41.1 -60.8 -51.9 -21.3 5.2 -1.6 124 29 B Y H ><>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 3,-0.6 0.863 110.5 58.4 -65.9 -37.0 -17.8 4.2 -0.3 125 30 B A H ><5S+ 0 0 40 -4,-2.1 3,-1.6 -5,-0.3 -1,-0.2 0.894 98.2 60.8 -58.7 -42.4 -17.2 7.7 1.2 126 31 B E H 3<5S+ 0 0 60 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.824 109.5 41.4 -53.0 -37.1 -20.3 7.2 3.4 127 32 B I T <<5S- 0 0 3 -4,-0.8 40,-2.3 -3,-0.6 41,-0.8 0.317 127.2 -96.7 -99.6 7.2 -18.7 4.1 5.0 128 33 B G T < 5S+ 0 0 30 -3,-1.6 2,-0.3 -4,-0.3 -3,-0.2 0.667 82.0 122.4 92.8 20.1 -15.3 5.7 5.3 129 34 B Y < - 0 0 31 -5,-2.8 2,-0.6 -8,-0.1 -1,-0.3 -0.851 56.3-133.4-114.5 150.5 -13.5 4.3 2.2 130 35 B E > - 0 0 125 -2,-0.3 4,-2.0 1,-0.2 3,-0.4 -0.907 15.1-145.9-100.6 118.6 -11.8 6.1 -0.8 131 36 B L H > S+ 0 0 3 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.896 97.3 53.4 -51.5 -47.3 -13.0 4.5 -4.0 132 37 B D H > S+ 0 0 62 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.870 107.4 51.2 -60.4 -39.1 -9.6 5.0 -5.7 133 38 B T H > S+ 0 0 66 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.930 112.1 47.0 -60.8 -47.7 -7.7 3.3 -2.9 134 39 B L H X S+ 0 0 3 -4,-2.0 4,-2.6 1,-0.2 3,-0.3 0.920 108.3 54.5 -61.9 -45.5 -10.0 0.3 -3.1 135 40 B L H < S+ 0 0 17 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.852 105.4 54.3 -58.3 -36.1 -9.8 0.0 -6.9 136 41 B K H < S+ 0 0 167 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.858 110.4 46.1 -66.1 -36.5 -6.0 -0.1 -6.7 137 42 B Q H < S- 0 0 131 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.917 138.8 -10.4 -67.4 -45.8 -6.3 -3.1 -4.3 138 43 B N >< - 0 0 82 -4,-2.6 3,-1.6 -5,-0.1 -1,-0.3 -0.887 51.1-146.4-161.1 123.0 -8.8 -4.8 -6.5 139 44 B P G > S+ 0 0 26 0, 0.0 3,-2.3 0, 0.0 4,-0.2 0.743 94.9 78.5 -60.7 -25.6 -10.8 -3.6 -9.6 140 45 B G G > S+ 0 0 25 1,-0.3 3,-1.7 2,-0.2 -5,-0.1 0.698 74.5 75.5 -56.4 -24.3 -13.7 -5.8 -8.4 141 46 B Y G < S+ 0 0 52 -3,-1.6 -1,-0.3 1,-0.3 -6,-0.1 0.664 78.8 74.0 -62.1 -17.0 -14.6 -3.1 -5.8 142 47 B A G < S+ 0 0 0 -3,-2.3 2,-1.0 -89,-0.1 -1,-0.3 0.757 80.0 79.3 -65.8 -25.7 -16.0 -1.2 -8.8 143 48 B N < + 0 0 10 -3,-1.7 3,-0.3 -4,-0.2 4,-0.2 -0.770 61.0 169.5 -85.5 103.1 -18.9 -3.7 -8.7 144 49 B T > + 0 0 3 -2,-1.0 4,-3.0 1,-0.2 5,-0.3 0.316 36.6 109.1-105.7 6.8 -20.9 -2.3 -5.8 145 50 B C H > S+ 0 0 8 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.872 88.0 42.5 -54.9 -42.8 -24.3 -4.1 -5.8 146 51 B A H > S+ 0 0 0 32,-0.4 4,-2.7 -3,-0.3 31,-0.4 0.829 112.6 53.4 -74.6 -33.0 -23.5 -6.1 -2.7 147 52 B V H > S+ 0 0 0 31,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.949 113.2 44.9 -60.1 -49.0 -22.0 -3.0 -1.0 148 53 B R H X S+ 0 0 0 -4,-3.0 4,-2.0 2,-0.2 -40,-0.3 0.889 114.3 47.6 -63.0 -43.2 -25.3 -1.2 -1.8 149 54 B M H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.907 109.2 54.3 -66.4 -40.9 -27.4 -4.1 -0.6 150 55 B S H X S+ 0 0 0 -4,-2.7 4,-2.5 27,-0.3 -2,-0.2 0.911 110.3 47.1 -53.9 -47.0 -25.4 -4.4 2.6 151 56 B L H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.871 110.1 51.8 -65.4 -41.0 -26.1 -0.8 3.4 152 57 B A H X S+ 0 0 0 -4,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.893 110.7 49.3 -62.9 -41.0 -29.8 -1.1 2.6 153 58 B L H ><>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 3,-1.2 0.946 110.7 48.9 -63.0 -50.4 -30.0 -4.0 5.0 154 59 B L H ><5S+ 0 0 17 -4,-2.5 3,-1.9 1,-0.3 -2,-0.2 0.919 108.8 54.1 -53.4 -46.7 -28.2 -2.1 7.8 155 60 B K H 3<5S+ 0 0 55 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.618 110.1 47.6 -66.8 -13.3 -30.5 0.8 7.2 156 61 B T T <<5S- 0 0 28 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.120 120.7-106.8-112.5 17.8 -33.5 -1.5 7.7 157 62 B G T < 5 + 0 0 71 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.762 66.9 150.4 67.7 30.5 -32.1 -3.2 10.9 158 63 B I < - 0 0 8 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.827 38.1-136.0-100.5 130.6 -31.2 -6.5 9.2 159 64 B S + 0 0 102 -2,-0.5 2,-0.3 -5,-0.0 33,-0.2 -0.630 35.9 144.3 -89.0 140.0 -28.3 -8.5 10.7 160 65 B F - 0 0 28 -2,-0.3 2,-0.4 15,-0.1 15,-0.3 -0.959 46.0-108.0-163.6 155.3 -25.6 -10.2 8.5 161 66 B K + 0 0 164 -2,-0.3 2,-0.3 22,-0.1 25,-0.1 -0.793 38.9 178.6 -88.7 131.9 -21.8 -11.0 8.6 162 67 B G - 0 0 17 -2,-0.4 15,-0.3 1,-0.1 14,-0.0 -0.869 31.6-140.6-127.5 166.5 -19.6 -9.0 6.2 163 68 B R S S+ 0 0 158 13,-0.7 14,-0.2 -2,-0.3 -1,-0.1 0.691 82.5 76.9 -96.4 -23.2 -15.9 -8.9 5.5 164 69 B L E S-D 176 0D 13 12,-3.1 12,-3.3 1,-0.0 2,-0.1 -0.808 76.8-139.2 -98.3 109.5 -15.5 -5.1 5.0 165 70 B P E -D 175 0D 69 0, 0.0 2,-0.5 0, 0.0 10,-0.2 -0.418 16.2-123.9 -70.0 136.3 -15.5 -3.1 8.3 166 71 B I - 0 0 6 8,-2.9 7,-2.0 5,-0.3 -38,-0.2 -0.705 26.8-176.7 -81.8 125.5 -17.4 0.2 8.3 167 72 B K + 0 0 131 -40,-2.3 2,-0.3 -2,-0.5 -39,-0.2 0.644 58.6 31.1 -98.3 -20.4 -15.1 3.0 9.4 168 73 B K S S+ 0 0 116 -41,-0.8 3,-0.4 3,-0.0 -1,-0.1 -0.949 89.7 16.1-140.8 156.4 -17.4 6.0 9.4 169 74 B G S > S- 0 0 50 -2,-0.3 3,-1.8 1,-0.2 -42,-0.1 -0.232 102.4 -25.7 87.3-166.1 -21.0 7.1 10.1 170 75 B A T 3 S+ 0 0 94 1,-0.3 -1,-0.2 3,-0.0 -43,-0.1 0.703 135.6 45.3 -59.8 -24.8 -24.1 5.6 11.7 171 76 B Y T > S+ 0 0 71 -3,-0.4 3,-2.5 2,-0.1 -5,-0.3 0.140 74.3 146.7-112.6 18.2 -22.9 2.0 11.1 172 77 B K T < S+ 0 0 150 -3,-1.8 -5,-0.2 1,-0.3 3,-0.1 -0.315 71.3 30.3 -50.9 130.6 -19.3 2.3 12.2 173 78 B G T 3 S+ 0 0 72 -7,-2.0 -1,-0.3 1,-0.5 -6,-0.1 0.076 102.7 97.5 98.0 -23.4 -18.3 -1.0 13.8 174 79 B K S < S- 0 0 123 -3,-2.5 -8,-2.9 -8,-0.1 -1,-0.5 -0.266 71.2-118.9 -81.2 179.6 -20.7 -3.0 11.6 175 80 B T E -D 165 0D 42 -15,-0.3 2,-0.4 -10,-0.2 -15,-0.1 -0.913 9.3-145.4-128.1 152.2 -19.6 -4.7 8.4 176 81 B I E -D 164 0D 0 -12,-3.3 -12,-3.1 -2,-0.3 -13,-0.7 -0.894 11.7-145.0-107.6 141.2 -20.3 -4.7 4.6 177 82 B E - 0 0 7 -31,-0.4 -27,-0.3 -2,-0.4 -28,-0.1 -0.929 14.6-174.6-103.5 106.8 -20.3 -7.8 2.4 178 83 B P + 0 0 25 0, 0.0 2,-0.5 0, 0.0 -32,-0.4 0.578 60.2 84.4 -78.7 -10.7 -18.9 -6.6 -1.0 179 84 B G > - 0 0 19 -33,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.844 66.2-152.8 -98.8 125.3 -19.5 -10.0 -2.7 180 85 B A H > S+ 0 0 10 -2,-0.5 4,-2.8 47,-0.2 5,-0.2 0.896 95.4 46.2 -61.3 -47.7 -22.9 -10.7 -4.1 181 86 B K H > S+ 0 0 82 2,-0.2 4,-3.7 1,-0.2 5,-0.2 0.935 112.8 50.5 -62.0 -47.8 -22.8 -14.5 -3.8 182 87 B L H > S+ 0 0 81 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.908 113.9 44.7 -58.3 -44.1 -21.5 -14.3 -0.3 183 88 B L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.909 115.5 47.5 -66.0 -42.7 -24.2 -11.9 0.8 184 89 B A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.930 108.8 54.4 -62.3 -45.7 -26.8 -14.0 -1.0 185 90 B D H X S+ 0 0 26 -4,-3.7 4,-2.8 1,-0.2 -1,-0.2 0.845 111.3 46.8 -56.9 -37.0 -25.5 -17.2 0.6 186 91 B Q H X S+ 0 0 31 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.909 111.0 48.3 -72.4 -46.8 -25.9 -15.6 4.0 187 92 B L H < S+ 0 0 3 -4,-2.4 4,-0.4 2,-0.2 7,-0.3 0.877 119.8 42.5 -57.7 -38.3 -29.4 -14.2 3.4 188 93 B H H < S+ 0 0 49 -4,-2.6 3,-0.3 -5,-0.2 -2,-0.2 0.944 120.7 36.2 -73.5 -52.9 -30.4 -17.7 2.1 189 94 B R H < S+ 0 0 199 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.734 134.7 8.7 -75.5 -24.9 -28.7 -19.9 4.6 190 95 B S S < S+ 0 0 76 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 -0.407 92.7 94.6-167.1 69.8 -29.2 -17.8 7.7 191 96 B S S > S- 0 0 35 -4,-0.4 3,-0.9 -3,-0.3 -31,-0.1 -0.958 74.6-102.6-152.5 174.1 -31.4 -14.7 7.8 192 97 B S T 3 S+ 0 0 60 -2,-0.3 -95,-0.4 1,-0.2 3,-0.1 0.415 114.8 69.9 -79.7 -2.3 -34.9 -13.4 8.7 193 98 B F T 3 S- 0 0 12 -6,-0.3 -1,-0.2 1,-0.2 63,-0.1 0.736 96.9-152.3 -76.2 -26.5 -35.5 -13.3 4.9 194 99 B G < - 0 0 30 -3,-0.9 -1,-0.2 -7,-0.3 2,-0.2 -0.268 40.0 -23.7 77.6-172.0 -35.6 -17.1 5.0 195 100 B K - 0 0 176 -6,-0.1 -7,-0.1 1,-0.1 -6,-0.1 -0.474 68.9-122.7 -73.6 138.9 -34.6 -19.3 2.1 196 101 B A - 0 0 11 -2,-0.2 2,-0.4 59,-0.1 59,-0.2 -0.359 21.9-109.4 -72.0 156.9 -34.9 -18.0 -1.4 197 102 B K E -E 254 0E 126 57,-2.6 57,-2.0 -2,-0.1 2,-0.5 -0.786 39.3-143.7 -79.0 131.9 -37.0 -19.5 -4.2 198 103 B I E -E 253 0E 58 -2,-0.4 2,-0.4 55,-0.2 55,-0.2 -0.910 18.0-173.6-110.4 123.2 -34.5 -20.9 -6.7 199 104 B F E -E 252 0E 15 53,-2.9 53,-2.3 -2,-0.5 3,-0.0 -0.930 14.7-158.0-114.5 141.7 -35.0 -20.9 -10.4 200 105 B F S S+ 0 0 138 -2,-0.4 2,-0.3 51,-0.2 -1,-0.1 0.432 74.7 26.9-101.2 -1.5 -32.7 -22.6 -12.9 201 106 B N S > S- 0 0 63 51,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.976 80.1-109.7-154.4 160.6 -33.6 -20.6 -16.0 202 107 B A H > S+ 0 0 27 -2,-0.3 4,-3.0 2,-0.2 5,-0.2 0.890 113.8 53.1 -62.2 -45.4 -34.8 -17.1 -17.0 203 108 B P H > S+ 0 0 85 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.922 111.9 46.7 -57.4 -44.5 -38.3 -18.2 -18.2 204 109 B D H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.904 113.6 49.3 -60.0 -43.2 -38.9 -20.0 -14.9 205 110 B A H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.913 111.0 48.5 -64.6 -43.8 -37.7 -17.0 -13.0 206 111 B E H X S+ 0 0 108 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.902 117.3 41.6 -64.2 -42.2 -39.9 -14.5 -14.9 207 112 B K H < S+ 0 0 140 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.867 116.1 50.1 -70.8 -37.7 -43.0 -16.7 -14.4 208 113 B G H < S+ 0 0 14 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.909 115.1 40.8 -69.9 -45.0 -42.1 -17.5 -10.8 209 114 B I H >< S+ 0 0 0 -4,-2.7 3,-2.3 -5,-0.2 -2,-0.2 0.925 86.7 151.8 -68.7 -44.2 -41.5 -13.9 -9.7 210 115 B G T 3< S- 0 0 33 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.1 -0.299 74.3 -13.8 59.0-119.7 -44.5 -12.9 -11.8 211 116 B N T 3 S+ 0 0 134 -4,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.251 112.2 108.4 -98.5 10.4 -46.2 -9.7 -10.4 212 117 B K < - 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