==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PEPTIDE BINDING PROTEIN 23-MAR-09 3GQ0 . COMPND 2 MOLECULE: ATP-DEPENDENT CLP PROTEASE ADAPTER PROTEIN CLPS; . SOURCE 2 ORGANISM_SCIENTIFIC: CAULOBACTER VIBRIOIDES; . AUTHOR T.A.BAKER,G.ROMAN-HERNANDEZ,R.T.SAUER,R.A.GRANT . 166 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9413.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 69.9 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 . 30 18.1 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 . 4 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 44.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.4 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 0 0 0 0 0 0 2 0 2 0 0 2 0 0 0 0 0 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 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 38 A P 0 0 175 0, 0.0 53,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -5.3 -27.3 2.7 -10.2 2 39 A S - 0 0 43 1,-0.1 52,-0.5 51,-0.1 2,-0.2 -0.203 360.0-140.5 -56.2 133.4 -24.7 5.4 -11.0 3 40 A L - 0 0 75 50,-0.1 79,-2.8 51,-0.1 2,-0.4 -0.500 14.5-135.9 -82.7 163.6 -23.0 5.1 -14.4 4 41 A Y E -AB 52 81A 49 48,-3.8 48,-2.8 77,-0.3 2,-0.4 -0.981 4.3-138.8-126.9 135.0 -19.3 5.9 -14.7 5 42 A R E -AB 51 80A 7 75,-3.0 75,-2.0 -2,-0.4 2,-0.5 -0.741 16.4-137.0 -90.6 138.4 -17.5 7.9 -17.4 6 43 A V E -AB 50 79A 0 44,-2.9 43,-3.5 -2,-0.4 44,-0.9 -0.839 23.8-167.1 -97.1 128.1 -14.2 6.6 -18.7 7 44 A L E -AB 48 78A 0 71,-3.5 71,-2.6 -2,-0.5 2,-0.4 -0.880 13.8-157.2-117.7 144.8 -11.5 9.2 -19.1 8 45 A I E -AB 47 77A 0 39,-1.9 39,-1.5 -2,-0.4 2,-0.3 -0.967 18.0-139.8-115.4 139.9 -8.2 9.3 -20.9 9 46 A L E -AB 46 76A 26 67,-2.5 67,-0.6 -2,-0.4 37,-0.2 -0.699 19.1-112.8 -97.6 149.3 -5.5 11.7 -19.9 10 47 A N + 0 0 59 35,-2.8 2,-0.3 -2,-0.3 32,-0.1 -0.455 38.6 170.4 -75.1 151.1 -3.2 13.6 -22.2 11 48 A D - 0 0 31 3,-0.2 34,-0.1 -2,-0.1 64,-0.1 -0.965 40.4-119.5-155.2 167.8 0.5 12.9 -22.3 12 49 A D S S+ 0 0 138 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 0.143 103.2 44.2-100.3 19.9 3.5 13.8 -24.5 13 50 A Y S S+ 0 0 183 2,-0.1 -1,-0.1 1,-0.1 62,-0.0 0.638 80.2 94.8-131.8 -38.7 4.5 10.3 -25.6 14 51 A T S S- 0 0 17 1,-0.1 -3,-0.2 2,-0.1 59,-0.1 -0.472 78.9-118.3 -64.6 122.8 1.4 8.3 -26.6 15 52 A P > - 0 0 53 0, 0.0 4,-1.6 0, 0.0 3,-0.1 -0.280 11.6-128.1 -60.5 146.0 1.0 8.6 -30.4 16 53 A M H > S+ 0 0 94 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.886 109.4 57.7 -60.1 -42.7 -2.3 10.2 -31.6 17 54 A E H > S+ 0 0 107 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.864 104.8 51.0 -58.5 -37.5 -2.9 7.2 -33.9 18 55 A F H > S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.900 109.5 49.9 -67.3 -39.8 -2.8 4.9 -30.9 19 56 A V H X S+ 0 0 14 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.918 112.7 46.9 -63.6 -44.3 -5.3 7.1 -29.0 20 57 A V H X S+ 0 0 3 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.936 112.2 50.8 -60.4 -47.8 -7.6 7.1 -32.0 21 58 A Y H X S+ 0 0 77 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.907 109.2 51.8 -55.0 -44.7 -7.1 3.3 -32.3 22 59 A V H X>S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.6 0.912 110.6 47.1 -60.3 -44.9 -8.0 3.0 -28.6 23 60 A L H X5S+ 0 0 0 -4,-2.2 6,-1.8 1,-0.2 4,-0.9 0.888 116.3 43.6 -67.4 -40.8 -11.2 5.0 -29.0 24 61 A E H X5S+ 0 0 66 -4,-2.6 4,-0.6 4,-0.2 -2,-0.2 0.909 121.0 44.4 -63.7 -42.5 -12.3 3.1 -32.1 25 62 A R H <5S+ 0 0 153 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.956 128.7 16.0 -70.5 -58.4 -11.2 -0.2 -30.4 26 63 A F H <5S+ 0 0 25 -4,-3.2 -3,-0.2 -5,-0.2 -1,-0.1 0.555 130.5 43.3-102.3 -11.5 -12.5 -0.1 -26.9 27 64 A F H < - 0 0 63 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.390 39.3-103.4 -63.3 159.4 -16.1 5.8 -35.6 31 68 A R H > S+ 0 0 123 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.869 123.6 53.8 -56.5 -36.4 -12.7 7.1 -36.7 32 69 A E H > S+ 0 0 126 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.894 111.3 43.3 -67.3 -41.0 -14.2 10.6 -37.0 33 70 A D H > S+ 0 0 59 2,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.837 113.8 52.6 -72.4 -33.5 -15.6 10.6 -33.5 34 71 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 -2,-0.2 0.934 107.5 51.4 -65.6 -46.1 -12.3 9.1 -32.2 35 72 A T H X S+ 0 0 44 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.899 109.7 50.8 -56.8 -43.9 -10.3 11.8 -33.9 36 73 A R H X S+ 0 0 128 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.929 113.5 43.3 -60.8 -48.3 -12.5 14.5 -32.2 37 74 A I H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.914 113.1 52.8 -65.2 -43.3 -12.1 13.0 -28.8 38 75 A M H X S+ 0 0 14 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.920 112.6 44.0 -57.5 -46.7 -8.3 12.5 -29.3 39 76 A L H X S+ 0 0 83 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.862 111.6 53.8 -68.5 -36.4 -7.8 16.1 -30.3 40 77 A H H X S+ 0 0 75 -4,-2.2 4,-2.9 -5,-0.2 6,-0.4 0.888 109.0 48.8 -63.8 -39.9 -10.0 17.3 -27.5 41 78 A V H X S+ 0 0 6 -4,-2.6 4,-2.3 1,-0.2 -31,-0.2 0.890 109.2 53.2 -64.8 -40.3 -7.9 15.3 -25.0 42 79 A H H < S+ 0 0 102 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.854 118.7 35.3 -61.3 -35.8 -4.8 16.8 -26.5 43 80 A Q H < S+ 0 0 173 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.821 127.3 35.0 -90.0 -35.4 -6.2 20.3 -26.1 44 81 A N H < S- 0 0 40 -4,-2.9 120,-0.3 -5,-0.2 -3,-0.2 0.601 97.8-126.3 -98.8 -15.7 -8.0 19.9 -22.8 45 82 A G S < S+ 0 0 22 -4,-2.3 -35,-2.8 -5,-0.3 2,-0.3 0.157 87.6 44.1 88.5 -18.8 -5.7 17.4 -21.1 46 83 A V E -A 9 0A 0 -6,-0.4 2,-0.3 -37,-0.2 -37,-0.2 -0.990 62.8-179.0-154.7 150.9 -8.6 15.1 -20.5 47 84 A G E -A 8 0A 0 -39,-1.5 -39,-1.9 -2,-0.3 2,-0.5 -0.997 30.4-111.2-153.9 151.2 -11.6 13.7 -22.3 48 85 A V E -A 7 0A 42 -2,-0.3 -41,-0.2 -41,-0.2 3,-0.1 -0.729 21.4-176.0 -85.7 124.6 -14.5 11.4 -21.9 49 86 A C E - 0 0 0 -43,-3.5 2,-0.3 -2,-0.5 -1,-0.2 0.792 64.4 -50.9 -86.0 -32.8 -14.3 8.2 -23.9 50 87 A G E -A 6 0A 10 -44,-0.9 -44,-2.9 2,-0.0 2,-0.4 -0.964 47.4-105.1 174.5 174.7 -17.8 7.0 -22.9 51 88 A V E +A 5 0A 53 -2,-0.3 -46,-0.3 -46,-0.3 2,-0.2 -0.993 45.1 150.3-127.5 127.5 -20.2 6.4 -20.1 52 89 A Y E -A 4 0A 46 -48,-2.8 -48,-3.8 -2,-0.4 30,-0.1 -0.822 50.1 -69.7-142.3 176.4 -21.0 2.9 -18.9 53 90 A T > - 0 0 62 -2,-0.2 4,-2.8 -50,-0.2 5,-0.2 -0.312 57.4-102.6 -64.8 161.6 -22.1 0.8 -15.9 54 91 A Y H > S+ 0 0 93 -52,-0.5 4,-2.5 1,-0.2 5,-0.1 0.914 120.5 48.1 -55.5 -49.1 -19.4 0.5 -13.2 55 92 A E H > S+ 0 0 127 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.886 115.2 44.9 -61.7 -41.7 -18.4 -3.0 -14.2 56 93 A V H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.874 112.5 51.6 -70.5 -38.8 -18.2 -2.2 -17.9 57 94 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.904 108.2 54.1 -61.1 -40.7 -16.3 1.0 -17.2 58 95 A E H X S+ 0 0 87 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.911 109.3 45.5 -63.4 -44.0 -13.9 -1.0 -15.1 59 96 A T H X S+ 0 0 70 -4,-1.7 4,-2.6 1,-0.2 -1,-0.2 0.873 110.9 53.4 -68.6 -36.8 -13.1 -3.5 -17.8 60 97 A K H X S+ 0 0 42 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.886 108.4 50.3 -66.8 -36.7 -12.7 -0.8 -20.4 61 98 A V H X S+ 0 0 22 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.968 113.0 45.8 -60.2 -53.0 -10.1 1.0 -18.2 62 99 A A H X S+ 0 0 58 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.876 112.2 51.9 -58.1 -40.7 -8.2 -2.2 -17.7 63 100 A Q H X S+ 0 0 81 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.876 110.2 47.6 -66.5 -39.1 -8.3 -3.0 -21.5 64 101 A V H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.925 114.5 46.5 -67.4 -45.2 -7.0 0.5 -22.5 65 102 A I H X S+ 0 0 44 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.945 113.8 48.4 -59.5 -50.5 -4.2 0.3 -19.9 66 103 A D H X S+ 0 0 81 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.915 114.2 46.2 -57.4 -46.3 -3.3 -3.3 -21.0 67 104 A S H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.933 114.6 47.4 -62.4 -47.4 -3.3 -2.3 -24.7 68 105 A A H <>S+ 0 0 0 -4,-2.9 5,-3.5 1,-0.2 3,-0.3 0.935 112.5 47.8 -60.7 -49.7 -1.3 0.9 -24.0 69 106 A R H ><5S+ 0 0 93 -4,-3.1 3,-0.9 3,-0.3 -1,-0.2 0.875 111.4 50.3 -61.8 -39.5 1.4 -0.9 -21.9 70 107 A R H 3<5S+ 0 0 157 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.757 111.0 48.6 -72.8 -24.5 1.8 -3.7 -24.4 71 108 A H T 3<5S- 0 0 80 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.406 120.2-120.7 -83.6 -1.7 2.2 -1.1 -27.1 72 109 A Q T < 5 + 0 0 175 -3,-0.9 -3,-0.3 1,-0.2 -2,-0.1 0.871 66.9 138.9 59.6 40.5 4.7 0.4 -24.6 73 110 A H < - 0 0 43 -5,-3.5 -1,-0.2 -8,-0.2 -2,-0.1 -0.868 57.2-135.9-110.8 150.9 2.8 3.7 -24.4 74 111 A P + 0 0 51 0, 0.0 -5,-0.1 0, 0.0 -62,-0.0 0.185 44.9 157.9 -88.4 15.9 2.1 5.6 -21.1 75 112 A L - 0 0 3 -11,-0.1 2,-0.4 1,-0.1 -6,-0.1 -0.161 31.8-145.4 -50.2 121.9 -1.5 6.3 -22.0 76 113 A Q E +B 9 0A 89 -67,-0.6 -67,-2.5 -8,-0.1 2,-0.4 -0.776 21.0 177.4 -95.3 133.6 -3.4 7.0 -18.8 77 114 A C E +B 8 0A 9 -2,-0.4 2,-0.2 -69,-0.2 -69,-0.2 -0.999 9.0 149.2-138.7 133.7 -7.0 5.9 -18.4 78 115 A T E -B 7 0A 11 -71,-2.6 -71,-3.5 -2,-0.4 2,-0.3 -0.816 27.4-128.8-147.6-174.2 -9.4 6.2 -15.4 79 116 A M E -B 6 0A 19 -73,-0.3 2,-0.3 -2,-0.2 -73,-0.2 -0.971 14.1-176.1-144.3 156.3 -13.0 6.6 -14.5 80 117 A E E -B 5 0A 8 -75,-2.0 -75,-3.0 -2,-0.3 52,-0.0 -0.984 42.5 -76.9-148.7 158.6 -15.4 8.7 -12.4 81 118 A K E B 4 0A 124 -2,-0.3 -77,-0.3 -77,-0.2 -79,-0.0 -0.236 360.0 360.0 -52.0 136.3 -19.1 8.9 -11.5 82 119 A D 0 0 96 -79,-2.8 -1,-0.2 -30,-0.1 -78,-0.2 0.476 360.0 360.0 -78.3 360.0 -21.3 10.3 -14.2 83 !* 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 84 36 B Q 0 0 150 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.8 -31.9 24.5 -22.1 85 37 B K - 0 0 88 1,-0.1 3,-0.1 3,-0.0 2,-0.1 -0.473 360.0-107.2 -57.5 133.4 -29.1 25.6 -19.7 86 38 B P - 0 0 114 0, 0.0 53,-0.1 0, 0.0 -1,-0.1 -0.479 56.9 -72.9 -61.7 144.5 -25.9 25.3 -21.6 87 39 B S - 0 0 43 -2,-0.1 52,-0.5 1,-0.1 2,-0.2 0.102 46.3-126.6 -35.1 139.5 -23.9 22.3 -20.3 88 40 B L - 0 0 74 50,-0.1 79,-2.8 -3,-0.1 2,-0.4 -0.497 21.9-136.0 -82.9 163.7 -22.2 22.6 -16.9 89 41 B Y E -CD 137 166B 50 48,-3.8 48,-2.8 77,-0.3 2,-0.4 -0.982 4.1-138.8-127.3 135.2 -18.5 21.8 -16.6 90 42 B R E -CD 136 165B 9 75,-3.0 75,-2.0 -2,-0.4 2,-0.5 -0.743 16.5-137.2 -90.9 138.4 -16.8 19.7 -13.9 91 43 B V E -CD 135 164B 0 44,-2.9 43,-3.5 -2,-0.4 44,-0.9 -0.841 23.8-167.1 -97.3 128.5 -13.4 20.9 -12.6 92 44 B L E -CD 133 163B 0 71,-3.5 71,-2.7 -2,-0.5 2,-0.4 -0.881 13.8-157.1-118.2 144.7 -10.8 18.3 -12.2 93 45 B I E -CD 132 162B 0 39,-1.9 39,-1.5 -2,-0.4 2,-0.3 -0.967 18.0-139.8-115.6 139.6 -7.4 18.1 -10.4 94 46 B L E -CD 131 161B 34 67,-2.5 67,-0.5 -2,-0.4 37,-0.2 -0.693 19.1-112.8 -97.3 149.3 -4.8 15.7 -11.5 95 47 B N + 0 0 58 35,-2.8 2,-0.3 -2,-0.3 32,-0.1 -0.456 38.7 170.4 -74.8 151.1 -2.5 13.7 -9.2 96 48 B D - 0 0 32 3,-0.2 34,-0.1 -2,-0.1 64,-0.1 -0.965 40.4-119.6-155.3 167.8 1.2 14.4 -9.1 97 49 B D S S+ 0 0 137 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 0.146 103.2 44.2-100.5 19.7 4.2 13.4 -6.9 98 50 B Y S S+ 0 0 182 2,-0.1 -1,-0.1 1,-0.1 62,-0.0 0.641 80.2 94.8-131.4 -38.7 5.3 16.9 -5.8 99 51 B T S S- 0 0 16 1,-0.1 -3,-0.2 2,-0.1 59,-0.1 -0.471 78.9-118.4 -64.5 122.6 2.2 18.9 -4.8 100 52 B P > - 0 0 54 0, 0.0 4,-1.6 0, 0.0 3,-0.1 -0.273 11.6-128.0 -60.3 146.2 1.8 18.6 -1.0 101 53 B M H > S+ 0 0 93 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.887 109.5 57.8 -60.3 -42.6 -1.5 17.1 0.3 102 54 B E H > S+ 0 0 107 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.868 104.8 50.9 -58.2 -37.7 -2.1 20.0 2.5 103 55 B F H > S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.901 109.5 49.9 -67.3 -39.8 -1.9 22.3 -0.4 104 56 B V H X S+ 0 0 14 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.916 112.7 46.9 -63.7 -44.2 -4.5 20.2 -2.3 105 57 B V H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.937 112.2 50.9 -60.4 -48.0 -6.8 20.2 0.7 106 58 B Y H X S+ 0 0 77 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.907 109.2 51.7 -54.7 -45.1 -6.2 24.0 1.0 107 59 B V H X>S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.6 0.909 110.6 47.2 -60.0 -44.7 -7.1 24.4 -2.7 108 60 B L H X5S+ 0 0 0 -4,-2.2 6,-1.8 1,-0.2 4,-1.0 0.891 116.3 43.5 -67.6 -41.0 -10.4 22.4 -2.3 109 61 B E H X5S+ 0 0 66 -4,-2.6 4,-0.6 4,-0.2 -2,-0.2 0.908 120.9 44.5 -63.6 -42.5 -11.4 24.3 0.8 110 62 B R H <5S+ 0 0 153 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.954 128.6 16.0 -70.6 -58.1 -10.3 27.6 -0.8 111 63 B F H <5S+ 0 0 26 -4,-3.2 -3,-0.2 -5,-0.2 -1,-0.1 0.556 130.5 43.2-102.8 -11.5 -11.6 27.5 -4.4 112 64 B F H < - 0 0 63 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.390 39.3-103.4 -62.6 159.5 -15.2 21.6 4.3 116 68 B R H > S+ 0 0 122 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.864 123.5 53.9 -57.1 -35.7 -11.8 20.2 5.4 117 69 B E H > S+ 0 0 126 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.894 111.2 43.3 -67.7 -41.1 -13.4 16.8 5.7 118 70 B D H > S+ 0 0 58 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.832 113.8 52.6 -72.4 -33.3 -14.8 16.8 2.1 119 71 B A H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -2,-0.2 0.929 107.5 51.4 -65.9 -45.9 -11.5 18.3 0.9 120 72 B T H X S+ 0 0 43 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.898 109.7 50.7 -57.0 -43.5 -9.5 15.5 2.5 121 73 B R H X S+ 0 0 129 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.929 113.5 43.3 -61.0 -48.5 -11.7 12.9 0.9 122 74 B I H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.916 113.1 52.9 -65.3 -43.3 -11.3 14.4 -2.6 123 75 B M H X S+ 0 0 14 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.920 112.6 43.9 -57.0 -47.0 -7.6 14.9 -2.1 124 76 B L H X S+ 0 0 81 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.856 111.7 53.9 -68.6 -35.8 -7.1 11.3 -1.1 125 77 B H H X S+ 0 0 78 -4,-2.2 4,-2.9 -5,-0.2 6,-0.4 0.884 109.0 48.8 -64.5 -39.3 -9.4 10.1 -3.9 126 78 B V H X S+ 0 0 6 -4,-2.6 4,-2.3 2,-0.2 -31,-0.2 0.890 109.2 53.3 -65.3 -40.3 -7.2 12.1 -6.4 127 79 B H H < S+ 0 0 102 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.851 118.7 35.3 -61.3 -35.8 -4.1 10.5 -4.9 128 80 B Q H < S+ 0 0 175 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.819 127.2 35.0 -90.2 -35.4 -5.5 7.0 -5.4 129 81 B N H < S- 0 0 48 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.601 97.8-126.3 -98.8 -15.6 -7.4 7.5 -8.6 130 82 B G S < S+ 0 0 24 -4,-2.3 -35,-2.8 -5,-0.3 2,-0.3 0.153 87.7 44.0 88.6 -19.1 -5.0 9.9 -10.3 131 83 B V E -C 94 0B 0 -6,-0.4 2,-0.3 -37,-0.2 -37,-0.2 -0.991 62.8-179.0-154.5 151.0 -7.9 12.4 -10.9 132 84 B G E -C 93 0B 0 -39,-1.5 -39,-1.9 -2,-0.3 2,-0.5 -0.997 30.4-111.0-153.9 151.5 -10.9 13.8 -9.0 133 85 B V E -C 92 0B 42 -2,-0.3 -41,-0.2 -41,-0.2 3,-0.1 -0.731 21.4-176.1 -85.7 124.4 -13.8 16.1 -9.4 134 86 B C E - 0 0 0 -43,-3.5 2,-0.3 -2,-0.5 -1,-0.2 0.792 64.5 -50.7 -85.7 -33.1 -13.5 19.3 -7.4 135 87 B G E -C 91 0B 11 -44,-0.9 -44,-2.9 2,-0.0 2,-0.4 -0.963 47.5-105.4 174.8 174.5 -17.0 20.5 -8.4 136 88 B V E +C 90 0B 53 -2,-0.3 -46,-0.3 -46,-0.3 2,-0.2 -0.993 45.1 150.4-127.3 127.4 -19.4 21.2 -11.2 137 89 B Y E -C 89 0B 47 -48,-2.8 -48,-3.8 -2,-0.4 30,-0.1 -0.814 49.9 -69.6-141.9 176.9 -20.2 24.7 -12.3 138 90 B T > - 0 0 61 -2,-0.2 4,-2.8 -50,-0.2 5,-0.2 -0.317 57.4-102.3 -65.3 161.8 -21.2 26.8 -15.3 139 91 B Y H > S+ 0 0 94 -52,-0.5 4,-2.5 1,-0.2 5,-0.2 0.916 120.6 47.8 -55.3 -49.6 -18.5 27.1 -18.0 140 92 B E H > S+ 0 0 126 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.891 115.2 45.1 -60.9 -42.9 -17.5 30.6 -17.0 141 93 B V H > S+ 0 0 61 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 112.5 51.3 -69.2 -38.6 -17.3 29.8 -13.3 142 94 B A H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.903 109.0 52.5 -62.0 -40.6 -15.4 26.5 -14.0 143 95 B E H X S+ 0 0 84 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.899 109.4 48.2 -64.9 -40.2 -13.0 28.5 -16.2 144 96 B T H X S+ 0 0 70 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.891 110.5 50.9 -67.5 -41.2 -12.3 31.0 -13.3 145 97 B K H X S+ 0 0 44 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.864 108.5 52.2 -67.8 -35.8 -11.8 28.2 -10.8 146 98 B V H X S+ 0 0 22 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.967 111.9 45.6 -60.3 -52.9 -9.3 26.4 -13.0 147 99 B A H X S+ 0 0 58 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.880 112.4 51.9 -58.5 -40.6 -7.3 29.6 -13.5 148 100 B Q H X S+ 0 0 72 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.878 110.2 47.5 -66.3 -39.2 -7.4 30.4 -9.8 149 101 B V H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.928 114.6 46.5 -67.4 -45.4 -6.1 26.9 -8.8 150 102 B I H X S+ 0 0 44 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.945 113.8 48.5 -59.1 -50.4 -3.3 27.1 -11.4 151 103 B D H X S+ 0 0 82 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.915 114.1 46.2 -58.0 -46.0 -2.4 30.6 -10.3 152 104 B S H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.933 114.6 47.5 -62.4 -47.3 -2.4 29.6 -6.6 153 105 B A H <>S+ 0 0 0 -4,-2.9 5,-3.6 1,-0.2 3,-0.2 0.932 112.4 47.9 -60.9 -49.2 -0.4 26.4 -7.3 154 106 B R H ><5S+ 0 0 93 -4,-3.1 3,-0.9 3,-0.3 -1,-0.2 0.877 111.4 50.2 -62.1 -39.4 2.2 28.2 -9.4 155 107 B R H 3<5S+ 0 0 159 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.757 111.0 48.7 -72.9 -24.4 2.7 31.0 -6.9 156 108 B H T 3<5S- 0 0 80 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.411 120.2-120.8 -83.5 -2.0 3.1 28.3 -4.2 157 109 B Q T < 5 + 0 0 176 -3,-0.9 -3,-0.3 1,-0.2 -2,-0.1 0.874 66.8 138.8 59.9 40.6 5.5 26.8 -6.7 158 110 B H < - 0 0 43 -5,-3.6 -1,-0.2 -8,-0.2 -2,-0.1 -0.870 57.3-135.8-111.0 151.0 3.6 23.6 -7.0 159 111 B P + 0 0 50 0, 0.0 -5,-0.1 0, 0.0 -62,-0.0 0.182 44.9 157.9 -88.3 15.9 2.9 21.7 -10.2 160 112 B L - 0 0 4 -11,-0.1 2,-0.4 -7,-0.1 -6,-0.1 -0.165 31.8-145.4 -50.0 121.8 -0.7 21.0 -9.3 161 113 B Q E +D 94 0B 89 -67,-0.5 -67,-2.5 -8,-0.1 2,-0.4 -0.775 20.9 177.5 -95.2 133.6 -2.6 20.3 -12.6 162 114 B C E +D 93 0B 9 -2,-0.4 2,-0.2 -69,-0.2 -69,-0.2 -0.999 9.1 149.2-138.5 133.4 -6.2 21.5 -12.9 163 115 B T E -D 92 0B 19 -71,-2.7 -71,-3.5 -2,-0.4 2,-0.3 -0.815 27.3-129.1-147.3-174.2 -8.6 21.3 -15.9 164 116 B M E -D 91 0B 15 -120,-0.3 2,-0.3 -73,-0.3 -73,-0.2 -0.969 14.0-175.9-144.3 156.6 -12.3 20.9 -16.8 165 117 B E E -D 90 0B 2 -75,-2.0 -75,-3.0 -2,-0.3 -118,-0.1 -0.985 42.5 -77.0-149.4 157.7 -14.7 18.8 -18.9 166 118 B K E D 89 0B 120 -2,-0.3 -77,-0.3 -77,-0.2 -118,-0.0 -0.226 360.0 360.0 -51.6 136.7 -18.3 18.8 -19.8 167 119 B D 0 0 88 -79,-2.8 -1,-0.2 -30,-0.1 -78,-0.2 0.473 360.0 360.0 -78.5 360.0 -20.5 17.4 -17.1