==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-MAR-04 1V0O . COMPND 2 MOLECULE: CELL DIVISION CONTROL PROTEIN 2 HOMOLOG; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR S.HOLTON,A.MERCKX,D.BURGESS,C.DOERIG,M.NOBLE,J.ENDICOTT . 550 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28092.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 15.1 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 . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 25 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 4 2 1 1 0 1 2 1 2 0 0 0 2 0 0 0 2 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 . 0 6 2 2 3 1 2 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 2 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 3 A K 0 0 186 0, 0.0 21,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 136.6 11.0 9.5 51.1 2 4 A Y + 0 0 44 19,-0.1 2,-0.3 20,-0.1 19,-0.2 -0.913 360.0 172.4-132.6 155.5 14.6 8.6 50.1 3 5 A H E +A 20 0A 82 17,-1.9 17,-2.3 -2,-0.3 0, 0.0 -0.955 47.9 60.1-158.4 172.2 17.9 9.5 51.6 4 6 A G E - 0 0 57 -2,-0.3 -1,-0.1 15,-0.2 14,-0.1 0.863 69.6-167.8 67.5 37.8 21.7 9.0 51.6 5 7 A L E - 0 0 82 -3,-0.1 2,-0.4 14,-0.1 14,-0.2 -0.287 11.0-177.2 -62.4 139.0 21.8 10.1 48.0 6 8 A E E -A 18 0A 131 12,-1.5 12,-2.8 0, 0.0 2,-0.1 -0.966 29.9-117.4-141.0 120.7 25.1 9.5 46.1 7 9 A K E +A 17 0A 122 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.374 40.8 161.0 -58.0 124.8 25.8 10.5 42.6 8 10 A I E + 0 0 79 8,-2.3 2,-0.3 1,-0.3 9,-0.2 0.483 61.1 4.8-118.4 -14.0 26.4 7.5 40.4 9 11 A G E -A 16 0A 22 7,-1.6 7,-1.7 2,-0.0 2,-0.3 -0.992 50.7-152.8-163.6 166.4 25.8 8.9 36.9 10 12 A E E +A 15 0A 89 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.934 14.1 169.1-152.4 126.6 25.0 11.9 34.7 11 13 A G E > -A 14 0A 34 3,-2.2 3,-0.6 -2,-0.3 -2,-0.0 -0.562 52.2 -88.2-114.9-169.5 23.3 12.3 31.4 12 14 A T T 3 S+ 0 0 79 1,-0.2 3,-0.1 -2,-0.2 141,-0.0 0.849 121.7 37.3 -70.4 -37.3 22.2 15.4 29.5 13 15 A Y T 3 S- 0 0 61 1,-0.2 20,-1.2 19,-0.1 2,-0.3 0.159 122.8 -0.1-109.8 16.9 18.7 15.7 31.1 14 16 A G E < -AB 11 32A 4 -3,-0.6 -3,-2.2 18,-0.2 2,-0.4 -0.901 59.4-109.6 172.1 161.7 19.3 14.6 34.6 15 17 A V E -AB 10 31A 17 16,-1.8 16,-2.6 -2,-0.3 2,-0.4 -0.911 29.6-146.1-104.8 133.3 21.6 13.4 37.5 16 18 A V E -AB 9 30A 42 -7,-1.7 -8,-2.3 -2,-0.4 -7,-1.6 -0.869 18.0-174.1-100.7 133.2 21.2 9.8 38.7 17 19 A Y E -AB 7 29A 56 12,-2.4 12,-3.2 -2,-0.4 2,-0.4 -0.971 25.4-129.0-124.7 140.1 21.7 9.0 42.5 18 20 A K E +AB 6 28A 77 -12,-2.8 -12,-1.5 -2,-0.4 2,-0.3 -0.749 44.0 165.6 -76.9 132.9 21.8 5.8 44.5 19 21 A A E - B 0 27A 3 8,-2.2 8,-2.2 -2,-0.4 2,-0.4 -0.945 31.5-128.7-145.2 164.8 19.5 6.1 47.5 20 22 A Q E -AB 3 26A 101 -17,-2.3 -17,-1.9 -2,-0.3 6,-0.2 -0.913 16.1-141.0-115.9 144.5 17.7 4.1 50.2 21 23 A N > - 0 0 25 4,-2.0 3,-1.3 -2,-0.4 -19,-0.1 -0.195 48.0 -80.6 -83.4-170.2 14.0 4.2 51.2 22 24 A N T 3 S+ 0 0 107 -21,-0.4 -20,-0.1 1,-0.2 -1,-0.0 0.481 129.7 53.3 -76.4 -0.9 12.8 4.0 54.8 23 25 A Y T 3 S- 0 0 195 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.207 119.7-102.4-115.3 11.8 13.3 0.2 54.9 24 26 A G S < S+ 0 0 39 -3,-1.3 2,-0.3 1,-0.3 -2,-0.1 0.497 73.7 142.9 83.7 3.9 16.9 0.2 53.7 25 27 A E - 0 0 107 1,-0.1 -4,-2.0 -5,-0.0 2,-0.3 -0.587 46.2-126.3 -81.9 140.8 16.1 -0.9 50.1 26 28 A T E +B 20 0A 48 -2,-0.3 46,-0.5 -6,-0.2 2,-0.3 -0.671 33.8 162.1 -95.6 138.3 18.2 0.6 47.3 27 29 A F E -B 19 0A 31 -8,-2.2 -8,-2.2 -2,-0.3 2,-0.5 -0.893 37.3-112.4-140.3 169.1 16.8 2.4 44.2 28 30 A A E -BC 18 70A 10 42,-2.2 42,-2.9 -2,-0.3 2,-0.6 -0.940 26.8-155.9-108.7 126.2 18.1 4.8 41.6 29 31 A L E -BC 17 69A 10 -12,-3.2 -12,-2.4 -2,-0.5 2,-0.8 -0.914 1.4-159.6-108.0 121.6 16.8 8.4 41.6 30 32 A K E -BC 16 68A 26 38,-2.8 38,-2.0 -2,-0.6 2,-0.6 -0.858 5.9-159.7-101.3 102.4 16.8 10.4 38.4 31 33 A K E -BC 15 67A 75 -16,-2.6 -16,-1.8 -2,-0.8 36,-0.2 -0.761 16.0-139.7 -80.2 119.1 16.6 14.1 39.2 32 34 A I E -B 14 0A 13 34,-2.0 34,-0.4 -2,-0.6 -18,-0.2 -0.533 7.3-133.0 -80.9 147.9 15.4 15.9 36.0 33 35 A R 0 0 117 -20,-1.2 -19,-0.1 -2,-0.2 -1,-0.1 0.237 360.0 360.0 -91.8 12.2 17.0 19.3 35.1 34 36 A L 0 0 141 -21,-0.2 -20,-0.0 32,-0.1 -3,-0.0 0.903 360.0 360.0 45.8 360.0 13.6 21.1 34.4 35 ! 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 36 45 A S > 0 0 99 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -38.1 5.9 16.9 28.6 37 46 A T H > + 0 0 30 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.886 360.0 46.9 -62.6 -40.7 9.2 15.4 27.6 38 47 A T H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.892 108.4 55.3 -67.9 -39.7 9.3 13.7 31.0 39 48 A I H > S+ 0 0 119 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.885 107.4 50.3 -59.1 -39.3 5.6 12.6 30.5 40 49 A R H X S+ 0 0 62 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.932 109.8 49.2 -67.8 -44.7 6.5 10.9 27.2 41 50 A E H X S+ 0 0 7 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.903 110.6 51.4 -56.5 -45.6 9.5 9.0 28.7 42 51 A I H X S+ 0 0 20 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.852 104.6 56.4 -61.2 -37.4 7.3 7.8 31.6 43 52 A S H X S+ 0 0 60 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.908 108.9 47.3 -65.1 -38.2 4.7 6.5 29.2 44 53 A I H X S+ 0 0 5 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.923 111.1 50.2 -63.5 -47.2 7.3 4.3 27.5 45 54 A L H < S+ 0 0 10 -4,-2.1 11,-0.4 1,-0.2 -1,-0.2 0.794 110.7 51.0 -64.4 -29.1 8.6 3.0 30.9 46 55 A K H < S+ 0 0 136 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.860 113.0 45.4 -74.4 -37.4 5.0 2.2 31.9 47 56 A E H < S+ 0 0 133 -4,-1.7 2,-0.6 -5,-0.2 -2,-0.2 0.872 99.7 75.1 -72.2 -43.5 4.4 0.2 28.6 48 57 A L < + 0 0 4 -4,-2.5 2,-0.4 -5,-0.1 -1,-0.1 -0.663 51.4 166.9 -83.1 116.5 7.6 -1.7 28.6 49 58 A K + 0 0 127 -2,-0.6 2,-0.3 6,-0.1 5,-0.1 -0.933 24.1 130.8-128.0 105.6 7.8 -4.6 31.0 50 59 A H > - 0 0 43 -2,-0.4 3,-1.7 3,-0.4 53,-0.0 -0.990 65.2-113.8-156.7 147.6 10.7 -7.0 30.3 51 60 A S T 3 S+ 0 0 92 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.804 116.4 45.9 -51.3 -36.3 13.6 -8.7 32.1 52 61 A N T 3 S+ 0 0 14 47,-0.1 80,-2.4 79,-0.1 2,-0.4 -0.011 98.2 81.2-105.9 27.7 16.2 -6.6 30.2 53 62 A I B < S-e 132 0B 1 -3,-1.7 -3,-0.4 78,-0.3 80,-0.2 -0.999 86.5-108.9-131.2 131.9 14.5 -3.2 30.5 54 63 A V - 0 0 7 78,-2.3 2,-0.4 -2,-0.4 -6,-0.1 -0.273 34.1-128.0 -64.4 139.6 14.9 -1.0 33.7 55 64 A K - 0 0 67 -4,-0.1 16,-2.0 -6,-0.1 2,-0.4 -0.741 9.6-145.5 -96.0 133.8 11.8 -0.7 35.8 56 65 A L E -D 70 0A 27 -2,-0.4 14,-0.2 -11,-0.4 3,-0.1 -0.809 13.8-177.0 -93.1 136.6 10.3 2.6 36.9 57 66 A Y E - 0 0 126 12,-3.3 2,-0.3 -2,-0.4 13,-0.2 0.794 57.3 -28.7-107.6 -43.1 8.6 2.5 40.4 58 67 A D E -D 69 0A 66 11,-1.3 11,-2.8 2,-0.0 2,-0.4 -0.991 44.3-122.5-164.9-177.3 7.3 6.0 40.7 59 68 A V E -D 68 0A 23 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.992 16.4-160.5-132.2 120.6 7.3 9.7 40.0 60 69 A I E -D 67 0A 64 7,-2.4 7,-1.6 -2,-0.4 2,-0.8 -0.905 9.6-165.0-109.4 112.9 7.5 12.4 42.7 61 70 A H E +D 66 0A 145 -2,-0.6 5,-0.2 5,-0.2 2,-0.2 -0.803 14.8 167.5-108.9 92.7 6.4 15.9 41.5 62 71 A T - 0 0 86 3,-2.4 -2,-0.0 -2,-0.8 5,-0.0 -0.517 47.9-113.7 -78.8 164.9 7.3 18.9 43.6 63 72 A K S S+ 0 0 191 -2,-0.2 -1,-0.1 1,-0.2 3,-0.0 0.876 118.5 27.0 -67.7 -38.1 6.8 22.3 42.0 64 73 A K S S+ 0 0 159 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.339 125.8 51.0-104.9 4.2 10.5 22.9 42.0 65 74 A R - 0 0 168 2,-0.0 -3,-2.4 -34,-0.0 2,-0.4 -1.000 52.4-176.6-146.9 141.6 11.7 19.2 41.9 66 75 A L E + D 0 61A 34 -34,-0.4 -34,-2.0 -2,-0.3 2,-0.4 -0.984 11.0 178.9-140.6 125.8 10.9 16.1 39.8 67 76 A V E -CD 31 60A 28 -7,-1.6 -7,-2.4 -2,-0.4 2,-0.5 -0.993 17.8-153.3-136.2 126.6 12.4 12.7 40.5 68 77 A L E -CD 30 59A 0 -38,-2.0 -38,-2.8 -2,-0.4 2,-0.5 -0.879 16.7-147.5 -96.0 128.1 11.9 9.3 38.8 69 78 A V E +CD 29 58A 0 -11,-2.8 -12,-3.3 -2,-0.5 -11,-1.3 -0.865 25.8 171.7-101.8 122.1 12.5 6.3 41.1 70 79 A F E -CD 28 56A 24 -42,-2.9 -42,-2.2 -2,-0.5 -14,-0.2 -0.756 39.6 -88.5-122.5 165.1 13.9 3.2 39.3 71 80 A E - 0 0 27 -16,-2.0 2,-0.4 -2,-0.2 -44,-0.2 -0.435 51.7-120.6 -65.5 154.8 15.3 -0.2 40.2 72 81 A H - 0 0 36 -46,-0.5 2,-0.4 -2,-0.1 -46,-0.1 -0.861 26.2-175.1-112.5 133.7 19.1 -0.0 40.9 73 82 A L - 0 0 12 -2,-0.4 52,-0.2 1,-0.1 51,-0.0 -0.987 24.9-136.6-123.7 139.4 22.0 -1.8 39.2 74 83 A D S S+ 0 0 79 -2,-0.4 2,-0.2 49,-0.1 51,-0.2 0.780 77.7 19.7 -63.4 -33.5 25.5 -1.5 40.6 75 84 A Q E -F 124 0B 76 49,-1.7 49,-2.2 4,-0.0 2,-0.3 -0.780 58.0-140.6-135.6 164.0 27.3 -1.0 37.2 76 85 A D E >> -F 123 0B 25 47,-0.3 4,-1.5 -2,-0.2 3,-0.5 -0.876 37.1-107.3-124.3 170.2 27.1 -0.2 33.6 77 86 A L H 3> S+ 0 0 0 45,-2.5 4,-2.6 42,-1.1 5,-0.2 0.854 114.4 63.2 -65.8 -34.8 28.8 -1.8 30.6 78 87 A K H 3> S+ 0 0 56 41,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.869 104.5 46.8 -57.5 -41.5 31.2 1.2 30.1 79 88 A K H <> S+ 0 0 92 -3,-0.5 4,-2.2 2,-0.2 5,-0.3 0.889 110.8 52.1 -67.6 -40.2 32.7 0.6 33.6 80 89 A L H X S+ 0 0 40 -4,-1.5 4,-1.3 1,-0.2 -2,-0.2 0.910 114.3 43.2 -62.2 -41.3 33.1 -3.1 32.9 81 90 A L H < S+ 0 0 7 -4,-2.6 6,-0.3 2,-0.2 -2,-0.2 0.847 110.3 56.9 -70.8 -36.2 34.9 -2.4 29.6 82 91 A D H < S+ 0 0 113 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.971 114.3 36.5 -62.0 -54.8 37.0 0.4 31.2 83 92 A V H < S+ 0 0 118 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.808 103.4 98.9 -65.0 -30.3 38.5 -1.9 33.9 84 93 A C S < S- 0 0 37 -4,-1.3 3,-0.4 -5,-0.3 2,-0.3 -0.386 83.0-115.0 -72.3 129.1 38.6 -4.8 31.4 85 94 A E S S- 0 0 146 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.489 78.7 -51.0 -42.5 112.5 41.6 -5.8 29.6 86 95 A G S S- 0 0 39 -2,-0.3 102,-0.2 -4,-0.1 -1,-0.2 0.516 119.4 -7.7 6.4 72.3 40.8 -5.1 26.0 87 96 A G S S- 0 0 2 -3,-0.4 99,-0.2 -6,-0.3 98,-0.1 0.237 78.3 -86.6 104.6 146.7 37.5 -7.0 25.8 88 97 A L - 0 0 19 97,-2.2 2,-0.2 1,-0.1 -7,-0.0 -0.200 54.1 -85.3 -75.2 167.7 35.2 -9.3 27.8 89 98 A E >> - 0 0 155 1,-0.1 4,-2.4 4,-0.0 3,-0.7 -0.553 42.7-112.4 -74.0 144.6 35.4 -13.1 27.8 90 99 A S H 3> S+ 0 0 89 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.841 114.8 49.6 -45.5 -51.0 33.5 -14.8 25.0 91 100 A V H 3> S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.868 113.7 46.9 -62.3 -38.0 30.8 -16.4 27.1 92 101 A T H <> S+ 0 0 54 -3,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.891 111.4 50.5 -67.7 -41.9 30.1 -13.1 28.9 93 102 A A H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.931 110.6 49.7 -64.7 -43.5 30.0 -11.1 25.6 94 103 A K H X S+ 0 0 70 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.900 110.9 51.0 -57.5 -42.9 27.5 -13.6 24.2 95 104 A S H X S+ 0 0 46 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.896 111.1 45.6 -65.7 -45.6 25.4 -13.3 27.3 96 105 A F H X S+ 0 0 8 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.901 113.8 50.0 -65.2 -41.1 25.2 -9.5 27.2 97 106 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.865 110.2 49.8 -64.7 -38.0 24.4 -9.5 23.5 98 107 A L H X S+ 0 0 62 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.899 114.1 45.2 -68.7 -38.3 21.7 -12.1 23.9 99 108 A Q H X S+ 0 0 23 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.916 113.1 49.8 -71.3 -45.6 20.1 -10.0 26.7 100 109 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.918 111.8 49.5 -55.6 -47.0 20.5 -6.7 24.8 101 110 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.865 110.8 49.3 -60.9 -40.3 18.9 -8.4 21.7 102 111 A N H X S+ 0 0 54 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.955 113.1 47.4 -64.9 -48.0 15.9 -9.7 23.8 103 112 A G H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.886 116.8 42.3 -58.1 -43.3 15.4 -6.3 25.4 104 113 A I H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.818 109.9 56.1 -79.6 -32.3 15.6 -4.4 22.1 105 114 A A H X S+ 0 0 4 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.912 109.6 48.0 -62.8 -39.9 13.4 -7.0 20.2 106 115 A Y H X S+ 0 0 35 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.920 110.6 51.5 -64.7 -46.8 10.7 -6.5 22.8 107 116 A C H <>S+ 0 0 2 -4,-1.8 5,-2.4 1,-0.2 3,-0.3 0.925 111.7 46.5 -51.3 -52.2 11.1 -2.7 22.4 108 117 A H H ><5S+ 0 0 28 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.861 107.7 55.6 -66.5 -37.5 10.7 -2.9 18.7 109 118 A D H 3<5S+ 0 0 92 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.827 109.1 49.7 -60.7 -31.8 7.7 -5.2 18.9 110 119 A R T 3<5S- 0 0 118 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.125 122.7-107.6 -92.9 16.9 6.1 -2.5 21.1 111 120 A R T < 5S+ 0 0 150 -3,-1.6 30,-3.2 1,-0.2 2,-0.5 0.793 75.2 135.5 62.7 35.5 6.9 0.3 18.6 112 121 A V E < -H 140 0C 4 -5,-2.4 2,-0.4 28,-0.2 28,-0.2 -0.968 37.0-166.2-116.5 123.5 9.6 1.8 20.6 113 122 A L E -H 139 0C 10 26,-2.6 26,-2.5 -2,-0.5 58,-0.1 -0.911 5.4-162.3-101.6 136.3 12.9 2.9 19.1 114 123 A H - 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0 0 156 1,-0.1 2,-0.5 0, 0.0 -2,-0.0 -0.153 69.9-107.3 -62.2 147.1 -1.0 46.7 -4.3 445 178 B Y + 0 0 85 3,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.678 57.7 164.4 -66.2 122.8 -3.5 46.1 -1.6 446 179 B S > - 0 0 31 -2,-0.5 3,-1.0 1,-0.1 4,-0.3 -0.938 47.4-157.9-154.7 125.7 -4.0 42.4 -2.0 447 180 B T T >> S+ 0 0 47 -2,-0.3 3,-1.3 1,-0.2 4,-0.9 0.718 91.5 79.9 -67.3 -23.4 -5.5 39.6 0.1 448 181 B T H 3> S+ 0 0 21 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.738 77.3 71.5 -57.1 -27.2 -3.4 37.2 -2.0 449 182 B I H <> S+ 0 0 13 -3,-1.0 4,-1.3 1,-0.2 -1,-0.3 0.870 99.2 45.0 -57.2 -40.6 -0.4 38.1 0.2 450 183 B D H <> S+ 0 0 0 -3,-1.3 4,-1.9 -4,-0.3 -1,-0.2 0.814 106.4 59.7 -77.2 -30.5 -1.7 36.2 3.1 451 184 B I H X S+ 0 0 2 -4,-0.9 4,-2.0 2,-0.2 -1,-0.2 0.862 102.5 52.6 -67.0 -39.0 -2.7 33.2 1.1 452 185 B W H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.955 109.6 49.6 -57.8 -49.7 0.8 32.6 -0.1 453 186 B S H X S+ 0 0 4 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.870 108.3 53.5 -56.6 -39.1 1.9 32.7 3.6 454 187 B V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.880 107.8 50.8 -65.3 -39.4 -0.8 30.1 4.5 455 188 B G H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.922 110.5 49.1 -61.7 -45.3 0.5 27.8 1.7 456 189 B C H X S+ 0 0 3 -4,-2.4 4,-1.8 1,-0.2 11,-0.4 0.879 113.1 46.2 -61.8 -41.1 4.1 28.2 3.1 457 190 B I H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.860 110.9 53.5 -69.2 -37.7 2.8 27.4 6.7 458 191 B F H >X S+ 0 0 1 -4,-2.4 4,-1.6 2,-0.2 3,-0.6 0.974 109.6 47.8 -58.9 -53.8 0.8 24.5 5.3 459 192 B A H 3X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 6,-0.3 0.872 110.1 53.3 -53.9 -40.1 3.9 23.1 3.7 460 193 B E H 3X S+ 0 0 17 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.806 106.7 51.5 -68.9 -32.4 5.9 23.6 6.9 461 194 B M H << S+ 0 0 2 -4,-1.7 -97,-1.9 -3,-0.6 -1,-0.2 0.777 112.8 45.6 -72.0 -31.3 3.3 21.6 8.9 462 195 B V H < S+ 0 0 19 -4,-1.6 -2,-0.2 -99,-0.2 -1,-0.2 0.889 124.6 31.0 -78.4 -38.5 3.5 18.7 6.5 463 196 B N H < S- 0 0 15 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.765 96.2-126.3 -92.6 -30.7 7.3 18.6 6.3 464 197 B G S < S+ 0 0 23 -4,-2.0 -4,-0.1 -102,-0.3 -3,-0.1 0.299 82.6 68.7 97.9 -5.7 8.4 19.8 9.7 465 198 B T S S- 0 0 70 -6,-0.3 -2,-0.2 -103,-0.1 -1,-0.2 -0.965 94.1 -80.6-147.6 152.5 10.7 22.5 8.2 466 199 B P - 0 0 27 0, 0.0 -9,-0.1 0, 0.0 -33,-0.0 -0.372 29.3-150.9 -59.1 127.4 10.4 25.8 6.3 467 200 B L S S+ 0 0 26 -11,-0.4 -10,-0.0 1,-0.2 -11,-0.0 0.863 91.7 24.8 -64.0 -36.7 9.8 25.3 2.5 468 201 B F + 0 0 3 -36,-0.3 2,-1.7 -12,-0.1 -1,-0.2 -0.611 69.3 173.8-134.1 70.2 11.7 28.6 1.6 469 202 B P + 0 0 38 0, 0.0 2,-0.1 0, 0.0 -37,-0.0 -0.478 20.4 170.0 -83.7 75.5 14.2 29.6 4.3 470 203 B G - 0 0 4 -2,-1.7 -39,-0.3 1,-0.1 -38,-0.2 -0.419 34.2-154.0 -89.2 162.9 15.9 32.6 2.6 471 204 B V S S+ 0 0 124 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.404 77.9 20.1-118.5 -8.2 18.4 35.2 4.0 472 205 B S S > S- 0 0 55 1,-0.1 4,-2.5 -41,-0.0 5,-0.2 -0.949 87.2 -96.2-151.1 171.2 17.7 38.2 1.7 473 206 B E H > S+ 0 0 63 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.907 123.3 40.5 -54.9 -48.2 14.9 39.4 -0.6 474 207 B A H > S+ 0 0 63 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.753 112.8 54.2 -79.0 -25.9 16.5 38.0 -3.8 475 208 B D H > S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.885 107.7 52.0 -69.9 -42.0 17.6 34.7 -2.1 476 209 B Q H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.920 110.5 48.8 -52.8 -50.1 14.0 34.2 -1.0 477 210 B L H X S+ 0 0 10 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.924 111.1 48.6 -58.5 -48.9 12.9 34.7 -4.6 478 211 B M H X S+ 0 0 41 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.888 108.1 54.7 -65.6 -36.6 15.4 32.3 -6.0 479 212 B R H X S+ 0 0 71 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.884 109.7 47.8 -62.6 -39.8 14.5 29.6 -3.5 480 213 B I H >X S+ 0 0 0 -4,-1.8 4,-3.1 1,-0.2 3,-0.6 0.925 111.9 49.5 -63.6 -45.3 10.9 29.8 -4.5 481 214 B F H 3X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.829 104.6 58.2 -67.1 -36.2 11.8 29.6 -8.3 482 215 B R H 3< S+ 0 0 102 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.753 118.8 30.9 -66.4 -27.1 14.0 26.6 -7.7 483 216 B I H << S+ 0 0 34 -4,-0.9 28,-3.0 -3,-0.6 -2,-0.2 0.873 134.2 26.1 -90.4 -53.6 11.0 24.6 -6.3 484 217 B L H < S- 0 0 19 -4,-3.1 -3,-0.2 26,-0.2 -2,-0.2 0.567 113.3-101.7 -95.1 -11.3 8.0 26.1 -8.1 485 218 B G < - 0 0 4 -4,-1.9 24,-0.2 -5,-0.4 -1,-0.2 0.055 35.7 -75.3 105.4 148.1 9.6 27.3 -11.4 486 219 B T - 0 0 11 22,-2.1 21,-0.0 -5,-0.1 -8,-0.0 -0.634 57.4-111.1 -74.7 131.9 10.8 30.6 -12.8 487 220 B P - 0 0 5 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.250 36.3-177.2 -58.8 147.9 7.8 32.8 -13.9 488 221 B N > - 0 0 77 1,-0.0 4,-1.5 5,-0.0 7,-0.1 -0.915 41.9-101.0-136.6 168.3 7.2 33.4 -17.6 489 222 B S T 4 S+ 0 0 65 -2,-0.3 5,-0.1 1,-0.2 6,-0.1 0.735 117.9 56.6 -64.7 -25.7 4.5 35.5 -19.3 490 223 B K T 4 S+ 0 0 192 1,-0.2 -1,-0.2 2,-0.1 0, 0.0 0.971 117.2 32.7 -66.1 -54.1 2.4 32.5 -20.3 491 224 B N T 4 S+ 0 0 74 1,-0.3 44,-0.3 -3,-0.0 -2,-0.2 0.541 136.3 25.5 -84.5 -5.8 2.0 31.3 -16.6 492 225 B W S >< S- 0 0 11 -4,-1.5 3,-1.5 42,-0.1 -1,-0.3 -0.583 84.0-149.1-155.1 82.9 2.1 34.8 -15.1 493 226 B P T 3 S+ 0 0 65 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.292 79.8 10.8 -56.5 135.1 0.9 37.5 -17.5 494 227 B N T > S+ 0 0 106 -5,-0.1 3,-1.8 1,-0.1 4,-0.2 0.566 80.3 133.2 71.3 13.9 2.4 41.0 -17.1 495 228 B V G X + 0 0 0 -3,-1.5 3,-1.4 1,-0.3 6,-0.1 0.796 63.2 70.1 -60.3 -26.1 5.1 39.7 -14.6 496 229 B T G 3 S+ 0 0 76 1,-0.3 -1,-0.3 -4,-0.2 5,-0.1 0.591 88.2 63.7 -68.9 -13.0 7.6 41.7 -16.7 497 230 B E G < S+ 0 0 146 -3,-1.8 -1,-0.3 3,-0.1 -2,-0.2 0.558 73.4 115.2 -86.1 -10.8 6.1 45.0 -15.4 498 231 B L S X S- 0 0 28 -3,-1.4 3,-1.9 -4,-0.2 -57,-0.1 -0.382 76.4-121.7 -66.2 135.4 7.1 44.3 -11.8 499 232 B P T 3 S+ 0 0 99 0, 0.0 -58,-0.2 0, 0.0 -1,-0.1 0.784 108.7 33.6 -51.7 -33.8 9.6 46.8 -10.5 500 233 B K T 3 S+ 0 0 117 -60,-2.9 2,-0.2 2,-0.1 -59,-0.1 0.109 83.3 128.6-114.7 19.3 12.3 44.2 -9.7 501 234 B Y < - 0 0 54 -3,-1.9 -5,-0.0 -61,-0.3 3,-0.0 -0.570 43.7-157.4 -65.3 136.3 11.6 41.6 -12.4 502 235 B D > - 0 0 75 -2,-0.2 3,-1.5 1,-0.1 -2,-0.1 -0.989 14.9-149.3-118.9 123.9 14.8 40.8 -14.2 503 236 B P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.680 96.8 62.7 -63.9 -15.8 14.5 39.4 -17.8 504 237 B N T 3 + 0 0 134 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.182 68.4 140.3 -99.6 16.4 17.8 37.4 -17.1 505 238 B F < - 0 0 32 -3,-1.5 2,-0.1 1,-0.1 -19,-0.0 -0.359 63.7-106.1 -52.1 135.1 16.4 35.3 -14.2 506 239 B T - 0 0 89 1,-0.1 2,-0.6 0, 0.0 -1,-0.1 -0.439 38.1-118.2 -65.1 139.7 17.8 31.8 -14.5 507 240 B V + 0 0 106 -2,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.759 35.4 178.3 -95.7 116.3 15.1 29.4 -15.7 508 241 B Y - 0 0 79 -2,-0.6 -22,-2.1 -27,-0.1 -25,-0.1 -0.899 22.3-133.9-111.2 145.1 14.1 26.6 -13.4 509 242 B E - 0 0 144 -2,-0.4 -24,-0.3 -24,-0.2 2,-0.1 -0.666 37.7 -91.3 -91.5 153.8 11.3 24.1 -14.2 510 243 B P - 0 0 83 0, 0.0 -26,-0.2 0, 0.0 -27,-0.1 -0.419 36.3-128.4 -65.4 135.0 8.8 23.2 -11.5 511 244 B L - 0 0 71 -28,-3.0 5,-0.1 -2,-0.1 -28,-0.0 -0.542 37.9 -92.7 -72.1 148.5 9.6 20.3 -9.2 512 245 B P >> - 0 0 75 0, 0.0 3,-1.2 0, 0.0 4,-0.5 -0.399 33.0-125.8 -60.3 141.5 6.9 17.7 -8.9 513 246 B W H >> S+ 0 0 69 1,-0.3 3,-0.9 2,-0.2 4,-0.8 0.848 107.7 58.4 -59.9 -34.5 4.7 18.5 -5.9 514 247 B E H 34 S+ 0 0 122 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.678 94.6 65.6 -72.1 -19.7 5.2 15.0 -4.4 515 248 B S H <4 S+ 0 0 76 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.699 115.1 26.1 -79.4 -21.1 9.0 15.4 -4.3 516 249 B F H << S+ 0 0 25 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.341 118.8 58.2-121.6 5.3 9.0 18.2 -1.7 517 250 B L S >< S- 0 0 3 -4,-0.8 3,-0.7 3,-0.1 2,-0.2 -0.580 74.9-177.3-129.1 68.5 5.6 17.4 0.1 518 251 B K T 3 + 0 0 128 1,-0.2 3,-0.1 -3,-0.2 -3,-0.1 -0.486 64.4 19.5 -75.5 131.6 6.2 13.8 1.3 519 252 B G T 3 S+ 0 0 78 1,-0.2 2,-0.4 -2,-0.2 -1,-0.2 0.840 88.4 128.1 81.5 35.9 3.3 12.1 3.1 520 253 B L < - 0 0 30 -3,-0.7 -1,-0.2 -6,-0.1 -3,-0.1 -0.991 54.4-127.5-127.1 123.5 0.5 14.4 1.8 521 254 B D > - 0 0 78 -2,-0.4 4,-2.1 -3,-0.1 5,-0.2 -0.066 31.7 -95.7 -68.3 170.4 -2.6 12.9 0.2 522 255 B E H > S+ 0 0 183 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.828 120.7 47.1 -60.6 -42.2 -3.9 14.0 -3.2 523 256 B S H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 27,-0.3 0.874 111.7 51.4 -69.5 -38.3 -6.5 16.5 -2.1 524 257 B G H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.879 109.9 50.0 -62.9 -40.3 -4.1 18.2 0.3 525 258 B I H X S+ 0 0 14 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.882 109.9 52.0 -64.4 -38.9 -1.6 18.5 -2.5 526 259 B D H X S+ 0 0 60 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.928 111.5 44.8 -64.3 -48.6 -4.3 20.0 -4.7 527 260 B L H >X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 3,-0.6 0.939 113.7 50.6 -59.0 -48.8 -5.2 22.7 -2.1 528 261 B L H >X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 3,-0.7 0.892 107.1 53.0 -59.9 -42.6 -1.6 23.5 -1.4 529 262 B S H 3< S+ 0 0 18 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.772 106.9 53.9 -64.8 -27.1 -0.7 24.0 -5.1 530 263 B K H << S+ 0 0 67 -4,-1.1 10,-2.1 -3,-0.6 3,-0.4 0.687 108.5 48.7 -82.6 -21.3 -3.6 26.4 -5.4 531 264 B M H << S+ 0 0 0 -4,-1.1 2,-0.3 -3,-0.7 -2,-0.2 0.848 109.3 53.8 -79.2 -40.0 -2.3 28.5 -2.5 532 265 B L S < S+ 0 0 5 -4,-2.1 2,-0.4 -5,-0.2 -1,-0.2 -0.202 70.4 139.8 -95.7 42.3 1.2 28.6 -3.9 533 266 B K - 0 0 69 -3,-0.4 6,-0.1 -2,-0.3 -3,-0.1 -0.731 49.5-143.9 -71.5 132.9 0.4 29.9 -7.4 534 267 B L S S+ 0 0 22 -2,-0.4 -97,-0.4 -50,-0.1 -1,-0.2 0.938 87.1 71.9 -68.2 -45.9 3.2 32.4 -8.2 535 268 B D S >> S- 0 0 10 -44,-0.3 3,-1.7 1,-0.2 4,-0.5 -0.588 79.0-149.2 -70.3 114.8 0.7 34.7 -10.0 536 269 B P G >4 S+ 0 0 14 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.809 94.6 62.6 -60.8 -28.9 -1.4 36.3 -7.2 537 270 B N G 34 S+ 0 0 131 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.717 103.4 50.2 -64.5 -23.6 -4.4 36.5 -9.6 538 271 B Q G <4 S+ 0 0 84 -3,-1.7 -1,-0.2 2,-0.1 2,-0.1 0.505 87.8 111.0 -93.9 -7.7 -4.4 32.8 -9.9 539 272 B R S << S- 0 0 13 -3,-0.9 -8,-0.2 -4,-0.5 -9,-0.1 -0.396 73.0-111.9 -71.7 143.2 -4.3 32.0 -6.1 540 273 B I - 0 0 21 -10,-2.1 2,-0.2 -13,-0.2 -1,-0.1 -0.371 32.0-124.3 -63.8 149.4 -7.2 30.5 -4.3 541 274 B T > - 0 0 57 1,-0.1 4,-2.0 -2,-0.0 5,-0.1 -0.535 22.3-110.5 -87.3 164.8 -9.0 32.8 -1.8 542 275 B A H > S+ 0 0 4 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.903 119.6 53.2 -59.7 -42.3 -9.5 31.9 1.9 543 276 B K H > S+ 0 0 116 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.873 111.0 46.5 -62.9 -38.4 -13.2 31.5 1.3 544 277 B Q H >4 S+ 0 0 101 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.853 108.2 55.4 -71.4 -37.9 -12.6 29.1 -1.6 545 278 B A H >< S+ 0 0 1 -4,-2.0 3,-1.2 1,-0.2 6,-0.2 0.826 101.6 57.4 -66.9 -32.7 -10.0 27.0 0.3 546 279 B L H 3< S+ 0 0 33 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.758 104.0 54.4 -68.1 -25.2 -12.5 26.4 3.1 547 280 B E T << S+ 0 0 138 -3,-0.6 -1,-0.2 -4,-0.6 -2,-0.2 0.405 86.7 119.5 -85.0 -0.0 -14.8 24.9 0.5 548 281 B H S X> S- 0 0 26 -3,-1.2 3,-1.1 -4,-0.2 4,-0.6 -0.306 74.1-121.1 -71.8 152.7 -12.1 22.4 -0.7 549 282 B A H >> S+ 0 0 41 1,-0.2 4,-0.6 2,-0.2 3,-0.6 0.747 103.6 76.6 -62.6 -30.0 -12.5 18.6 -0.6 550 283 B Y H 34 S+ 0 0 8 -27,-0.3 3,-0.5 1,-0.3 -1,-0.2 0.828 98.7 44.6 -50.6 -37.1 -9.4 18.3 1.6 551 284 B F H <4 S+ 0 0 34 -3,-1.1 -1,-0.3 -6,-0.2 -2,-0.2 0.728 110.9 54.1 -82.2 -23.4 -11.5 19.5 4.6 552 285 B K H << 0 0 130 -3,-0.6 -1,-0.2 -4,-0.6 -2,-0.2 0.423 360.0 360.0 -86.4 -0.7 -14.5 17.2 3.7 553 286 B E < 0 0 148 -4,-0.6 -3,-0.1 -3,-0.5 -2,-0.0 0.276 360.0 360.0-118.5 360.0 -12.4 14.0 3.6