==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-APR-13 4KAN . COMPND 2 MOLECULE: PROBABLE SUGAR KINASE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHIZOBIUM ETLI; . AUTHOR V.N.MALASHKEVICH,R.BHOSLE,R.TORO,B.HILLERICH,A.GIZZI,S.GARFO . 660 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25554.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 499 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 7.6 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 52 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 31.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 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 2 2 3 1 0 2 2 4 0 4 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 2 6 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 PARALLEL BRIDGES PER LADDER . 0 0 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 2 1 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 X 0 0 249 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 138.3 35.5 -22.7 -21.8 2 0 A T - 0 0 30 1,-0.1 148,-0.1 0, 0.0 147,-0.1 -0.976 360.0-133.5-124.8 141.7 32.6 -20.9 -23.5 3 1 A R S S+ 0 0 105 -2,-0.4 2,-0.4 1,-0.1 147,-0.2 0.878 88.3 27.8 -60.0 -40.3 32.8 -17.5 -25.3 4 2 A F E -a 150 0A 17 145,-2.6 147,-2.0 142,-0.2 71,-0.2 -0.951 48.8-164.9-129.8 144.1 29.7 -16.1 -23.7 5 3 A D E S+ 0 0 12 69,-2.5 147,-1.6 -2,-0.4 2,-0.4 0.877 86.6 14.5 -80.7 -48.8 27.8 -16.6 -20.5 6 4 A V E -ab 152 75A 0 68,-2.0 70,-2.0 145,-0.2 2,-0.5 -0.982 56.8-170.3-138.9 121.9 24.6 -14.9 -21.6 7 5 A L E -ab 153 76A 0 145,-2.8 147,-3.0 -2,-0.4 2,-0.3 -0.942 17.4-166.0 -99.8 130.0 23.3 -13.8 -25.1 8 6 A T E -ab 154 77A 0 68,-2.4 70,-2.2 -2,-0.5 2,-0.4 -0.902 5.8-163.2-114.6 154.8 20.2 -11.6 -25.0 9 7 A V E +ab 155 78A 2 145,-1.9 147,-1.4 -2,-0.3 2,-0.3 -0.999 30.2 117.2-137.2 128.6 17.9 -10.8 -27.9 10 8 A G - 0 0 0 68,-2.0 2,-0.6 -2,-0.4 70,-0.3 -0.962 63.8 -49.6-168.3-175.3 15.4 -7.9 -27.9 11 9 A N - 0 0 9 -2,-0.3 2,-0.7 68,-0.1 51,-0.3 -0.676 51.6-134.4 -76.0 115.9 14.1 -4.7 -29.2 12 10 A A + 0 0 0 -2,-0.6 101,-0.6 68,-0.3 2,-0.3 -0.657 40.6 167.3 -77.5 112.2 17.0 -2.2 -29.5 13 11 A I E -i 113 0B 16 -2,-0.7 45,-2.7 45,-0.3 2,-0.5 -0.959 36.1-145.4-134.2 141.2 15.6 1.1 -28.0 14 12 A V E -iJ 114 57B 0 99,-1.9 101,-2.0 -2,-0.3 2,-0.3 -0.935 29.7-134.2-101.7 129.8 16.9 4.4 -26.8 15 13 A D E -iJ 115 56B 6 41,-3.1 41,-2.0 -2,-0.5 2,-0.5 -0.676 12.1-160.4 -87.0 141.1 14.8 5.8 -23.8 16 14 A I E -iJ 116 55B 11 99,-3.0 101,-2.8 -2,-0.3 2,-0.4 -0.982 24.2-163.9-118.9 110.5 13.6 9.3 -23.6 17 15 A I E +iJ 117 54B 9 37,-3.2 37,-1.9 -2,-0.5 2,-0.3 -0.840 20.0 153.5-113.7 131.9 12.8 9.9 -19.9 18 16 A S E -i 118 0B 15 99,-2.2 101,-2.5 -2,-0.4 2,-0.2 -0.988 38.0-117.4-148.4 152.0 10.8 12.6 -18.2 19 17 A R E +i 119 0B 121 -2,-0.3 2,-0.3 33,-0.3 32,-0.3 -0.635 36.9 176.2 -83.3 148.1 8.9 13.0 -14.9 20 18 A C - 0 0 18 99,-1.9 101,-0.3 -2,-0.2 2,-0.1 -0.964 28.5-107.9-144.6 163.6 5.1 13.7 -15.2 21 19 A N >> - 0 0 89 -2,-0.3 4,-0.8 99,-0.1 3,-0.6 -0.417 38.1-104.4 -84.2 168.9 2.1 14.1 -12.9 22 20 A D H >> S+ 0 0 88 1,-0.2 4,-1.2 2,-0.2 3,-0.7 0.882 118.6 58.1 -61.7 -39.3 -0.7 11.5 -12.5 23 21 A Q H 3> S+ 0 0 95 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.787 93.8 67.2 -64.6 -28.3 -3.1 13.6 -14.6 24 22 A F H <> S+ 0 0 32 -3,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.911 101.0 48.1 -58.4 -42.8 -0.7 13.6 -17.6 25 23 A L H <<>S+ 0 0 6 -4,-0.8 5,-2.6 -3,-0.7 4,-0.3 0.905 114.4 45.8 -65.0 -42.2 -1.2 9.8 -18.1 26 24 A I H ><5S+ 0 0 109 -4,-1.2 3,-1.4 3,-0.2 -2,-0.2 0.951 111.8 50.8 -65.3 -49.9 -5.0 10.2 -17.8 27 25 A D H 3<5S+ 0 0 105 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.820 117.6 39.7 -58.1 -34.1 -5.1 13.2 -20.2 28 26 A N T 3<5S- 0 0 11 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.314 107.9-122.3-100.9 7.1 -3.0 11.3 -22.8 29 27 A Q T < 5 + 0 0 170 -3,-1.4 2,-0.5 -4,-0.3 -3,-0.2 0.894 53.6 160.0 51.2 46.0 -4.7 7.9 -22.3 30 28 A I < - 0 0 8 -5,-2.6 2,-0.5 -6,-0.1 -1,-0.2 -0.883 44.2-123.4 -95.8 123.6 -1.4 6.2 -21.4 31 29 A T > - 0 0 63 -2,-0.5 3,-1.3 96,-0.1 96,-0.2 -0.578 33.8-119.9 -70.2 119.0 -1.8 3.0 -19.5 32 30 A K T 3 S+ 0 0 90 -2,-0.5 94,-0.1 1,-0.2 3,-0.1 -0.329 87.5 5.7 -64.9 140.0 0.2 3.4 -16.3 33 31 A A T 3 S+ 0 0 39 1,-0.2 -1,-0.2 -2,-0.0 2,-0.2 0.443 110.6 106.9 71.7 5.4 3.1 1.0 -15.6 34 32 A A S < S- 0 0 4 -3,-1.3 93,-2.3 155,-0.1 2,-0.7 -0.601 77.0-109.4-113.9 167.9 2.7 -0.6 -19.0 35 33 A X E -k 127 0B 14 -2,-0.2 2,-0.6 91,-0.2 93,-0.2 -0.901 36.4-165.9 -96.0 113.3 4.5 -0.8 -22.4 36 34 A N E -k 128 0B 27 91,-2.8 93,-2.3 -2,-0.7 2,-0.2 -0.909 11.6-140.8-104.1 113.3 2.3 1.1 -24.8 37 35 A L E -k 129 0B 74 -2,-0.6 2,-0.3 91,-0.2 93,-0.2 -0.537 25.7-175.7 -72.8 140.5 3.1 0.6 -28.5 38 36 A I - 0 0 17 91,-2.5 93,-0.4 -2,-0.2 2,-0.1 -0.975 20.0-128.8-137.8 150.1 2.8 3.8 -30.6 39 37 A D > - 0 0 100 -2,-0.3 4,-2.3 91,-0.1 5,-0.1 -0.298 41.5 -92.8 -87.5 179.2 3.0 4.7 -34.3 40 38 A A H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.893 124.5 51.4 -62.1 -41.8 5.1 7.5 -35.7 41 39 A E H > S+ 0 0 158 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.925 111.8 46.2 -61.8 -47.2 2.3 10.1 -35.6 42 40 A R H > S+ 0 0 79 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.857 108.2 57.5 -63.9 -36.1 1.6 9.3 -31.9 43 41 A A H X S+ 0 0 12 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.925 108.6 46.0 -59.8 -43.7 5.3 9.5 -31.1 44 42 A E H X S+ 0 0 136 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.918 113.8 49.3 -62.8 -43.8 5.4 13.0 -32.5 45 43 A L H X S+ 0 0 63 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.954 113.5 44.4 -62.8 -50.9 2.2 14.0 -30.6 46 44 A L H >X S+ 0 0 0 -4,-3.0 4,-0.9 1,-0.2 3,-0.9 0.911 112.2 52.6 -64.2 -40.7 3.4 12.6 -27.3 47 45 A Y H >< S+ 0 0 36 -4,-2.4 3,-1.0 -5,-0.3 -1,-0.2 0.912 103.7 57.6 -60.7 -40.2 6.9 14.1 -27.7 48 46 A S H 3< S+ 0 0 86 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.750 112.2 42.4 -62.3 -23.8 5.3 17.6 -28.3 49 47 A R H << S+ 0 0 136 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.520 95.1 100.5 -96.9 -10.6 3.6 17.3 -24.9 50 48 A X << - 0 0 4 -3,-1.0 3,-0.1 -4,-0.9 -30,-0.1 -0.485 69.4-125.5 -80.3 146.9 6.6 15.9 -23.0 51 49 A G - 0 0 25 -32,-0.3 377,-0.1 1,-0.2 -1,-0.1 -0.067 55.5 -49.6 -73.6-178.7 8.7 18.0 -20.8 52 50 A P S S- 0 0 53 0, 0.0 -33,-0.3 0, 0.0 2,-0.2 -0.320 73.6-160.9 -51.1 139.3 12.5 18.4 -21.1 53 51 A A - 0 0 12 367,-0.2 335,-0.5 -35,-0.1 2,-0.4 -0.749 22.0-134.7-129.8 167.1 13.9 14.9 -21.2 54 52 A L E -JL 17 387B 16 -37,-1.9 -37,-3.2 -2,-0.2 2,-0.4 -0.946 22.5-140.8-116.5 143.2 17.1 12.8 -20.6 55 53 A E E +JL 16 386B 1 331,-2.6 331,-2.8 -2,-0.4 2,-0.3 -0.893 25.9 163.6-108.6 140.5 18.2 10.1 -23.1 56 54 A A E -JL 15 385B 12 -41,-2.0 -41,-3.1 -2,-0.4 329,-0.1 -0.983 44.0 -99.0-149.4 139.0 19.6 6.7 -22.1 57 55 A S E +J 14 0B 5 327,-0.5 -43,-0.2 -2,-0.3 2,-0.1 -0.322 55.4 157.8 -54.7 134.3 20.2 3.5 -24.0 58 56 A G + 0 0 0 -45,-2.7 -45,-0.3 255,-0.1 -1,-0.1 -0.205 19.5 141.5-131.3-136.7 17.4 1.0 -23.1 59 57 A G > - 0 0 4 -47,-0.2 4,-3.1 3,-0.2 5,-0.3 0.555 57.1-113.6 84.7 120.8 15.7 -2.1 -24.5 60 58 A S H > S+ 0 0 14 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.934 116.4 38.0 -53.6 -55.2 14.7 -4.7 -21.9 61 59 A A H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.828 113.9 58.1 -65.7 -31.5 17.2 -7.4 -23.1 62 60 A G H > S+ 0 0 0 -51,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.948 107.0 47.3 -61.1 -49.2 19.8 -4.7 -23.9 63 61 A N H X S+ 0 0 4 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.902 111.2 52.2 -56.8 -43.8 19.6 -3.7 -20.2 64 62 A T H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.931 110.1 47.0 -62.0 -44.6 19.9 -7.3 -19.1 65 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.915 111.7 51.3 -64.0 -43.3 23.0 -7.9 -21.3 66 64 A A H X S+ 0 0 3 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.892 109.3 51.7 -58.2 -41.4 24.6 -4.7 -20.0 67 65 A G H X S+ 0 0 2 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.882 106.9 51.6 -64.7 -41.7 23.9 -5.8 -16.4 68 66 A V H X>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 4,-0.7 0.924 112.1 47.1 -58.2 -46.9 25.5 -9.2 -16.9 69 67 A A H ><5S+ 0 0 15 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.910 109.5 54.0 -62.8 -42.9 28.7 -7.5 -18.3 70 68 A N H 3<5S+ 0 0 21 -4,-2.4 251,-0.9 1,-0.3 -1,-0.2 0.909 106.0 52.8 -57.1 -43.1 28.6 -5.0 -15.3 71 69 A L H 3<5S- 0 0 7 -4,-2.3 -1,-0.3 249,-0.2 -2,-0.2 0.665 128.4 -99.2 -67.1 -18.7 28.6 -8.0 -12.9 72 70 A G T <<5S+ 0 0 58 -3,-0.9 -3,-0.2 -4,-0.7 -2,-0.1 0.361 81.1 128.1 115.4 -0.4 31.7 -9.4 -14.7 73 71 A G < - 0 0 8 -5,-2.4 2,-0.7 -6,-0.2 -1,-0.3 -0.270 65.5-104.5 -81.0 170.9 30.0 -12.0 -17.0 74 72 A K - 0 0 126 212,-0.1 -69,-2.5 -2,-0.0 -68,-2.0 -0.879 47.1-179.1-101.6 114.5 30.5 -12.4 -20.7 75 73 A A E -b 6 0A 2 -2,-0.7 25,-2.4 23,-0.4 2,-0.3 -0.847 17.3-173.8-120.8 151.6 27.5 -11.0 -22.6 76 74 A A E -bc 7 100A 0 -70,-2.0 -68,-2.4 -2,-0.3 2,-0.3 -0.919 10.3-157.1-133.9 161.1 26.4 -10.7 -26.2 77 75 A Y E -bc 8 101A 0 23,-2.3 25,-0.5 -2,-0.3 2,-0.5 -0.998 10.3-161.4-143.7 136.0 23.3 -9.0 -27.7 78 76 A F E +b 9 0A 3 -70,-2.2 -68,-2.0 -2,-0.3 2,-0.3 -0.984 37.4 127.7-111.7 130.8 21.2 -9.2 -30.9 79 77 A G - 0 0 0 -2,-0.5 2,-0.6 -70,-0.2 24,-0.2 -0.882 49.0-118.5-176.2 147.5 19.0 -6.2 -31.7 80 78 A N + 0 0 2 -70,-0.3 33,-0.3 -2,-0.3 -68,-0.3 -0.856 30.1 169.1-109.0 119.0 18.5 -4.0 -34.7 81 79 A V - 0 0 1 -2,-0.6 25,-0.5 22,-0.3 26,-0.3 -0.591 32.1-109.7-103.5 174.0 19.1 -0.2 -34.8 82 80 A A - 0 0 0 -2,-0.2 2,-1.8 23,-0.2 26,-0.3 -0.611 34.5 -98.9 -96.3 167.7 19.2 2.2 -37.7 83 81 A A S S+ 0 0 55 24,-2.5 2,-0.2 -2,-0.2 25,-0.1 -0.559 88.9 100.2 -84.8 72.6 22.2 4.0 -39.2 84 82 A D S > S- 0 0 22 -2,-1.8 4,-2.1 23,-0.1 5,-0.2 -0.828 90.5 -84.6-147.8 179.0 21.4 7.2 -37.4 85 83 A Q H > S+ 0 0 36 -2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.895 125.2 49.6 -64.8 -41.0 22.5 9.1 -34.3 86 84 A L H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.890 111.7 50.3 -64.0 -37.5 20.2 7.3 -31.9 87 85 A G H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.863 109.0 51.5 -65.8 -37.8 21.5 4.0 -33.3 88 86 A D H X S+ 0 0 91 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.889 110.2 49.5 -66.1 -40.5 25.1 5.2 -32.9 89 87 A I H X S+ 0 0 9 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.938 112.1 47.8 -60.2 -49.4 24.3 6.0 -29.2 90 88 A F H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 5,-0.3 0.933 113.4 47.8 -56.8 -48.1 22.8 2.6 -28.6 91 89 A T H X S+ 0 0 38 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.929 113.1 48.7 -60.7 -46.1 25.7 0.9 -30.3 92 90 A H H X S+ 0 0 21 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.927 110.5 49.6 -59.4 -48.6 28.2 2.9 -28.3 93 91 A D H X S+ 0 0 3 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.897 114.0 42.3 -66.9 -41.2 26.6 2.3 -24.9 94 92 A I H <>S+ 0 0 0 -4,-2.0 5,-1.8 -5,-0.2 3,-0.4 0.925 117.6 46.0 -72.4 -42.0 26.2 -1.4 -25.1 95 93 A R H ><5S+ 0 0 142 -4,-2.1 3,-1.2 -5,-0.3 -2,-0.2 0.860 108.5 57.7 -64.3 -35.7 29.7 -2.0 -26.6 96 94 A A H 3<5S+ 0 0 39 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.747 100.3 57.5 -68.5 -24.6 31.2 0.4 -24.0 97 95 A Q T 3<5S- 0 0 48 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.570 126.4-102.7 -80.9 -10.2 29.8 -1.8 -21.2 98 96 A G T < 5S+ 0 0 56 -3,-1.2 -23,-0.4 -4,-0.3 2,-0.4 0.650 73.7 143.1 97.5 19.7 31.8 -4.8 -22.7 99 97 A V < - 0 0 6 -5,-1.8 2,-0.6 -25,-0.1 -1,-0.3 -0.758 56.0-119.4 -89.6 133.9 28.9 -6.5 -24.5 100 98 A H E +c 76 0A 53 -25,-2.4 -23,-2.3 -2,-0.4 2,-0.4 -0.663 43.5 169.2 -69.3 116.1 29.5 -8.2 -27.9 101 99 A Y E +c 77 0A 5 -2,-0.6 -23,-0.1 -25,-0.2 -6,-0.1 -0.898 15.1 147.0-139.5 109.7 27.1 -6.3 -30.2 102 100 A Q + 0 0 95 -25,-0.5 2,-0.4 -2,-0.4 -24,-0.1 0.224 19.6 134.3-131.2 10.2 27.5 -6.8 -33.9 103 101 A T - 0 0 6 -26,-0.4 -22,-0.3 -24,-0.2 38,-0.1 -0.535 50.9-138.1 -65.3 120.2 24.0 -6.6 -35.4 104 102 A K - 0 0 98 -2,-0.4 -21,-0.1 -24,-0.1 -1,-0.1 -0.643 11.6-116.4 -88.8 133.4 24.4 -4.3 -38.5 105 103 A P - 0 0 56 0, 0.0 -23,-0.2 0, 0.0 3,-0.1 -0.307 14.2-148.1 -60.7 151.0 21.9 -1.6 -39.3 106 104 A K - 0 0 81 -25,-0.5 2,-0.3 1,-0.3 -24,-0.1 0.561 65.1 -52.0 -97.2 -9.4 20.1 -2.1 -42.7 107 105 A G - 0 0 31 -26,-0.3 -24,-2.5 3,-0.1 -1,-0.3 -0.956 64.1 -75.0 161.0-171.3 19.8 1.6 -43.4 108 106 A A S S+ 0 0 35 -2,-0.3 4,-0.1 -26,-0.3 -26,-0.1 0.615 91.7 100.6 -90.0 -16.7 18.5 4.8 -41.9 109 107 A F S S+ 0 0 171 2,-0.1 -1,-0.1 23,-0.1 3,-0.0 -0.992 74.3 32.4-132.3 131.5 14.8 4.1 -42.3 110 108 A P S S- 0 0 39 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 0.547 104.2-129.4 -62.9 152.7 12.8 3.1 -40.3 111 109 A P - 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0 0 10 -5,-2.6 2,-0.5 -6,-0.1 -1,-0.2 -0.880 43.6-123.9 -95.7 125.1 42.0 16.3 -21.5 362 29 B T > - 0 0 62 -2,-0.5 3,-1.3 96,-0.1 96,-0.2 -0.600 33.9-120.4 -71.5 121.2 42.4 19.5 -19.5 363 30 B K T 3 S+ 0 0 91 -2,-0.5 94,-0.1 1,-0.2 3,-0.1 -0.347 86.9 6.2 -69.2 140.0 40.5 19.0 -16.3 364 31 B A T 3 S+ 0 0 38 1,-0.2 -1,-0.2 -2,-0.1 2,-0.2 0.458 110.9 103.7 72.7 5.0 37.6 21.4 -15.4 365 32 B A S < S- 0 0 4 -3,-1.3 93,-2.3 155,-0.1 2,-0.7 -0.635 78.5-106.0-117.5 169.1 37.9 23.1 -18.8 366 33 B X E -p 458 0B 15 -2,-0.2 2,-0.6 91,-0.2 93,-0.2 -0.889 36.7-165.5 -94.1 113.6 36.2 23.3 -22.2 367 34 B N E -p 459 0B 28 91,-2.9 93,-2.2 -2,-0.7 2,-0.2 -0.922 11.7-140.6-104.5 112.7 38.4 21.4 -24.7 368 35 B L E -p 460 0B 75 -2,-0.6 2,-0.3 91,-0.2 93,-0.2 -0.524 25.9-176.1 -71.8 138.2 37.6 22.0 -28.4 369 36 B I - 0 0 17 91,-2.5 93,-0.5 -2,-0.2 2,-0.1 -0.969 20.0-129.1-136.4 151.8 37.9 18.9 -30.6 370 37 B D > - 0 0 100 -2,-0.3 4,-2.3 91,-0.1 5,-0.1 -0.308 40.7 -93.3 -88.7 180.0 37.6 18.0 -34.2 371 38 B A H > S+ 0 0 43 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.894 124.2 50.5 -63.1 -42.4 35.4 15.3 -35.7 372 39 B E H > S+ 0 0 154 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.918 112.6 46.9 -61.8 -45.1 38.3 12.7 -35.7 373 40 B R H > S+ 0 0 78 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.863 108.3 56.4 -65.6 -36.6 39.0 13.4 -32.0 374 41 B A H X S+ 0 0 10 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.925 109.3 46.2 -60.6 -42.8 35.3 13.2 -31.2 375 42 B E H X S+ 0 0 142 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.923 113.9 48.8 -65.2 -41.6 35.1 9.7 -32.7 376 43 B L H X S+ 0 0 64 -4,-2.2 4,-0.9 2,-0.2 -2,-0.2 0.949 113.5 45.0 -64.1 -50.5 38.3 8.6 -30.9 377 44 B L H >X S+ 0 0 0 -4,-3.0 4,-1.0 1,-0.2 3,-0.8 0.905 112.0 52.5 -62.6 -40.8 37.2 10.0 -27.4 378 45 B Y H >< S+ 0 0 48 -4,-2.3 3,-0.9 -5,-0.3 -1,-0.2 0.908 103.7 57.2 -62.3 -40.0 33.7 8.5 -27.8 379 46 B S H 3< S+ 0 0 87 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.766 112.7 42.3 -61.4 -23.8 35.3 5.1 -28.6 380 47 B R H << S+ 0 0 139 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.542 95.4 99.4 -97.6 -11.1 37.1 5.3 -25.2 381 48 B X S << S- 0 0 4 -4,-1.0 3,-0.1 -3,-0.9 -30,-0.1 -0.487 70.3-124.5 -80.4 146.1 34.1 6.7 -23.2 382 49 B G - 0 0 26 -32,-0.2 -285,-0.1 1,-0.2 -1,-0.1 -0.075 55.7 -50.6 -73.0-178.0 32.0 4.4 -21.0 383 50 B P S S- 0 0 52 0, 0.0 -33,-0.3 0, 0.0 2,-0.3 -0.276 73.1-160.5 -53.7 143.3 28.2 4.1 -21.3 384 51 B A - 0 0 13 -295,-0.2 -327,-0.5 -35,-0.1 2,-0.4 -0.779 21.9-133.0-131.6 166.0 26.7 7.6 -21.3 385 52 B L E -LO 56 348B 15 -37,-1.9 -37,-3.1 -2,-0.3 2,-0.4 -0.933 23.4-141.0-113.2 144.5 23.6 9.7 -20.7 386 53 B E E +LO 55 347B 0 -331,-2.8 -331,-2.6 -2,-0.4 2,-0.3 -0.899 26.2 162.1-110.8 141.7 22.5 12.5 -23.1 387 54 B A E -LO 54 346B 12 -41,-2.0 -41,-3.0 -2,-0.4 -333,-0.1 -0.978 44.5 -97.9-152.5 138.7 21.0 15.8 -22.1 388 55 B S E + O 0 345B 5 -335,-0.5 -43,-0.2 -2,-0.3 2,-0.1 -0.318 55.1 157.6 -55.4 136.2 20.5 19.1 -23.8 389 56 B G + 0 0 0 -45,-2.7 -45,-0.3 255,-0.1 -1,-0.1 -0.215 18.8 141.2-133.0-137.7 23.3 21.5 -22.9 390 57 B G > - 0 0 4 -47,-0.2 4,-3.1 3,-0.2 5,-0.3 0.563 57.0-113.7 83.5 118.8 25.0 24.6 -24.3 391 58 B S H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.926 116.1 37.5 -49.2 -57.9 25.9 27.2 -21.7 392 59 B A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.823 114.0 58.1 -64.9 -33.3 23.5 30.0 -22.8 393 60 B G H > S+ 0 0 0 -51,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.946 107.2 47.6 -59.9 -49.3 20.8 27.3 -23.6 394 61 B N H X S+ 0 0 4 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.894 111.0 52.0 -56.0 -44.0 21.0 26.2 -20.0 395 62 B T H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.932 109.9 47.8 -63.4 -44.7 20.7 29.8 -18.8 396 63 B A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.938 111.8 50.4 -61.0 -44.6 17.6 30.4 -21.0 397 64 B A H X S+ 0 0 3 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.901 109.7 51.9 -57.0 -42.9 16.1 27.2 -19.6 398 65 B G H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.891 107.2 51.2 -63.1 -41.6 16.8 28.3 -16.1 399 66 B V H X>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 4,-0.8 0.939 112.4 46.7 -59.6 -47.7 15.2 31.7 -16.5 400 67 B A H ><5S+ 0 0 14 -4,-2.2 3,-0.9 3,-0.2 -2,-0.2 0.907 109.2 54.9 -60.9 -44.3 12.0 30.0 -17.9 401 68 B N H 3<5S+ 0 0 21 -4,-2.6 251,-0.8 1,-0.3 -1,-0.2 0.902 106.4 51.4 -54.4 -45.4 12.1 27.4 -15.0 402 69 B L H 3<5S- 0 0 4 -4,-2.2 -1,-0.3 249,-0.2 -2,-0.2 0.668 129.1 -98.6 -67.1 -18.1 12.1 30.3 -12.5 403 70 B G T <<5S+ 0 0 56 -3,-0.9 -3,-0.2 -4,-0.8 -2,-0.1 0.397 80.6 129.0 114.4 0.8 9.1 31.8 -14.3 404 71 B G < - 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0 0 77 -5,-2.5 -1,-0.2 -6,-0.2 5,-0.0 -0.334 48.9 -91.6 -79.2 157.7 15.2 42.9 -7.6 624 291 B S > - 0 0 62 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.272 35.9-112.5 -63.0 154.3 18.2 44.3 -5.7 625 292 B L H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.871 119.3 53.4 -58.3 -38.2 21.7 43.3 -6.8 626 293 B E H > S+ 0 0 79 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.934 110.3 47.0 -60.5 -46.4 22.1 41.3 -3.5 627 294 B D H > S+ 0 0 40 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.840 108.6 55.3 -65.7 -34.4 18.9 39.4 -4.2 628 295 B C H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.933 109.7 47.1 -59.1 -47.0 19.9 38.8 -7.8 629 296 B G H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.888 110.9 51.9 -60.6 -41.8 23.1 37.2 -6.4 630 297 B K H X S+ 0 0 79 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.920 110.2 48.0 -62.6 -44.0 21.0 35.2 -3.9 631 298 B L H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.898 111.8 50.9 -62.2 -40.4 18.8 33.9 -6.7 632 299 B G H X S+ 0 0 0 -4,-2.4 4,-2.7 -18,-0.3 -18,-0.2 0.923 110.2 48.4 -62.5 -44.8 21.8 33.0 -8.7 633 300 B C H X S+ 0 0 10 -4,-2.5 4,-2.4 2,-0.2 -37,-0.4 0.863 110.7 52.3 -65.9 -36.0 23.4 31.1 -5.8 634 301 B L H X S+ 0 0 16 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.964 112.3 43.8 -61.6 -52.0 20.2 29.2 -5.2 635 302 B A H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -24,-0.2 0.912 115.4 48.6 -63.0 -43.0 19.9 28.1 -8.8 636 303 B A H X S+ 0 0 16 -4,-2.7 4,-1.6 -26,-0.2 -1,-0.2 0.913 109.5 52.2 -61.8 -45.9 23.6 27.1 -9.1 637 304 B G H < S+ 0 0 7 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 0.853 109.9 50.6 -59.4 -34.6 23.4 25.2 -5.8 638 305 B I H >< S+ 0 0 25 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.947 107.9 50.9 -68.2 -47.2 20.4 23.2 -7.1 639 306 B V H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.3 -2,-0.2 0.820 102.1 59.4 -68.4 -28.9 22.0 22.3 -10.4 640 307 B I T 3< S+ 0 0 25 -4,-1.6 -38,-2.0 1,-0.3 -37,-1.7 0.583 95.9 65.4 -76.5 -5.5 25.2 20.9 -9.0 641 308 B Q T < S+ 0 0 58 -3,-1.6 2,-0.3 -4,-0.3 -1,-0.3 0.177 102.0 53.1 -99.6 14.7 23.2 18.3 -7.0 642 309 B Q S < S- 0 0 19 -3,-1.2 2,-0.4 -39,-0.4 -39,-0.2 -0.957 86.2-105.5-141.7 160.2 22.0 16.5 -10.1 643 310 B I S S+ 0 0 46 -2,-0.3 3,-0.1 -41,-0.1 -2,-0.1 -0.711 88.7 46.2 -79.2 138.1 23.3 14.8 -13.2 644 311 B G S S- 0 0 7 -2,-0.4 -2,-0.2 1,-0.1 4,-0.1 0.090 85.5-105.9 101.4 146.3 22.5 17.1 -16.2 645 312 B P S S+ 0 0 2 0, 0.0 -1,-0.1 0, 0.0 -35,-0.1 0.437 98.2 65.2 -90.9 0.4 23.0 20.8 -16.7 646 313 B R S S- 0 0 27 -3,-0.1 -251,-0.1 -258,-0.1 -258,-0.0 -0.986 92.6-109.6-126.3 120.4 19.4 22.0 -16.5 647 314 B P - 0 0 6 0, 0.0 4,-0.1 0, 0.0 -8,-0.1 -0.207 20.3-160.5 -53.0 131.0 17.5 21.6 -13.2 648 315 B X S S+ 0 0 103 -4,-0.1 2,-0.2 2,-0.1 -629,-0.1 0.501 72.4 70.0 -88.4 -8.6 14.8 18.9 -13.4 649 316 B T S S- 0 0 85 1,-0.0 2,-0.6 -11,-0.0 -11,-0.0 -0.588 101.0 -81.1-105.7 168.6 13.0 20.3 -10.4 650 317 B S > - 0 0 48 -2,-0.2 4,-1.7 1,-0.2 -248,-0.1 -0.602 33.3-173.7 -78.3 116.0 11.1 23.6 -10.0 651 318 B L H > S+ 0 0 1 -2,-0.6 4,-2.7 2,-0.2 -249,-0.2 0.827 87.2 56.7 -74.5 -33.2 13.4 26.6 -9.4 652 319 B S H > S+ 0 0 23 -251,-0.8 4,-2.0 2,-0.2 -1,-0.2 0.911 109.1 46.0 -64.2 -41.9 10.4 28.8 -8.8 653 320 B E H > S+ 0 0 116 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.893 112.6 51.0 -65.5 -40.6 9.2 26.5 -6.0 654 321 B A H X S+ 0 0 18 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.907 109.7 49.8 -63.2 -43.1 12.7 26.4 -4.6 655 322 B A H <>S+ 0 0 0 -4,-2.7 5,-2.9 2,-0.2 6,-1.0 0.887 111.3 49.3 -60.7 -42.3 12.9 30.2 -4.7 656 323 B K H ><5S+ 0 0 113 -4,-2.0 3,-1.2 5,-0.2 -2,-0.2 0.920 111.9 48.2 -62.3 -46.3 9.5 30.4 -2.9 657 324 B Q H 3<5S+ 0 0 178 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.864 109.6 52.5 -63.4 -37.9 10.6 27.9 -0.2 658 325 B A T 3<5S- 0 0 56 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.406 116.6-115.4 -79.9 1.2 13.9 29.7 0.3 659 326 B G T < 5S+ 0 0 64 -3,-1.2 -3,-0.2 -4,-0.2 -2,-0.1 0.716 84.9 116.9 72.6 23.4 12.0 33.0 0.9 660 327 B L < 0 0 25 -5,-2.9 -4,-0.2 -6,-0.2 -5,-0.1 0.730 360.0 360.0 -94.6 -26.9 13.5 34.7 -2.2 661 328 B I 0 0 80 -6,-1.0 -5,-0.2 -9,-0.1 -6,-0.1 0.466 360.0 360.0-131.1 360.0 10.2 35.1 -4.1