==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-SEP-09 2KO1 . COMPND 2 MOLECULE: GTP PYROPHOSPHOKINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLOROBACULUM TEPIDUM; . AUTHOR A.ELETSKY,E.GARCIA,H.WANG,C.CICCOSANTI,M.JIANG,R.NAIR, . 176 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10548.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 80.7 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 . 63 35.8 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 . 2 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 . 1 0.6 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 . 33 18.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 19.3 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+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 1 1 2 0 0 0 0 0 0 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 1 2 1 1 0 2 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 1 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 0 243 0, 0.0 2,-0.1 0, 0.0 54,-0.0 0.000 360.0 360.0 360.0 101.4 11.3 -21.1 14.0 2 2 A T + 0 0 93 52,-0.1 2,-0.2 2,-0.0 53,-0.1 -0.386 360.0 165.4 -82.2 157.6 8.2 -18.9 14.6 3 3 A D + 0 0 84 -2,-0.1 2,-0.3 2,-0.0 51,-0.3 -0.662 6.7 173.7-172.4 121.0 6.3 -16.7 12.0 4 4 A F E -A 53 0A 49 49,-2.7 49,-2.3 -2,-0.2 2,-1.0 -0.891 41.2 -98.5-132.1 157.9 2.9 -15.2 12.2 5 5 A L E -A 52 0A 34 -2,-0.3 2,-0.4 47,-0.2 47,-0.3 -0.663 44.4-162.5 -79.1 102.7 0.7 -12.8 10.2 6 6 A A E -A 51 0A 0 45,-2.5 45,-2.4 -2,-1.0 2,-0.4 -0.755 2.3-156.8 -93.7 128.7 1.1 -9.4 11.9 7 7 A G E -AB 50 78A 0 71,-0.7 71,-2.2 -2,-0.4 2,-0.4 -0.833 7.3-169.9-105.3 144.1 -1.4 -6.6 11.4 8 8 A I E -AB 49 77A 0 41,-2.4 41,-2.5 -2,-0.4 2,-0.5 -0.991 9.7-153.9-133.0 138.8 -0.7 -2.9 11.9 9 9 A R E -AB 48 76A 93 67,-2.7 67,-2.6 -2,-0.4 2,-0.5 -0.954 11.9-173.1-116.5 119.2 -3.1 0.2 11.9 10 10 A I E -AB 47 75A 0 37,-2.7 37,-2.7 -2,-0.5 2,-0.5 -0.942 3.8-177.3-113.4 120.0 -1.7 3.6 11.0 11 11 A V E +AB 46 74A 32 63,-2.3 62,-2.1 -2,-0.5 63,-1.7 -0.959 18.8 151.0-118.5 117.2 -3.9 6.8 11.3 12 12 A G E -AB 45 72A 0 33,-2.1 33,-2.7 -2,-0.5 60,-0.3 -0.879 50.3 -77.4-136.5 169.2 -2.3 10.1 10.2 13 13 A E E -A 44 0A 71 58,-2.4 2,-1.7 -2,-0.3 31,-0.3 -0.499 47.7-112.9 -73.2 131.2 -3.4 13.5 8.8 14 14 A D + 0 0 42 29,-2.4 2,-0.3 -2,-0.2 -1,-0.1 -0.437 57.0 165.8 -65.0 85.6 -4.3 13.5 5.1 15 15 A K >> - 0 0 95 -2,-1.7 2,-2.4 1,-0.0 3,-0.7 -0.743 52.2 -85.1-106.7 159.1 -1.4 15.6 3.9 16 16 A N T 34 S- 0 0 154 -2,-0.3 -2,-0.0 1,-0.2 -1,-0.0 -0.351 120.8 -0.1 -56.1 74.0 0.2 16.4 0.5 17 17 A G T >> S+ 0 0 22 -2,-2.4 4,-2.7 105,-0.1 3,-0.5 0.060 100.5 104.0 133.6 -22.9 2.5 13.4 0.5 18 18 A M H <> S+ 0 0 7 -3,-0.7 4,-2.9 1,-0.2 5,-0.2 0.917 82.1 51.4 -55.2 -51.4 1.8 11.5 3.7 19 19 A T H 3X S+ 0 0 0 -4,-0.7 4,-1.0 1,-0.2 -1,-0.2 0.817 114.8 45.8 -57.4 -31.4 -0.3 8.7 2.1 20 20 A N H <> S+ 0 0 20 -3,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.931 115.1 44.0 -76.3 -48.5 2.6 8.2 -0.4 21 21 A Q H X S+ 0 0 93 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.872 108.5 59.4 -66.9 -37.5 5.5 8.2 2.1 22 22 A I H X S+ 0 0 1 -4,-2.9 4,-1.6 -5,-0.2 -1,-0.2 0.947 113.4 34.2 -59.4 -54.2 3.7 6.0 4.6 23 23 A T H X S+ 0 0 0 -4,-1.0 4,-2.0 -5,-0.2 -1,-0.2 0.802 113.9 62.0 -73.9 -27.4 3.2 3.0 2.4 24 24 A G H < S+ 0 0 14 -4,-1.7 4,-0.4 2,-0.2 -2,-0.2 0.879 104.7 47.4 -60.8 -39.0 6.5 3.8 0.7 25 25 A V H >< S+ 0 0 37 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.881 106.8 58.2 -67.1 -40.4 8.2 3.2 4.1 26 26 A I H >< S+ 0 0 1 -4,-1.6 3,-2.1 1,-0.3 5,-0.3 0.910 99.4 56.9 -55.1 -46.3 6.2 -0.0 4.5 27 27 A S T 3< S+ 0 0 33 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.712 96.9 66.5 -59.4 -20.9 7.8 -1.4 1.3 28 28 A K T < S+ 0 0 155 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.515 81.3 108.0 -80.3 -5.6 11.2 -0.8 2.8 29 29 A F S < S- 0 0 15 -3,-2.1 -3,-0.0 -4,-0.2 80,-0.0 -0.153 81.8-116.4 -70.6 166.9 10.6 -3.5 5.5 30 30 A D S S+ 0 0 147 2,-0.1 2,-0.3 0, 0.0 -1,-0.1 0.276 91.9 79.8 -84.4 11.5 12.3 -7.0 5.7 31 31 A T S S- 0 0 15 -5,-0.3 2,-0.4 22,-0.0 -2,-0.1 -0.855 82.4-111.1-124.6 155.9 8.9 -8.6 5.2 32 32 A N - 0 0 29 -2,-0.3 20,-0.5 20,-0.1 2,-0.5 -0.712 32.4-117.6 -90.6 130.4 6.5 -9.3 2.3 33 33 A I E +C 51 0A 1 -2,-0.4 18,-0.2 1,-0.2 3,-0.2 -0.497 34.4 172.6 -68.1 113.1 3.2 -7.4 2.0 34 34 A R E S- 0 0 43 16,-2.4 95,-2.8 -2,-0.5 2,-0.3 0.803 73.6 -3.5 -88.4 -35.6 0.4 -9.9 2.2 35 35 A T E -CD 50 128A 21 15,-1.9 15,-2.7 93,-0.2 2,-0.4 -0.922 61.1-176.0-158.2 132.3 -2.3 -7.2 2.4 36 36 A I E -CD 49 127A 0 91,-2.2 91,-2.3 -2,-0.3 2,-0.4 -0.996 2.6-177.8-131.6 128.2 -2.3 -3.4 2.5 37 37 A V E +CD 48 126A 28 11,-2.2 11,-2.8 -2,-0.4 2,-0.5 -0.885 6.3 171.6-130.2 103.4 -5.4 -1.2 2.9 38 38 A L E +CD 47 125A 0 87,-2.5 87,-2.4 -2,-0.4 2,-0.3 -0.930 8.4 158.5-110.4 130.3 -5.0 2.6 2.9 39 39 A N E -CD 46 124A 25 7,-1.6 7,-2.7 -2,-0.5 2,-0.3 -0.970 30.4-137.3-151.8 139.3 -8.1 4.9 2.8 40 40 A A E +C 45 0A 36 83,-1.9 5,-0.3 -2,-0.3 -27,-0.0 -0.713 22.4 172.0 -94.9 145.7 -8.8 8.5 3.7 41 41 A K - 0 0 180 3,-3.0 2,-0.3 -2,-0.3 -1,-0.1 0.755 67.7 -9.8-116.7 -74.7 -12.0 9.5 5.6 42 42 A D S S- 0 0 141 2,-0.2 3,-0.1 0, 0.0 -28,-0.0 -0.718 125.2 -46.0-136.9 80.9 -12.4 13.0 6.8 43 43 A G S S+ 0 0 55 -2,-0.3 -29,-2.4 1,-0.2 2,-0.3 0.454 127.0 85.1 70.7 -2.8 -9.0 14.9 6.5 44 44 A I E -A 13 0A 67 -31,-0.3 -3,-3.0 -30,-0.1 2,-0.4 -0.882 63.8-151.9-124.2 159.5 -7.4 11.7 8.0 45 45 A F E -AC 12 40A 2 -33,-2.7 -33,-2.1 -2,-0.3 2,-0.5 -0.993 1.0-156.8-133.2 141.0 -6.2 8.5 6.5 46 46 A T E -AC 11 39A 13 -7,-2.7 -7,-1.6 -2,-0.4 2,-0.5 -0.967 8.2-169.8-118.3 117.9 -5.9 4.9 8.0 47 47 A C E -AC 10 38A 0 -37,-2.7 -37,-2.7 -2,-0.5 2,-0.6 -0.931 6.3-158.7-105.6 124.2 -3.5 2.4 6.4 48 48 A N E -AC 9 37A 24 -11,-2.8 -11,-2.2 -2,-0.5 2,-0.5 -0.903 7.0-158.9-105.7 117.0 -3.7 -1.2 7.6 49 49 A L E -AC 8 36A 0 -41,-2.5 -41,-2.4 -2,-0.6 2,-0.5 -0.818 7.5-171.8 -98.8 128.1 -0.5 -3.3 7.0 50 50 A M E +AC 7 35A 7 -15,-2.7 -16,-2.4 -2,-0.5 -15,-1.9 -0.938 27.0 137.3-120.6 109.7 -0.7 -7.1 6.9 51 51 A I E -AC 6 33A 1 -45,-2.4 -45,-2.5 -2,-0.5 2,-0.4 -0.804 48.2-101.0-140.1 176.6 2.7 -8.9 6.8 52 52 A F E +A 5 0A 58 -20,-0.5 2,-0.3 -47,-0.3 -47,-0.2 -0.868 32.7 179.0-109.6 144.0 4.5 -11.9 8.3 53 53 A V E -A 4 0A 3 -49,-2.3 -49,-2.7 -2,-0.4 3,-0.1 -0.999 28.2-145.9-143.0 141.6 7.1 -11.8 11.2 54 54 A K S S+ 0 0 132 -2,-0.3 2,-0.3 -51,-0.3 -1,-0.1 0.928 87.1 24.8 -68.5 -45.9 9.2 -14.5 13.0 55 55 A N S >> S- 0 0 83 1,-0.1 4,-1.0 -52,-0.1 3,-0.5 -0.902 71.9-125.7-128.5 148.0 9.1 -12.8 16.4 56 56 A T H 3> S+ 0 0 87 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.797 113.5 60.7 -61.6 -26.4 6.8 -10.3 18.2 57 57 A D H 3> S+ 0 0 107 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.890 99.0 55.0 -67.0 -40.5 9.9 -8.1 18.7 58 58 A K H <> S+ 0 0 53 -3,-0.5 4,-0.8 1,-0.2 -1,-0.2 0.810 110.4 47.8 -59.4 -31.4 10.3 -7.9 14.9 59 59 A L H >X S+ 0 0 4 -4,-1.0 4,-1.3 2,-0.2 3,-0.6 0.929 108.2 50.8 -76.6 -48.3 6.7 -6.6 14.9 60 60 A T H 3X S+ 0 0 76 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.821 106.1 59.4 -59.5 -30.6 7.1 -4.0 17.7 61 61 A T H 3X S+ 0 0 73 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.878 98.5 57.0 -63.9 -39.4 10.2 -2.7 15.7 62 62 A L H < S+ 0 0 0 -4,-2.0 3,-1.5 -3,-0.5 -2,-0.2 0.801 105.6 65.1 -77.3 -30.8 6.3 4.0 11.3 67 67 A R T 3< S+ 0 0 176 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.563 81.2 82.0 -71.3 -7.6 6.1 6.2 14.4 68 68 A K T 3 S+ 0 0 134 -3,-0.5 2,-0.6 -4,-0.3 -1,-0.3 0.579 71.3 96.4 -71.5 -9.8 9.0 8.2 13.0 69 69 A V X - 0 0 14 -3,-1.5 3,-1.6 1,-0.1 -3,-0.0 -0.751 64.4-155.4 -92.5 118.3 6.5 10.1 10.8 70 70 A Q T 3 S+ 0 0 192 -2,-0.6 -1,-0.1 1,-0.3 -3,-0.0 0.772 92.6 62.3 -60.7 -28.4 5.3 13.5 12.3 71 71 A G T 3 S+ 0 0 2 -59,-0.1 -58,-2.4 2,-0.0 2,-0.4 0.665 91.9 79.3 -74.3 -16.7 2.0 13.3 10.3 72 72 A V E < +B 12 0A 18 -3,-1.6 -60,-0.3 -60,-0.3 3,-0.1 -0.751 44.9 170.3 -94.6 139.8 1.0 10.1 12.1 73 73 A F E + 0 0 122 -62,-2.1 2,-0.4 -2,-0.4 -61,-0.2 0.513 67.6 50.1-121.2 -14.2 -0.5 10.1 15.6 74 74 A T E +B 11 0A 47 -63,-1.7 -63,-2.3 2,-0.0 2,-0.4 -0.978 50.1 167.7-131.3 124.0 -1.7 6.5 15.9 75 75 A V E +B 10 0A 12 -2,-0.4 2,-0.2 -65,-0.2 -65,-0.2 -0.887 23.5 160.8-132.1 103.3 0.4 3.3 15.3 76 76 A E E -B 9 0A 118 -67,-2.6 -67,-2.7 -2,-0.4 2,-0.4 -0.724 38.8-111.2-124.3 165.7 -1.3 0.2 16.6 77 77 A R E -B 8 0A 110 -69,-0.2 2,-0.9 -2,-0.2 -69,-0.3 -0.840 23.1-137.8 -97.5 132.8 -1.3 -3.7 16.3 78 78 A L E +B 7 0A 36 -71,-2.2 -71,-0.7 -2,-0.4 3,-0.1 -0.795 31.7 164.8 -89.8 103.0 -4.3 -5.4 14.7 79 79 A S + 0 0 82 -2,-0.9 2,-0.8 1,-0.1 -1,-0.2 0.956 60.8 63.9 -81.4 -60.9 -5.0 -8.5 16.9 80 80 A N S S- 0 0 142 2,-0.1 2,-0.3 -73,-0.0 -1,-0.1 -0.548 76.2-175.4 -69.9 105.2 -8.5 -9.6 15.8 81 81 A L - 0 0 63 -2,-0.8 -2,-0.0 2,-0.1 -1,-0.0 -0.785 35.3-149.4-108.2 149.2 -8.0 -10.5 12.1 82 82 A E + 0 0 128 -2,-0.3 2,-1.5 2,-0.1 -1,-0.1 0.226 63.0 122.4 -91.8 12.3 -10.5 -11.6 9.4 83 83 A H - 0 0 62 -78,-0.1 2,-1.8 1,-0.1 -2,-0.1 -0.591 43.7-170.7 -85.5 86.4 -7.8 -13.7 7.8 84 84 A H + 0 0 166 -2,-1.5 2,-0.9 1,-0.0 -1,-0.1 -0.585 14.7 174.5 -74.9 83.8 -9.1 -17.2 7.7 85 85 A H + 0 0 152 -2,-1.8 2,-0.2 2,-0.0 -2,-0.1 -0.805 22.9 121.5 -99.7 96.9 -5.8 -18.9 6.6 86 86 A H - 0 0 169 -2,-0.9 2,-0.4 0, 0.0 -2,-0.0 -0.722 55.5-109.1-138.4-173.4 -6.3 -22.7 6.6 87 87 A H 0 0 179 -2,-0.2 -2,-0.0 1,-0.1 0, 0.0 -0.996 360.0 360.0-128.5 136.6 -6.1 -25.8 4.4 88 88 A H 0 0 260 -2,-0.4 -1,-0.1 0, 0.0 0, 0.0 0.647 360.0 360.0-118.7 360.0 -9.1 -27.9 3.1 89 !* 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 90 1 B M 0 0 205 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -80.0 -13.6 19.5 -12.1 91 2 B T + 0 0 86 53,-0.0 2,-0.2 2,-0.0 51,-0.0 0.770 360.0 71.8 -74.3 -26.6 -10.7 18.6 -14.4 92 3 B D + 0 0 79 49,-0.1 2,-0.3 52,-0.0 51,-0.2 -0.609 62.9 166.7 -88.7 146.5 -9.6 16.3 -11.6 93 4 B F E -E 142 0A 75 49,-1.6 49,-2.2 -2,-0.2 2,-1.0 -0.986 44.3 -95.4-155.2 157.9 -11.4 13.1 -10.6 94 5 B L E -E 141 0A 44 -2,-0.3 2,-0.3 47,-0.2 47,-0.2 -0.665 46.7-166.5 -79.3 103.0 -10.8 10.0 -8.4 95 6 B A E -E 140 0A 3 45,-2.8 45,-2.1 -2,-1.0 2,-0.4 -0.649 4.7-147.7 -93.6 148.2 -9.4 7.4 -10.9 96 7 B G E -EF 139 167A 1 71,-0.5 71,-2.6 -2,-0.3 2,-0.3 -0.926 12.6-175.5-120.8 141.4 -9.2 3.6 -10.1 97 8 B I E -EF 138 166A 0 41,-2.8 41,-2.2 -2,-0.4 2,-0.4 -0.960 9.6-156.3-129.6 149.2 -6.7 0.9 -11.2 98 9 B R E -EF 137 165A 84 67,-3.0 67,-2.4 -2,-0.3 2,-0.6 -0.975 8.0-169.5-130.2 119.9 -6.6 -2.8 -10.5 99 10 B I E -EF 136 164A 0 37,-2.3 37,-3.0 -2,-0.4 2,-0.6 -0.925 4.2-177.5-113.2 117.1 -3.3 -4.8 -10.7 100 11 B V E +EF 135 163A 18 63,-2.2 63,-1.7 -2,-0.6 62,-1.6 -0.938 20.8 148.1-115.5 113.8 -3.3 -8.7 -10.6 101 12 B G E -EF 134 161A 0 33,-1.6 33,-2.5 -2,-0.6 60,-0.2 -0.862 52.5 -70.2-135.4 171.7 0.1 -10.3 -10.6 102 13 B E E -E 133 0A 73 58,-2.0 2,-1.6 -2,-0.3 31,-0.2 -0.409 48.8-117.1 -68.5 132.1 1.8 -13.5 -9.3 103 14 B D + 0 0 43 29,-2.4 2,-0.3 -2,-0.2 -1,-0.1 -0.530 51.9 160.7 -73.2 87.2 2.3 -13.5 -5.5 104 15 B K > - 0 0 107 -2,-1.6 2,-2.9 1,-0.0 4,-0.9 -0.806 55.9 -95.1-105.2 156.1 6.1 -13.6 -5.1 105 16 B N T 4 S+ 0 0 151 -2,-0.3 -2,-0.1 1,-0.2 -73,-0.0 -0.390 121.2 15.2 -62.3 69.0 8.4 -12.8 -2.2 106 17 B G T > S+ 0 0 25 -2,-2.9 4,-3.0 -73,-0.1 3,-0.4 -0.031 101.6 87.9 154.8 -36.5 8.9 -9.2 -3.4 107 18 B M H > S+ 0 0 11 -3,-0.3 4,-2.9 1,-0.2 5,-0.2 0.922 90.9 50.5 -54.4 -51.1 6.3 -8.5 -6.1 108 19 B T H X S+ 0 0 0 -4,-0.9 4,-1.1 1,-0.2 -1,-0.2 0.825 115.4 45.3 -58.5 -31.9 3.7 -7.2 -3.6 109 20 B N H > S+ 0 0 21 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.932 115.5 43.7 -76.5 -48.8 6.3 -4.9 -2.1 110 21 B Q H X S+ 0 0 89 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.888 110.6 56.6 -65.7 -40.0 7.7 -3.6 -5.4 111 22 B I H X S+ 0 0 0 -4,-2.9 4,-1.7 -5,-0.3 -1,-0.2 0.949 113.2 36.9 -60.1 -53.9 4.3 -3.0 -6.9 112 23 B T H X S+ 0 0 0 -4,-1.1 4,-2.7 -5,-0.2 -1,-0.2 0.801 114.0 60.1 -71.8 -27.1 2.9 -0.7 -4.2 113 24 B G H X S+ 0 0 12 -4,-1.6 4,-1.1 2,-0.2 -2,-0.2 0.931 104.8 47.3 -61.2 -47.3 6.4 0.8 -3.9 114 25 B V H < S+ 0 0 43 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.885 113.6 50.1 -59.1 -39.5 6.2 1.9 -7.6 115 26 B I H >< S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 -2,-0.2 0.909 105.7 54.5 -64.6 -43.7 2.7 3.2 -6.8 116 27 B S H 3< S+ 0 0 16 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.748 105.4 54.9 -65.7 -22.8 3.8 5.2 -3.7 117 28 B K T 3< S+ 0 0 162 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.229 85.2 117.4 -97.5 13.2 6.5 7.0 -5.9 118 29 B F S < S- 0 0 18 -3,-1.7 4,-0.1 2,-0.1 -3,-0.1 -0.054 79.1-109.2 -66.3 179.2 4.0 8.2 -8.4 119 30 B D S S+ 0 0 116 2,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.750 95.5 68.8 -81.7 -26.2 3.3 11.9 -9.1 120 31 B T S S- 0 0 20 1,-0.1 2,-0.4 -100,-0.0 -2,-0.1 -0.350 87.3-102.3 -96.0 171.3 -0.2 11.8 -7.5 121 32 B N - 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