==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 04-FEB-10 3AEA . COMPND 2 MOLECULE: SUCCINATE DEHYDROGENASE [UBIQUINONE] FLAVOPROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR S.HARADA,T.SASAKI,M.SHINDO,Y.KIDO,D.K.INAOKA,J.OMORI,A.OSANA . 1092 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42628.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 747 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 79 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 387 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.5 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 2 4 1 1 1 4 1 2 0 4 1 1 1 0 0 1 0 1 0 1 0 2 1 1 1 1 0 RESIDUES PER ALPHA HELIX . 2 4 2 3 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 . 11 5 1 2 2 0 1 2 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 . 3 4 1 2 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 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 10 A S 0 0 79 0, 0.0 438,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 53.0 48.5 35.4 -25.4 2 11 A T + 0 0 156 2,-0.5 0, 0.0 1,-0.1 0, 0.0 0.468 360.0 65.8 67.9 4.8 48.9 38.1 -28.1 3 12 A Q S S+ 0 0 113 1,-0.2 -1,-0.1 0, 0.0 0, 0.0 0.558 96.0 61.1-116.0 -35.0 47.7 35.4 -30.6 4 13 A Y S S- 0 0 11 188,-0.1 -2,-0.5 2,-0.0 2,-0.5 -0.877 75.5-141.1-108.8 120.0 44.2 35.1 -29.1 5 14 A P - 0 0 76 0, 0.0 188,-1.7 0, 0.0 2,-0.6 -0.659 17.9-149.9 -75.2 124.9 41.7 38.0 -28.9 6 15 A V B -a 193 0A 66 -2,-0.5 2,-0.6 186,-0.1 188,-0.2 -0.874 12.3-172.4-100.3 119.9 39.8 37.9 -25.7 7 16 A V - 0 0 71 186,-1.9 188,-0.5 -2,-0.6 2,-0.3 -0.929 14.6-149.8-113.5 107.2 36.2 39.2 -25.7 8 17 A D - 0 0 68 -2,-0.6 2,-0.4 186,-0.2 188,-0.2 -0.581 8.4-159.4 -81.5 134.4 34.7 39.4 -22.3 9 18 A H E -b 196 0A 44 186,-1.7 188,-2.8 -2,-0.3 2,-0.5 -0.897 4.8-149.0-114.1 144.0 30.9 39.0 -21.8 10 19 A E E +b 197 0A 121 -2,-0.4 2,-0.2 186,-0.2 188,-0.2 -0.936 29.7 151.0-119.7 112.4 28.8 40.2 -18.8 11 20 A F - 0 0 20 186,-2.7 188,-0.2 -2,-0.5 25,-0.2 -0.806 49.7-126.2-130.6 170.2 25.7 38.3 -17.8 12 21 A D S S+ 0 0 14 23,-2.3 187,-1.5 1,-0.3 188,-1.3 0.839 95.7 7.5 -81.6 -39.0 23.6 37.5 -14.7 13 22 A A E -ef 36 200B 0 22,-1.4 24,-2.6 185,-0.2 2,-0.5 -0.998 60.8-156.1-148.8 140.2 23.8 33.7 -15.2 14 23 A V E -ef 37 201B 0 186,-2.1 188,-3.3 -2,-0.3 2,-0.6 -0.979 5.6-164.4-120.3 121.8 25.6 31.3 -17.5 15 24 A V E -ef 38 202B 0 22,-2.5 24,-2.0 -2,-0.5 2,-0.9 -0.930 8.2-155.5-104.3 117.2 24.2 27.8 -18.2 16 25 A V E +ef 39 203B 6 186,-3.5 188,-3.2 -2,-0.6 24,-0.2 -0.817 64.1 46.2 -94.6 100.8 26.8 25.5 -19.7 17 26 A G - 0 0 9 22,-1.9 9,-0.1 -2,-0.9 188,-0.1 -0.331 54.9-150.4 137.0 140.1 24.8 22.9 -21.6 18 27 A A + 0 0 4 -2,-0.1 29,-0.3 4,-0.1 187,-0.1 -0.048 63.1 105.2-126.9 30.8 21.9 22.7 -24.0 19 28 A G S > S- 0 0 14 185,-0.5 4,-1.6 27,-0.1 5,-0.2 0.272 95.5 -68.0 -81.0-147.0 20.5 19.3 -23.1 20 29 A G H > S+ 0 0 1 2,-0.2 4,-2.6 3,-0.2 5,-0.2 0.979 139.1 35.6 -70.0 -61.5 17.3 18.8 -21.1 21 30 A A H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.907 117.9 55.2 -56.4 -46.2 18.7 20.1 -17.9 22 31 A G H > S+ 0 0 1 182,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.905 113.5 39.2 -54.3 -49.6 20.7 22.7 -19.8 23 32 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 5,-0.5 0.939 113.9 52.0 -68.1 -51.0 17.7 24.2 -21.6 24 33 A R H X S+ 0 0 12 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.881 114.3 44.6 -56.1 -42.5 15.2 24.0 -18.7 25 34 A A H X S+ 0 0 0 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.875 112.0 55.7 -65.8 -39.8 17.7 25.9 -16.4 26 35 A A H >X S+ 0 0 0 -4,-1.6 4,-1.2 -5,-0.3 3,-0.9 0.982 116.2 29.3 -59.9 -67.3 18.5 28.4 -19.2 27 36 A F H 3X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.753 111.3 68.7 -70.7 -25.0 15.1 29.8 -20.1 28 37 A G H 3X S+ 0 0 7 -4,-1.2 4,-1.2 -5,-0.5 -1,-0.2 0.839 103.1 45.9 -58.3 -35.5 13.8 29.2 -16.5 29 38 A L H S+ 0 0 0 -4,-1.2 5,-3.1 -3,-0.9 4,-0.6 0.864 112.0 49.7 -73.2 -41.4 16.3 32.0 -15.5 30 39 A S H ><5S+ 0 0 8 -4,-1.2 3,-0.6 3,-0.2 -2,-0.2 0.884 110.7 50.8 -63.5 -40.6 15.2 34.2 -18.4 31 40 A E H 3<5S+ 0 0 88 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.834 106.4 54.8 -63.5 -36.3 11.5 33.6 -17.4 32 41 A A H 3<5S- 0 0 43 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.641 130.6 -98.8 -71.9 -16.9 12.5 34.6 -13.8 33 42 A G T <<5S+ 0 0 49 -4,-0.6 2,-0.2 -3,-0.6 -3,-0.2 0.419 75.6 141.9 115.0 4.6 13.8 37.8 -15.2 34 43 A F < - 0 0 6 -5,-3.1 2,-1.2 -6,-0.1 -1,-0.3 -0.537 58.7-121.3 -84.3 139.9 17.6 37.1 -15.4 35 44 A N - 0 0 64 -2,-0.2 -23,-2.3 127,-0.1 -22,-1.4 -0.687 49.6-171.0 -73.0 98.1 19.9 38.2 -18.2 36 45 A T E -e 13 0B 0 -2,-1.2 127,-2.7 125,-0.4 2,-0.4 -0.797 22.6-164.7-109.7 136.3 20.9 34.6 -19.1 37 46 A A E -eg 14 163B 0 -24,-2.6 -22,-2.5 -2,-0.4 2,-0.5 -0.906 8.5-154.7-110.8 145.5 23.6 33.2 -21.5 38 47 A C E -eg 15 164B 0 125,-2.9 127,-3.1 -2,-0.4 2,-0.6 -0.932 5.9-162.5-125.6 109.0 23.7 29.6 -22.7 39 48 A V E +eg 16 165B 1 -24,-2.0 -22,-1.9 -2,-0.5 2,-0.3 -0.794 20.2 161.2 -95.5 121.0 27.0 28.1 -23.7 40 49 A T E - g 0 166B 11 125,-2.0 128,-3.1 -2,-0.6 127,-0.7 -1.000 37.6-154.1-143.3 138.3 26.9 24.9 -25.8 41 50 A K S S+ 0 0 36 -2,-0.3 2,-0.2 126,-0.3 128,-0.2 0.664 88.3 44.0 -83.3 -19.6 29.4 23.1 -28.1 42 51 A L S S- 0 0 25 126,-0.2 125,-0.7 125,-0.1 126,-0.2 -0.708 102.7 -88.9-111.0 168.2 26.6 21.6 -30.1 43 52 A F >> - 0 0 7 -2,-0.2 3,-2.1 123,-0.2 4,-0.6 -0.669 48.7-111.6 -70.8 135.6 23.3 23.0 -31.5 44 53 A P G >4 S+ 0 0 2 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.725 116.3 53.5 -43.1 -34.9 20.7 22.6 -28.7 45 54 A T G 34 S+ 0 0 0 1,-0.2 5,-0.2 721,-0.1 106,-0.1 0.781 100.8 59.6 -73.9 -27.5 18.7 19.9 -30.7 46 55 A R G <4 S+ 0 0 6 -3,-2.1 -1,-0.2 631,-0.1 5,-0.1 0.579 77.6 120.8 -77.6 -10.2 21.8 17.8 -31.3 47 56 A S S X< S- 0 0 9 -3,-0.6 3,-2.4 -4,-0.6 4,-0.3 -0.170 79.8-112.1 -51.2 141.0 22.2 17.4 -27.5 48 57 A H G >> S+ 0 0 53 1,-0.3 3,-5.2 2,-0.2 4,-0.5 0.862 109.2 82.2 -43.8 -35.1 22.1 13.7 -26.5 49 58 A T G >4 S+ 0 0 18 1,-0.4 3,-1.9 2,-0.2 -1,-0.3 0.810 82.6 68.2 -54.4 -25.5 18.8 14.1 -24.8 50 59 A V G <4 S+ 0 0 1 -3,-2.4 97,-0.5 1,-0.3 -1,-0.4 0.821 90.6 59.9 -56.5 -34.1 17.5 13.8 -28.3 51 60 A A G <4 S+ 0 0 5 -3,-5.2 -1,-0.3 -4,-0.3 -2,-0.2 0.510 78.7 120.7 -75.6 -4.9 18.6 10.2 -28.4 52 61 A A << + 0 0 23 -3,-1.9 94,-1.8 -4,-0.5 95,-0.9 -0.413 29.0 163.9 -69.6 135.2 16.3 9.3 -25.5 53 62 A Q + 0 0 8 92,-0.2 92,-0.5 91,-0.2 -1,-0.1 0.704 52.6 65.7-123.7 -36.9 13.7 6.7 -26.3 54 63 A G S S- 0 0 18 1,-0.2 2,-0.3 90,-0.1 91,-0.1 0.990 89.9-105.0 -62.6 -82.3 12.1 5.2 -23.1 55 64 A G - 0 0 3 85,-0.1 2,-0.4 89,-0.0 351,-0.4 -0.988 20.5 -82.4 173.0-171.2 10.2 7.9 -21.2 56 65 A I E -J 139 0C 1 83,-3.6 83,-2.4 -2,-0.3 2,-0.3 -0.988 40.5-126.9-127.8 124.1 9.8 10.3 -18.4 57 66 A N E +J 138 0C 0 346,-1.6 2,-0.3 -2,-0.4 81,-0.2 -0.550 38.8 150.8 -81.1 129.1 8.6 9.2 -14.9 58 67 A A - 0 0 0 79,-2.3 2,-1.2 -2,-0.3 3,-0.4 -0.963 44.7-134.4-153.5 137.8 5.6 10.9 -13.2 59 68 A A + 0 0 10 33,-0.3 9,-0.2 -2,-0.3 7,-0.1 -0.344 56.8 135.6 -89.1 54.3 3.0 9.7 -10.7 60 69 A L - 0 0 37 -2,-1.2 -1,-0.2 77,-0.2 6,-0.1 0.750 61.5-134.5 -70.4 -25.9 0.2 11.4 -12.6 61 70 A G + 0 0 22 -3,-0.4 -2,-0.1 75,-0.1 76,-0.1 0.966 53.5 145.3 68.9 56.6 -1.9 8.2 -12.2 62 71 A N S S+ 0 0 18 74,-0.3 52,-0.2 55,-0.1 54,-0.1 0.661 74.0 34.3 -97.9 -20.9 -3.2 7.9 -15.7 63 72 A M S S- 0 0 69 73,-0.5 2,-0.2 1,-0.3 74,-0.1 0.874 137.1 -10.6 -94.0 -61.7 -3.2 4.1 -16.0 64 73 A E S S- 0 0 49 72,-0.4 2,-0.5 0, 0.0 -1,-0.3 -0.555 96.3 -70.9-116.9-172.1 -4.1 3.1 -12.5 65 74 A E - 0 0 171 -2,-0.2 2,-0.3 -3,-0.1 -4,-0.1 -0.795 62.0-175.3 -86.1 125.9 -4.3 5.2 -9.3 66 75 A D - 0 0 28 -2,-0.5 2,-0.4 -7,-0.1 61,-0.0 -0.825 22.4-150.8-125.8 156.3 -0.7 6.2 -8.3 67 76 A N >> - 0 0 42 -2,-0.3 3,-1.0 1,-0.1 4,-0.9 -0.991 17.6-140.2-126.4 137.5 1.2 7.9 -5.5 68 77 A W H 3> S+ 0 0 32 -2,-0.4 4,-1.7 1,-0.3 -1,-0.1 0.709 103.2 65.5 -68.3 -20.4 4.5 9.8 -5.8 69 78 A R H 3> S+ 0 0 64 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.766 97.9 53.7 -70.7 -27.5 5.6 8.4 -2.5 70 79 A W H <> S+ 0 0 41 -3,-1.0 4,-1.6 2,-0.2 56,-0.3 0.807 108.1 49.7 -73.2 -31.9 5.5 4.9 -4.2 71 80 A H H X S+ 0 0 0 -4,-0.9 4,-1.7 2,-0.2 -2,-0.2 0.816 106.4 56.9 -72.6 -33.5 7.8 6.4 -6.8 72 81 A F H X S+ 0 0 2 -4,-1.7 4,-2.0 1,-0.2 5,-0.2 0.933 107.2 47.9 -58.4 -49.2 10.0 7.7 -4.0 73 82 A Y H X S+ 0 0 44 -4,-1.7 4,-2.5 1,-0.2 5,-0.2 0.882 109.3 52.6 -60.6 -42.6 10.4 4.2 -2.7 74 83 A D H X S+ 0 0 0 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.852 110.4 48.0 -64.6 -36.7 11.2 2.7 -6.1 75 84 A T H X S+ 0 0 1 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.915 115.0 42.9 -71.4 -46.0 14.0 5.2 -6.7 76 85 A V H <>S+ 0 0 0 -4,-2.0 5,-1.5 2,-0.2 7,-0.3 0.872 113.9 51.5 -69.9 -37.4 15.7 4.8 -3.3 77 86 A K H ><5S+ 0 0 27 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.878 112.8 47.4 -63.5 -38.1 15.4 1.0 -3.4 78 87 A G H 3<5S+ 0 0 0 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.761 102.2 63.3 -71.7 -27.2 17.0 1.2 -6.9 79 88 A S T ><5S- 0 0 0 -4,-1.4 3,-1.8 319,-0.1 319,-1.2 0.408 105.8-127.8 -79.4 2.6 19.7 3.5 -5.6 80 89 A D T < 5 - 0 0 4 -3,-0.9 -3,-0.2 1,-0.3 -2,-0.1 0.751 63.9 -65.7 53.9 29.6 20.9 0.7 -3.3 81 90 A W T 3 > - 0 0 0 310,-2.5 4,-1.7 309,-0.3 3,-0.9 -0.665 19.7-155.0 -77.0 112.0 20.3 11.0 -1.1 85 94 A Q H 3> S+ 0 0 0 509,-2.6 4,-1.7 -2,-0.7 513,-0.3 0.628 88.0 63.8 -70.9 -16.1 16.7 10.9 0.0 86 95 A D H 3> S+ 0 0 9 511,-0.2 4,-1.6 508,-0.2 -1,-0.3 0.874 109.9 40.7 -69.9 -37.0 16.4 14.7 0.3 87 96 A A H <> S+ 0 0 0 -3,-0.9 4,-1.9 306,-0.2 -2,-0.2 0.848 113.6 52.1 -78.5 -38.3 16.9 15.0 -3.4 88 97 A I H X S+ 0 0 0 -4,-1.7 4,-2.5 306,-0.2 5,-0.2 0.874 109.0 52.0 -65.9 -39.2 14.8 11.9 -4.3 89 98 A H H X S+ 0 0 2 -4,-1.7 4,-2.2 2,-0.2 5,-0.3 0.974 109.7 48.2 -56.5 -57.8 11.9 13.4 -2.3 90 99 A Y H X S+ 0 0 39 -4,-1.6 4,-1.3 1,-0.2 -2,-0.2 0.845 115.4 45.1 -53.6 -41.2 12.1 16.8 -4.1 91 100 A M H X S+ 0 0 0 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.928 112.3 48.1 -71.9 -48.1 12.2 15.1 -7.5 92 101 A T H < S+ 0 0 0 -4,-2.5 -33,-0.3 1,-0.2 -2,-0.2 0.811 113.5 48.2 -66.7 -32.2 9.4 12.5 -7.0 93 102 A E H < S+ 0 0 84 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.841 115.1 45.1 -72.9 -35.7 7.1 15.2 -5.6 94 103 A Q H X S+ 0 0 33 -4,-1.3 4,-3.0 -5,-0.3 5,-0.3 0.590 90.6 93.4 -82.1 -11.8 7.9 17.5 -8.5 95 104 A A H X S+ 0 0 0 -4,-1.0 4,-1.4 1,-0.2 -1,-0.2 0.895 89.6 37.4 -50.0 -54.4 7.5 14.6 -10.9 96 105 A P H > S+ 0 0 28 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.889 118.6 50.6 -68.2 -37.3 3.8 15.2 -11.8 97 106 A A H > S+ 0 0 38 -4,-0.5 4,-1.3 1,-0.2 -2,-0.2 0.851 110.4 48.5 -67.6 -37.5 4.1 19.0 -11.7 98 107 A S H X S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 -1,-0.2 0.790 111.8 48.3 -75.7 -31.1 7.2 19.1 -14.0 99 108 A V H >X S+ 0 0 0 -4,-1.4 4,-2.5 -5,-0.3 3,-0.7 0.944 108.9 51.9 -72.6 -51.6 5.6 16.8 -16.7 100 109 A V H 3X S+ 0 0 9 -4,-2.0 4,-2.0 1,-0.3 644,-0.3 0.874 107.4 57.3 -47.9 -39.6 2.3 18.7 -16.8 101 110 A E H 3X S+ 0 0 20 -4,-1.3 4,-0.8 643,-0.2 -1,-0.3 0.869 107.9 44.8 -59.7 -41.4 4.6 21.7 -17.3 102 111 A L H S+ 0 0 0 -4,-1.0 5,-1.9 -3,-0.7 4,-1.1 0.889 110.7 52.2 -72.9 -42.7 6.2 20.1 -20.4 103 112 A E H <5S+ 0 0 0 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.861 109.9 51.0 -61.5 -36.1 2.9 19.0 -21.9 104 113 A N H <5S+ 0 0 2 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.739 102.7 59.5 -72.4 -24.4 1.7 22.5 -21.5 105 114 A Y H <5S- 0 0 9 -4,-0.8 630,-1.6 -3,-0.3 -1,-0.2 0.738 133.2 -90.0 -72.1 -25.6 4.8 23.8 -23.3 106 115 A G T <5 + 0 0 0 -4,-1.1 -3,-0.2 -3,-0.3 -2,-0.1 0.516 67.9 160.0 128.2 15.3 3.7 21.7 -26.3 107 116 A M < - 0 0 1 -5,-1.9 2,-1.8 1,-0.1 -1,-0.2 -0.516 39.2-135.3 -69.3 123.3 5.2 18.3 -25.8 108 117 A P - 0 0 1 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.391 31.7-177.5 -84.9 63.1 3.2 15.8 -28.0 109 118 A F - 0 0 0 -2,-1.8 32,-0.3 32,-0.1 30,-0.0 -0.206 35.2 -98.8 -55.9 145.6 2.9 12.9 -25.5 110 119 A S - 0 0 6 30,-2.0 8,-3.0 8,-0.2 2,-0.2 -0.349 48.1-129.0 -62.3 149.8 1.1 9.7 -26.6 111 120 A R B -L 117 0D 3 6,-0.2 6,-0.2 641,-0.1 2,-0.1 -0.625 12.4-140.4-113.9 165.1 -2.5 9.7 -25.5 112 121 A T - 0 0 16 4,-1.1 640,-0.5 -2,-0.2 -1,-0.1 -0.295 40.7 -90.5-105.8-172.1 -5.0 7.4 -23.7 113 122 A E S S+ 0 0 177 1,-0.2 639,-0.1 -2,-0.1 -1,-0.0 0.848 131.6 45.3 -66.9 -36.5 -8.6 6.4 -24.0 114 123 A D S S- 0 0 119 -52,-0.2 -1,-0.2 637,-0.1 637,-0.0 0.789 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0 0 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.885 114.2 51.5 -71.8 -41.4 10.6 25.1 -41.5 790 184 B L H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.860 105.2 55.3 -64.9 -38.8 7.2 25.1 -43.2 791 185 B M H X S+ 0 0 7 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.846 107.3 51.0 -63.6 -34.5 6.4 21.5 -42.1 792 186 B Q H X S+ 0 0 9 -4,-1.0 4,-1.3 2,-0.2 -1,-0.2 0.829 105.7 54.5 -71.2 -34.7 7.0 22.7 -38.5 793 187 B A H < S+ 0 0 5 -4,-1.5 4,-0.5 2,-0.2 3,-0.3 0.914 112.0 45.0 -61.4 -42.7 4.7 25.6 -39.0 794 188 B Y H >X S+ 0 0 27 -4,-2.0 4,-2.0 1,-0.2 3,-1.0 0.871 105.3 62.0 -65.4 -39.9 2.1 23.1 -40.1 795 189 B R H 3< S+ 0 0 9 -4,-2.1 4,-0.2 1,-0.3 -1,-0.2 0.808 109.6 41.1 -55.8 -33.6 3.0 20.9 -37.1 796 190 B W T 3< S+ 0 0 5 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.505 109.3 62.1 -94.4 -6.9 1.8 23.7 -34.8 797 191 B M T <4 S+ 0 0 3 -3,-1.0 -2,-0.2 -4,-0.5 -3,-0.1 0.942 108.4 37.2 -79.8 -53.2 -1.2 24.5 -37.0 798 192 B I S < S+ 0 0 32 -4,-2.0 2,-0.4 -41,-0.1 -2,-0.1 0.511 85.5 118.6 -81.6 -5.4 -3.1 21.2 -36.7 799 193 B D > - 0 0 2 -5,-0.3 3,-1.3 -4,-0.2 6,-0.1 -0.511 62.3-144.8 -63.4 119.1 -2.1 20.7 -33.0 800 194 B S T 3 S+ 0 0 44 -2,-0.4 -1,-0.2 -46,-0.3 -51,-0.1 0.615 95.6 57.4 -65.8 -14.7 -5.4 20.6 -31.2 801 195 B R T 3 S+ 0 0 3 -53,-0.1 2,-0.3 -695,-0.1 -1,-0.3 0.706 85.3 95.2 -88.1 -23.5 -3.9 22.4 -28.2 802 196 B D < - 0 0 7 -3,-1.3 3,-0.3 1,-0.1 -65,-0.2 -0.536 49.5-173.5 -75.5 131.0 -2.7 25.5 -30.2 803 197 B D S S+ 0 0 63 -67,-3.1 3,-0.4 -2,-0.3 -66,-0.2 0.574 73.8 72.4 -96.6 -13.8 -5.1 28.4 -30.2 804 198 B F > + 0 0 47 -68,-0.7 4,-1.5 1,-0.2 5,-0.2 0.008 54.0 124.9 -97.2 28.9 -3.2 30.6 -32.7 805 199 B T H > S+ 0 0 41 -3,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.814 73.2 51.5 -57.0 -35.1 -4.0 28.5 -35.9 806 200 B E H >> S+ 0 0 74 -3,-0.4 4,-1.5 1,-0.2 3,-1.1 0.966 111.5 41.6 -69.7 -56.1 -5.4 31.6 -37.7 807 201 B E H 3> S+ 0 0 74 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.666 105.3 66.3 -70.7 -18.7 -2.5 34.1 -37.2 808 202 B R H 3< S+ 0 0 12 -4,-1.5 -1,-0.3 2,-0.2 -2,-0.2 0.773 106.9 42.6 -68.8 -28.2 0.1 31.3 -37.9 809 203 B L H X< S+ 0 0 2 -3,-1.1 3,-1.6 -4,-0.6 -2,-0.2 0.814 108.6 57.7 -83.3 -36.2 -1.4 31.2 -41.5 810 204 B A H >< S+ 0 0 49 -4,-1.5 3,-1.3 1,-0.3 -2,-0.2 0.717 94.0 68.2 -66.5 -22.5 -1.6 35.1 -41.7 811 205 B K T 3< S+ 0 0 116 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.521 98.2 53.7 -72.9 -6.7 2.2 35.1 -41.0 812 206 B L T < S+ 0 0 6 -3,-1.6 6,-0.4 1,-0.1 7,-0.3 0.140 70.8 117.1-112.4 17.1 2.6 33.5 -44.5 813 207 B Q < + 0 0 33 -3,-1.3 185,-0.5 4,-0.1 184,-0.3 0.079 54.0 88.9 -83.6 26.5 0.6 36.1 -46.5 814 208 B D S >>S- 0 0 53 -2,-0.1 4,-0.7 -3,-0.1 5,-0.7 -0.806 87.7-112.8-113.1 163.1 3.6 37.2 -48.6 815 209 B P T 45S+ 0 0 66 0, 0.0 -2,-0.1 0, 0.0 -31,-0.0 0.577 109.5 45.3 -71.2 -8.1 4.7 35.7 -52.0 816 210 B F T >5S+ 0 0 15 3,-0.1 4,-0.5 4,-0.1 -31,-0.3 0.840 95.9 63.6-104.9 -42.7 7.9 34.4 -50.5 817 211 B S T 45S- 0 0 18 -33,-0.2 -32,-1.1 1,-0.1 -31,-0.5 0.892 131.5 -8.9 -55.1 -48.5 7.4 32.7 -47.1 818 212 B L T ><5S+ 0 0 0 -4,-0.7 3,-1.7 -6,-0.4 -1,-0.1 0.717 126.0 67.4-116.7 -43.0 5.2 29.9 -48.4 819 213 B Y T 34 + 0 0 8 1,-0.1 4,-1.2 3,-0.0 5,-0.1 0.607 59.3 126.5 71.2 16.7 9.3 17.4 -54.4 826 220 B N H > + 0 0 10 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.767 68.6 63.2 -70.5 -24.8 13.0 17.2 -53.8 827 221 B C H > S+ 0 0 10 2,-0.2 4,-1.0 1,-0.2 3,-0.2 0.949 107.4 36.4 -63.8 -55.2 12.3 17.7 -50.1 828 222 B T H 4 S+ 0 0 11 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.798 115.1 58.2 -71.7 -30.4 10.3 14.5 -49.4 829 223 B G H < S+ 0 0 48 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.812 113.0 36.5 -68.3 -33.4 12.5 12.5 -51.8 830 224 B T H < S+ 0 0 11 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.555 81.4 127.4-100.0 -9.9 15.7 13.2 -50.0 831 225 B C >< - 0 0 23 -4,-1.0 3,-1.0 4,-0.2 -143,-0.1 -0.277 48.3-154.6 -54.4 120.6 14.5 13.1 -46.4 832 226 B P T 3 S+ 0 0 18 0, 0.0 -1,-0.2 0, 0.0 -144,-0.1 0.758 95.1 51.2 -69.6 -25.2 16.7 10.7 -44.4 833 227 B K T 3 S- 0 0 26 2,-0.0 -2,-0.1 -145,-0.0 -145,-0.0 0.391 114.0-117.2 -91.9 0.4 13.9 10.1 -41.9 834 228 B G < + 0 0 66 -3,-1.0 -3,-0.1 1,-0.2 -6,-0.0 0.537 62.2 151.0 78.4 8.9 11.4 9.3 -44.7 835 229 B L - 0 0 22 -8,-0.1 -4,-0.2 1,-0.1 -1,-0.2 -0.165 44.8-132.5 -73.1 167.4 9.1 12.3 -43.8 836 230 B N > + 0 0 40 -76,-0.5 4,-1.4 1,-0.2 3,-0.2 -0.655 34.8 159.2-127.5 73.7 6.9 14.2 -46.3 837 231 B P H > S+ 0 0 5 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.892 76.2 58.6 -64.0 -40.9 7.3 18.0 -45.9 838 232 B G H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.869 102.7 53.1 -56.2 -42.9 6.0 18.7 -49.4 839 233 B K H > S+ 0 0 79 127,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.933 111.4 46.4 -55.7 -48.6 2.7 17.0 -48.6 840 234 B A H X S+ 0 0 3 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.881 109.2 55.0 -62.5 -40.4 2.3 19.2 -45.5 841 235 B I H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.895 108.4 48.1 -60.8 -42.2 3.3 22.3 -47.5 842 236 B A H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.796 109.9 53.7 -66.6 -29.9 0.5 21.5 -50.0 843 237 B E H X S+ 0 0 44 -4,-1.4 4,-1.3 2,-0.2 -2,-0.2 0.804 106.0 52.5 -74.5 -31.7 -1.8 21.0 -47.0 844 238 B I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 3,-0.4 0.941 105.5 54.1 -64.1 -49.8 -0.9 24.5 -45.7 845 239 B K H X S+ 0 0 5 -4,-2.0 4,-1.0 1,-0.3 -2,-0.2 0.852 107.0 52.7 -53.1 -38.6 -1.7 26.0 -49.1 846 240 B K H X S+ 0 0 63 -4,-1.3 4,-0.7 1,-0.2 -1,-0.3 0.863 108.4 49.3 -64.7 -38.8 -5.2 24.4 -48.8 847 241 B M H X S+ 0 0 54 -4,-1.3 4,-2.5 -3,-0.4 3,-0.3 0.836 105.0 59.8 -68.5 -33.5 -5.6 26.0 -45.3 848 242 B M H < S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.788 108.2 43.2 -66.4 -31.5 -4.6 29.4 -46.7 849 243 B A H < S+ 0 0 33 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.625 120.6 41.2 -88.2 -15.5 -7.5 29.4 -49.2 850 244 B T H < S+ 0 0 97 -4,-0.7 -2,-0.2 -3,-0.3 -3,-0.1 0.790 87.0 96.9-104.3 -36.0 -10.1 28.1 -46.8 851 245 B Y < - 0 0 32 -4,-2.5 2,-0.2 -5,-0.1 -45,-0.0 -0.281 58.4-153.6 -63.5 140.9 -9.5 29.9 -43.4 852 246 B K 0 0 154 -2,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.577 360.0 360.0-113.0 175.0 -11.7 32.9 -42.7 853 247 B E 0 0 178 -2,-0.2 -2,-0.0 141,-0.0 0, 0.0 -0.422 360.0 360.0 59.2 360.0 -11.4 36.1 -40.6 854 !* 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 0.0 855 6 C T 0 0 72 0, 0.0 2,-0.2 0, 0.0 -693,-0.1 0.000 360.0 360.0 360.0 151.0 18.3 38.6 -30.1 856 7 C T > - 0 0 73 -695,-0.1 4,-1.6 1,-0.1 5,-0.1 -0.606 360.0-106.6-109.7 172.2 15.3 38.1 -32.4 857 8 C A H > S+ 0 0 14 1,-0.2 4,-1.3 2,-0.2 -127,-0.2 0.847 119.5 49.0 -66.3 -37.0 14.6 35.9 -35.5 858 9 C K H > S+ 0 0 177 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.793 109.6 52.3 -74.5 -30.4 14.8 38.9 -37.9 859 10 C E H > S+ 0 0 85 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.822 105.8 54.2 -72.8 -34.1 18.1 40.1 -36.4 860 11 C E H X S+ 0 0 55 -4,-1.6 4,-0.9 2,-0.2 -2,-0.2 0.856 110.8 45.9 -67.5 -37.5 19.7 36.6 -36.8 861 12 C M H X S+ 0 0 45 -4,-1.3 4,-1.4 2,-0.2 -2,-0.2 0.841 112.1 51.7 -70.7 -36.6 18.8 36.6 -40.5 862 13 C E H X S+ 0 0 117 -4,-1.4 4,-1.0 1,-0.2 -2,-0.2 0.835 113.4 43.7 -70.9 -34.6 20.1 40.2 -40.9 863 14 C R H X S+ 0 0 157 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.641 105.4 65.6 -84.7 -18.2 23.4 39.3 -39.2 864 15 C F H X S+ 0 0 14 -4,-0.9 4,-1.9 2,-0.2 3,-0.3 0.961 106.8 38.4 -64.1 -54.1 23.7 36.0 -41.2 865 16 C W H X S+ 0 0 62 -4,-1.4 4,-2.1 1,-0.2 5,-0.3 0.840 112.3 57.4 -70.4 -35.5 24.0 37.7 -44.6 866 17 C N H X S+ 0 0 107 -4,-1.0 4,-0.6 1,-0.2 -1,-0.2 0.814 111.3 44.5 -62.2 -32.5 26.3 40.5 -43.3 867 18 C K H < S+ 0 0 115 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.920 117.4 40.3 -77.6 -48.3 28.7 37.9 -42.0 868 19 C N H ><>S+ 0 0 2 -4,-1.9 3,-1.2 1,-0.2 5,-0.5 0.862 113.2 50.2 -76.1 -39.7 28.9 35.6 -45.1 869 20 C L H 3<5S+ 0 0 120 -4,-2.1 -1,-0.2 1,-0.3 -3,-0.1 0.817 109.0 54.0 -69.7 -31.7 28.9 38.1 -47.9 870 21 C G T 3<5S+ 0 0 72 -4,-0.6 2,-0.3 -5,-0.3 -1,-0.3 0.017 106.1 69.7 -89.5 26.6 31.7 40.1 -46.3 871 22 C S T < 5S- 0 0 47 -3,-1.2 2,-0.2 2,-0.1 -4,-0.0 -0.970 87.7-115.3-142.2 156.8 33.8 36.9 -46.1 872 23 C N T 5 + 0 0 129 -2,-0.3 -3,-0.1 -245,-0.1 -4,-0.1 -0.021 63.7 139.6 -84.3 32.0 35.6 34.6 -48.5 873 24 C R < - 0 0 40 -5,-0.5 2,-0.2 -2,-0.2 -2,-0.1 -0.623 48.4-130.1 -76.9 131.3 33.4 31.6 -47.8 874 25 C P - 0 0 24 0, 0.0 -161,-2.6 0, 0.0 2,-0.5 -0.544 13.7-116.0 -84.4 146.9 32.4 29.6 -50.9 875 26 C L B -H 712 0R 80 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4,-1.1 -3,-0.2 -2,-0.2 0.758 116.1 52.9 -72.6 -26.8 7.0 8.5 -60.5 973 124 C Q H >X S+ 0 0 127 -4,-1.9 4,-1.9 2,-0.2 3,-0.5 0.976 113.8 39.1 -67.8 -59.3 3.8 6.6 -61.4 974 125 C S H 3X S+ 0 0 33 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.752 110.2 63.1 -64.6 -27.6 1.8 9.7 -62.4 975 126 C G H 3X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.887 105.6 44.4 -62.1 -42.3 4.9 11.2 -64.0 976 127 C V H < S+ 0 0 51 -4,-1.7 3,-1.0 2,-0.2 -1,-0.2 0.774 108.9 56.7 -86.2 -30.2 -3.6 15.4 -82.9 990 141 C A H 3< S+ 0 0 4 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.756 100.8 60.3 -69.2 -25.5 -1.0 15.8 -85.6 991 142 C A T 3< 0 0 84 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.473 360.0 360.0 -79.7 -4.1 -2.8 13.0 -87.5 992 143 C M < 0 0 108 -3,-1.0 -1,-0.2 102,-0.0 -2,-0.2 0.718 360.0 360.0 -89.6 360.0 -5.9 15.3 -87.6 993 !* 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 0.0 994 35 D S 0 0 165 0, 0.0 2,-0.2 0, 0.0 -141,-0.0 0.000 360.0 360.0 360.0 44.2 -6.0 42.3 -42.2 995 36 D S - 0 0 101 -185,-0.0 2,-0.3 -182,-0.0 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1,-0.2 -1,-0.2 0.876 108.9 46.0 -64.4 -40.6 -4.3 31.0 -60.5 1006 47 D R H X S+ 0 0 62 -4,-1.4 4,-1.6 -3,-0.3 -1,-0.2 0.729 110.4 54.8 -77.5 -23.6 -5.9 27.5 -59.9 1007 48 D V H X S+ 0 0 84 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.917 110.4 43.8 -73.4 -46.0 -9.3 28.8 -61.0 1008 49 D V H X S+ 0 0 14 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.756 110.0 59.3 -70.6 -24.2 -8.0 30.1 -64.3 1009 50 D S H X S+ 0 0 23 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.935 109.7 40.4 -66.8 -48.4 -6.1 26.9 -64.7 1010 51 D V H X S+ 0 0 78 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.759 114.8 54.7 -71.6 -25.3 -9.2 24.7 -64.5 1011 52 D L H X S+ 0 0 98 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.900 110.2 44.6 -71.2 -42.9 -11.0 27.3 -66.7 1012 53 D L H X S+ 0 0 26 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.828 112.0 53.5 -69.5 -33.8 -8.3 27.1 -69.4 1013 54 D L H < S+ 0 0 63 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.865 112.2 44.8 -66.2 -38.7 -8.4 23.3 -69.1 1014 55 D G H X S+ 0 0 40 -4,-1.6 4,-1.0 1,-0.2 -2,-0.2 0.806 108.9 57.1 -73.4 -31.7 -12.2 23.4 -69.6 1015 56 D L H X S+ 0 0 22 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66 D S H > S+ 0 0 67 -2,-0.3 4,-1.5 1,-0.2 5,-0.2 0.843 122.6 56.8 -67.6 -35.5 -16.7 34.3 -81.5 1026 67 D A H > S+ 0 0 80 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.794 108.4 46.2 -66.9 -30.8 -17.9 34.0 -77.9 1027 68 D M H > S+ 0 0 31 2,-0.2 4,-1.3 1,-0.1 -1,-0.2 0.701 105.8 62.9 -81.9 -22.9 -15.4 31.2 -77.3 1028 69 D D H X S+ 0 0 8 -4,-1.0 4,-1.6 2,-0.2 -2,-0.2 0.914 104.8 43.0 -68.4 -46.0 -12.6 33.2 -79.0 1029 70 D Y H X S+ 0 0 78 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.887 113.8 50.3 -69.6 -41.1 -12.6 36.1 -76.5 1030 71 D S H X S+ 0 0 43 -4,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.802 112.6 48.5 -66.7 -30.0 -12.9 33.9 -73.4 1031 72 D L H X S+ 0 0 14 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.802 111.2 50.3 -75.9 -32.1 -10.0 31.9 -74.8 1032 73 D A H X S+ 0 0 0 -4,-1.6 4,-1.1 2,-0.2 -2,-0.2 0.791 113.6 46.7 -72.6 -29.9 -8.1 35.2 -75.4 1033 74 D A H X S+ 0 0 40 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.931 117.0 39.8 -76.3 -50.1 -8.9 36.2 -71.8 1034 75 D A H X S+ 0 0 4 -4,-2.2 4,-1.9 1,-0.2 5,-0.3 0.829 113.9 55.3 -69.3 -34.2 -7.9 32.9 -70.1 1035 76 D L H X S+ 0 0 44 -4,-1.6 4,-1.1 1,-0.2 -1,-0.2 0.884 113.9 38.4 -68.8 -41.7 -4.8 32.4 -72.3 1036 77 D T H X S+ 0 0 16 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.865 116.4 51.5 -76.5 -38.5 -3.3 35.8 -71.6 1037 78 D L H X S+ 0 0 64 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.962 110.8 44.9 -65.0 -56.2 -4.2 35.8 -67.9 1038 79 D H H X S+ 0 0 52 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.878 116.6 47.9 -56.2 -42.8 -2.8 32.4 -66.9 1039 80 D G H X S+ 0 0 12 -4,-1.1 4,-2.6 -5,-0.3 5,-0.3 0.870 109.1 53.0 -65.6 -40.6 0.4 33.1 -68.9 1040 81 D H H X S+ 0 0 42 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.873 114.3 41.6 -63.7 -40.2 0.8 36.6 -67.3 1041 82 D W H X S+ 0 0 73 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.737 112.2 59.5 -76.4 -25.0 0.6 35.0 -63.8 1042 83 D G H >X S+ 0 0 29 -4,-1.4 3,-1.3 -5,-0.3 4,-1.2 0.980 109.6 37.6 -65.3 -60.5 2.8 32.2 -65.1 1043 84 D I H 3X S+ 0 0 39 -4,-2.6 4,-2.9 1,-0.3 5,-0.2 0.828 106.9 70.7 -60.9 -32.5 5.8 34.3 -66.0 1044 85 D G H 3X S+ 0 0 11 -4,-1.2 4,-1.6 -5,-0.3 -1,-0.3 0.809 100.0 46.7 -51.6 -34.0 5.0 36.4 -63.0 1045 86 D Q H S+ 0 0 24 -4,-1.2 4,-2.2 2,-0.2 5,-0.5 0.886 110.6 50.0 -59.9 -41.4 9.3 32.9 -63.0 1047 88 D V H X5S+ 0 0 15 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.934 110.7 47.8 -62.4 -48.9 10.2 36.6 -62.5 1048 89 D T H <5S+ 0 0 10 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.721 114.7 49.7 -66.6 -21.8 9.7 36.4 -58.7 1049 90 D D H <5S+ 0 0 2 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.962 125.5 15.4 -80.3 -58.8 11.9 33.3 -58.6 1050 91 D Y H <5S+ 0 0 118 -4,-2.2 2,-0.6 -5,-0.1 -3,-0.2 0.859 100.5 89.5 -91.6 -40.4 15.0 34.2 -60.6 1051 92 D V << - 0 0 41 -4,-1.3 2,-0.5 -5,-0.5 6,-0.1 -0.491 59.6-168.8 -69.0 109.2 15.0 38.0 -60.9 1052 93 D R + 0 0 113 -2,-0.6 2,-0.2 4,-0.1 3,-0.1 -0.893 39.0 59.1-105.5 122.3 16.9 39.3 -57.8 1053 94 D G > - 0 0 43 -2,-0.5 4,-0.9 1,-0.1 5,-0.1 -0.596 69.6-113.9 141.7 158.8 16.8 43.0 -57.0 1054 95 D D H > S+ 0 0 149 -2,-0.2 4,-0.8 2,-0.1 -1,-0.1 0.837 115.9 41.3 -86.5 -39.9 14.6 46.0 -56.2 1055 96 D A H > S+ 0 0 81 2,-0.2 4,-1.0 1,-0.1 -1,-0.1 0.785 117.4 48.3 -77.9 -30.6 15.4 47.9 -59.5 1056 97 D L H > S+ 0 0 112 2,-0.2 4,-2.5 1,-0.2 -2,-0.1 0.894 110.1 47.8 -79.2 -44.1 15.2 44.8 -61.7 1057 98 D Q H X S+ 0 0 35 -4,-0.9 4,-2.0 2,-0.2 5,-0.2 0.786 107.8 58.1 -68.6 -29.0 11.9 43.4 -60.5 1058 99 D K H X S+ 0 0 168 -4,-0.8 4,-0.8 2,-0.2 -1,-0.2 0.902 113.9 38.1 -62.0 -43.0 10.3 46.8 -60.8 1059 100 D A H X S+ 0 0 64 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.824 114.9 53.3 -79.1 -35.3 11.3 46.8 -64.5 1060 101 D A H X S+ 0 0 29 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.897 108.7 48.4 -68.2 -42.9 10.5 43.1 -65.1 1061 102 D K H X S+ 0 0 89 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.768 115.1 46.7 -69.0 -27.8 7.0 43.3 -63.7 1062 103 D A H X S+ 0 0 58 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.921 112.7 47.9 -75.5 -49.6 6.3 46.4 -65.8 1063 104 D G H X S+ 0 0 46 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.800 112.5 50.0 -61.8 -33.2 7.8 44.9 -69.0 1064 105 D L H X S+ 0 0 17 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.879 110.0 50.4 -70.0 -40.8 5.8 41.7 -68.5 1065 106 D L H X S+ 0 0 103 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.874 109.0 51.8 -65.0 -39.7 2.6 43.8 -68.0 1066 107 D A H X S+ 0 0 50 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.894 112.6 46.0 -61.6 -41.9 3.3 45.7 -71.2 1067 108 D L H X S+ 0 0 67 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.917 113.1 48.7 -66.7 -45.8 3.7 42.4 -73.1 1068 109 D S H X S+ 0 0 19 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.819 111.7 49.8 -65.7 -35.0 0.6 40.9 -71.5 1069 110 D A H X S+ 0 0 61 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.905 113.5 45.4 -68.7 -44.1 -1.5 44.0 -72.3 1070 111 D F H X S+ 0 0 123 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.815 111.4 53.8 -67.7 -32.8 -0.3 43.9 -76.0 1071 112 D T H X S+ 0 0 4 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.914 111.0 44.5 -68.0 -44.3 -0.9 40.2 -76.2 1072 113 D F H X S+ 0 0 86 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.886 115.4 47.9 -67.5 -40.0 -4.5 40.5 -75.0 1073 114 D A H X S+ 0 0 45 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.867 110.3 53.3 -66.0 -38.3 -5.1 43.5 -77.4 1074 115 D G H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.859 111.8 44.3 -64.1 -39.1 -3.5 41.6 -80.2 1075 116 D L H X S+ 0 0 2 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.890 112.2 51.5 -72.8 -42.3 -5.8 38.6 -79.7 1076 117 D C H X S+ 0 0 29 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.863 109.9 50.0 -63.4 -38.6 -8.9 40.8 -79.3 1077 118 D Y H X>S+ 0 0 109 -4,-2.1 4,-2.8 2,-0.2 5,-0.6 0.883 111.6 49.4 -63.5 -40.2 -8.1 42.6 -82.6 1078 119 D F H X5S+ 0 0 10 -4,-1.3 6,-1.0 1,-0.2 4,-0.7 0.820 110.8 49.8 -68.9 -33.7 -7.6 39.2 -84.2 1079 120 D N H <5S+ 0 0 9 -4,-2.1 -1,-0.2 4,-0.1 -2,-0.2 0.801 119.7 37.0 -72.3 -30.9 -11.0 38.0 -82.9 1080 121 D Y H <5S+ 0 0 173 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.930 129.8 23.7 -87.9 -53.8 -12.8 41.2 -84.1 1081 122 D H H <5S+ 0 0 125 -4,-2.8 -3,-0.2 -5,-0.2 2,-0.2 0.672 123.3 42.2 -93.5 -21.0 -11.2 42.1 -87.5 1082 123 D D S < - 0 0 0 -6,-1.0 4,-2.0 3,-0.1 5,-0.2 -0.055 29.3 -72.1 91.6 163.0 -10.5 34.6 -84.7 1085 126 D I H > S+ 0 0 16 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.920 127.4 49.7 -58.5 -51.5 -8.5 32.0 -82.7 1086 127 D C H > S+ 0 0 21 -62,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.899 115.1 42.7 -56.3 -47.7 -10.8 29.0 -83.3 1087 128 D K H > S+ 0 0 112 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.827 111.0 56.7 -70.4 -33.3 -11.0 29.5 -87.1 1088 129 D A H X S+ 0 0 4 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.879 109.0 44.9 -66.5 -41.5 -7.3 30.2 -87.4 1089 130 D V H X S+ 0 0 78 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.902 112.5 52.8 -67.2 -42.7 -6.3 26.9 -85.8 1090 131 D A H X S+ 0 0 44 -4,-1.7 4,-1.3 -5,-0.2 -2,-0.2 0.873 112.5 44.1 -60.3 -41.7 -8.8 25.1 -87.9 1091 132 D M H < S+ 0 0 52 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.891 113.5 50.7 -69.8 -42.1 -7.5 26.6 -91.1 1092 133 D L H < S+ 0 0 84 -4,-2.0 3,-0.4 -5,-0.2 -2,-0.2 0.761 107.6 55.6 -66.7 -27.2 -3.8 26.0 -90.1 1093 134 D W H < S+ 0 0 43 -4,-1.6 2,-2.0 1,-0.2 -2,-0.2 0.948 100.1 52.4 -79.1 -52.3 -4.5 22.3 -89.3 1094 135 D K < 0 0 173 -4,-1.3 -1,-0.2 1,-0.2 -4,-0.0 -0.441 360.0 360.0 -81.0 64.8 -5.9 20.9 -92.5 1095 136 D L 0 0 43 -2,-2.0 -1,-0.2 -3,-0.4 -2,-0.1 0.657 360.0 360.0-126.0 360.0 -3.0 22.3 -94.4