==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2006 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/ELECTRON TRANSPORT 11-DEC-02 1NEK . COMPND 2 MOLECULE: SUCCINATE DEHYDROGENASE FLAVOPROTEIN SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR V.YANKOVSKAYA,R.HORSEFIELD,S.TORNROTH,C.LUNA-CHAVEZ, . 1068 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42330.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 760 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 1 0.1 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 . 77 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 403 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.1 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 1 5 1 3 2 1 1 3 2 1 0 3 0 1 0 0 1 0 0 0 1 1 2 1 0 2 1 RESIDUES PER ALPHA HELIX . 2 2 5 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 0 PARALLEL BRIDGES PER LADDER . 7 4 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 2 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 1 A M 0 0 208 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 98.9 106.2 112.6 153.5 2 2 A K + 0 0 201 2,-0.1 0, 0.0 0, 0.0 0, 0.0 0.528 360.0 99.7-115.0 -8.3 106.2 110.9 150.1 3 3 A L - 0 0 50 1,-0.1 188,-0.1 188,-0.0 434,-0.0 -0.709 69.4-123.6 -91.0 129.2 102.9 109.0 149.9 4 4 A P - 0 0 62 0, 0.0 188,-2.0 0, 0.0 2,-0.4 -0.168 26.3-152.4 -59.7 152.8 99.9 110.4 148.0 5 5 A V E -a 192 0A 84 186,-0.2 2,-0.4 188,-0.1 188,-0.2 -0.982 15.6-166.9-136.5 146.4 96.6 111.0 149.7 6 6 A R E -a 193 0A 104 186,-1.9 188,-1.1 -2,-0.4 2,-0.3 -0.944 16.4-153.3-134.2 109.8 93.0 111.1 148.7 7 7 A E E +a 194 0A 130 -2,-0.4 2,-0.3 186,-0.2 188,-0.2 -0.670 22.1 161.8 -88.8 134.9 90.5 112.5 151.2 8 8 A F E -a 195 0A 20 186,-1.7 188,-0.8 -2,-0.3 189,-0.2 -0.967 48.8-125.1-144.8 154.7 86.8 111.4 151.2 9 9 A D S S+ 0 0 45 23,-1.1 2,-0.3 -2,-0.3 24,-0.2 0.502 101.1 11.3 -79.8 -0.9 84.1 111.6 153.8 10 10 A A - 0 0 0 22,-0.3 24,-2.2 184,-0.2 2,-0.4 -0.957 59.2-154.9-170.9 150.9 83.9 107.9 153.1 11 11 A V E -de 34 198B 0 186,-1.8 188,-3.5 -2,-0.3 2,-0.8 -0.978 9.2-163.3-134.7 118.4 85.6 104.9 151.5 12 12 A V E -de 35 199B 0 22,-2.9 24,-2.5 -2,-0.4 2,-1.3 -0.849 8.0-159.4-106.6 97.8 83.6 101.9 150.5 13 13 A I E +de 36 200B 9 186,-3.1 188,-2.5 -2,-0.8 24,-0.1 -0.614 63.9 42.8 -79.4 93.2 86.0 99.0 149.9 14 14 A G - 0 0 10 22,-1.7 23,-0.2 -2,-1.3 188,-0.1 -0.141 56.4-150.9 137.0 125.3 84.1 96.6 147.8 15 15 A A + 0 0 2 4,-0.1 29,-0.2 -2,-0.1 187,-0.1 -0.027 57.8 120.7-109.0 29.7 81.8 96.9 144.7 16 16 A G S > S- 0 0 15 185,-0.6 4,-1.5 27,-0.1 5,-0.2 0.179 87.3 -71.9 -73.4-158.9 79.7 93.9 145.4 17 17 A G H > S+ 0 0 1 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.930 136.0 37.2 -64.7 -44.7 76.0 93.9 145.9 18 18 A A H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.902 110.9 59.6 -74.1 -43.2 76.2 95.6 149.3 19 19 A G H > S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.814 111.4 40.7 -55.8 -35.3 79.2 97.8 148.5 20 20 A M H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 5,-0.2 0.855 108.7 57.9 -82.7 -37.6 77.3 99.6 145.8 21 21 A R H X S+ 0 0 8 -4,-1.4 4,-1.3 -5,-0.2 -2,-0.2 0.799 115.0 41.0 -61.8 -25.1 73.9 99.8 147.6 22 22 A A H X S+ 0 0 0 -4,-1.6 4,-3.1 2,-0.2 5,-0.3 0.882 110.3 53.3 -88.2 -45.0 75.9 101.7 150.2 23 23 A A H X S+ 0 0 0 -4,-1.8 4,-1.0 -5,-0.2 -2,-0.2 0.853 112.5 49.5 -57.9 -31.6 78.0 103.8 148.0 24 24 A L H X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 3,-0.4 0.960 112.6 44.2 -71.0 -52.6 74.8 104.9 146.4 25 25 A Q H X S+ 0 0 24 -4,-1.3 4,-1.0 1,-0.2 -2,-0.2 0.855 111.4 53.5 -60.9 -39.9 73.0 105.7 149.6 26 26 A I H <>S+ 0 0 2 -4,-3.1 5,-1.2 1,-0.2 -1,-0.2 0.785 110.2 49.1 -66.6 -28.4 76.0 107.5 151.0 27 27 A S H ><5S+ 0 0 40 -4,-1.0 3,-1.6 -3,-0.4 -1,-0.2 0.798 102.5 59.6 -80.9 -31.7 76.0 109.7 147.9 28 28 A Q H 3<5S+ 0 0 104 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.800 99.4 61.6 -65.3 -26.9 72.3 110.4 148.1 29 29 A S T 3<5S- 0 0 42 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.254 120.0-108.9 -83.6 12.2 73.1 112.0 151.5 30 30 A G T < 5S+ 0 0 69 -3,-1.6 2,-0.5 1,-0.2 -3,-0.2 0.884 72.6 142.6 62.1 38.4 75.4 114.6 149.9 31 31 A Q < - 0 0 22 -5,-1.2 2,-0.3 -4,-0.0 -1,-0.2 -0.954 55.8-121.0-112.7 125.6 78.5 112.8 151.4 32 32 A T + 0 0 64 -2,-0.5 -23,-1.1 -3,-0.1 2,-0.4 -0.498 44.9 174.7 -66.6 127.9 81.7 112.7 149.3 33 33 A C - 0 0 8 -2,-0.3 126,-0.7 -24,-0.2 2,-0.4 -0.993 28.5-153.2-145.5 138.9 82.6 109.0 148.8 34 34 A A E -df 11 159B 0 -24,-2.2 -22,-2.9 -2,-0.4 2,-0.5 -0.894 12.7-155.9-108.4 137.4 85.0 106.8 147.0 35 35 A L E -df 12 160B 0 124,-2.0 126,-3.3 -2,-0.4 2,-0.3 -0.957 13.1-162.4-114.0 127.6 84.2 103.3 146.0 36 36 A L E +df 13 161B 2 -24,-2.5 -22,-1.7 -2,-0.5 2,-0.3 -0.806 10.6 175.0-113.9 154.0 87.0 100.7 145.5 37 37 A S - 0 0 10 124,-1.5 127,-4.0 -2,-0.3 126,-0.4 -0.998 34.7-145.6-155.6 149.8 87.2 97.4 143.7 38 38 A K S S+ 0 0 28 -2,-0.3 2,-0.3 125,-0.3 -1,-0.1 0.764 96.7 22.7 -81.1 -30.0 89.7 94.6 142.8 39 39 A V S S- 0 0 15 125,-0.1 124,-0.6 124,-0.1 125,-0.2 -0.774 110.8 -69.1-127.0 171.6 87.8 93.9 139.6 40 40 A F > - 0 0 12 -2,-0.3 3,-3.3 122,-0.2 4,-0.4 -0.493 58.7-111.4 -62.1 131.5 85.4 96.0 137.5 41 41 A P G > S+ 0 0 0 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.712 115.1 60.7 -36.0 -36.5 82.3 96.3 139.7 42 42 A T G 3 S+ 0 0 0 1,-0.2 105,-0.1 4,-0.1 -2,-0.1 0.498 98.0 60.0 -76.8 -1.4 80.2 94.0 137.4 43 43 A R G < S+ 0 0 11 -3,-3.3 601,-0.4 607,-0.1 -1,-0.2 0.534 73.9 120.9-102.7 -8.0 82.6 91.1 138.0 44 44 A S S X S- 0 0 16 -3,-1.0 3,-2.0 -4,-0.4 4,-0.3 -0.134 84.1 -98.7 -51.4 153.5 82.2 90.9 141.8 45 45 A H G > S+ 0 0 43 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.703 115.2 78.3 -51.5 -23.0 80.9 87.5 143.0 46 46 A T G > S+ 0 0 22 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.826 78.3 69.5 -58.7 -32.3 77.4 88.9 143.3 47 47 A V G < S+ 0 0 2 -3,-2.0 96,-0.7 1,-0.3 -1,-0.3 0.758 94.0 59.6 -55.5 -25.1 76.9 88.6 139.5 48 48 A S G < S+ 0 0 10 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.628 76.4 119.6 -80.9 -15.6 76.8 84.8 140.0 49 49 A A < + 0 0 25 -3,-1.9 93,-1.9 -4,-0.3 94,-0.7 -0.159 32.1 165.9 -52.1 141.7 73.9 84.8 142.4 50 50 A Q + 0 0 12 91,-0.2 91,-0.7 90,-0.2 87,-0.3 0.500 48.8 64.9-121.7 -95.1 70.9 82.7 141.1 51 51 A G S S- 0 0 9 89,-0.1 2,-0.3 85,-0.1 73,-0.1 0.484 92.4-121.6 0.9 -72.4 68.0 81.6 143.3 52 52 A G - 0 0 4 84,-0.1 2,-0.5 87,-0.1 353,-0.3 -0.985 30.7 -52.1 149.1-158.9 66.6 85.1 144.0 53 53 A I E -I 135 0C 0 82,-3.2 82,-3.1 -2,-0.3 2,-0.8 -0.971 41.7-144.2-121.9 118.4 65.8 87.4 146.9 54 54 A T E +I 134 0C 1 348,-2.6 2,-0.3 -2,-0.5 80,-0.3 -0.734 41.0 141.7 -85.9 115.3 63.6 86.1 149.7 55 55 A V - 0 0 0 78,-2.5 2,-1.2 -2,-0.8 3,-0.3 -0.981 57.0-109.1-151.4 144.8 61.4 88.9 150.9 56 56 A A + 0 0 10 -2,-0.3 9,-0.1 33,-0.3 77,-0.1 -0.656 56.2 142.8 -79.7 98.2 57.8 88.9 152.0 57 57 A L - 0 0 12 -2,-1.2 -1,-0.2 4,-0.1 6,-0.1 0.737 52.2-135.8-105.0 -33.7 56.0 90.8 149.2 58 58 A G + 0 0 24 -3,-0.3 -2,-0.1 3,-0.2 75,-0.1 0.613 67.3 119.6 87.4 14.6 52.7 88.8 149.2 59 59 A N S S+ 0 0 23 1,-0.2 3,-0.1 62,-0.1 61,-0.1 0.968 78.2 39.9 -74.6 -56.0 52.5 88.5 145.4 60 60 A T S S- 0 0 34 1,-0.3 2,-0.3 72,-0.2 -1,-0.2 0.786 141.4 -24.9 -63.3 -28.2 52.6 84.7 145.1 61 61 A H S S- 0 0 47 71,-0.1 -1,-0.3 70,-0.0 -3,-0.2 -0.886 85.9 -70.8-179.3 152.8 50.4 84.5 148.1 62 62 A E + 0 0 168 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 -0.172 62.4 156.8 -53.1 144.1 49.5 86.5 151.2 63 63 A D - 0 0 30 -6,-0.1 2,-0.3 -7,-0.1 -1,-0.0 -0.983 32.0-139.4-163.6 165.9 52.3 86.7 153.8 64 64 A N >> - 0 0 51 -2,-0.3 4,-0.8 1,-0.1 3,-0.7 -0.973 27.9-120.0-135.2 152.4 53.8 88.6 156.7 65 65 A W H 3> S+ 0 0 47 -2,-0.3 4,-1.2 1,-0.2 3,-0.2 0.767 108.6 67.1 -61.3 -26.2 57.4 89.5 157.7 66 66 A E H 3> S+ 0 0 84 1,-0.3 4,-2.6 2,-0.3 3,-0.5 0.909 95.6 53.2 -62.0 -43.1 57.1 87.6 161.0 67 67 A W H <> S+ 0 0 103 -3,-0.7 4,-2.2 1,-0.3 -1,-0.3 0.808 106.8 55.7 -61.5 -25.6 56.7 84.3 159.2 68 68 A H H X S+ 0 0 2 -4,-0.8 4,-1.2 2,-0.2 -1,-0.3 0.828 106.9 49.9 -74.1 -31.3 59.9 85.3 157.6 69 69 A M H X S+ 0 0 0 -4,-1.2 4,-3.9 -3,-0.5 5,-0.3 0.970 113.0 43.3 -70.4 -54.3 61.4 85.7 161.1 70 70 A Y H X S+ 0 0 82 -4,-2.6 4,-1.9 1,-0.2 5,-0.4 0.949 113.6 51.5 -55.9 -51.3 60.3 82.3 162.4 71 71 A D H < S+ 0 0 16 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.850 119.9 38.8 -54.5 -32.9 61.4 80.6 159.1 72 72 A T H X S+ 0 0 7 -4,-1.2 4,-1.2 -3,-0.2 -2,-0.2 0.829 112.2 51.7 -88.9 -37.1 64.7 82.4 159.6 73 73 A V H >X>S+ 0 0 0 -4,-3.9 4,-2.1 2,-0.2 5,-1.9 0.973 115.3 42.5 -64.9 -53.9 65.3 82.2 163.4 74 74 A K H 3<5S+ 0 0 26 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.736 111.7 61.1 -61.7 -20.2 64.8 78.5 163.5 75 75 A G H 345S+ 0 0 3 -5,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.790 107.3 40.5 -77.1 -28.2 66.8 78.6 160.3 76 76 A S H <<5S- 0 0 0 -4,-1.2 321,-0.9 -3,-1.1 -2,-0.2 0.748 114.0-115.7 -89.1 -25.9 69.8 80.0 162.1 77 77 A D T <5 - 0 0 3 -4,-2.1 -3,-0.2 -5,-0.1 -4,-0.1 0.748 64.5 -65.5 92.3 33.2 69.3 77.8 165.2 78 78 A Y S - 0 0 18 312,-1.9 4,-2.3 -2,-0.4 5,-0.2 -0.304 17.5-153.5 -61.3 131.6 70.0 88.1 166.5 82 82 A Q H > S+ 0 0 10 492,-1.5 4,-2.4 2,-0.2 5,-0.2 0.855 95.7 55.5 -71.8 -37.0 66.3 88.8 166.7 83 83 A D H > S+ 0 0 63 493,-0.5 4,-2.0 491,-0.4 -1,-0.2 0.948 114.8 37.7 -61.5 -49.1 66.8 92.5 166.7 84 84 A A H > S+ 0 0 1 309,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.943 117.7 47.8 -69.0 -51.7 68.8 92.4 163.5 85 85 A I H X S+ 0 0 0 -4,-2.3 4,-2.9 308,-0.3 5,-0.4 0.936 110.5 54.4 -55.7 -46.3 66.8 89.8 161.7 86 86 A E H X S+ 0 0 39 -4,-2.4 4,-3.2 1,-0.2 5,-0.3 0.972 109.1 47.2 -48.6 -64.3 63.6 91.6 162.7 87 87 A Y H X S+ 0 0 57 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.845 114.5 48.1 -44.9 -45.9 64.8 94.8 161.1 88 88 A M H X S+ 0 0 1 -4,-2.5 4,-0.6 2,-0.2 -1,-0.2 0.987 114.8 41.4 -63.4 -60.8 65.9 93.0 158.0 89 89 A C H >< S+ 0 0 0 -4,-2.9 3,-0.7 1,-0.2 -33,-0.3 0.910 118.6 47.9 -54.1 -46.2 62.7 91.0 157.3 90 90 A K H 3< S+ 0 0 95 -4,-3.2 4,-0.3 -5,-0.4 -1,-0.2 0.936 116.7 41.0 -60.4 -51.1 60.5 94.0 158.3 91 91 A T H 3X S+ 0 0 15 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.437 94.6 99.0 -78.3 1.9 62.4 96.5 156.1 92 92 A G H > S+ 0 0 22 0, 0.0 4,-2.7 0, 0.0 3,-1.1 0.931 112.7 50.0 -45.2 -66.2 59.7 94.7 151.0 94 94 A E H 3> S+ 0 0 99 -4,-0.3 4,-1.2 1,-0.3 -2,-0.2 0.848 112.0 50.5 -43.9 -44.4 60.3 98.5 150.8 95 95 A A H 3X S+ 0 0 0 -4,-1.5 4,-0.8 -3,-0.3 -1,-0.3 0.814 113.4 44.3 -67.1 -33.9 64.0 97.9 150.1 96 96 A I H XX S+ 0 0 0 -4,-1.6 4,-1.3 -3,-1.1 3,-0.6 0.908 109.6 51.9 -79.3 -44.7 63.3 95.5 147.3 97 97 A L H 3X S+ 0 0 17 -4,-2.7 4,-2.0 1,-0.3 -2,-0.2 0.820 102.6 64.8 -60.6 -27.5 60.6 97.4 145.6 98 98 A E H 3X S+ 0 0 58 -4,-1.2 4,-0.6 -5,-0.4 -1,-0.3 0.920 100.5 49.9 -58.8 -44.6 63.1 100.2 145.7 99 99 A L H <<>S+ 0 0 1 -4,-0.8 5,-1.5 -3,-0.6 -1,-0.2 0.786 107.1 53.5 -65.6 -31.6 65.3 98.1 143.4 100 100 A E H ><5S+ 0 0 0 -4,-1.3 3,-1.8 1,-0.2 -1,-0.2 0.870 103.8 55.6 -73.1 -34.2 62.4 97.5 141.0 101 101 A H H 3<5S+ 0 0 82 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.694 102.8 58.2 -68.6 -15.8 61.8 101.2 140.8 102 102 A M T 3<5S- 0 0 22 -4,-0.6 608,-0.7 -3,-0.2 -1,-0.3 0.463 131.1 -97.1 -89.1 -5.9 65.5 101.3 139.7 103 103 A G T < 5 + 0 0 0 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.2 0.714 56.9 174.5 99.6 23.7 64.6 99.0 136.9 104 104 A L < - 0 0 1 -5,-1.5 2,-3.0 1,-0.1 -1,-0.2 -0.508 37.6-122.2 -70.4 123.2 65.5 95.5 138.1 105 105 A P + 0 0 4 0, 0.0 -1,-0.1 0, 0.0 39,-0.1 -0.199 45.3 172.4 -58.7 49.8 64.5 92.8 135.5 106 106 A F - 0 0 4 -2,-3.0 31,-0.2 1,-0.1 2,-0.1 -0.175 36.5-108.0 -61.2 156.2 62.2 90.8 137.9 107 107 A S - 0 0 10 29,-1.4 15,-1.6 15,-0.3 2,-0.3 -0.473 39.7-132.2 -79.8 161.9 60.1 88.0 136.5 108 108 A R B -K 121 0D 11 13,-0.2 2,-0.4 -2,-0.1 11,-0.2 -0.800 5.8-130.3-120.8 161.7 56.4 88.7 136.3 109 109 A L + 0 0 26 11,-0.7 2,-0.1 9,-0.5 11,-0.1 -0.878 57.7 80.5-114.7 143.2 53.1 87.0 137.2 110 110 A D S S+ 0 0 48 -2,-0.4 2,-0.4 615,-0.1 7,-0.3 -0.615 79.6 33.0 170.2 -96.1 49.9 86.4 135.2 111 111 A D + 0 0 117 5,-0.2 2,-0.3 -2,-0.1 5,-0.2 -0.703 58.3 141.6 -97.3 139.8 49.6 83.5 132.8 112 112 A G B > -L 115 0E 30 3,-1.3 3,-0.8 -2,-0.4 -3,-0.0 -0.944 64.4 -81.5-155.6 164.8 51.2 80.1 133.0 113 113 A R T 3 S- 0 0 149 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.893 124.2 -2.8 -35.6 -69.6 50.2 76.5 132.3 114 114 A I T 3 S+ 0 0 152 -3,-0.1 -1,-0.3 0, 0.0 2,-0.2 -0.062 124.5 74.4-120.6 34.2 48.3 76.1 135.6 115 115 A Y B < +L 112 0E 172 -3,-0.8 -3,-1.3 2,-0.0 2,-0.2 -0.837 47.4 178.5-136.5 173.2 48.9 79.4 137.3 116 116 A Q + 0 0 142 -2,-0.2 -5,-0.2 -5,-0.2 -7,-0.1 -0.633 16.8 124.5 178.2 121.4 47.7 83.1 137.1 117 117 A R - 0 0 120 -7,-0.3 -57,-0.0 -2,-0.2 -58,-0.0 -0.946 48.7 -71.5-174.7 155.4 48.2 86.5 138.9 118 118 A P - 0 0 82 0, 0.0 2,-1.5 0, 0.0 -9,-0.5 0.277 64.1 -67.2 -49.5 173.2 49.3 90.3 138.4 119 119 A F S S+ 0 0 61 -11,-0.2 605,-0.2 602,-0.1 3,-0.1 0.186 80.6 136.8 -48.5 11.9 52.6 92.1 137.6 120 120 A G S S- 0 0 6 -2,-1.5 -11,-0.7 1,-0.1 2,-0.2 -0.072 70.7 -85.7 -62.0 167.8 54.2 91.3 140.9 121 121 A G B -K 108 0D 3 -13,-0.1 2,-0.3 1,-0.1 -13,-0.2 -0.585 56.3-108.7 -68.7 136.0 57.8 90.2 141.2 122 122 A Q - 0 0 18 -15,-1.6 14,-2.6 14,-0.4 2,-0.5 -0.560 34.1-155.2 -70.0 131.3 57.6 86.5 140.7 123 123 A S E -J 135 0C 5 -2,-0.3 12,-0.3 12,-0.3 2,-0.3 -0.953 7.7-156.9-111.8 121.8 58.3 84.7 144.0 124 124 A K E -J 134 0C 3 10,-4.0 10,-1.5 -2,-0.5 9,-0.6 -0.686 26.2 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3,-2.1 -0.426 30.9-113.1 -69.0 143.7 53.0 91.9 132.3 726 137 B P H 3> S+ 0 0 28 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.825 120.4 56.1 -45.0 -37.2 54.9 88.7 131.4 727 138 B E H 3> S+ 0 0 152 2,-0.2 4,-0.7 1,-0.2 -2,-0.0 0.827 111.9 42.5 -66.8 -31.4 54.4 89.6 127.8 728 139 B Q H <4 S+ 0 0 63 -3,-2.1 3,-0.3 2,-0.2 46,-0.2 0.854 115.6 48.0 -81.3 -37.8 56.0 93.0 128.4 729 140 B R H >< S+ 0 0 12 -4,-2.8 3,-1.3 1,-0.2 4,-0.2 0.739 100.7 67.3 -75.0 -21.7 58.8 91.5 130.6 730 141 B E H >< S+ 0 0 122 -4,-1.9 3,-2.7 -5,-0.4 -1,-0.2 0.915 86.3 70.1 -63.2 -39.2 59.4 88.9 128.0 731 142 B K T 3< S+ 0 0 130 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.600 90.5 61.8 -52.6 -16.9 60.6 91.6 125.6 732 143 B L T X> S+ 0 0 0 -3,-1.3 3,-1.9 -4,-0.2 4,-0.8 0.566 75.8 113.7 -88.3 -11.6 63.7 92.1 127.8 733 144 B D T <4 S+ 0 0 79 -3,-2.7 -3,-0.0 1,-0.3 0, 0.0 -0.289 81.9 20.2 -61.3 147.3 65.0 88.5 127.3 734 145 B G T 34 S+ 0 0 21 1,-0.1 76,-0.4 73,-0.1 -1,-0.3 0.535 119.8 71.2 70.8 5.4 68.3 88.4 125.4 735 146 B L T <4 S+ 0 0 18 -3,-1.9 -2,-0.2 74,-0.1 34,-0.2 0.513 92.5 44.0-127.6 -13.8 68.8 92.0 126.3 736 147 B Y S < S+ 0 0 18 -4,-0.8 -3,-0.1 1,-0.1 -589,-0.1 0.484 94.9 77.0-111.6 -3.8 69.6 92.1 130.0 737 148 B E + 0 0 20 70,-0.1 -1,-0.1 2,-0.0 2,-0.1 0.371 59.6 130.6 -86.4 2.7 72.0 89.2 130.2 738 149 B C - 0 0 26 1,-0.1 -3,-0.0 -3,-0.1 -4,-0.0 -0.384 39.8-166.8 -61.1 132.5 74.9 91.1 128.7 739 150 B I - 0 0 3 -2,-0.1 -1,-0.1 -89,-0.0 -2,-0.0 0.156 37.3-117.9-106.3 16.3 78.0 90.6 130.9 740 151 B L + 0 0 6 1,-0.1 -698,-0.1 22,-0.1 -2,-0.1 0.878 66.4 141.7 49.9 47.4 80.0 93.4 129.4 741 152 B C - 0 0 11 -89,-0.1 -1,-0.1 -79,-0.0 -88,-0.1 0.643 51.5-143.1 -89.4 -17.1 82.8 91.1 128.1 742 153 B A > + 0 0 1 1,-0.1 4,-1.2 -43,-0.0 5,-0.1 0.806 58.2 133.2 60.4 30.6 83.2 93.1 124.9 743 154 B C H > S+ 0 0 0 2,-0.1 4,-0.7 3,-0.1 -83,-0.1 0.907 75.2 47.5 -74.0 -36.7 83.8 90.0 122.8 744 155 B C H >4 S+ 0 0 12 2,-0.2 3,-1.1 1,-0.2 -1,-0.1 0.956 112.6 42.7 -66.8 -56.9 81.3 91.5 120.4 745 156 B S H >4 S+ 0 0 1 1,-0.3 3,-2.2 2,-0.2 6,-0.2 0.901 110.2 58.9 -59.3 -40.0 82.5 95.1 120.1 746 157 B T H 3< S+ 0 0 2 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.762 105.1 51.8 -59.3 -24.3 86.1 93.8 119.9 747 158 B S T << S+ 0 0 7 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.221 90.3 96.9 -98.0 13.0 85.1 91.8 116.8 748 159 B C X> - 0 0 15 -3,-2.2 4,-1.0 1,-0.1 3,-0.6 -0.889 54.7-162.1-113.1 113.9 83.5 94.7 115.0 749 160 B P H >> S+ 0 0 24 0, 0.0 4,-1.9 0, 0.0 3,-0.7 0.863 94.6 59.7 -56.6 -37.5 85.5 96.7 112.3 750 161 B S H 3> S+ 0 0 4 1,-0.3 4,-1.4 2,-0.2 8,-0.2 0.928 106.7 48.1 -56.5 -41.6 83.0 99.6 112.5 751 162 B F H <4 S+ 0 0 8 -3,-0.6 -1,-0.3 1,-0.2 6,-0.1 0.675 105.4 58.9 -71.9 -19.3 84.0 99.8 116.2 752 163 B W H << S+ 0 0 25 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.910 111.3 40.2 -75.4 -39.8 87.7 99.7 115.3 753 164 B W H < S+ 0 0 71 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.708 129.9 27.8 -79.3 -23.3 87.4 102.8 113.1 754 165 B N >X + 0 0 5 -4,-1.4 4,-1.7 -5,-0.2 3,-1.1 -0.351 65.0 158.8-139.6 57.3 85.1 104.8 115.4 755 166 B P T 34 S+ 0 0 27 0, 0.0 -53,-0.2 0, 0.0 -1,-0.1 0.836 86.3 29.8 -47.6 -40.5 85.7 103.6 119.0 756 167 B D T 34 S+ 0 0 90 -3,-0.1 3,-0.1 -55,-0.1 -5,-0.1 0.410 123.9 44.1-105.2 -0.2 84.2 106.8 120.3 757 168 B K T <4 S+ 0 0 104 -3,-1.1 2,-0.5 1,-0.2 33,-0.1 0.794 104.4 58.3-107.1 -51.0 81.7 107.7 117.7 758 169 B F S < S- 0 0 2 -4,-1.7 33,-0.2 -8,-0.2 -1,-0.2 -0.700 77.7-142.9 -81.7 126.4 79.9 104.5 116.8 759 170 B I - 0 0 5 32,-1.2 4,-0.3 -2,-0.5 -1,-0.1 0.906 35.8-142.4 -56.5 -47.7 78.3 103.0 120.0 760 171 B G > - 0 0 0 31,-0.4 4,-1.9 1,-0.1 5,-0.3 -0.144 27.5 -63.3 101.8 161.9 79.0 99.4 119.1 761 172 B P H > S+ 0 0 3 0, 0.0 4,-2.4 0, 0.0 3,-0.2 0.908 128.0 45.8 -45.5 -64.3 77.2 96.0 119.6 762 173 B A H > S+ 0 0 6 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.870 113.8 49.2 -52.6 -45.1 77.0 95.9 123.4 763 174 B G H > S+ 0 0 3 -4,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.861 111.9 46.6 -67.3 -36.5 75.9 99.5 123.8 764 175 B L H X S+ 0 0 0 -4,-1.9 4,-3.0 -3,-0.2 5,-0.2 0.886 109.1 55.5 -73.3 -35.9 73.1 99.3 121.3 765 176 B L H X S+ 0 0 3 -4,-2.4 4,-1.3 -5,-0.3 -2,-0.2 0.884 112.9 43.5 -60.4 -37.3 71.9 96.0 122.8 766 177 B A H X S+ 0 0 9 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.768 109.8 55.0 -78.4 -29.2 71.7 97.9 126.1 767 178 B A H X S+ 0 0 3 -4,-1.7 4,-2.0 1,-0.2 3,-0.4 0.938 110.1 48.0 -68.5 -42.9 70.1 101.0 124.5 768 179 B Y H X S+ 0 0 31 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.860 100.0 65.6 -65.3 -34.7 67.5 98.6 123.2 769 180 B R H < S+ 0 0 8 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.919 112.9 34.2 -54.2 -41.0 67.1 97.1 126.6 770 181 B F H >< S+ 0 0 0 -4,-1.3 3,-1.0 -3,-0.4 -1,-0.2 0.770 109.8 64.0 -85.7 -24.8 65.7 100.5 127.8 771 182 B L H 3< S+ 0 0 7 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.843 112.7 35.4 -65.3 -35.4 64.0 101.5 124.6 772 183 B I T 3< S+ 0 0 27 -4,-2.0 2,-0.8 -5,-0.1 -1,-0.2 0.082 87.7 117.8-107.6 22.8 61.6 98.6 124.9 773 184 B D X - 0 0 3 -3,-1.0 3,-3.1 1,-0.1 6,-0.1 -0.827 57.2-149.9 -94.8 110.2 61.2 98.6 128.7 774 185 B S T 3 S+ 0 0 54 -2,-0.8 -1,-0.1 1,-0.3 -51,-0.1 0.731 97.4 59.4 -45.8 -28.0 57.6 99.3 129.6 775 186 B R T 3 S+ 0 0 5 -53,-0.1 2,-0.5 -672,-0.1 -1,-0.3 0.654 88.7 87.4 -80.7 -15.3 58.9 100.9 132.8 776 187 B D < - 0 0 10 -3,-3.1 3,-0.3 -6,-0.2 -64,-0.2 -0.750 51.2-175.8 -92.4 130.9 61.0 103.5 130.9 777 188 B T + 0 0 54 -66,-3.0 -65,-0.1 -2,-0.5 3,-0.1 0.166 68.1 72.0-110.4 17.8 59.3 106.7 129.8 778 189 B E > + 0 0 64 -67,-0.4 4,-2.6 -8,-0.2 5,-0.2 0.021 54.6 124.3-121.2 28.9 62.0 108.5 127.8 779 190 B T H > S+ 0 0 28 -3,-0.3 4,-2.3 1,-0.2 5,-0.2 0.907 76.1 45.7 -55.4 -50.7 62.0 106.4 124.7 780 191 B D H > S+ 0 0 94 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.873 115.1 48.9 -63.9 -34.4 61.3 109.2 122.2 781 192 B S H > S+ 0 0 74 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.873 110.0 52.5 -70.2 -35.6 64.0 111.3 124.0 782 193 B R H < S+ 0 0 20 -4,-2.6 4,-0.3 1,-0.2 -2,-0.2 0.878 107.1 52.7 -66.6 -37.3 66.3 108.3 123.8 783 194 B L H >< S+ 0 0 4 -4,-2.3 3,-0.9 1,-0.2 4,-0.3 0.808 102.9 56.3 -69.7 -31.7 65.7 108.0 120.0 784 195 B D H >< S+ 0 0 79 -4,-1.3 3,-0.9 1,-0.2 -1,-0.2 0.865 103.4 56.7 -68.5 -32.3 66.6 111.6 119.3 785 196 B G T 3< S+ 0 0 54 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.573 108.7 46.1 -74.3 -9.2 69.9 111.0 121.0 786 197 B L T < S+ 0 0 12 -3,-0.9 6,-0.3 -4,-0.3 -1,-0.2 0.321 84.4 94.5-114.9 9.1 70.7 108.2 118.6 787 198 B S < + 0 0 10 -3,-0.9 181,-2.2 -4,-0.3 182,-0.7 0.481 58.3 103.6 -80.9 -2.5 69.7 109.8 115.3 788 199 B D S S- 0 0 61 179,-0.2 5,-0.4 -3,-0.2 4,-0.3 0.129 87.7 -97.6 -64.5-167.7 73.1 111.1 114.3 789 200 B A S S+ 0 0 16 179,-0.1 -1,-0.1 177,-0.1 178,-0.1 0.685 112.4 31.2 -89.2 -18.7 75.2 109.5 111.6 790 201 B F S > S+ 0 0 16 3,-0.1 4,-1.0 -33,-0.1 -31,-0.3 0.850 94.2 78.0-106.8 -47.6 77.5 107.4 113.8 791 202 B S T 4 S- 0 0 18 -33,-0.2 -32,-1.2 1,-0.2 -31,-0.4 0.774 124.6 -11.0 -32.7 -45.9 75.8 106.3 117.0 792 203 B V T >4 S+ 0 0 0 -6,-0.3 3,-2.0 -4,-0.3 -1,-0.2 0.696 122.4 70.4-125.7 -50.4 73.9 103.6 115.3 793 204 B F T 34 S+ 0 0 19 -5,-0.4 -2,-0.1 1,-0.3 -3,-0.1 0.407 77.7 81.9 -59.6 2.3 74.1 103.7 111.5 794 205 B R T 3< + 0 0 5 -4,-1.0 2,-0.5 -40,-0.1 -1,-0.3 0.613 69.9 105.3 -81.0 -9.3 77.7 102.7 111.4 795 206 B C < - 0 0 16 -3,-2.0 -3,-0.0 -5,-0.1 -47,-0.0 -0.589 47.1-179.2 -74.0 121.2 76.4 99.1 111.7 796 207 B H - 0 0 41 -2,-0.5 -1,-0.1 0, 0.0 -3,-0.1 0.190 50.4-106.1-105.6 14.9 76.6 97.3 108.4 797 208 B S + 0 0 13 1,-0.1 58,-0.1 15,-0.0 -2,-0.1 0.955 65.4 151.9 60.2 50.7 75.1 94.0 109.5 798 209 B I - 0 0 21 56,-0.1 56,-0.1 57,-0.1 57,-0.1 0.715 39.7-150.8 -81.8 -25.3 78.4 92.1 109.5 799 210 B M > + 0 0 1 1,-0.1 4,-1.2 52,-0.1 52,-0.1 0.787 56.7 126.1 58.8 32.6 77.2 89.8 112.3 800 211 B N H > S+ 0 0 9 2,-0.2 4,-1.9 1,-0.1 5,-0.1 0.777 72.5 59.4 -83.2 -29.5 80.6 89.1 113.8 801 212 B C H > S+ 0 0 10 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.899 106.6 43.8 -63.1 -43.3 79.1 90.2 117.1 802 213 B V H 4 S+ 0 0 25 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.933 108.9 61.9 -67.5 -42.5 76.4 87.5 117.0 803 214 B S H < S+ 0 0 21 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.868 113.4 31.4 -47.3 -46.7 79.1 85.1 115.9 804 215 B V H < S+ 0 0 14 -4,-1.9 -1,-0.2 -60,-0.1 -2,-0.2 0.562 78.7 129.6 -97.1 -8.8 81.1 85.5 119.1 805 216 B C >< - 0 0 25 -4,-1.3 3,-1.2 -3,-0.5 -144,-0.0 -0.256 41.6-159.3 -58.1 118.8 78.6 86.2 121.9 806 217 B P T 3 S+ 0 0 40 0, 0.0 -1,-0.2 0, 0.0 -145,-0.0 0.891 95.1 47.9 -58.8 -43.3 79.3 83.8 124.9 807 218 B K T 3 S- 0 0 55 -70,-0.0 -2,-0.1 1,-0.0 -73,-0.1 0.426 115.5-115.3 -82.0 0.0 75.7 84.4 126.1 808 219 B G < + 0 0 66 -3,-1.2 2,-0.2 1,-0.2 -6,-0.1 0.844 59.8 158.9 68.8 34.1 74.2 83.8 122.7 809 220 B L - 0 0 10 -8,-0.1 -4,-0.2 -72,-0.1 -1,-0.2 -0.566 36.0-141.6 -88.6 154.5 72.9 87.4 122.5 810 221 B N > + 0 0 13 -76,-0.4 4,-1.5 -2,-0.2 3,-0.1 -0.775 25.7 168.0-121.9 86.3 72.1 89.0 119.1 811 222 B P H > S+ 0 0 3 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.848 78.1 62.7 -63.6 -34.5 73.1 92.7 118.9 812 223 B T H > S+ 0 0 9 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.942 105.8 44.7 -56.5 -47.9 72.6 92.8 115.1 813 224 B R H > S+ 0 0 111 116,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.862 113.5 51.1 -63.7 -37.6 68.9 92.0 115.6 814 225 B A H X S+ 0 0 4 -4,-1.5 4,-1.5 1,-0.2 3,-0.3 0.895 109.4 49.7 -66.7 -41.7 68.6 94.6 118.4 815 226 B I H X S+ 0 0 3 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.800 105.4 58.9 -68.7 -27.6 70.3 97.2 116.3 816 227 B G H X S+ 0 0 15 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.835 106.3 47.1 -70.4 -32.2 67.8 96.4 113.6 817 228 B H H X S+ 0 0 68 -4,-1.2 4,-2.5 -3,-0.3 -2,-0.2 0.806 109.0 53.9 -77.3 -32.2 64.9 97.2 115.9 818 229 B I H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.903 106.8 53.0 -66.5 -42.1 66.5 100.5 117.0 819 230 B K H X S+ 0 0 9 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.867 108.9 49.9 -61.1 -36.0 66.8 101.5 113.3 820 231 B S H X S+ 0 0 55 -4,-1.1 4,-2.3 2,-0.2 3,-0.3 0.971 106.9 52.7 -67.1 -53.1 63.1 100.8 112.9 821 232 B M H X S+ 0 0 57 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.874 108.6 52.4 -49.7 -41.4 62.1 102.9 115.8 822 233 B L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.3 0.920 108.3 50.3 -60.7 -46.3 64.2 105.7 114.4 823 234 B L H < S+ 0 0 51 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.830 110.7 49.7 -61.4 -35.9 62.3 105.4 111.0 824 235 B Q H < S+ 0 0 167 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.908 118.5 38.6 -71.4 -39.3 59.0 105.5 112.8 825 236 B R H < S+ 0 0 95 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.679 122.7 38.8 -86.6 -17.8 60.0 108.6 114.7 826 237 B N < 0 0 49 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.1 -0.290 360.0 360.0-130.6 53.2 61.9 110.5 112.0 827 238 B A 0 0 126 -3,-0.5 143,-0.0 143,-0.0 142,-0.0 -0.959 360.0 360.0-169.5 360.0 60.1 109.9 108.8 828 !* 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 0.0 829 1 C M 0 0 157 0, 0.0 5,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 101.3 105.3 110.0 122.2 830 2 C I > - 0 0 116 3,-0.2 3,-0.8 1,-0.2 2,-0.7 0.141 360.0 -49.8 -71.6-159.0 104.5 113.7 121.6 831 3 C R T 3 S- 0 0 237 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 -0.716 126.0 -9.9 -85.2 115.8 107.2 116.2 122.5 832 4 C N T 3 S+ 0 0 157 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.855 118.7 90.6 66.4 40.8 108.6 115.4 126.0 833 5 C V < - 0 0 82 -3,-0.8 -3,-0.2 0, 0.0 -1,-0.2 -0.888 60.8-164.6-159.9 128.4 105.8 112.9 126.9 834 6 C K + 0 0 146 -2,-0.3 -4,-0.2 -5,-0.2 -3,-0.0 -0.271 34.6 48.9-113.8-166.2 106.2 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1,-0.1 -5,-0.1 3,-0.1 -2,-0.1 -0.216 78.2-136.1 -60.3 141.8 71.9 113.7 105.1 966 10 D R S S- 0 0 177 -7,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.834 90.7 -11.9 -64.5 -31.9 70.8 116.1 107.7 967 11 D N S > S- 0 0 57 -8,-0.1 4,-1.5 -179,-0.1 -179,-0.2 -0.857 89.0 -79.0-151.8-174.1 71.1 113.2 110.1 968 12 D G H > S+ 0 0 1 -181,-2.2 4,-2.1 -2,-0.3 -180,-0.2 0.916 121.1 54.4 -63.6 -49.0 71.6 109.5 110.1 969 13 D V H > S+ 0 0 2 -182,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.834 106.5 55.9 -55.5 -34.5 68.0 108.3 109.3 970 14 D H H > S+ 0 0 54 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.951 107.3 47.2 -62.1 -52.1 68.1 110.6 106.3 971 15 D D H X S+ 0 0 9 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.848 109.0 55.7 -59.3 -37.7 71.2 108.9 104.9 972 16 D F H X S+ 0 0 13 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.980 113.0 41.0 -58.7 -55.6 69.7 105.5 105.5 973 17 D I H X S+ 0 0 66 -4,-2.2 4,-3.6 1,-0.2 5,-0.3 0.943 111.9 52.3 -59.7 -55.0 66.6 106.4 103.4 974 18 D L H X S+ 0 0 40 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.867 111.7 48.7 -54.3 -35.3 68.3 108.2 100.6 975 19 D 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D Y H X S+ 0 0 33 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.873 109.8 50.4 -56.7 -40.9 67.1 101.2 85.8 986 30 D I H X S+ 0 0 49 -4,-2.3 4,-3.3 2,-0.2 5,-0.2 0.944 110.3 48.6 -64.7 -47.8 69.8 98.5 85.6 987 31 D I H X S+ 0 0 99 -4,-2.2 4,-4.1 1,-0.2 5,-0.3 0.941 110.7 53.5 -55.6 -48.0 67.2 95.8 84.8 988 32 D Y H X S+ 0 0 59 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.925 114.2 39.6 -51.9 -51.6 65.9 98.1 82.2 989 33 D M H X S+ 0 0 28 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.851 117.8 49.5 -69.0 -35.9 69.3 98.5 80.5 990 34 D V H X S+ 0 0 83 -4,-3.3 4,-2.5 2,-0.2 -2,-0.2 0.957 106.7 54.5 -66.9 -50.5 70.2 94.9 81.0 991 35 D G H < S+ 0 0 36 -4,-4.1 -1,-0.2 1,-0.2 -2,-0.2 0.853 108.9 51.8 -50.8 -36.4 66.9 93.7 79.6 992 36 D F H >< S+ 0 0 39 -4,-1.3 3,-1.4 -5,-0.3 -1,-0.2 0.931 109.7 45.6 -67.7 -48.5 67.7 95.8 76.5 993 37 D F H >X S+ 0 0 68 -4,-1.9 3,-1.2 1,-0.3 4,-0.9 0.830 109.0 56.1 -66.0 -31.8 71.2 94.3 76.0 994 38 D A T 3< S+ 0 0 80 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.255 110.1 47.3 -84.2 13.4 70.0 90.8 76.5 995 39 D T T <4 S+ 0 0 122 -3,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 -0.001 102.1 68.4-137.5 22.1 67.4 91.4 73.7 996 40 D S T <4 + 0 0 33 -3,-1.2 2,-0.8 1,-0.1 -2,-0.2 0.804 54.6 172.1-111.3 -48.4 69.9 92.9 71.2 997 41 D G S < S+ 0 0 73 -4,-0.9 2,-0.8 2,-0.1 -1,-0.1 -0.598 77.2 25.9 70.7-109.7 72.4 90.4 69.9 998 42 D E S S- 0 0 179 -2,-0.8 2,-0.6 1,-0.0 -1,-0.0 -0.777 85.9-145.8 -91.3 111.8 74.1 92.4 67.2 999 43 D L - 0 0 51 -2,-0.8 2,-0.3 4,-0.1 -2,-0.1 -0.662 13.4-163.7 -82.9 119.1 73.8 96.1 68.1 1000 44 D T >> - 0 0 72 -2,-0.6 4,-2.9 1,-0.1 3,-0.7 -0.761 31.6-118.6-100.5 146.4 73.5 98.4 65.1 1001 45 D Y H 3> S+ 0 0 44 -2,-0.3 4,-1.9 1,-0.3 5,-0.2 0.808 118.7 55.4 -51.7 -29.6 74.1 102.1 65.2 1002 46 D E H 3> S+ 0 0 132 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.896 111.1 42.5 -70.9 -39.9 70.5 102.4 64.1 1003 47 D V H <> S+ 0 0 68 -3,-0.7 4,-1.7 2,-0.2 -2,-0.2 0.880 114.3 51.3 -72.8 -40.1 69.3 100.3 67.1 1004 48 D W H >X S+ 0 0 12 -4,-2.9 4,-1.4 2,-0.2 3,-0.7 0.981 114.9 39.5 -61.7 -60.5 71.6 102.0 69.6 1005 49 D I H 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1015 59 D V H X S+ 0 0 104 -4,-2.8 4,-0.8 -5,-0.2 -1,-0.2 0.797 115.6 45.6 -69.3 -28.2 64.5 110.4 81.3 1016 60 D F H >X S+ 0 0 34 -4,-1.8 4,-2.7 -5,-0.2 3,-0.5 0.933 109.6 54.0 -80.5 -46.8 65.4 107.2 83.1 1017 61 D T H 3X S+ 0 0 8 -4,-2.3 4,-1.8 1,-0.3 -2,-0.2 0.848 112.7 44.5 -55.7 -34.6 69.1 107.5 82.3 1018 62 D L H 3X S+ 0 0 27 -4,-1.6 4,-1.5 2,-0.2 -1,-0.3 0.727 109.7 55.2 -84.0 -18.8 69.1 110.9 83.8 1019 63 D L H S+ 0 0 32 -4,-2.4 4,-3.1 2,-0.2 5,-0.6 0.922 102.6 54.8 -68.5 -41.5 74.0 107.9 91.7 1025 69 D L H X5S+ 0 0 24 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.962 114.5 38.5 -53.3 -58.3 75.0 111.4 92.9 1026 70 D I H X5S+ 0 0 31 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.891 122.8 43.4 -60.3 -43.8 73.0 111.1 96.0 1027 71 D H H X5S+ 0 0 42 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.983 117.7 40.1 -69.4 -62.1 73.8 107.4 96.5 1028 72 D A H X5S+ 0 0 13 -4,-3.1 4,-2.8 1,-0.2 5,-0.4 0.794 111.9 61.3 -61.0 -25.4 77.6 107.4 95.8 1029 73 D W H XX S+ 0 0 22 -4,-2.2 4,-1.8 1,-0.2 3,-1.2 0.950 111.0 48.3 -59.2 -52.5 83.9 104.8 103.4 1036 80 D L H 3X S+ 0 0 14 -4,-2.5 4,-1.4 1,-0.3 -1,-0.2 0.832 104.0 61.3 -58.3 -33.8 86.1 108.0 103.8 1037 81 D T H 3< S+ 0 0 9 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.776 109.3 44.0 -64.9 -25.8 84.8 108.5 107.3 1038 82 D D H << S+ 0 0 4 -3,-1.2 -2,-0.2 -4,-0.9 -1,-0.2 0.891 126.5 20.6 -86.2 -43.9 86.3 105.1 108.2 1039 83 D Y H < S+ 0 0 115 -4,-1.8 2,-1.3 1,-0.2 -3,-0.2 0.833 107.1 67.6-100.8 -37.4 89.8 105.2 106.6 1040 84 D V < + 0 0 22 -4,-1.4 -1,-0.2 -5,-0.3 6,-0.2 -0.633 52.5 164.1 -89.4 85.1 90.9 108.7 105.9 1041 85 D K + 0 0 101 -2,-1.3 2,-0.6 -3,-0.1 -1,-0.2 0.747 46.1 93.3 -73.4 -25.9 91.4 110.2 109.4 1042 86 D P S > S- 0 0 82 0, 0.0 4,-2.4 0, 0.0 5,-0.2 -0.586 70.2-146.5 -72.5 119.2 93.4 113.3 108.4 1043 87 D L H > S+ 0 0 110 -2,-0.6 4,-2.3 1,-0.2 5,-0.3 0.930 91.6 49.2 -48.4 -63.0 90.9 116.1 108.0 1044 88 D A H > S+ 0 0 84 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.874 113.6 47.6 -47.9 -45.1 92.6 118.1 105.2 1045 89 D L H > S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.961 111.0 50.1 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0.984 110.7 49.6 -69.7 -53.6 82.7 117.2 91.7 1056 100 D A H X S+ 0 0 28 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.911 113.0 48.0 -47.0 -50.0 83.1 114.0 89.7 1057 101 D L H X S+ 0 0 1 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.919 111.2 49.4 -58.9 -46.2 79.6 113.0 90.6 1058 102 D V H X S+ 0 0 57 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.893 111.1 50.7 -61.3 -40.2 78.2 116.4 89.6 1059 103 D V H X S+ 0 0 76 -4,-3.1 4,-3.7 2,-0.2 5,-0.4 0.882 102.5 60.1 -65.2 -37.7 80.0 116.2 86.3 1060 104 D Y H X S+ 0 0 37 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.937 109.4 43.7 -53.8 -48.2 78.6 112.7 85.6 1061 105 D V H X S+ 0 0 16 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.878 115.6 46.6 -66.4 -38.8 75.1 114.2 85.7 1062 106 D I H X S+ 0 0 96 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.933 113.1 48.3 -70.7 -44.8 76.0 117.2 83.7 1063 107 D Y H X S+ 0 0 85 -4,-3.7 4,-3.0 1,-0.2 5,-0.3 0.924 107.6 59.0 -59.9 -41.0 77.8 115.2 81.1 1064 108 D G H X S+ 0 0 3 -4,-2.3 4,-2.8 -5,-0.4 -2,-0.2 0.948 105.8 47.2 -50.6 -53.4 74.8 112.9 81.1 1065 109 D F H X S+ 0 0 100 -4,-2.1 4,-2.8 1,-0.2 5,-0.4 0.950 111.9 50.2 -53.4 -53.3 72.6 115.9 80.1 1066 110 D V H X S+ 0 0 63 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.918 112.9 45.6 -52.8 -50.2 75.0 116.9 77.3 1067 111 D V H < S+ 0 0 17 -4,-3.0 4,-0.3 1,-0.2 -1,-0.2 0.921 114.5 50.1 -59.7 -46.3 75.1 113.4 75.9 1068 112 D V H >< S+ 0 0 17 -4,-2.8 3,-1.2 -5,-0.3 -2,-0.2 0.895 111.9 42.4 -63.7 -46.3 71.4 112.9 76.1 1069 113 D W H 3< S+ 0 0 170 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.751 107.8 65.1 -75.4 -15.7 70.2 116.1 74.4 1070 114 D G T 3< 0 0 57 -4,-1.2 -1,-0.2 -5,-0.4 -2,-0.2 0.540 360.0 360.0 -79.5 -6.0 72.9 115.5 71.9 1071 115 D V < 0 0 47 -3,-1.2 -3,-0.1 -4,-0.3 -62,-0.1 0.427 360.0 360.0-110.9 360.0 71.2 112.4 70.6