==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 04-FEB-10 3AE1 . 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) . 42433.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 741 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 95 8.7 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 . 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 . 2 0.2 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 . 72 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 391 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.2 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 3 1 1 1 2 1 4 2 3 1 1 1 1 0 0 0 1 0 1 0 2 1 0 1 2 0 RESIDUES PER ALPHA HELIX . 1 3 2 3 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 PARALLEL BRIDGES PER LADDER . 8 5 2 1 1 3 0 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 . 4 1 2 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 80 0, 0.0 438,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 82.3 12.4 35.8 -25.2 2 11 A T + 0 0 154 2,-0.6 0, 0.0 1,-0.1 0, 0.0 0.586 360.0 67.1 63.5 12.6 12.7 38.9 -27.4 3 12 A Q S S+ 0 0 128 1,-0.2 -1,-0.1 2,-0.0 0, 0.0 0.395 97.5 62.3-122.1 -25.4 12.3 36.5 -30.4 4 13 A Y S S- 0 0 11 188,-0.0 -2,-0.6 2,-0.0 2,-0.4 -0.900 84.9-132.4-106.1 124.5 8.8 35.8 -29.3 5 14 A P - 0 0 82 0, 0.0 188,-1.3 0, 0.0 2,-0.5 -0.624 21.7-151.6 -72.2 128.2 6.1 38.5 -29.1 6 15 A V E -a 193 0A 73 -2,-0.4 2,-0.5 186,-0.1 188,-0.2 -0.909 10.8-170.3-107.1 123.6 4.2 38.5 -25.8 7 16 A V E -a 194 0A 67 186,-1.9 188,-2.0 -2,-0.5 2,-0.3 -0.957 11.6-149.2-115.1 120.6 0.6 39.7 -25.6 8 17 A D E -a 195 0A 78 -2,-0.5 2,-0.3 186,-0.2 188,-0.2 -0.709 10.2-164.4 -92.8 137.7 -1.0 40.1 -22.2 9 18 A H E -a 196 0A 45 186,-2.9 188,-2.4 -2,-0.3 2,-0.5 -0.929 7.9-147.9-120.9 145.3 -4.7 39.7 -21.6 10 19 A E E +a 197 0A 119 -2,-0.3 2,-0.3 186,-0.2 188,-0.2 -0.957 29.8 150.8-118.8 121.6 -6.8 40.7 -18.6 11 20 A F - 0 0 19 186,-2.4 188,-0.5 -2,-0.5 25,-0.2 -0.852 49.9-128.1-138.4 171.6 -9.8 38.7 -17.4 12 21 A D S S+ 0 0 21 23,-2.7 188,-1.0 1,-0.3 187,-0.5 0.762 95.6 10.2 -88.4 -32.5 -11.9 37.8 -14.4 13 22 A A E -de 36 200B 0 22,-1.4 24,-2.5 186,-0.2 2,-0.4 -0.998 59.7-155.3-149.8 144.2 -11.7 34.1 -15.0 14 23 A V E -de 37 201B 0 186,-2.4 188,-3.4 -2,-0.3 2,-0.6 -0.991 6.5-166.6-120.9 126.7 -9.8 31.6 -17.2 15 24 A V E -de 38 202B 0 22,-2.7 24,-1.9 -2,-0.4 2,-0.8 -0.961 8.4-156.1-110.2 116.2 -11.1 28.2 -18.1 16 25 A V E +de 39 203B 7 186,-3.5 188,-3.3 -2,-0.6 24,-0.2 -0.834 65.5 39.4 -90.7 111.3 -8.5 25.9 -19.7 17 26 A G - 0 0 10 22,-2.9 9,-0.1 -2,-0.8 188,-0.1 -0.055 55.3-150.6 120.7 136.3 -10.5 23.3 -21.7 18 27 A A + 0 0 2 4,-0.2 29,-0.2 -2,-0.1 187,-0.1 -0.020 60.9 109.6-126.9 29.1 -13.6 23.4 -23.9 19 28 A G S > S- 0 0 12 185,-0.5 4,-1.8 27,-0.1 5,-0.2 0.221 94.4 -64.9 -77.3-153.6 -14.9 19.8 -23.3 20 29 A G H > S+ 0 0 1 2,-0.2 4,-1.5 3,-0.1 5,-0.2 0.956 138.7 39.2 -62.0 -51.6 -18.0 18.9 -21.4 21 30 A A H > S+ 0 0 6 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.974 114.6 52.5 -62.2 -58.1 -16.6 20.2 -18.1 22 31 A G H > S+ 0 0 0 182,-0.4 4,-3.1 1,-0.2 -4,-0.2 0.885 109.8 47.3 -45.5 -56.4 -14.9 23.3 -19.6 23 32 A L H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.5 0.909 110.5 50.0 -55.0 -51.3 -17.9 24.7 -21.4 24 33 A R H X S+ 0 0 10 -4,-1.5 4,-0.9 1,-0.2 -1,-0.2 0.869 117.8 41.9 -59.3 -38.1 -20.3 24.3 -18.5 25 34 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.866 114.2 54.3 -71.5 -39.4 -17.8 26.1 -16.3 26 35 A A H X S+ 0 0 0 -4,-3.1 4,-1.2 -5,-0.3 3,-0.3 0.964 118.0 29.8 -62.3 -59.0 -17.0 28.6 -19.1 27 36 A F H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.704 113.5 65.5 -78.2 -19.9 -20.5 30.0 -19.8 28 37 A G H X S+ 0 0 9 -4,-0.9 4,-0.8 -5,-0.5 -1,-0.2 0.837 102.8 48.3 -65.9 -36.1 -21.6 29.3 -16.2 29 38 A L H <>S+ 0 0 0 -4,-1.5 5,-1.7 -3,-0.3 3,-0.3 0.905 113.3 46.1 -67.1 -45.0 -19.1 32.0 -15.1 30 39 A S H ><5S+ 0 0 11 -4,-1.2 3,-2.0 1,-0.2 -2,-0.2 0.841 105.3 60.0 -68.6 -35.8 -20.4 34.4 -17.8 31 40 A E H 3<5S+ 0 0 100 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.830 103.9 53.1 -56.3 -34.2 -24.0 33.7 -16.9 32 41 A A T 3<5S- 0 0 40 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.245 129.8-101.0 -87.3 10.7 -23.0 35.0 -13.4 33 42 A G T < 5S+ 0 0 51 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.734 73.3 144.0 80.5 26.1 -21.7 38.2 -15.1 34 43 A F < - 0 0 5 -5,-1.7 2,-1.3 -6,-0.1 -1,-0.2 -0.786 57.3-121.5 -97.7 139.1 -17.9 37.4 -15.1 35 44 A N - 0 0 68 -2,-0.4 -23,-2.7 127,-0.1 -22,-1.4 -0.674 49.5-175.6 -75.6 97.1 -15.6 38.5 -17.9 36 45 A T E -d 13 0B 0 -2,-1.3 127,-2.6 -24,-0.2 2,-0.4 -0.766 22.6-160.7-109.6 141.3 -14.4 34.9 -18.8 37 46 A A E -df 14 163B 0 -24,-2.5 -22,-2.7 -2,-0.3 2,-0.5 -0.907 5.6-156.7-112.4 146.1 -11.9 33.5 -21.2 38 47 A C E -df 15 164B 0 125,-2.1 127,-3.2 -2,-0.4 2,-0.5 -0.933 6.8-165.2-126.8 110.5 -11.8 29.9 -22.5 39 48 A V E +df 16 165B 1 -24,-1.9 -22,-2.9 -2,-0.5 2,-0.3 -0.806 18.2 163.7 -97.0 129.5 -8.4 28.6 -23.7 40 49 A T E - f 0 166B 10 125,-2.3 128,-2.8 -2,-0.5 127,-0.8 -0.991 38.6-151.6-152.3 136.3 -8.5 25.4 -25.8 41 50 A K S S+ 0 0 40 -2,-0.3 2,-0.3 126,-0.3 128,-0.1 0.696 89.3 46.1 -81.9 -21.4 -6.2 23.5 -28.1 42 51 A L S S- 0 0 22 126,-0.1 125,-0.6 125,-0.1 126,-0.2 -0.742 101.9 -92.5-108.5 163.1 -9.1 21.9 -30.0 43 52 A F >> - 0 0 6 -2,-0.3 3,-2.5 123,-0.2 4,-0.7 -0.666 49.2-110.1 -69.0 131.8 -12.2 23.5 -31.4 44 53 A P G >4 S+ 0 0 1 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.767 117.3 51.8 -34.5 -48.8 -14.8 23.0 -28.6 45 54 A T G 34 S+ 0 0 0 1,-0.2 5,-0.2 4,-0.1 106,-0.1 0.795 102.4 59.4 -61.9 -32.3 -16.8 20.5 -30.6 46 55 A R G <4 S+ 0 0 7 -3,-2.5 -1,-0.2 631,-0.1 630,-0.1 0.638 78.5 120.0 -75.8 -15.1 -13.8 18.3 -31.3 47 56 A S S X< S- 0 0 10 -3,-1.1 3,-2.1 -4,-0.7 4,-0.3 -0.074 83.2-103.6 -49.7 150.4 -13.1 17.8 -27.6 48 57 A H G > S+ 0 0 50 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.666 109.8 83.9 -56.1 -20.9 -13.1 14.1 -26.5 49 58 A T G > S+ 0 0 19 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.747 79.1 67.4 -55.8 -24.4 -16.6 14.5 -25.0 50 59 A V G < S+ 0 0 3 -3,-2.1 97,-0.6 1,-0.2 -1,-0.3 0.850 89.8 63.5 -62.6 -34.8 -18.1 13.9 -28.4 51 60 A A G < S+ 0 0 10 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.694 77.5 115.7 -63.9 -20.6 -16.8 10.3 -28.4 52 61 A A < + 0 0 24 -3,-0.9 94,-1.3 -4,-0.4 95,-1.0 -0.230 27.7 155.2 -58.8 138.0 -19.1 9.6 -25.4 53 62 A Q + 0 0 11 92,-0.2 92,-0.4 91,-0.2 -1,-0.1 0.533 50.3 73.7-141.8 -24.4 -21.8 7.1 -26.2 54 63 A G S S- 0 0 18 1,-0.2 2,-0.3 90,-0.1 91,-0.1 0.998 91.6-107.3 -63.8 -77.2 -23.0 5.4 -23.0 55 64 A G - 0 0 3 85,-0.1 2,-0.4 88,-0.1 351,-0.3 -0.987 19.3 -82.7 171.0-168.6 -25.1 8.0 -21.2 56 65 A I E -I 139 0C 0 83,-3.6 83,-2.1 -2,-0.3 2,-0.3 -0.984 42.2-128.6-130.2 118.9 -25.5 10.5 -18.4 57 66 A N E +I 138 0C 0 346,-2.5 2,-0.3 -2,-0.4 81,-0.2 -0.509 39.1 147.9 -78.5 127.6 -26.6 9.3 -14.9 58 67 A A - 0 0 0 79,-2.1 2,-1.9 -2,-0.3 3,-0.3 -0.956 48.3-128.7-151.7 138.8 -29.5 10.9 -13.1 59 68 A A + 0 0 12 33,-0.4 9,-0.2 -2,-0.3 7,-0.1 -0.468 55.3 142.2 -82.3 64.7 -32.1 9.5 -10.7 60 69 A L - 0 0 38 -2,-1.9 -1,-0.2 77,-0.1 6,-0.1 0.703 54.9-137.8 -77.5 -22.4 -35.0 11.1 -12.7 61 70 A G + 0 0 28 -3,-0.3 -2,-0.1 75,-0.1 76,-0.1 0.852 53.6 142.5 68.4 38.9 -37.2 8.0 -12.1 62 71 A N S S+ 0 0 14 74,-0.2 52,-0.1 55,-0.1 54,-0.1 0.742 74.7 28.5 -80.2 -26.5 -38.5 7.9 -15.6 63 72 A M S S- 0 0 68 1,-0.5 2,-0.3 73,-0.4 74,-0.1 0.869 136.0 -0.2-103.7 -57.0 -38.6 4.1 -16.0 64 73 A E S S- 0 0 44 72,-0.3 -1,-0.5 0, 0.0 2,-0.2 -0.856 97.0 -77.9-123.0 165.9 -39.1 2.8 -12.4 65 74 A E - 0 0 158 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 -0.452 60.3-174.5 -66.4 134.6 -39.4 4.8 -9.2 66 75 A D - 0 0 27 -2,-0.2 2,-0.4 -7,-0.1 61,-0.1 -0.905 24.5-152.3-135.6 155.4 -36.0 6.0 -8.1 67 76 A N >> - 0 0 44 -2,-0.3 3,-1.4 1,-0.1 4,-1.0 -0.997 20.0-138.1-127.7 136.1 -34.2 7.9 -5.3 68 77 A W H 3> S+ 0 0 35 -2,-0.4 4,-1.6 1,-0.3 -1,-0.1 0.766 103.5 66.2 -63.3 -24.8 -31.0 9.9 -5.8 69 78 A R H 3> S+ 0 0 66 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.756 96.0 55.4 -68.3 -26.6 -29.7 8.4 -2.5 70 79 A W H <> S+ 0 0 29 -3,-1.4 4,-1.9 2,-0.2 56,-0.2 0.865 106.3 50.6 -70.2 -38.4 -29.6 4.9 -4.2 71 80 A H H X S+ 0 0 0 -4,-1.0 4,-1.4 2,-0.2 -2,-0.2 0.826 108.0 55.0 -65.7 -34.0 -27.4 6.4 -6.9 72 81 A F H X S+ 0 0 1 -4,-1.6 4,-2.2 2,-0.2 3,-0.4 0.953 106.7 49.2 -59.9 -52.9 -25.2 7.8 -4.1 73 82 A Y H X S+ 0 0 53 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.878 110.4 50.8 -56.3 -42.6 -24.8 4.3 -2.6 74 83 A D H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.812 110.0 49.6 -68.5 -32.0 -23.8 2.8 -6.0 75 84 A T H X S+ 0 0 3 -4,-1.4 4,-2.2 -3,-0.4 -2,-0.2 0.938 113.3 44.1 -72.8 -49.0 -21.2 5.4 -6.7 76 85 A V H <>S+ 0 0 0 -4,-2.2 5,-1.6 2,-0.2 7,-0.3 0.864 116.5 47.8 -65.1 -37.2 -19.4 5.1 -3.3 77 86 A K H ><5S+ 0 0 31 -4,-2.2 3,-1.8 -5,-0.3 -2,-0.2 0.943 112.1 49.6 -66.0 -47.8 -19.6 1.3 -3.5 78 87 A G H 3<5S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.856 102.6 61.9 -56.1 -38.0 -18.2 1.4 -7.0 79 88 A S T ><5S- 0 0 0 -4,-2.2 319,-2.2 316,-0.2 3,-1.4 0.491 108.5-127.3 -68.1 -4.9 -15.4 3.7 -5.8 80 89 A D T < 5 - 0 0 8 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.785 62.9 -65.5 57.6 31.0 -14.3 0.8 -3.6 81 90 A W T 3 > - 0 0 1 310,-2.2 4,-1.1 -2,-0.4 3,-1.0 -0.618 19.8-154.8 -73.9 114.5 -14.9 11.0 -1.0 85 94 A Q H 3> S+ 0 0 0 509,-2.3 4,-2.7 -2,-0.6 513,-0.3 0.683 85.8 66.8 -72.1 -21.4 -18.5 10.8 0.0 86 95 A D H 3> S+ 0 0 8 508,-0.3 4,-1.3 510,-0.3 -1,-0.3 0.821 108.9 39.3 -65.9 -33.0 -19.0 14.6 0.5 87 96 A A H <> S+ 0 0 0 -3,-1.0 4,-1.7 306,-0.2 -2,-0.2 0.686 113.7 54.1 -89.8 -23.5 -18.5 15.1 -3.2 88 97 A I H X S+ 0 0 0 -4,-1.1 4,-2.5 2,-0.2 5,-0.3 0.889 108.7 49.9 -74.0 -41.6 -20.5 12.0 -4.1 89 98 A H H X S+ 0 0 4 -4,-2.7 4,-1.8 1,-0.2 5,-0.3 0.956 112.2 48.9 -54.0 -52.9 -23.4 13.3 -2.1 90 99 A Y H X S+ 0 0 46 -4,-1.3 4,-1.6 1,-0.2 -2,-0.2 0.873 115.5 42.5 -56.8 -43.8 -23.1 16.7 -3.9 91 100 A M H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.947 112.8 48.6 -73.1 -51.3 -23.0 15.1 -7.4 92 101 A T H < S+ 0 0 0 -4,-2.5 -33,-0.4 1,-0.2 -1,-0.2 0.755 113.0 49.6 -66.7 -26.9 -25.8 12.4 -7.0 93 102 A E H X S+ 0 0 85 -4,-1.8 4,-0.6 -5,-0.3 -1,-0.2 0.919 113.9 45.0 -70.6 -47.1 -28.2 15.0 -5.5 94 103 A Q H X S+ 0 0 34 -4,-1.6 4,-3.2 -5,-0.3 5,-0.3 0.746 91.3 92.6 -67.4 -23.9 -27.5 17.4 -8.3 95 104 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.831 88.7 38.5 -39.9 -61.5 -27.8 14.6 -10.9 96 105 A P H > S+ 0 0 25 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.921 118.4 49.2 -60.5 -46.5 -31.5 15.0 -11.8 97 106 A A H X S+ 0 0 44 -4,-0.6 4,-1.5 1,-0.2 -2,-0.2 0.866 112.9 49.2 -57.3 -39.5 -31.3 18.8 -11.6 98 107 A S H X S+ 0 0 0 -4,-3.2 4,-1.4 2,-0.2 -1,-0.2 0.864 110.5 47.7 -70.3 -40.9 -28.2 18.8 -13.9 99 108 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.904 110.7 51.5 -68.8 -43.0 -29.7 16.5 -16.6 100 109 A V H X S+ 0 0 7 -4,-2.3 4,-2.3 1,-0.2 644,-0.3 0.877 104.8 58.3 -59.7 -38.6 -32.9 18.5 -16.7 101 110 A E H X S+ 0 0 23 -4,-1.5 4,-1.1 643,-0.2 -1,-0.2 0.919 108.8 45.1 -54.5 -45.6 -30.8 21.6 -17.2 102 111 A L H X>S+ 0 0 0 -4,-1.4 5,-2.0 2,-0.2 4,-0.8 0.862 110.5 52.5 -68.1 -40.1 -29.3 19.9 -20.3 103 112 A E H <5S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.866 110.1 49.0 -65.1 -37.4 -32.6 18.8 -21.7 104 113 A N H <5S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.733 103.1 61.5 -74.3 -23.5 -34.0 22.3 -21.4 105 114 A Y H <5S- 0 0 6 -4,-1.1 630,-1.7 -5,-0.2 -1,-0.2 0.735 131.2 -91.8 -69.3 -25.6 -30.9 23.6 -23.1 106 115 A G T <5 + 0 0 0 -4,-0.8 -3,-0.2 -3,-0.4 -2,-0.1 0.475 67.3 159.1 127.3 8.0 -31.9 21.5 -26.2 107 116 A M < - 0 0 0 -5,-2.0 2,-1.9 1,-0.1 -1,-0.2 -0.440 41.1-133.2 -63.5 123.7 -30.2 18.1 -25.8 108 117 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.408 33.5-178.2 -83.4 65.8 -32.2 15.6 -27.9 109 118 A F - 0 0 0 -2,-1.9 32,-0.3 32,-0.1 30,-0.0 -0.206 34.0 -99.3 -56.6 149.2 -32.5 12.8 -25.4 110 119 A S - 0 0 8 30,-2.3 8,-2.1 8,-0.2 2,-0.3 -0.225 46.6-125.1 -62.4 163.4 -34.3 9.6 -26.4 111 120 A R B -K 117 0D 8 6,-0.2 6,-0.2 641,-0.1 2,-0.1 -0.896 12.0-144.3-129.3 148.8 -37.9 9.3 -25.3 112 121 A T - 0 0 12 4,-2.2 640,-0.4 -2,-0.3 3,-0.3 -0.253 43.3 -94.5 -90.7-178.1 -40.2 7.0 -23.4 113 122 A E S S+ 0 0 167 1,-0.2 639,-0.1 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138.0 23.1 -72.4 -25.2 -18.5 31.2 -55.4 780 174 B N T >X S+ 0 0 3 -4,-1.6 4,-2.2 -5,-0.2 3,-0.9 -0.115 72.9 135.9-136.6 40.3 -20.5 32.7 -52.6 781 175 B G T <4 + 0 0 10 -3,-0.7 -2,-0.1 -4,-0.4 -1,-0.1 0.727 69.3 63.8 -60.3 -24.3 -19.1 31.4 -49.3 782 176 B D T 34 S+ 0 0 30 1,-0.2 -1,-0.2 -4,-0.1 -2,-0.1 0.838 120.2 16.5 -70.9 -36.3 -19.3 34.9 -47.8 783 177 B K T <4 S+ 0 0 96 -3,-0.9 2,-0.5 33,-0.1 -2,-0.2 0.523 107.7 86.0-118.1 -12.5 -23.1 35.2 -47.9 784 178 B Y < - 0 0 2 -4,-2.2 33,-0.2 -8,-0.1 34,-0.1 -0.837 63.0-152.0 -97.5 126.9 -24.3 31.7 -48.4 785 179 B L > - 0 0 13 32,-1.4 4,-0.6 -2,-0.5 -1,-0.1 0.769 33.7-141.9 -71.0 -28.8 -24.7 29.6 -45.2 786 180 B G H > - 0 0 0 31,-0.4 4,-2.4 3,-0.1 5,-0.2 0.171 28.2 -71.6 81.3 158.6 -24.0 26.2 -46.9 787 181 B P H > S+ 0 0 1 0, 0.0 4,-3.3 0, 0.0 5,-0.3 0.888 125.3 55.2 -52.9 -53.6 -25.6 22.8 -46.3 788 182 B A H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -2,-0.1 0.921 115.5 37.3 -46.3 -58.6 -24.1 22.0 -42.9 789 183 B V H X S+ 0 0 0 -4,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.879 117.2 52.7 -64.3 -40.7 -25.3 25.3 -41.2 790 184 B L H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.889 105.8 53.2 -63.6 -41.8 -28.7 25.1 -43.1 791 185 B M H X S+ 0 0 5 -4,-3.3 4,-1.8 1,-0.2 -1,-0.2 0.842 108.3 51.0 -62.8 -35.8 -29.4 21.6 -42.0 792 186 B Q H X S+ 0 0 9 -4,-1.4 4,-1.6 -5,-0.3 -1,-0.2 0.818 106.5 53.6 -73.0 -31.9 -28.8 22.6 -38.4 793 187 B A H X S+ 0 0 6 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.885 110.4 48.1 -65.9 -36.9 -31.2 25.5 -38.8 794 188 B Y H X S+ 0 0 35 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.849 104.9 60.3 -69.0 -34.5 -33.7 22.9 -40.1 795 189 B R H < S+ 0 0 14 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.897 110.2 40.4 -55.7 -44.4 -32.9 20.8 -37.0 796 190 B W H < S+ 0 0 8 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.645 108.6 63.3 -84.3 -16.2 -34.1 23.6 -34.7 797 191 B M H < S+ 0 0 4 -4,-1.0 -2,-0.2 1,-0.2 -1,-0.2 0.956 109.9 35.6 -70.1 -51.8 -37.1 24.4 -36.9 798 192 B I S < S+ 0 0 30 -4,-1.9 2,-0.8 -41,-0.1 -1,-0.2 0.286 85.8 116.7 -90.8 11.0 -38.8 21.0 -36.5 799 193 B D > - 0 0 2 1,-0.2 3,-2.1 -4,-0.1 6,-0.1 -0.733 61.6-147.3 -77.1 114.2 -37.8 20.5 -32.9 800 194 B S T 3 S+ 0 0 47 -2,-0.8 -1,-0.2 -46,-0.3 -45,-0.1 0.738 94.1 59.8 -56.9 -27.0 -41.2 20.5 -31.1 801 195 B R T 3 S+ 0 0 3 -53,-0.1 2,-0.4 -695,-0.1 -1,-0.3 0.657 85.8 94.1 -77.3 -17.5 -39.7 22.2 -28.0 802 196 B D < - 0 0 6 -3,-2.1 3,-0.3 1,-0.1 -65,-0.2 -0.643 51.0-173.1 -83.9 128.9 -38.5 25.3 -30.0 803 197 B D S S+ 0 0 61 -67,-2.8 3,-0.3 -2,-0.4 -66,-0.1 0.336 73.4 74.7-100.3 5.0 -41.0 28.2 -30.0 804 198 B F > + 0 0 46 -68,-0.4 4,-1.8 -8,-0.2 5,-0.2 0.033 52.9 124.1-109.2 27.0 -39.0 30.3 -32.6 805 199 B T H > S+ 0 0 44 -3,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.837 76.1 44.9 -56.9 -40.8 -39.9 28.3 -35.8 806 200 B E H > S+ 0 0 73 -3,-0.3 4,-1.6 2,-0.2 3,-0.2 0.934 114.0 46.1 -71.9 -48.8 -41.3 31.3 -37.7 807 201 B E H > S+ 0 0 67 1,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.730 107.4 59.4 -69.7 -23.8 -38.6 33.8 -36.9 808 202 B R H < S+ 0 0 10 -4,-1.8 4,-0.4 2,-0.2 3,-0.4 0.870 106.9 46.8 -68.2 -41.1 -35.9 31.3 -37.7 809 203 B L H >< S+ 0 0 2 -4,-1.1 3,-1.4 -3,-0.2 -2,-0.2 0.847 104.5 63.1 -64.6 -36.5 -37.3 31.0 -41.2 810 204 B A H >< S+ 0 0 26 -4,-1.6 3,-1.3 1,-0.3 -1,-0.2 0.771 91.3 64.9 -62.3 -29.2 -37.4 34.8 -41.3 811 205 B K T 3< S+ 0 0 104 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.754 99.1 54.4 -62.6 -26.2 -33.6 35.0 -41.0 812 206 B L T < S+ 0 0 4 -3,-1.4 2,-2.3 -4,-0.4 6,-0.5 0.422 74.4 115.9 -89.6 -0.1 -33.3 33.3 -44.4 813 207 B Q < + 0 0 26 -3,-1.3 182,-0.2 -4,-0.2 184,-0.2 -0.452 56.9 80.6 -75.8 74.7 -35.5 35.9 -46.2 814 208 B D S >S- 0 0 45 -2,-2.3 5,-0.6 182,-0.1 4,-0.5 -0.951 89.6 -99.3-164.6 168.0 -32.9 37.2 -48.5 815 209 B P T 5S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.876 110.8 33.2 -65.0 -35.5 -31.3 36.2 -51.9 816 210 B F T >5S+ 0 0 25 3,-0.1 4,-0.8 1,-0.1 -31,-0.2 0.886 97.5 68.6 -94.9 -45.0 -28.1 34.7 -50.5 817 211 B S T 45S- 0 0 23 -33,-0.2 -32,-1.4 1,-0.2 -31,-0.4 0.839 126.8 -6.1 -53.7 -46.8 -28.5 32.9 -47.1 818 212 B L T >45S+ 0 0 0 -6,-0.5 3,-1.8 -4,-0.5 -1,-0.2 0.741 122.9 69.8-111.5 -45.4 -30.6 30.0 -48.3 819 213 B Y T 34 + 0 0 10 1,-0.1 4,-1.3 63,-0.0 63,-0.1 0.628 59.0 123.9 70.5 17.9 -26.5 17.4 -54.4 826 220 B N H > S+ 0 0 8 2,-0.2 4,-1.2 3,-0.1 -52,-0.1 0.774 72.0 60.0 -71.1 -27.7 -22.7 17.3 -53.8 827 221 B C H >> S+ 0 0 8 2,-0.2 4,-1.2 1,-0.2 3,-0.7 0.977 108.2 39.4 -62.4 -59.9 -23.4 17.8 -50.1 828 222 B T H 34 S+ 0 0 16 1,-0.2 3,-0.2 2,-0.2 -1,-0.2 0.849 114.7 56.4 -58.9 -37.8 -25.5 14.7 -49.6 829 223 B G H 3< S+ 0 0 49 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.776 113.1 38.1 -65.2 -29.2 -23.2 12.7 -51.9 830 224 B T H << S+ 0 0 12 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.596 77.1 127.0-103.3 -13.6 -20.1 13.4 -49.9 831 225 B C >< - 0 0 24 -4,-1.2 3,-1.6 4,-0.2 -143,-0.1 -0.257 47.7-154.1 -56.3 117.5 -21.2 13.3 -46.2 832 226 B P T 3 S+ 0 0 23 0, 0.0 -1,-0.2 0, 0.0 -144,-0.1 0.606 93.9 55.4 -69.1 -10.6 -18.9 10.9 -44.3 833 227 B K T 3 S- 0 0 32 2,-0.1 -2,-0.1 -145,-0.0 -70,-0.0 0.359 112.8-115.4-104.0 2.0 -21.8 10.3 -41.8 834 228 B G < + 0 0 69 -3,-1.6 -3,-0.0 1,-0.2 -6,-0.0 0.544 64.8 148.0 77.9 9.3 -24.4 9.3 -44.4 835 229 B L - 0 0 16 1,-0.1 -4,-0.2 -72,-0.0 -1,-0.2 -0.234 47.5-132.9 -76.6 165.3 -26.6 12.3 -43.7 836 230 B N > + 0 0 38 -76,-0.5 4,-1.2 1,-0.1 3,-0.1 -0.677 32.4 163.3-123.2 75.7 -28.8 14.1 -46.2 837 231 B P H > S+ 0 0 4 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.843 75.0 55.6 -64.9 -36.4 -28.3 17.9 -46.0 838 232 B G H > S+ 0 0 2 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 102.5 54.7 -64.1 -44.0 -29.9 18.7 -49.4 839 233 B K H > S+ 0 0 77 127,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.882 109.7 49.3 -54.6 -41.1 -33.2 17.0 -48.6 840 234 B A H X S+ 0 0 4 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.896 108.4 52.5 -65.9 -42.3 -33.3 19.1 -45.5 841 235 B I H X S+ 0 0 2 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.931 110.0 48.2 -58.8 -47.1 -32.6 22.3 -47.5 842 236 B A H X S+ 0 0 6 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.789 110.2 53.0 -62.8 -29.2 -35.5 21.4 -49.9 843 237 B E H X S+ 0 0 40 -4,-1.3 4,-1.2 -5,-0.2 -1,-0.2 0.790 108.0 50.5 -77.3 -30.3 -37.7 20.8 -46.8 844 238 B I H X S+ 0 0 0 -4,-1.9 4,-3.0 -3,-0.2 3,-0.3 0.932 105.9 55.5 -66.2 -49.2 -36.7 24.3 -45.6 845 239 B K H X S+ 0 0 6 -4,-2.5 4,-0.9 1,-0.3 -2,-0.2 0.854 106.7 51.1 -54.3 -39.4 -37.6 25.8 -48.9 846 240 B K H X S+ 0 0 66 -4,-1.3 4,-0.6 2,-0.2 -1,-0.3 0.870 111.4 46.6 -65.2 -40.5 -41.1 24.3 -48.7 847 241 B M H >X S+ 0 0 47 -4,-1.2 4,-2.3 -3,-0.3 3,-0.9 0.894 108.3 56.8 -67.7 -41.0 -41.6 25.7 -45.2 848 242 B M H 3< S+ 0 0 1 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.739 111.7 43.5 -58.9 -26.5 -40.3 29.1 -46.4 849 243 B A H 3< S+ 0 0 37 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.556 120.9 37.0 -97.6 -11.5 -43.1 29.1 -49.0 850 244 B T H << S+ 0 0 106 -3,-0.9 2,-0.2 -4,-0.6 -2,-0.2 0.617 81.4 107.8-120.8 -20.8 -46.0 27.9 -46.9 851 245 B Y < - 0 0 33 -4,-2.3 2,-0.2 -5,-0.1 -4,-0.0 -0.455 61.2-138.7 -66.8 130.7 -45.6 29.4 -43.4 852 246 B K 0 0 180 -2,-0.2 -1,-0.1 0, 0.0 -2,-0.1 -0.626 360.0 360.0 -97.7 154.3 -48.2 32.1 -42.8 853 247 B E 0 0 180 -2,-0.2 -2,-0.0 -47,-0.0 0, 0.0 -0.535 360.0 360.0 62.0 360.0 -47.8 35.6 -41.1 854 !* 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 74 0, 0.0 2,-0.1 0, 0.0 -693,-0.0 0.000 360.0 360.0 360.0 134.0 -17.7 38.9 -30.4 856 7 C T > - 0 0 72 1,-0.1 4,-1.7 -695,-0.0 5,-0.1 -0.413 360.0-108.4 -85.5 165.2 -20.8 38.5 -32.5 857 8 C A H > S+ 0 0 13 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.856 120.7 49.5 -59.3 -39.4 -21.2 36.2 -35.6 858 9 C K H > S+ 0 0 179 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.863 109.2 51.7 -69.0 -38.9 -21.1 39.2 -38.0 859 10 C E H > S+ 0 0 96 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.819 108.0 53.3 -66.5 -33.2 -18.0 40.6 -36.3 860 11 C E H X S+ 0 0 53 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.913 107.7 48.7 -67.9 -45.9 -16.2 37.3 -36.7 861 12 C M H X S+ 0 0 40 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.830 108.1 55.7 -63.7 -34.7 -16.9 37.1 -40.5 862 13 C E H X S+ 0 0 117 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.870 111.5 43.6 -64.4 -38.1 -15.7 40.6 -40.9 863 14 C R H X S+ 0 0 163 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.788 107.4 60.3 -77.7 -31.3 -12.4 39.6 -39.2 864 15 C F H X S+ 0 0 11 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.916 110.2 40.7 -60.2 -46.6 -12.2 36.4 -41.2 865 16 C W H X S+ 0 0 67 -4,-1.7 4,-2.1 1,-0.2 5,-0.3 0.830 114.0 52.2 -74.6 -34.2 -12.1 38.2 -44.5 866 17 C N H X S+ 0 0 100 -4,-1.3 4,-0.6 -5,-0.2 -1,-0.2 0.786 111.5 48.6 -70.2 -29.2 -9.8 41.0 -43.3 867 18 C K H < S+ 0 0 74 -4,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.893 118.8 35.9 -75.5 -43.2 -7.3 38.4 -42.0 868 19 C N H >< S+ 0 0 3 -4,-1.7 3,-1.5 2,-0.2 5,-0.4 0.889 114.2 51.1 -84.6 -43.1 -7.2 36.3 -45.2 869 20 C L H 3< S+ 0 0 122 -4,-2.1 -1,-0.2 1,-0.3 -3,-0.2 0.839 112.4 49.6 -62.8 -35.2 -7.5 38.9 -48.0 870 21 C G T 3< S+ 0 0 71 -4,-0.6 -1,-0.3 -5,-0.3 2,-0.2 0.195 107.8 76.0 -87.4 15.4 -4.6 40.9 -46.4 871 22 C S S < S- 0 0 46 -3,-1.5 -3,-0.1 2,-0.1 -4,-0.0 -0.609 83.5-120.5-117.7 178.2 -2.5 37.7 -46.2 872 23 C N + 0 0 120 -2,-0.2 -3,-0.1 -245,-0.1 -4,-0.1 0.057 63.2 135.2-106.9 21.7 -0.5 35.4 -48.5 873 24 C R - 0 0 37 -5,-0.4 2,-0.3 1,-0.1 -2,-0.1 -0.546 49.8-134.3 -71.2 131.6 -2.6 32.3 -47.8 874 25 C P - 0 0 27 0, 0.0 -161,-2.3 0, 0.0 2,-0.3 -0.671 16.2-114.3 -89.3 143.8 -3.5 30.4 -51.0 875 26 C L B -E 712 0O 66 -2,-0.3 -163,-0.2 -163,-0.2 3,-0.1 -0.573 32.6-115.5 -72.7 134.1 -6.9 29.0 -51.8 876 27 C S - 0 0 0 -165,-2.5 -166,-1.7 -2,-0.3 -165,-0.1 -0.482 41.5 -96.2 -66.4 138.5 -7.2 25.2 -51.9 877 28 C P + 0 0 27 0, 0.0 -1,-0.1 0, 0.0 -166,-0.1 -0.233 47.1 170.9 -58.3 147.5 -8.1 23.9 -55.4 878 29 C H S >> S+ 0 0 33 -169,-0.2 4,-2.3 -168,-0.1 3,-0.5 0.643 70.9 21.5-123.7 -79.9 -11.8 23.2 -56.1 879 30 C I T 34 S+ 0 0 72 1,-0.2 5,-0.1 2,-0.2 0, 0.0 0.907 119.8 63.3 -61.9 -41.9 -13.0 22.4 -59.6 880 31 C T T 34 S+ 0 0 119 1,-0.2 -1,-0.2 3,-0.0 0, 0.0 0.801 119.3 21.0 -49.6 -38.3 -9.4 21.4 -60.5 881 32 C I T <4 S+ 0 0 29 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.685 92.2 111.6-110.7 -24.6 -9.4 18.5 -58.1 882 33 C Y S < S- 0 0 18 -4,-2.3 2,-0.4 1,-0.1 -196,-0.2 -0.327 71.2-114.1 -68.8 133.2 -13.0 17.6 -57.3 883 34 C R - 0 0 188 -198,-1.8 2,-0.2 -2,-0.1 -1,-0.1 -0.504 31.4-130.7 -69.0 117.2 -14.2 14.2 -58.5 884 35 C W - 0 0 133 -2,-0.4 2,-0.3 -5,-0.1 -1,-0.1 -0.498 26.6-173.1 -74.8 131.9 -16.9 14.7 -61.2 885 36 C S > - 0 0 49 -2,-0.2 4,-3.2 1,-0.1 5,-0.2 -0.805 35.5-110.2-120.2 163.2 -20.2 12.7 -60.8 886 37 C L H > S+ 0 0 63 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.930 117.6 47.6 -58.0 -51.8 -23.2 12.2 -63.1 887 38 C P H > S+ 0 0 22 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.861 116.6 46.7 -59.2 -34.7 -25.7 14.2 -60.8 888 39 C M H >> S+ 0 0 10 2,-0.2 4,-1.4 1,-0.2 3,-1.0 0.940 112.2 47.5 -69.9 -51.4 -23.0 17.0 -60.6 889 40 C A H 3X S+ 0 0 37 -4,-3.2 4,-1.5 1,-0.3 -1,-0.2 0.869 109.7 55.6 -58.0 -37.9 -22.3 17.0 -64.4 890 41 C M H 3X S+ 0 0 6 -4,-2.7 4,-1.0 -5,-0.2 -1,-0.3 0.702 101.7 58.3 -69.6 -21.8 -26.0 17.1 -65.1 891 42 C S H XX S+ 0 0 20 -3,-1.0 4,-1.5 -4,-0.6 3,-0.5 0.946 105.0 46.5 -73.8 -49.6 -26.4 20.2 -63.0 892 43 C I H 3X S+ 0 0 93 -4,-1.4 4,-2.9 1,-0.2 -2,-0.2 0.879 109.2 57.5 -59.0 -39.0 -24.0 22.4 -64.9 893 44 C C H 3X S+ 0 0 63 -4,-1.5 4,-3.1 1,-0.2 -1,-0.2 0.830 102.0 54.8 -60.0 -35.7 -25.6 21.2 -68.1 894 45 C H H < S+ 0 0 0 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90 C A H X S+ 0 0 55 -4,-1.2 4,-0.6 2,-0.2 -1,-0.2 0.892 112.4 45.2 -64.8 -41.4 -29.6 21.7 -87.5 940 91 C K H X S+ 0 0 28 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.829 113.8 49.6 -71.2 -35.2 -33.0 20.6 -86.0 941 92 C F H X S+ 0 0 60 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.895 109.7 50.6 -69.3 -42.7 -31.3 18.1 -83.7 942 93 C G H < S+ 0 0 42 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.588 113.9 45.9 -73.3 -13.0 -28.8 20.7 -82.4 943 94 C I H X S+ 0 0 120 -4,-0.6 4,-0.7 -3,-0.2 -2,-0.2 0.793 118.3 40.1 -93.0 -39.4 -31.6 23.1 -81.7 944 95 C V H X S+ 0 0 14 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.803 102.0 72.6 -79.8 -31.1 -33.9 20.6 -80.0 945 96 C F H X S+ 0 0 86 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.890 102.6 38.6 -53.9 -49.6 -31.2 18.8 -78.0 946 97 C P H > S+ 0 0 29 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.835 117.4 51.9 -72.3 -29.7 -30.5 21.6 -75.5 947 98 C L H X S+ 0 0 57 -4,-0.7 4,-1.6 2,-0.2 -2,-0.2 0.873 111.7 45.2 -71.6 -39.2 -34.3 22.4 -75.3 948 99 C M H X S+ 0 0 23 -4,-3.0 4,-2.3 2,-0.2 5,-0.2 0.853 111.6 51.9 -74.9 -36.6 -35.3 18.8 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2,-0.2 -1,-0.2 0.954 108.8 51.1 -65.4 -50.1 -33.6 12.2 -68.2 979 130 C L H X S+ 0 0 66 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.892 112.8 45.3 -53.8 -46.5 -30.7 11.3 -70.5 980 131 C I H X S+ 0 0 100 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.897 114.0 48.8 -65.4 -43.5 -32.7 8.5 -72.2 981 132 C L H X S+ 0 0 68 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.826 109.8 53.8 -64.6 -33.7 -35.8 10.8 -72.6 982 133 C T H X S+ 0 0 2 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.958 109.7 45.3 -66.0 -52.6 -33.6 13.6 -74.0 983 134 C V H X S+ 0 0 75 -4,-2.1 4,-2.4 1,-0.2 5,-0.3 0.936 116.3 45.8 -55.2 -51.8 -32.1 11.4 -76.8 984 135 C L H X S+ 0 0 117 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.893 115.9 43.6 -62.3 -45.8 -35.4 9.9 -77.8 985 136 C S H X S+ 0 0 23 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.722 114.0 52.6 -74.7 -22.1 -37.4 13.1 -77.8 986 137 C S H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.883 115.7 38.5 -77.3 -42.2 -34.6 14.9 -79.6 987 138 C V H X S+ 0 0 67 -4,-2.4 4,-0.7 -5,-0.2 -2,-0.2 0.886 117.0 53.8 -70.5 -41.6 -34.4 12.3 -82.4 988 139 C G H < S+ 0 0 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4,-1.8 2,-0.2 -1,-0.2 0.895 115.3 47.8 -82.2 -44.7 -37.3 36.2 -51.3 999 40 D S H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.810 110.0 53.5 -68.3 -32.5 -39.7 33.3 -50.7 1000 41 D L H X S+ 0 0 117 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.884 108.7 49.9 -66.1 -40.3 -42.3 34.9 -52.9 1001 42 D H H X S+ 0 0 65 -4,-0.8 4,-1.9 -5,-0.2 -2,-0.2 0.881 109.5 51.8 -64.1 -40.1 -39.8 35.2 -55.7 1002 43 D W H X S+ 0 0 21 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.939 111.1 45.6 -62.5 -50.9 -38.8 31.6 -55.4 1003 44 D T H X S+ 0 0 42 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.894 109.5 56.5 -59.7 -42.9 -42.5 30.4 -55.6 1004 45 D G H X S+ 0 0 20 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.898 104.2 53.8 -53.7 -45.9 -43.0 32.7 -58.6 1005 46 D E H X S+ 0 0 20 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.916 112.0 43.0 -53.1 -50.4 -40.1 31.0 -60.4 1006 47 D R H X S+ 0 0 64 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.801 110.4 57.5 -71.6 -31.2 -41.6 27.5 -59.9 1007 48 D V H X S+ 0 0 86 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.957 109.1 43.5 -63.3 -51.8 -45.1 28.8 -60.8 1008 49 D V H X S+ 0 0 15 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.791 109.9 59.8 -65.6 -27.0 -44.0 30.1 -64.3 1009 50 D S H X S+ 0 0 26 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.946 108.6 41.0 -64.1 -49.4 -42.0 26.8 -64.7 1010 51 D V H < S+ 0 0 85 -4,-2.0 4,-0.4 2,-0.2 -1,-0.2 0.726 116.1 53.4 -70.8 -21.4 -45.1 24.6 -64.5 1011 52 D L H X S+ 0 0 83 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.874 110.6 44.7 -75.6 -42.7 -46.9 27.2 -66.6 1012 53 D L H X S+ 0 0 24 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.833 110.7 53.8 -70.7 -35.3 -44.2 27.1 -69.3 1013 54 D L H < S+ 0 0 67 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.721 110.1 50.7 -68.0 -22.8 -44.2 23.2 -69.1 1014 55 D G H > S+ 0 0 37 -4,-0.4 4,-1.2 -5,-0.2 -2,-0.2 0.834 107.1 52.6 -78.8 -35.7 -48.0 23.6 -69.6 1015 56 D L H X S+ 0 0 19 -4,-1.5 4,-2.8 1,-0.2 5,-0.2 0.808 95.7 65.5 -76.0 -33.7 -47.6 25.9 -72.7 1016 57 D L H X S+ 0 0 65 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.901 111.9 33.6 -59.7 -47.2 -45.2 23.8 -74.8 1017 58 D P H > S+ 0 0 68 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.827 118.5 55.5 -74.9 -29.9 -47.7 20.9 -75.4 1018 59 D A H X S+ 0 0 32 -4,-1.2 4,-1.6 1,-0.2 -2,-0.2 0.830 105.8 51.0 -68.9 -34.3 -50.7 23.4 -75.4 1019 60 D A H < S+ 0 0 9 -4,-2.8 -1,-0.2 2,-0.2 -3,-0.1 0.824 110.5 49.1 -72.5 -34.2 -49.1 25.4 -78.2 1020 61 D Y H < S+ 0 0 159 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.936 116.4 41.1 -67.5 -48.7 -48.6 22.4 -80.4 1021 62 D L H < S+ 0 0 137 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.758 131.4 25.8 -73.9 -27.4 -52.1 21.1 -79.9 1022 63 D N S < S- 0 0 95 -4,-1.6 2,-0.7 -5,-0.2 -1,-0.3 -0.614 73.9-175.9-138.7 77.6 -53.7 24.5 -80.3 1023 64 D P + 0 0 82 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 -0.658 31.8 126.7 -81.3 111.1 -51.5 26.9 -82.3 1024 65 D C S > S- 0 0 46 -2,-0.7 4,-0.6 1,-0.1 62,-0.2 -0.830 71.0 -85.2-150.4-176.1 -53.1 30.4 -82.3 1025 66 D S H >> S+ 0 0 79 -2,-0.2 4,-1.1 1,-0.2 3,-0.5 0.882 121.1 49.2 -66.8 -43.0 -52.8 34.1 -81.6 1026 67 D A H 3> S+ 0 0 66 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.782 108.5 53.3 -71.1 -29.4 -53.5 33.9 -77.8 1027 68 D M H 3> S+ 0 0 34 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.628 101.8 62.4 -79.6 -15.7 -51.0 31.1 -77.3 1028 69 D D H S- 0 0 48 -2,-0.4 4,-1.0 3,-0.1 5,-0.1 -0.413 76.5 -97.6 123.9 162.7 -19.0 43.8 -56.6 1054 95 D D H > S+ 0 0 161 2,-0.2 4,-1.4 -2,-0.1 5,-0.2 0.963 117.8 37.1 -76.5 -58.8 -21.2 46.8 -55.8 1055 96 D A H > S+ 0 0 88 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.820 120.4 48.2 -66.4 -34.4 -21.1 48.7 -59.1 1056 97 D L H > S+ 0 0 113 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.921 105.8 54.1 -74.3 -47.6 -21.1 45.6 -61.3 1057 98 D Q H X S+ 0 0 38 -4,-1.0 4,-1.5 1,-0.2 -2,-0.2 0.880 113.4 44.0 -55.6 -43.5 -24.0 43.7 -59.6 1058 99 D K H X S+ 0 0 169 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.893 114.2 51.0 -66.5 -41.8 -26.3 46.7 -60.1 1059 100 D A H X S+ 0 0 56 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.899 109.0 47.9 -66.5 -46.7 -25.1 47.3 -63.7 1060 101 D A H X S+ 0 0 32 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.905 110.8 53.0 -61.1 -44.4 -25.6 43.7 -64.9 1061 102 D K H X S+ 0 0 79 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.884 111.0 46.3 -56.4 -43.0 -29.1 43.7 -63.4 1062 103 D A H X S+ 0 0 62 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.846 112.7 51.4 -67.8 -35.9 -29.9 46.9 -65.3 1063 104 D G H X S+ 0 0 43 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.902 111.6 46.0 -65.6 -44.0 -28.3 45.3 -68.5 1064 105 D L H X S+ 0 0 20 -4,-3.0 4,-2.6 2,-0.2 5,-0.3 0.862 108.2 56.8 -67.2 -38.3 -30.4 42.2 -68.1 1065 106 D L H X S+ 0 0 107 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.890 111.4 43.5 -60.4 -41.5 -33.6 44.2 -67.5 1066 107 D A H X S+ 0 0 47 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.946 114.1 48.9 -67.2 -51.1 -33.1 46.1 -70.8 1067 108 D L H X S+ 0 0 83 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.863 114.4 44.6 -59.8 -41.6 -32.2 43.0 -72.8 1068 109 D S H X S+ 0 0 19 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.836 112.2 51.4 -75.0 -34.3 -35.2 41.0 -71.6 1069 110 D A H X S+ 0 0 55 -4,-1.5 4,-2.1 -5,-0.3 -2,-0.2 0.888 111.2 49.2 -66.1 -40.0 -37.6 43.9 -72.0 1070 111 D F H X S+ 0 0 122 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.861 109.9 52.6 -63.1 -38.1 -36.3 44.2 -75.6 1071 112 D T H X S+ 0 0 2 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.898 110.4 46.0 -66.3 -42.9 -36.8 40.4 -76.0 1072 113 D F H X S+ 0 0 85 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.865 113.8 49.3 -67.9 -36.9 -40.4 40.6 -74.8 1073 114 D A H X S+ 0 0 49 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.861 109.8 52.2 -67.8 -37.4 -41.1 43.6 -77.1 1074 115 D G H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.857 110.9 46.2 -67.1 -38.4 -39.5 41.8 -80.1 1075 116 D L H X S+ 0 0 3 -4,-1.7 4,-2.0 2,-0.2 10,-0.2 0.870 111.7 51.0 -71.9 -39.3 -41.6 38.7 -79.6 1076 117 D C H X S+ 0 0 29 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.868 111.0 48.7 -66.3 -38.2 -44.8 40.8 -79.2 1077 118 D Y H X S+ 0 0 114 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.889 110.2 52.5 -64.3 -41.6 -44.0 42.7 -82.4 1078 119 D F H X S+ 0 0 9 -4,-1.7 4,-0.9 1,-0.2 6,-0.8 0.854 111.5 45.9 -63.3 -37.9 -43.3 39.4 -84.2 1079 120 D N H < S+ 0 0 16 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.835 120.1 39.8 -71.8 -34.4 -46.8 38.1 -83.1 1080 121 D Y H < S+ 0 0 173 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.2 0.856 129.0 25.8 -85.3 -38.9 -48.5 41.3 -84.1 1081 122 D H H < S+ 0 0 116 -4,-3.3 2,-0.2 -5,-0.1 -3,-0.2 0.308 122.9 33.9-113.3 6.1 -46.8 42.2 -87.3 1082 123 D D S < S- 0 0 47 -4,-0.9 -164,-0.0 -5,-0.3 3,-0.0 -0.722 104.4 -60.9-144.6-164.8 -45.5 38.8 -88.6 1083 124 D V S S- 0 0 47 -2,-0.2 4,-0.4 1,-0.1 -4,-0.1 0.737 73.9-120.1 -59.4 -29.2 -46.3 35.0 -88.7 1084 125 D G >> - 0 0 1 -6,-0.8 4,-2.4 3,-0.1 3,-0.6 0.443 25.8 -89.6 86.6 131.9 -46.4 34.6 -84.9 1085 126 D I H 3> S+ 0 0 16 -10,-0.2 4,-2.3 1,-0.2 5,-0.2 0.747 122.1 55.0 -44.9 -44.0 -44.0 32.2 -83.1 1086 127 D C H 3> S+ 0 0 18 -62,-0.2 4,-1.8 1,-0.2 3,-0.3 0.958 116.1 36.8 -55.0 -57.3 -46.3 29.1 -83.2 1087 128 D K H <> S+ 0 0 133 -3,-0.6 4,-2.4 -4,-0.4 -1,-0.2 0.819 113.0 60.6 -64.3 -34.0 -46.7 29.3 -87.0 1088 129 D A H X S+ 0 0 3 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.855 106.4 45.8 -62.2 -38.0 -43.0 30.4 -87.3 1089 130 D V H X S+ 0 0 87 -4,-2.3 4,-1.9 -3,-0.3 -2,-0.2 0.900 111.7 52.9 -67.8 -42.9 -41.9 27.1 -85.7 1090 131 D A H X S+ 0 0 48 -4,-1.8 4,-1.6 -5,-0.2 -2,-0.2 0.851 111.7 45.1 -60.5 -39.4 -44.3 25.2 -88.0 1091 132 D M H < S+ 0 0 56 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.927 113.2 49.3 -70.4 -47.8 -42.8 26.9 -91.1 1092 133 D L H >< S+ 0 0 75 -4,-2.0 3,-0.5 -5,-0.2 -2,-0.2 0.801 111.3 52.3 -60.4 -31.3 -39.2 26.3 -89.9 1093 134 D W H 3< S+ 0 0 39 -4,-1.9 2,-1.2 1,-0.2 -101,-0.2 0.932 102.5 51.7 -79.7 -49.4 -39.9 22.7 -89.1 1094 135 D K T 3< 0 0 183 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.1 -0.192 360.0 360.0 -81.2 46.3 -41.4 21.3 -92.4 1095 136 D L < 0 0 37 -2,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.636 360.0 360.0-122.3 360.0 -38.5 22.8 -94.3