==== 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 3AE9 . 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) . 43320.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 724 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 3.8 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 . 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 . 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 . 82 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 371 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.3 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 3 3 3 0 3 2 1 4 1 3 1 1 1 0 0 1 0 0 0 1 2 1 2 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 1 3 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 8 5 2 1 2 1 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 . 6 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 10 A S 0 0 69 0, 0.0 2,-0.0 0, 0.0 438,-0.0 0.000 360.0 360.0 360.0 83.9 13.3 -35.9 25.2 2 11 A T + 0 0 162 2,-0.3 0, 0.0 1,-0.2 0, 0.0 0.185 360.0 75.1 65.2 -17.7 13.1 -38.7 27.8 3 12 A Q S S+ 0 0 122 1,-0.1 -1,-0.2 2,-0.0 0, 0.0 0.886 86.3 58.8 -86.3 -46.0 12.0 -36.0 30.3 4 13 A Y S S- 0 0 19 188,-0.0 2,-0.5 1,-0.0 -2,-0.3 -0.709 79.0-128.0 -96.6 136.3 8.4 -35.4 29.2 5 14 A P - 0 0 75 0, 0.0 188,-1.6 0, 0.0 2,-0.6 -0.719 20.2-149.7 -81.9 121.5 5.6 -38.1 29.0 6 15 A V E -a 193 0A 79 -2,-0.5 2,-0.6 186,-0.1 188,-0.2 -0.834 12.4-171.9 -94.9 116.4 3.9 -38.2 25.6 7 16 A V E -a 194 0A 62 186,-1.8 188,-1.1 -2,-0.6 2,-0.4 -0.922 10.9-152.0-112.6 108.5 0.2 -39.3 25.8 8 17 A D E -a 195 0A 79 -2,-0.6 2,-0.3 186,-0.2 188,-0.2 -0.665 10.9-169.6 -85.1 127.1 -1.4 -39.9 22.4 9 18 A H E -a 196 0A 47 186,-2.5 188,-1.8 -2,-0.4 2,-0.4 -0.876 8.5-149.2-112.4 149.6 -5.1 -39.4 22.0 10 19 A E E +a 197 0A 110 -2,-0.3 2,-0.2 186,-0.2 188,-0.2 -0.977 27.4 149.9-125.7 125.4 -7.2 -40.4 19.0 11 20 A F E -a 198 0A 24 186,-2.3 188,-0.5 -2,-0.4 25,-0.2 -0.832 48.9-123.1-142.1 176.3 -10.3 -38.6 17.8 12 21 A D E S+ 0 0 21 23,-2.4 188,-1.0 1,-0.3 187,-0.4 0.786 95.5 8.4 -92.6 -36.5 -12.5 -37.7 14.8 13 22 A A E -ab 200 36A 1 22,-1.5 24,-2.4 186,-0.2 2,-0.5 -0.971 61.7-156.4-151.8 133.4 -12.4 -33.9 15.2 14 23 A V E -ab 201 37A 0 186,-2.1 188,-3.5 -2,-0.3 2,-0.7 -0.943 2.9-163.4-114.3 126.4 -10.5 -31.5 17.4 15 24 A V E -ab 202 38A 0 22,-2.1 24,-2.0 -2,-0.5 2,-0.9 -0.905 7.4-158.4-110.3 103.6 -11.8 -28.0 18.3 16 25 A V E +ab 203 39A 5 186,-3.1 188,-3.2 -2,-0.7 24,-0.2 -0.734 67.6 37.3 -83.6 107.1 -9.0 -25.8 19.7 17 26 A G - 0 0 10 22,-3.3 23,-0.2 -2,-0.9 188,-0.1 0.106 60.5-149.1 117.6 126.8 -10.8 -23.0 21.6 18 27 A A + 0 0 3 4,-0.1 29,-0.3 20,-0.1 187,-0.1 -0.287 57.0 114.1-120.8 46.5 -14.0 -23.1 23.7 19 28 A G S > S- 0 0 16 185,-0.5 4,-1.2 27,-0.1 5,-0.1 0.305 90.6 -64.7 -84.5-142.4 -15.4 -19.6 23.2 20 29 A G H > S+ 0 0 2 2,-0.2 4,-1.5 3,-0.1 5,-0.1 0.920 139.3 38.2 -75.1 -48.1 -18.7 -18.8 21.5 21 30 A A H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.883 115.3 54.9 -68.2 -41.9 -17.5 -20.1 18.1 22 31 A G H > S+ 0 0 0 182,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.867 108.3 47.6 -61.5 -41.6 -15.6 -23.0 19.6 23 32 A L H X S+ 0 0 0 -4,-1.2 4,-2.8 2,-0.2 5,-0.5 0.907 108.9 52.3 -67.5 -45.2 -18.6 -24.4 21.5 24 33 A R H X S+ 0 0 8 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.856 115.6 42.5 -60.8 -37.3 -21.0 -24.2 18.5 25 34 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 3,-0.2 -1,-0.2 0.887 114.6 52.2 -71.9 -41.9 -18.5 -26.2 16.5 26 35 A A H X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.946 118.4 31.7 -62.3 -55.3 -17.7 -28.6 19.3 27 36 A F H X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.777 114.8 61.1 -77.7 -27.5 -21.3 -29.7 20.2 28 37 A G H X S+ 0 0 8 -4,-1.0 4,-1.1 -5,-0.5 -1,-0.2 0.813 103.7 50.6 -65.9 -33.5 -22.5 -29.3 16.6 29 38 A L H X>S+ 0 0 0 -4,-1.5 5,-2.1 2,-0.2 4,-1.3 0.885 112.4 45.0 -69.5 -42.6 -19.9 -32.0 15.5 30 39 A S H <5S+ 0 0 10 -4,-1.2 -2,-0.2 3,-0.3 131,-0.2 0.685 107.2 60.7 -74.5 -20.3 -21.1 -34.4 18.3 31 40 A E H <5S+ 0 0 86 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.833 106.9 45.2 -70.4 -35.9 -24.7 -33.5 17.3 32 41 A A H <5S- 0 0 59 -4,-1.1 -2,-0.2 -5,-0.1 -1,-0.2 0.773 131.9 -97.7 -75.2 -30.0 -23.8 -34.9 13.8 33 42 A G T <5S+ 0 0 45 -4,-1.3 2,-0.3 1,-0.2 -3,-0.3 0.684 70.7 146.1 118.2 32.9 -22.2 -37.9 15.5 34 43 A F < - 0 0 5 -5,-2.1 2,-1.6 392,-0.1 -1,-0.2 -0.762 57.1-117.5-100.7 143.3 -18.5 -37.2 15.6 35 44 A N - 0 0 69 -2,-0.3 -23,-2.4 127,-0.1 -22,-1.5 -0.621 50.0-171.4 -73.2 89.3 -16.0 -38.2 18.3 36 45 A T E -b 13 0A 0 -2,-1.6 127,-2.0 -24,-0.2 2,-0.5 -0.757 19.9-166.3-101.9 128.7 -15.1 -34.6 19.2 37 46 A A E -bc 14 163A 0 -24,-2.4 -22,-2.1 -2,-0.4 2,-0.5 -0.955 9.1-156.4-112.4 122.4 -12.4 -33.4 21.5 38 47 A C E -bc 15 164A 0 125,-3.0 127,-3.1 -2,-0.5 2,-0.4 -0.866 5.2-162.2-102.6 122.6 -12.4 -29.8 22.7 39 48 A V E +bc 16 165A 2 -24,-2.0 -22,-3.3 -2,-0.5 2,-0.3 -0.881 18.5 161.0-105.3 134.3 -9.1 -28.2 23.8 40 49 A T E - c 0 166A 11 125,-1.6 128,-2.9 -2,-0.4 127,-0.9 -0.972 37.8-154.1-155.5 136.2 -9.2 -25.1 25.9 41 50 A K S S+ 0 0 50 126,-0.3 2,-0.2 -2,-0.3 128,-0.2 0.681 90.4 45.1 -83.0 -20.2 -6.7 -23.2 28.2 42 51 A L S S- 0 0 26 126,-0.1 125,-0.7 125,-0.1 126,-0.2 -0.661 102.7 -90.8-107.6 170.0 -9.6 -21.6 30.2 43 52 A F >> - 0 0 9 -2,-0.2 3,-1.9 123,-0.2 4,-0.7 -0.727 46.6-110.9 -76.4 134.6 -12.8 -23.2 31.5 44 53 A P T 34 S+ 0 0 1 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.714 118.0 50.9 -37.9 -37.7 -15.5 -22.8 28.7 45 54 A T T 34 S+ 0 0 0 1,-0.2 5,-0.2 721,-0.1 105,-0.1 0.842 102.6 59.0 -71.0 -35.9 -17.4 -20.2 30.8 46 55 A R T <4 S+ 0 0 7 -3,-1.9 -1,-0.2 631,-0.1 625,-0.1 0.598 79.5 121.8 -73.0 -12.1 -14.3 -18.0 31.4 47 56 A S S >< S- 0 0 9 -4,-0.7 3,-1.9 -3,-0.4 4,-0.2 -0.115 81.3-105.6 -51.4 150.0 -13.9 -17.6 27.7 48 57 A H G > S+ 0 0 50 1,-0.3 3,-1.0 2,-0.2 4,-0.2 0.519 107.4 85.4 -65.2 -6.6 -13.9 -13.9 26.5 49 58 A T G > S+ 0 0 18 1,-0.2 3,-1.0 2,-0.2 -1,-0.3 0.684 76.4 69.4 -65.8 -19.3 -17.4 -14.3 25.0 50 59 A V G < S+ 0 0 5 -3,-1.9 97,-0.6 1,-0.2 -1,-0.2 0.784 87.0 66.8 -66.7 -28.0 -18.8 -13.5 28.5 51 60 A A G < S+ 0 0 10 -3,-1.0 -1,-0.2 -4,-0.2 -2,-0.2 0.664 74.2 115.3 -67.5 -17.7 -17.6 -9.9 28.1 52 61 A A < + 0 0 25 -3,-1.0 94,-1.6 -4,-0.2 95,-0.9 -0.344 30.3 159.9 -62.6 129.8 -20.1 -9.4 25.3 53 62 A Q + 0 0 19 92,-0.2 92,-0.4 91,-0.2 -1,-0.1 0.645 53.7 63.8-125.6 -30.1 -22.7 -6.8 26.2 54 63 A G S S- 0 0 16 1,-0.2 2,-0.3 90,-0.1 90,-0.1 0.998 91.6-105.9 -68.2 -79.8 -24.3 -5.3 23.1 55 64 A G - 0 0 3 85,-0.1 2,-0.4 88,-0.1 351,-0.3 -0.985 20.3 -82.7 172.4-166.4 -26.2 -8.1 21.2 56 65 A I E -H 139 0B 1 83,-3.0 83,-1.7 -2,-0.3 2,-0.2 -0.975 41.9-125.1-136.6 115.3 -26.4 -10.5 18.3 57 66 A N E +H 138 0B 0 346,-2.6 2,-0.3 -2,-0.4 81,-0.2 -0.422 38.4 156.0 -73.3 127.4 -27.8 -9.3 14.9 58 67 A A - 0 0 0 79,-2.4 2,-0.9 -2,-0.2 3,-0.4 -0.985 42.0-135.6-147.5 139.4 -30.7 -11.1 13.3 59 68 A A + 0 0 10 -2,-0.3 9,-0.2 33,-0.3 7,-0.1 -0.309 57.7 133.1 -91.1 51.3 -33.2 -9.9 10.7 60 69 A L - 0 0 38 -2,-0.9 -1,-0.2 77,-0.2 6,-0.1 0.807 63.7-132.0 -68.5 -31.3 -36.2 -11.5 12.5 61 70 A G + 0 0 18 -3,-0.4 76,-0.1 75,-0.2 -2,-0.1 0.984 54.5 143.7 73.7 65.7 -38.2 -8.3 12.2 62 71 A N S S+ 0 0 13 74,-0.3 3,-0.1 2,-0.1 54,-0.1 0.782 72.9 33.6-103.7 -38.0 -39.5 -7.8 15.7 63 72 A M S S- 0 0 57 73,-0.5 2,-0.3 1,-0.4 74,-0.1 0.952 140.0 -3.5 -79.7 -62.3 -39.5 -4.1 16.2 64 73 A E S S- 0 0 54 72,-0.4 -1,-0.4 0, 0.0 -2,-0.1 -0.923 97.6 -81.4-124.8 155.7 -40.3 -3.1 12.6 65 74 A E - 0 0 157 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 -0.361 59.7-168.1 -61.9 129.3 -40.7 -5.5 9.7 66 75 A D - 0 0 24 -7,-0.1 2,-0.4 -6,-0.1 -1,-0.1 -0.851 24.4-150.3-129.6 152.4 -37.3 -6.4 8.4 67 76 A N >> - 0 0 34 -2,-0.3 3,-1.2 1,-0.1 4,-0.7 -0.981 18.4-139.1-121.3 137.7 -35.5 -8.1 5.4 68 77 A W H 3> S+ 0 0 34 -2,-0.4 4,-1.1 1,-0.2 3,-0.2 0.722 97.0 69.7 -68.0 -23.9 -32.1 -9.9 5.8 69 78 A R H 3> S+ 0 0 72 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.695 93.4 57.7 -70.1 -20.6 -30.7 -8.5 2.6 70 79 A W H <> S+ 0 0 34 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.853 103.8 52.0 -73.1 -37.3 -30.6 -5.0 4.1 71 80 A H H X S+ 0 0 0 -4,-0.7 4,-1.4 -3,-0.2 -2,-0.2 0.758 106.8 55.4 -68.5 -26.7 -28.3 -6.5 6.9 72 81 A F H X S+ 0 0 3 -4,-1.1 4,-2.0 2,-0.2 5,-0.2 0.945 109.0 45.6 -65.0 -51.6 -26.2 -7.9 4.0 73 82 A Y H X S+ 0 0 46 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.871 110.9 53.2 -60.1 -41.8 -25.8 -4.4 2.5 74 83 A D H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.867 110.1 47.3 -64.1 -39.2 -25.0 -2.8 5.9 75 84 A T H X S+ 0 0 1 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.911 114.6 44.6 -70.0 -45.0 -22.2 -5.3 6.6 76 85 A V H <>S+ 0 0 0 -4,-2.0 5,-1.5 2,-0.2 7,-0.3 0.825 113.9 50.4 -70.6 -32.5 -20.5 -5.0 3.2 77 86 A K H ><5S+ 0 0 26 -4,-2.2 3,-1.0 -5,-0.2 -1,-0.2 0.884 113.2 47.0 -68.3 -39.5 -20.9 -1.1 3.3 78 87 A G H 3<5S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.786 101.5 65.1 -69.2 -29.8 -19.3 -1.3 6.8 79 88 A S T ><5S- 0 0 0 -4,-1.7 319,-2.3 319,-0.2 3,-1.1 0.478 106.3-127.4 -72.7 -2.7 -16.6 -3.6 5.5 80 89 A D T < 5 - 0 0 11 -3,-1.0 -3,-0.2 1,-0.2 -2,-0.1 0.811 63.4 -65.7 55.3 34.4 -15.3 -0.7 3.3 81 90 A W T 3 > - 0 0 0 310,-2.2 4,-1.6 309,-0.3 3,-1.2 -0.627 21.0-152.4 -75.8 112.4 -15.8 -11.2 1.0 85 94 A Q H 3> S+ 0 0 2 509,-2.4 4,-1.4 -2,-0.7 513,-0.3 0.575 88.4 65.4 -69.8 -13.0 -19.4 -11.1 -0.1 86 95 A D H 3> S+ 0 0 12 508,-0.2 4,-1.3 511,-0.2 -1,-0.3 0.838 107.9 41.6 -73.5 -34.6 -19.8 -14.9 -0.4 87 96 A A H <> S+ 0 0 0 -3,-1.2 4,-2.2 306,-0.2 -2,-0.2 0.887 112.7 52.8 -76.4 -43.0 -19.3 -15.1 3.4 88 97 A I H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 5,-0.2 0.836 107.4 53.9 -62.9 -35.6 -21.5 -12.0 4.2 89 98 A H H X S+ 0 0 2 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.958 110.9 44.8 -58.8 -53.7 -24.3 -13.6 2.1 90 99 A Y H X S+ 0 0 41 -4,-1.3 4,-1.5 1,-0.2 -2,-0.2 0.844 114.6 48.2 -63.1 -38.8 -24.2 -16.9 4.1 91 100 A M H < S+ 0 0 0 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.910 112.6 46.0 -70.0 -45.1 -24.0 -15.1 7.5 92 101 A T H < S+ 0 0 0 -4,-2.0 -33,-0.3 1,-0.2 -2,-0.2 0.735 114.1 48.7 -74.3 -24.5 -26.8 -12.7 7.0 93 102 A E H < S+ 0 0 81 -4,-1.6 4,-0.3 -5,-0.2 -1,-0.2 0.827 114.7 44.3 -80.7 -36.0 -29.2 -15.3 5.6 94 103 A Q S X S+ 0 0 43 -4,-1.5 4,-2.2 -5,-0.2 5,-0.2 0.357 91.9 94.2 -87.0 4.0 -28.4 -17.7 8.5 95 104 A A H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.929 89.1 36.6 -64.9 -49.6 -28.8 -14.8 10.9 96 105 A P H > S+ 0 0 28 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.755 117.5 55.9 -74.2 -21.8 -32.5 -15.3 11.8 97 106 A A H > S+ 0 0 39 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.848 108.9 44.1 -75.3 -37.7 -32.0 -19.1 11.6 98 107 A S H X S+ 0 0 1 -4,-2.2 4,-1.8 2,-0.2 -3,-0.1 0.853 112.2 50.6 -77.5 -37.5 -29.2 -19.2 14.2 99 108 A V H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 5,-0.2 0.892 110.2 49.9 -69.1 -41.6 -30.7 -16.8 16.7 100 109 A V H X S+ 0 0 9 -4,-1.3 4,-1.9 1,-0.2 644,-0.3 0.880 110.5 52.9 -58.5 -39.2 -34.0 -18.8 16.7 101 110 A E H X S+ 0 0 21 -4,-1.1 4,-0.7 643,-0.2 -2,-0.2 0.864 110.6 46.0 -63.7 -39.3 -31.8 -21.8 17.2 102 111 A L H X>S+ 0 0 1 -4,-1.8 5,-1.7 2,-0.2 4,-1.0 0.858 110.7 51.6 -73.6 -38.2 -30.1 -20.2 20.3 103 112 A E H <5S+ 0 0 0 -4,-2.4 3,-0.3 1,-0.2 -2,-0.2 0.859 108.9 52.1 -65.7 -37.2 -33.4 -19.0 21.8 104 113 A N H <5S+ 0 0 7 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.715 103.4 59.1 -70.3 -22.5 -34.7 -22.6 21.4 105 114 A Y H <5S- 0 0 10 -4,-0.7 630,-1.6 -3,-0.2 -1,-0.2 0.766 132.2 -83.8 -76.9 -29.0 -31.6 -23.9 23.3 106 115 A G T <5S+ 0 0 0 -4,-1.0 -3,-0.2 -3,-0.3 -2,-0.1 0.473 70.3 154.9 138.9 10.7 -32.4 -21.8 26.4 107 116 A M < - 0 0 0 -5,-1.7 2,-2.3 1,-0.1 -1,-0.2 -0.530 42.4-135.3 -70.4 117.6 -31.1 -18.2 25.8 108 117 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 -0.404 31.8-172.1 -77.8 68.6 -33.2 -15.9 28.1 109 118 A F - 0 0 0 -2,-2.3 32,-0.2 1,-0.1 641,-0.0 -0.254 28.1-104.6 -62.5 144.5 -33.7 -13.1 25.5 110 119 A S - 0 0 6 30,-1.9 8,-2.9 8,-0.2 2,-0.3 -0.341 44.0-140.5 -64.8 152.2 -35.4 -9.8 26.5 111 120 A R B -I 117 0C 5 6,-0.2 6,-0.2 641,-0.1 2,-0.2 -0.850 12.3-147.3-127.9 154.2 -39.0 -9.5 25.4 112 121 A T > - 0 0 27 4,-1.4 3,-1.3 -2,-0.3 640,-0.4 -0.439 47.0 -88.0-102.3-178.6 -41.5 -7.0 24.0 113 122 A E T 3 S+ 0 0 162 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-2,-0.2 1,-0.2 -3,-0.1 0.800 133.8 23.4 -79.0 -31.2 -18.8 -30.9 55.7 780 174 B N S X S+ 0 0 4 -4,-0.9 4,-2.1 -5,-0.2 3,-0.4 -0.329 70.8 142.1-134.0 52.7 -20.7 -32.5 52.8 781 175 B G T 4 S+ 0 0 13 -3,-0.4 -1,-0.1 1,-0.2 -3,-0.1 0.571 73.5 56.0 -70.6 -10.2 -19.1 -31.2 49.6 782 176 B D T 4 S+ 0 0 36 -3,-0.1 -1,-0.2 1,-0.0 -2,-0.1 0.800 120.2 23.0 -89.8 -34.4 -19.6 -34.7 48.0 783 177 B K T 4 S+ 0 0 95 -3,-0.4 2,-0.5 33,-0.1 -2,-0.2 0.588 106.9 78.6-113.9 -15.7 -23.3 -35.1 48.4 784 178 B Y < - 0 0 3 -4,-2.1 33,-0.2 1,-0.1 34,-0.1 -0.873 65.5-151.1 -99.6 126.7 -24.6 -31.5 48.8 785 179 B L - 0 0 15 32,-1.2 4,-0.4 -2,-0.5 -1,-0.1 0.845 36.2-137.4 -65.7 -38.6 -24.9 -29.5 45.5 786 180 B G > - 0 0 0 31,-0.4 4,-2.6 1,-0.1 3,-0.3 0.151 26.8 -69.8 91.8 151.2 -24.3 -26.1 47.0 787 181 B P H > S+ 0 0 1 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.782 126.3 51.1 -38.8 -50.8 -25.8 -22.6 46.5 788 182 B A H > S+ 0 0 4 2,-0.2 4,-1.1 1,-0.2 -2,-0.1 0.935 116.2 37.7 -61.2 -53.0 -24.5 -22.0 43.0 789 183 B V H > S+ 0 0 0 -4,-0.4 4,-1.3 -3,-0.3 -1,-0.2 0.865 115.5 55.0 -67.5 -38.7 -25.6 -25.3 41.4 790 184 B L H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.846 104.7 52.8 -65.0 -37.0 -28.9 -25.3 43.4 791 185 B M H X S+ 0 0 7 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.835 106.1 54.0 -67.8 -34.0 -29.9 -21.8 42.1 792 186 B Q H X S+ 0 0 7 -4,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.799 103.2 56.1 -71.9 -30.8 -29.3 -22.9 38.5 793 187 B A H X S+ 0 0 6 -4,-1.3 4,-0.5 2,-0.2 -1,-0.2 0.937 109.8 46.5 -60.8 -46.9 -31.7 -25.8 39.0 794 188 B Y H >X S+ 0 0 37 -4,-1.5 4,-1.8 1,-0.2 3,-0.8 0.856 105.3 61.3 -62.7 -38.5 -34.3 -23.3 40.1 795 189 B R H 3< S+ 0 0 7 -4,-1.9 4,-0.4 1,-0.3 -1,-0.2 0.911 108.8 41.1 -53.9 -48.3 -33.5 -21.1 37.1 796 190 B W H 3< S+ 0 0 7 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.516 108.0 66.1 -80.9 -7.0 -34.5 -23.8 34.7 797 191 B M H << S+ 0 0 3 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.953 110.3 30.2 -77.7 -54.6 -37.5 -24.7 36.8 798 192 B I S < S+ 0 0 39 -4,-1.8 2,-1.3 -41,-0.1 -2,-0.2 0.362 84.8 118.6 -89.9 5.5 -39.5 -21.4 36.4 799 193 B D > - 0 0 0 -4,-0.4 3,-3.4 -5,-0.2 -44,-0.1 -0.635 62.9-149.6 -66.2 97.8 -38.1 -20.9 32.9 800 194 B S T 3 S+ 0 0 54 -2,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.449 91.1 66.3 -63.3 1.2 -41.6 -21.1 31.4 801 195 B R T 3 S+ 0 0 3 -53,-0.1 2,-0.5 -695,-0.1 -1,-0.3 0.471 84.4 90.3 -92.9 -8.1 -40.1 -22.6 28.2 802 196 B D < - 0 0 7 -3,-3.4 3,-0.4 1,-0.1 -65,-0.2 -0.821 52.3-174.1 -97.5 124.5 -39.1 -25.7 30.1 803 197 B D S S+ 0 0 63 -67,-1.9 3,-0.3 -2,-0.5 -66,-0.1 0.466 74.2 74.2 -92.6 -4.1 -41.6 -28.6 30.3 804 198 B F > + 0 0 45 -68,-0.5 4,-1.0 1,-0.2 -1,-0.2 -0.085 53.7 122.6-104.8 33.3 -39.6 -30.7 32.7 805 199 B T H > S+ 0 0 38 -3,-0.4 4,-1.0 1,-0.2 -1,-0.2 0.845 71.4 52.4 -63.6 -37.0 -40.2 -28.7 35.9 806 200 B E H >> S+ 0 0 79 -3,-0.3 4,-1.7 1,-0.2 3,-0.5 0.940 109.1 44.3 -69.3 -52.0 -41.7 -31.6 37.9 807 201 B E H 3> S+ 0 0 67 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.650 106.7 62.7 -72.3 -16.3 -38.9 -34.3 37.4 808 202 B R H 3< S+ 0 0 16 -4,-1.0 4,-0.3 2,-0.2 -1,-0.2 0.851 108.2 42.8 -69.3 -37.8 -36.3 -31.6 38.1 809 203 B L H X< S+ 0 0 4 -4,-1.0 3,-1.0 -3,-0.5 -2,-0.2 0.809 109.4 57.5 -75.0 -32.9 -37.9 -31.3 41.6 810 204 B A H >< S+ 0 0 20 -4,-1.7 3,-1.0 1,-0.2 -1,-0.2 0.697 96.3 65.5 -69.6 -20.2 -38.2 -35.1 41.8 811 205 B K T 3< S+ 0 0 113 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.702 95.7 56.7 -73.6 -21.9 -34.4 -35.3 41.3 812 206 B L T < S+ 0 0 7 -3,-1.0 2,-1.7 -4,-0.3 6,-0.4 0.156 71.0 120.5 -95.8 17.4 -33.8 -33.6 44.6 813 207 B Q < + 0 0 32 -3,-1.0 184,-0.2 4,-0.1 185,-0.2 -0.302 52.3 86.4 -85.4 54.4 -35.8 -36.2 46.6 814 208 B D S >>S- 0 0 51 -2,-1.7 5,-0.7 183,-0.1 4,-0.7 -0.959 86.8-107.9-144.8 161.2 -32.9 -37.3 48.9 815 209 B P T 45S+ 0 0 67 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.741 110.9 36.6 -62.9 -24.6 -31.6 -36.0 52.3 816 210 B F T >5S+ 0 0 18 3,-0.1 4,-0.7 2,-0.1 -31,-0.2 0.871 97.3 69.4 -99.9 -44.4 -28.4 -34.5 50.8 817 211 B S T 45S- 0 0 23 -33,-0.2 -32,-1.2 1,-0.2 -31,-0.4 0.858 129.4 -11.3 -49.0 -50.9 -29.0 -32.9 47.4 818 212 B L T ><5S+ 0 0 0 -4,-0.7 3,-1.3 -6,-0.4 -1,-0.2 0.691 125.7 70.9-117.2 -39.3 -31.1 -30.0 48.5 819 213 B Y T 34 + 0 0 9 1,-0.1 4,-1.2 63,-0.0 63,-0.1 0.656 58.5 126.4 67.1 20.6 -27.2 -17.3 54.6 826 220 B N H > + 0 0 10 2,-0.2 4,-1.3 1,-0.2 -52,-0.1 0.724 69.9 59.4 -74.6 -22.8 -23.4 -17.1 54.0 827 221 B C H > S+ 0 0 14 2,-0.2 4,-1.2 1,-0.2 3,-0.2 0.939 105.2 45.1 -69.0 -51.0 -24.1 -17.6 50.3 828 222 B T H 4 S+ 0 0 15 1,-0.2 3,-0.2 2,-0.2 -2,-0.2 0.875 113.6 52.2 -60.4 -40.3 -26.2 -14.5 49.9 829 223 B G H < S+ 0 0 51 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.823 112.5 41.7 -67.2 -35.5 -23.8 -12.4 51.9 830 224 B T H < S+ 0 0 11 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.608 79.0 123.7 -92.4 -14.2 -20.6 -13.2 49.9 831 225 B C >< - 0 0 22 -4,-1.2 3,-1.0 4,-0.2 -143,-0.1 -0.296 47.4-158.4 -57.2 117.3 -22.0 -13.1 46.4 832 226 B P T 3 S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 -144,-0.1 0.693 91.6 53.7 -70.9 -20.4 -19.9 -10.6 44.4 833 227 B K T 3 S- 0 0 37 2,-0.0 -2,-0.1 -158,-0.0 -70,-0.0 0.448 113.2-116.5 -93.1 -3.2 -22.7 -10.1 41.8 834 228 B G < + 0 0 68 -3,-1.0 2,-0.1 1,-0.2 -6,-0.0 0.631 63.4 149.9 78.1 15.9 -25.2 -9.2 44.5 835 229 B L - 0 0 21 -72,-0.1 -4,-0.2 1,-0.1 -1,-0.2 -0.300 46.9-129.9 -77.9 164.6 -27.4 -12.3 43.7 836 230 B N > + 0 0 37 -76,-0.4 4,-1.1 1,-0.2 -8,-0.1 -0.735 35.2 160.9-120.5 81.2 -29.6 -14.1 46.3 837 231 B P H > S+ 0 0 3 0, 0.0 4,-2.1 0, 0.0 3,-0.4 0.918 74.9 57.6 -66.9 -43.6 -28.9 -17.8 46.2 838 232 B G H > S+ 0 0 3 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.862 103.9 52.1 -54.7 -43.4 -30.3 -18.5 49.6 839 233 B K H > S+ 0 0 77 127,-0.3 4,-1.3 1,-0.2 -1,-0.3 0.865 109.8 50.8 -59.2 -39.4 -33.7 -17.1 48.7 840 234 B A H X S+ 0 0 4 -4,-1.1 4,-1.5 -3,-0.4 -2,-0.2 0.881 108.2 50.7 -68.3 -41.0 -33.8 -19.3 45.6 841 235 B I H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 3,-0.4 0.932 111.5 47.7 -62.2 -46.8 -33.0 -22.5 47.6 842 236 B A H X S+ 0 0 4 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.796 108.9 55.9 -62.6 -29.6 -35.8 -21.7 50.1 843 237 B E H X S+ 0 0 44 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.795 106.4 49.7 -73.7 -30.7 -38.0 -21.1 47.1 844 238 B I H X S+ 0 0 0 -4,-1.5 4,-2.4 -3,-0.4 -2,-0.2 0.927 104.2 59.2 -67.7 -47.3 -37.3 -24.6 45.8 845 239 B K H X S+ 0 0 5 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.817 105.7 49.4 -51.4 -37.4 -38.1 -26.1 49.2 846 240 B K H X S+ 0 0 58 -4,-1.1 4,-0.7 2,-0.2 3,-0.5 0.899 110.2 48.9 -69.6 -43.7 -41.6 -24.6 48.9 847 241 B M H < S+ 0 0 48 -4,-1.3 3,-0.4 1,-0.2 -2,-0.2 0.830 105.7 60.2 -63.3 -33.9 -42.1 -26.0 45.4 848 242 B M H < S+ 0 0 0 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.790 108.6 42.4 -64.5 -32.2 -40.9 -29.4 46.7 849 243 B A H < S+ 0 0 26 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.553 114.4 54.5 -89.9 -10.5 -43.7 -29.5 49.3 850 244 B T S < S+ 0 0 104 -4,-0.7 2,-0.3 -3,-0.4 -1,-0.2 -0.338 82.9 94.1-125.1 50.4 -46.3 -28.2 46.8 851 245 B Y - 0 0 27 -3,-0.4 2,-0.2 -42,-0.0 -4,-0.0 -0.989 56.4-146.1-141.6 136.6 -46.2 -30.5 43.7 852 246 B K 0 0 155 -2,-0.3 -2,-0.0 1,-0.1 -3,-0.0 -0.478 360.0 360.0-102.7 167.2 -48.4 -33.6 43.0 853 247 B E 0 0 206 -2,-0.2 -1,-0.1 143,-0.0 142,-0.0 0.988 360.0 360.0 58.6 360.0 -47.9 -37.0 41.3 854 !* 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 68 0, 0.0 2,-0.2 0, 0.0 -693,-0.1 0.000 360.0 360.0 360.0 136.6 -17.7 -38.8 30.4 856 7 C T > - 0 0 76 1,-0.1 4,-2.1 -695,-0.1 5,-0.1 -0.575 360.0-106.9-104.3 169.1 -20.8 -38.4 32.6 857 8 C A H > S+ 0 0 17 1,-0.2 4,-1.0 2,-0.2 -127,-0.2 0.790 120.6 49.2 -65.0 -31.2 -21.6 -36.2 35.6 858 9 C K H > S+ 0 0 156 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.831 111.3 49.4 -76.4 -35.1 -21.3 -39.2 38.0 859 10 C E H > S+ 0 0 87 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.839 104.9 58.0 -71.5 -36.4 -18.0 -40.3 36.5 860 11 C E H X S+ 0 0 52 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.869 109.8 44.5 -61.3 -39.8 -16.5 -36.8 36.8 861 12 C M H X S+ 0 0 40 -4,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.859 111.0 53.3 -71.1 -39.0 -17.1 -36.8 40.5 862 13 C E H X S+ 0 0 98 -4,-1.4 4,-0.9 1,-0.2 -2,-0.2 0.827 111.2 46.1 -68.4 -33.4 -15.8 -40.3 41.0 863 14 C R H X S+ 0 0 153 -4,-1.9 4,-0.9 2,-0.2 -1,-0.2 0.661 105.8 62.7 -81.4 -19.6 -12.5 -39.4 39.3 864 15 C F H X S+ 0 0 10 -4,-0.7 4,-1.7 -5,-0.2 -2,-0.2 0.913 106.3 42.0 -68.6 -46.4 -12.3 -36.2 41.3 865 16 C W H X S+ 0 0 61 -4,-1.5 4,-1.7 1,-0.2 5,-0.2 0.775 110.9 56.1 -75.7 -28.5 -12.0 -38.0 44.7 866 17 C N H < S+ 0 0 105 -4,-0.9 4,-0.4 -5,-0.2 -1,-0.2 0.772 111.1 44.7 -72.5 -28.0 -9.6 -40.7 43.4 867 18 C K H < S+ 0 0 113 -4,-0.9 -2,-0.2 -3,-0.1 -1,-0.2 0.892 118.1 40.6 -79.8 -43.9 -7.2 -38.0 42.2 868 19 C N H >< S+ 0 0 3 -4,-1.7 3,-0.9 1,-0.2 5,-0.4 0.832 114.0 48.1 -80.8 -36.5 -7.2 -35.8 45.3 869 20 C L T 3< S+ 0 0 125 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.1 0.762 111.6 52.5 -75.4 -26.8 -7.3 -38.3 48.1 870 21 C G T 3 S+ 0 0 72 -4,-0.4 2,-0.3 -5,-0.2 -1,-0.2 0.016 104.8 74.2 -96.0 26.1 -4.4 -40.3 46.5 871 22 C S S < S- 0 0 41 -3,-0.9 2,-0.0 2,-0.1 -3,-0.0 -0.911 87.0-113.3-136.2 162.9 -2.2 -37.1 46.3 872 23 C N + 0 0 126 -2,-0.3 -3,-0.1 -245,-0.1 -4,-0.1 -0.049 65.9 138.4 -87.0 32.2 -0.2 -34.8 48.5 873 24 C R - 0 0 43 -5,-0.4 2,-0.3 1,-0.0 -2,-0.1 -0.589 48.3-131.8 -78.1 137.3 -2.5 -31.9 47.9 874 25 C P - 0 0 25 0, 0.0 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135.2 -89.7 107.0 -52.5 -26.9 82.4 1024 65 D C > - 0 0 43 -2,-0.8 4,-1.1 1,-0.0 3,-0.2 -0.874 68.3-100.6-142.7 172.8 -54.1 -30.4 82.5 1025 66 D S H > S+ 0 0 70 -2,-0.3 4,-0.9 1,-0.2 60,-0.1 0.802 120.8 55.6 -65.6 -31.8 -53.3 -34.1 82.3 1026 67 D A H > S+ 0 0 79 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.796 106.2 50.5 -71.2 -31.1 -54.6 -34.2 78.7 1027 68 D M H > S+ 0 0 27 -3,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.750 99.6 68.1 -76.1 -26.8 -52.1 -31.4 77.7 1028 69 D D H X S+ 0 0 10 -4,-1.1 4,-1.7 1,-0.2 -2,-0.2 0.895 101.7 42.5 -61.3 -46.3 -49.2 -33.4 79.3 1029 70 D Y H X S+ 0 0 78 -4,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.882 112.6 52.8 -70.8 -40.5 -49.2 -36.2 76.8 1030 71 D S H X S+ 0 0 46 -4,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.846 112.4 45.5 -63.9 -36.8 -49.6 -34.0 73.7 1031 72 D L H X S+ 0 0 22 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.843 113.0 50.9 -72.8 -36.2 -46.6 -31.8 74.9 1032 73 D A H X S+ 0 0 0 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.852 110.7 49.4 -67.8 -36.9 -44.6 -35.0 75.6 1033 74 D A H X S+ 0 0 39 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.906 115.4 41.6 -68.6 -44.9 -45.4 -36.4 72.1 1034 75 D A H X S+ 0 0 4 -4,-1.7 4,-2.2 2,-0.2 5,-0.2 0.831 113.4 53.5 -72.7 -34.8 -44.4 -33.2 70.2 1035 76 D L H X S+ 0 0 56 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.890 113.0 41.4 -69.3 -42.3 -41.3 -32.5 72.3 1036 77 D T H X S+ 0 0 18 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.771 116.3 50.0 -77.5 -28.2 -39.8 -36.0 71.8 1037 78 D L H X S+ 0 0 68 -4,-1.3 4,-2.2 2,-0.2 5,-0.2 0.949 112.9 44.0 -74.0 -52.2 -40.7 -36.1 68.1 1038 79 D H H X S+ 0 0 54 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.850 115.1 51.2 -60.1 -38.1 -39.3 -32.7 67.2 1039 80 D G H X S+ 0 0 16 -4,-1.4 4,-2.2 -5,-0.2 5,-0.2 0.904 109.0 49.5 -65.4 -44.8 -36.2 -33.5 69.3 1040 81 D H H X S+ 0 0 39 -4,-1.6 4,-1.5 1,-0.2 -2,-0.2 0.881 113.4 45.6 -63.1 -42.0 -35.6 -36.8 67.6 1041 82 D W H X S+ 0 0 70 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.748 110.3 56.9 -72.7 -25.4 -35.9 -35.2 64.1 1042 83 D G H >X S+ 0 0 33 -4,-1.3 4,-1.0 -5,-0.2 3,-0.9 0.938 109.0 42.4 -68.9 -50.5 -33.6 -32.4 65.2 1043 84 D I H 3X S+ 0 0 42 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.838 104.8 67.7 -64.4 -34.5 -30.7 -34.6 66.2 1044 85 D G H 3X S+ 0 0 9 -4,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.768 100.8 48.6 -55.7 -29.1 -31.4 -36.7 63.0 1045 86 D Q H << S+ 0 0 34 -3,-0.9 4,-0.4 -4,-0.6 -1,-0.2 0.818 110.0 50.4 -78.9 -35.7 -30.2 -33.6 61.1 1046 87 D V H >X S+ 0 0 25 -4,-1.0 4,-1.7 -3,-0.2 3,-0.6 0.883 111.7 49.2 -67.3 -40.6 -27.1 -33.2 63.2 1047 88 D V H 3X S+ 0 0 15 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.931 109.4 50.5 -63.7 -47.9 -26.3 -36.9 62.7 1048 89 D T H 3< S+ 0 0 10 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.527 113.5 48.4 -71.3 -5.7 -26.7 -36.7 58.9 1049 90 D D H <4 S+ 0 0 4 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.793 124.6 19.6-101.0 -38.1 -24.4 -33.7 58.8 1050 91 D Y H < S+ 0 0 122 -4,-1.7 2,-1.2 -3,-0.1 -3,-0.2 0.794 97.7 87.9-105.8 -37.9 -21.4 -34.7 60.9 1051 92 D V < - 0 0 43 -4,-1.7 2,-0.3 -5,-0.4 -1,-0.1 -0.536 68.1-161.1 -71.1 97.6 -21.4 -38.6 61.0 1052 93 D R + 0 0 122 -2,-1.2 4,-0.3 4,-0.1 5,-0.1 -0.608 45.5 20.2 -87.4 139.6 -19.4 -39.4 57.9 1053 94 D G S > S- 0 0 46 -2,-0.3 4,-1.0 1,-0.1 3,-0.5 0.243 80.2 -98.3 85.9 151.6 -19.6 -42.8 56.2 1054 95 D D H > S+ 0 0 127 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.729 110.2 75.8 -73.9 -24.2 -22.1 -45.7 56.4 1055 96 D A H 4 S+ 0 0 93 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.834 112.3 20.1 -58.1 -38.8 -19.9 -47.6 58.9 1056 97 D L H > S+ 0 0 120 -3,-0.5 4,-1.3 -4,-0.3 -1,-0.2 0.587 112.5 72.8-107.0 -17.0 -20.9 -45.3 61.9 1057 98 D Q H X S+ 0 0 33 -4,-1.0 4,-1.8 1,-0.2 5,-0.2 0.823 92.4 56.1 -70.9 -34.2 -24.1 -43.8 60.5 1058 99 D K H X S+ 0 0 167 -4,-1.3 4,-1.4 1,-0.2 -1,-0.2 0.895 111.2 43.0 -65.0 -42.8 -26.2 -47.0 60.9 1059 100 D A H > S+ 0 0 70 -4,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.774 110.5 57.5 -74.0 -29.0 -25.4 -47.2 64.6 1060 101 D A H X S+ 0 0 28 -4,-1.3 4,-1.4 2,-0.2 -2,-0.2 0.889 109.0 43.1 -70.5 -42.7 -25.9 -43.5 65.2 1061 102 D K H X S+ 0 0 91 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.845 118.6 45.3 -71.1 -36.6 -29.5 -43.5 63.9 1062 103 D A H X S+ 0 0 60 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.865 112.7 50.9 -72.7 -39.2 -30.3 -46.7 65.7 1063 104 D G H X S+ 0 0 44 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.785 112.1 47.7 -68.6 -30.6 -28.6 -45.4 68.9 1064 105 D L H X S+ 0 0 21 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.885 107.4 55.6 -73.5 -42.9 -30.6 -42.2 68.7 1065 106 D L H X S+ 0 0 106 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.843 106.5 51.2 -59.6 -37.5 -33.9 -44.1 68.1 1066 107 D A H X S+ 0 0 53 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.879 111.3 47.5 -66.0 -39.9 -33.4 -46.1 71.3 1067 108 D L H X S+ 0 0 76 -4,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.860 111.1 51.4 -69.3 -37.4 -32.8 -42.9 73.3 1068 109 D S H X S+ 0 0 22 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.848 110.5 47.7 -69.3 -37.8 -35.9 -41.2 71.8 1069 110 D A H X S+ 0 0 60 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.869 112.8 49.6 -69.6 -39.1 -38.1 -44.1 72.7 1070 111 D F H X S+ 0 0 112 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.852 111.0 50.0 -65.4 -37.9 -36.7 -44.1 76.2 1071 112 D T H X S+ 0 0 4 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.895 112.5 46.0 -69.0 -42.6 -37.3 -40.4 76.5 1072 113 D F H X S+ 0 0 87 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.878 114.0 48.1 -68.1 -40.1 -40.9 -40.6 75.3 1073 114 D A H X S+ 0 0 49 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.832 108.8 55.6 -68.0 -34.2 -41.6 -43.6 77.6 1074 115 D G H X S+ 0 0 0 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.856 109.5 45.6 -65.4 -38.1 -40.0 -41.7 80.5 1075 116 D L H X S+ 0 0 3 -4,-1.5 4,-2.2 2,-0.2 10,-0.2 0.867 110.7 52.3 -73.5 -39.3 -42.4 -38.8 80.1 1076 117 D C H X S+ 0 0 35 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.819 110.9 48.4 -66.7 -33.0 -45.5 -41.0 79.7 1077 118 D Y H X>S+ 0 0 112 -4,-1.7 4,-2.1 2,-0.2 5,-0.9 0.857 111.9 50.4 -69.6 -38.3 -44.5 -42.7 83.0 1078 119 D F H <5S+ 0 0 9 -4,-1.4 6,-0.3 3,-0.2 -2,-0.2 0.838 112.8 46.0 -68.6 -35.7 -44.0 -39.3 84.6 1079 120 D N H <5S+ 0 0 10 -4,-2.2 -2,-0.2 5,-0.1 -1,-0.2 0.850 119.4 38.1 -76.1 -37.5 -47.4 -38.0 83.4 1080 121 D Y H <5S+ 0 0 173 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.886 131.9 20.4 -83.2 -42.9 -49.5 -41.1 84.4 1081 122 D H T <5S+ 0 0 121 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.1 0.894 121.8 37.8 -95.9 -49.9 -47.8 -42.1 87.7 1082 123 D D S - 0 0 0 -6,-0.3 4,-2.4 2,-0.1 3,-0.2 0.054 20.9 -95.2 109.5 137.9 -46.9 -34.5 85.3 1085 126 D I H > S+ 0 0 23 1,-0.2 4,-1.0 -10,-0.2 5,-0.1 0.681 120.7 54.0 -61.5 -23.5 -44.7 -32.1 83.2 1086 127 D C H > S+ 0 0 22 2,-0.2 4,-1.3 -62,-0.1 3,-0.3 0.954 116.9 35.0 -71.1 -52.9 -47.1 -29.2 83.5 1087 128 D K H > S+ 0 0 121 -3,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.719 109.7 67.3 -74.9 -22.9 -47.3 -29.2 87.3 1088 129 D A H X S+ 0 0 4 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.882 104.8 41.7 -64.5 -41.5 -43.6 -30.2 87.6 1089 130 D V H X S+ 0 0 79 -4,-1.0 4,-2.5 -3,-0.3 5,-0.2 0.876 111.4 57.9 -70.3 -39.6 -42.5 -26.9 86.2 1090 131 D A H X S+ 0 0 43 -4,-1.3 4,-1.1 1,-0.2 -2,-0.2 0.852 111.5 40.6 -59.0 -39.5 -45.1 -25.1 88.3 1091 132 D M H < S+ 0 0 56 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.847 115.1 52.0 -76.4 -37.5 -43.6 -26.6 91.5 1092 133 D L H < S+ 0 0 78 -4,-1.6 -2,-0.2 -5,-0.2 3,-0.2 0.839 108.0 51.1 -68.1 -36.0 -40.0 -26.1 90.3 1093 134 D W H < S+ 0 0 44 -4,-2.5 2,-1.6 1,-0.2 -101,-0.2 0.912 102.7 57.4 -74.6 -45.8 -40.4 -22.4 89.5 1094 135 D K < 0 0 158 -4,-1.1 -1,-0.2 -5,-0.2 -4,-0.0 -0.598 360.0 360.0 -86.0 77.3 -42.0 -21.2 92.8 1095 136 D L 0 0 69 -2,-1.6 -1,-0.2 -3,-0.2 -2,-0.1 0.671 360.0 360.0-122.1 360.0 -39.1 -22.4 95.0