==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 21-APR-13 4K9W . COMPND 2 MOLECULE: CYTOCHROME P450 3A4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.F.SEVRIOUKOVA,T.L..POULOS . 1831 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 81032.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1282 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.4 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 . 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 . 92 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 231 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 747 40.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 32 1.7 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 4 5 10 2 9 3 0 4 4 4 4 0 4 0 5 0 2 1 0 0 0 0 1 1 2 0 4 RESIDUES PER ALPHA HELIX . 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 14 4 4 8 0 4 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 . 8 2 0 0 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 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 29 A S > 0 0 112 0, 0.0 3,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.7 50.4 5.0 22.8 2 30 A H T 3 + 0 0 43 1,-0.2 4,-0.2 2,-0.1 3,-0.2 0.378 360.0 74.7 -74.1 2.8 48.2 4.1 19.7 3 31 A G T 3> + 0 0 41 1,-0.2 4,-1.4 2,-0.1 -1,-0.2 -0.039 63.9 104.0-102.0 29.6 51.2 5.5 17.8 4 32 A L H <> S+ 0 0 40 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.935 82.2 41.1 -75.7 -48.0 53.4 2.4 18.5 5 33 A F H >>S+ 0 0 9 -3,-0.2 5,-3.2 2,-0.2 4,-0.6 0.829 113.0 54.5 -73.1 -32.4 53.1 0.8 15.1 6 34 A K H >45S+ 0 0 180 -4,-0.2 3,-1.1 3,-0.2 -1,-0.2 0.953 109.9 46.3 -60.8 -53.4 53.4 4.1 13.2 7 35 A K H 3<5S+ 0 0 178 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.839 113.5 50.0 -59.7 -35.0 56.7 5.0 15.0 8 36 A L H 3<5S- 0 0 48 -4,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.600 114.1-119.5 -79.4 -10.9 58.0 1.4 14.4 9 37 A G T <<5 + 0 0 64 -3,-1.1 -3,-0.2 -4,-0.6 -2,-0.1 0.932 63.5 144.9 70.3 48.1 57.1 1.7 10.7 10 38 A I < - 0 0 17 -5,-3.2 -1,-0.3 -6,-0.1 -2,-0.1 -0.984 46.0-128.3-122.2 122.5 54.6 -1.2 10.8 11 39 A P + 0 0 66 0, 0.0 34,-2.0 0, 0.0 29,-0.1 -0.215 45.7 130.2 -62.4 156.8 51.5 -1.2 8.7 12 40 A G - 0 0 21 32,-0.3 34,-0.1 27,-0.0 -2,-0.0 -0.799 56.7 -67.7 162.4 159.8 48.1 -1.8 10.2 13 41 A P - 0 0 24 0, 0.0 32,-0.0 0, 0.0 8,-0.0 -0.095 58.8 -93.9 -67.1 164.9 44.5 -0.4 10.5 14 42 A T - 0 0 120 32,-0.1 2,-0.2 7,-0.0 32,-0.0 -0.670 40.0-136.8 -88.7 125.2 43.8 2.9 12.2 15 43 A P - 0 0 32 0, 0.0 6,-0.2 0, 0.0 3,-0.1 -0.481 5.0-134.6 -81.7 148.4 42.7 2.6 15.9 16 44 A L B > -A 20 0A 90 4,-2.6 4,-2.3 -2,-0.2 6,-0.1 -0.698 44.2 -84.9 -90.8 152.4 39.9 4.5 17.7 17 45 A P T 4 S- 0 0 99 0, 0.0 2,-2.5 0, 0.0 -1,-0.1 -0.313 106.6 -7.7 -57.7 140.6 40.7 6.1 21.1 18 46 A F T 4 S+ 0 0 140 1,-0.2 32,-0.0 31,-0.1 -2,-0.0 -0.222 134.1 58.5 72.0 -51.4 40.2 3.5 23.9 19 47 A L T >4 S- 0 0 53 -2,-2.5 3,-1.8 1,-0.2 30,-1.6 0.777 78.8-173.1 -83.1 -27.6 38.7 0.8 21.7 20 48 A G B 3< -AB 16 48A 3 -4,-2.3 -4,-2.6 1,-0.3 -1,-0.2 -0.564 68.9 -29.0 71.3-123.8 41.6 0.4 19.3 21 49 A N T > S+ 0 0 6 26,-3.1 3,-2.5 -2,-0.4 -1,-0.3 0.334 105.0 116.1-104.9 7.2 40.6 -1.9 16.5 22 50 A I G X + 0 0 9 -3,-1.8 3,-1.2 25,-0.5 -1,-0.1 0.686 68.0 59.8 -52.7 -28.2 38.2 -3.8 18.7 23 51 A L G > S+ 0 0 97 1,-0.3 3,-1.6 -3,-0.2 -1,-0.3 0.735 88.4 72.4 -79.6 -18.5 35.1 -2.9 16.7 24 52 A S G < S+ 0 0 56 -3,-2.5 3,-0.4 1,-0.3 -1,-0.3 0.513 83.8 74.8 -66.2 -2.2 36.6 -4.5 13.6 25 53 A Y G X + 0 0 10 -3,-1.2 3,-2.1 -4,-0.2 -1,-0.3 0.551 64.8 96.1 -83.9 -10.1 35.8 -7.7 15.4 26 54 A H T < S+ 0 0 130 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.766 86.4 45.8 -58.6 -31.4 32.0 -7.4 14.7 27 55 A K T 3 S- 0 0 122 -3,-0.4 4,-0.4 1,-0.3 -1,-0.3 -0.139 136.8 -76.2 -98.4 36.0 32.2 -9.7 11.7 28 56 A G <> - 0 0 10 -3,-2.1 4,-1.0 415,-0.3 3,-0.3 0.440 36.9-106.6 80.1 140.5 34.4 -12.1 13.7 29 57 A F H > S+ 0 0 30 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.634 116.0 64.9 -75.5 -10.6 38.0 -11.7 14.6 30 58 A C H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.886 103.5 42.8 -76.4 -43.1 38.9 -14.4 12.0 31 59 A M H > S+ 0 0 102 -4,-0.4 4,-1.8 -3,-0.3 -2,-0.2 0.702 110.1 60.8 -75.4 -19.7 37.7 -12.3 9.0 32 60 A F H X S+ 0 0 14 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.946 108.2 42.0 -64.6 -47.6 39.4 -9.4 10.7 33 61 A D H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.923 114.0 51.2 -67.1 -47.2 42.8 -11.3 10.5 34 62 A M H X S+ 0 0 47 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.897 111.5 47.5 -54.1 -46.8 42.1 -12.6 6.9 35 63 A E H X S+ 0 0 129 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.895 113.1 48.3 -65.5 -41.8 41.3 -9.0 5.7 36 64 A C H X S+ 0 0 7 -4,-2.1 4,-3.4 2,-0.2 5,-0.4 0.895 110.8 51.5 -62.8 -42.6 44.4 -7.6 7.4 37 65 A H H X S+ 0 0 11 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.977 112.2 45.0 -58.5 -58.0 46.6 -10.3 5.9 38 66 A K H < S+ 0 0 190 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.839 121.2 40.7 -50.7 -41.7 45.4 -9.7 2.4 39 67 A K H < S+ 0 0 152 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.923 126.5 26.8 -77.4 -45.8 45.7 -6.0 2.8 40 68 A Y H < S- 0 0 55 -4,-3.4 3,-0.3 1,-0.3 2,-0.2 0.656 94.8-135.1 -99.4 -20.0 48.9 -5.5 4.7 41 69 A G < - 0 0 26 -4,-2.4 -1,-0.3 -5,-0.4 -2,-0.1 -0.635 60.1 -18.4 94.9-154.6 51.1 -8.5 3.9 42 70 A K S S+ 0 0 88 -2,-0.2 15,-1.8 1,-0.1 16,-0.5 0.572 127.0 37.1 -72.9 -11.4 53.2 -10.7 6.2 43 71 A V E + C 0 56A 12 -3,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.999 62.5 149.5-144.7 132.7 53.3 -8.3 9.1 44 72 A W E - C 0 55A 0 11,-1.9 11,-3.0 -2,-0.4 2,-0.3 -0.975 26.0-139.4-157.3 161.6 50.8 -5.8 10.6 45 73 A G E + C 0 54A 2 -34,-2.0 2,-0.3 -2,-0.3 9,-0.2 -0.935 21.5 162.4-128.2 147.9 49.9 -4.3 14.0 46 74 A F E - C 0 53A 0 7,-2.6 7,-3.8 -2,-0.3 2,-0.5 -0.914 30.6-113.3-151.6 178.0 46.7 -3.5 15.8 47 75 A Y E - C 0 52A 5 -2,-0.3 -26,-3.1 5,-0.3 2,-1.3 -0.973 1.5-156.8-128.7 117.6 45.3 -2.7 19.2 48 76 A D E > S-BC 20 51A 3 3,-2.4 3,-1.6 -2,-0.5 2,-0.6 -0.806 83.3 -59.8 -81.2 93.3 42.9 -4.7 21.4 49 77 A G T 3 S- 0 0 0 -30,-1.6 149,-0.1 -2,-1.3 148,-0.1 -0.531 121.5 -17.0 60.6-112.2 41.9 -1.6 23.2 50 78 A Q T 3 S+ 0 0 84 147,-1.1 -1,-0.3 -2,-0.6 148,-0.1 0.770 116.1 101.1 -89.4 -31.2 45.2 -0.4 24.7 51 79 A Q E < -C 48 0A 48 -3,-1.6 -3,-2.4 146,-0.3 2,-0.3 -0.376 69.5-141.2 -58.6 111.0 47.0 -3.8 24.2 52 80 A P E -C 47 0A 24 0, 0.0 305,-1.9 0, 0.0 2,-0.4 -0.608 17.7-162.5 -73.3 136.9 49.2 -3.5 21.1 53 81 A V E -Cd 46 357A 0 -7,-3.8 -7,-2.6 -2,-0.3 2,-0.7 -0.978 8.8-155.9-123.9 123.0 49.2 -6.7 19.1 54 82 A L E -Cd 45 358A 4 303,-2.4 305,-3.3 -2,-0.4 2,-0.4 -0.850 11.4-154.0 -95.4 114.5 51.8 -7.6 16.4 55 83 A A E -Cd 44 359A 0 -11,-3.0 -11,-1.9 -2,-0.7 2,-0.3 -0.745 13.1-171.7 -88.8 130.5 50.6 -10.1 13.7 56 84 A I E +C 43 0A 0 303,-2.3 -13,-0.2 -2,-0.4 -14,-0.1 -0.935 21.6 166.7-123.7 143.0 53.2 -12.2 12.0 57 85 A T + 0 0 1 -15,-1.8 -14,-0.1 -2,-0.3 -1,-0.1 0.393 43.8 110.1-136.3 -3.9 52.9 -14.6 9.0 58 86 A D >> - 0 0 54 -16,-0.5 4,-2.1 1,-0.1 3,-0.8 -0.703 64.9-138.0 -80.9 121.0 56.4 -15.3 8.0 59 87 A P H 3> S+ 0 0 20 0, 0.0 4,-2.5 0, 0.0 -1,-0.1 0.787 100.6 46.6 -46.6 -50.4 57.3 -19.0 8.8 60 88 A D H 3> S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.828 110.8 53.0 -64.1 -35.8 60.8 -18.4 10.1 61 89 A M H <> S+ 0 0 1 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.915 110.9 48.6 -64.2 -39.4 59.6 -15.5 12.2 62 90 A I H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.924 109.7 50.7 -65.6 -45.5 57.0 -17.9 13.6 63 91 A K H X>S+ 0 0 69 -4,-2.5 4,-2.8 1,-0.2 5,-1.4 0.893 109.5 52.6 -59.7 -43.8 59.6 -20.6 14.3 64 92 A T H <>S+ 0 0 10 -4,-2.3 5,-2.1 3,-0.2 -2,-0.2 0.947 116.3 36.8 -55.3 -52.2 61.7 -18.0 16.2 65 93 A V H <5S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.905 124.0 41.8 -76.8 -34.8 58.9 -16.9 18.5 66 94 A L H <5S+ 0 0 1 -4,-3.2 338,-0.4 -5,-0.2 -2,-0.2 0.855 134.0 7.0 -76.1 -39.3 57.4 -20.3 18.9 67 95 A V T <5S+ 0 0 36 -4,-2.8 3,-0.5 -5,-0.3 4,-0.3 0.848 125.3 43.4-111.6 -57.6 60.5 -22.5 19.3 68 96 A K T XS+ 0 0 53 -5,-2.1 4,-3.1 -6,-0.3 5,-2.8 0.226 83.1 109.5-118.3 11.4 62.9 -17.9 22.0 70 98 A C T 45S+ 0 0 0 -3,-0.5 -1,-0.1 1,-0.2 -2,-0.1 0.971 88.8 35.0 -46.5 -64.1 60.2 -19.5 24.0 71 99 A Y T 45S+ 0 0 74 -4,-0.3 -1,-0.2 1,-0.2 4,-0.1 0.764 125.6 41.9 -67.5 -26.0 62.3 -19.7 27.2 72 100 A S T 45S- 0 0 55 -4,-0.1 -1,-0.2 2,-0.1 -2,-0.2 0.805 136.5 -12.2 -97.4 -36.5 64.1 -16.5 26.6 73 101 A V T <5S+ 0 0 4 -4,-3.1 269,-2.4 -8,-0.1 3,-0.2 0.602 128.6 46.9-136.8 -28.0 61.5 -13.9 25.4 74 102 A F < + 0 0 0 -5,-2.8 -3,-0.1 267,-0.2 -4,-0.1 -0.269 63.7 130.4-118.0 46.8 58.2 -15.5 24.4 75 103 A T + 0 0 2 -6,-0.1 2,-0.3 -4,-0.1 -1,-0.2 0.770 59.9 58.0 -72.0 -26.1 57.4 -17.8 27.3 76 104 A N - 0 0 12 264,-0.4 264,-3.0 -3,-0.2 18,-0.1 -0.768 67.1-130.3-124.7 147.7 53.8 -16.8 28.0 77 105 A R - 0 0 84 16,-0.3 262,-0.1 -2,-0.3 -1,-0.1 -0.333 55.3 -71.6 -79.9 165.9 50.4 -16.4 26.5 78 106 A R - 0 0 48 -2,-0.1 2,-0.3 1,-0.1 -1,-0.2 -0.386 46.7-117.3 -58.3 133.2 48.3 -13.2 26.8 79 107 A P - 0 0 84 0, 0.0 -1,-0.1 0, 0.0 13,-0.0 -0.614 39.8-177.8 -66.3 135.8 46.9 -12.4 30.3 80 108 A F - 0 0 82 1,-0.3 -2,-0.0 -2,-0.3 115,-0.0 0.650 36.7 -48.0-125.9 -17.0 43.2 -12.5 29.7 81 109 A G S S- 0 0 4 115,-0.0 -1,-0.3 118,-0.0 2,-0.3 -0.965 81.8 -32.2 165.7-177.2 40.9 -11.7 32.7 82 110 A P + 0 0 0 0, 0.0 130,-3.1 0, 0.0 131,-0.3 -0.534 59.0 160.0 -68.4 122.8 40.2 -12.4 36.4 83 111 A V > - 0 0 12 -2,-0.3 3,-1.7 128,-0.2 128,-0.1 0.573 17.6-169.8-127.2 -16.6 41.2 -16.0 37.0 84 112 A G G > S- 0 0 30 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 -0.282 75.5 -7.4 60.8-135.2 41.7 -16.6 40.7 85 113 A F G > S+ 0 0 49 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.636 124.5 77.0 -69.0 -15.3 43.3 -19.9 41.7 86 114 A M G X + 0 0 4 -3,-1.7 3,-1.3 1,-0.3 -1,-0.3 0.518 68.9 88.2 -72.7 -4.7 42.9 -20.9 38.0 87 115 A K G < S+ 0 0 107 -3,-1.7 -1,-0.3 1,-0.2 7,-0.2 0.634 83.8 58.4 -63.7 -13.3 46.0 -18.6 37.5 88 116 A S G < S+ 0 0 8 -3,-1.5 -1,-0.2 5,-0.1 -2,-0.2 0.560 74.4 118.5 -94.2 -11.4 47.8 -21.9 38.2 89 117 A A S X> S- 0 0 0 -3,-1.3 4,-1.8 1,-0.1 3,-1.8 -0.341 75.2-120.9 -56.1 135.2 46.3 -23.9 35.4 90 118 A I T 34 S+ 0 0 11 1,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.846 109.6 52.9 -48.6 -45.9 49.2 -24.9 33.1 91 119 A S T 34 S+ 0 0 43 1,-0.2 -1,-0.3 171,-0.1 -14,-0.2 0.692 118.7 36.4 -64.1 -18.6 47.8 -23.2 29.9 92 120 A I T <4 S+ 0 0 35 -3,-1.8 -1,-0.2 -6,-0.2 -2,-0.2 0.590 95.8 109.3-108.9 -19.3 47.5 -19.9 31.8 93 121 A A < - 0 0 2 -4,-1.8 2,-0.3 -5,-0.1 -16,-0.3 -0.203 57.9-137.8 -69.0 157.0 50.6 -20.2 33.9 94 122 A E >> - 0 0 106 -7,-0.2 3,-1.2 -18,-0.1 4,-0.7 -0.876 42.6 -45.5-122.1 138.6 53.7 -18.1 33.4 95 123 A D H 3> S+ 0 0 52 -2,-0.3 4,-3.0 1,-0.2 3,-0.1 -0.095 121.6 15.4 58.5-121.7 57.4 -18.7 33.4 96 124 A E H 3> S+ 0 0 98 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.847 129.9 50.2 -61.4 -41.9 58.9 -20.8 36.2 97 125 A E H <> S+ 0 0 36 -3,-1.2 4,-1.7 2,-0.2 -1,-0.3 0.843 111.9 47.1 -65.7 -36.6 55.5 -22.2 37.3 98 126 A W H X S+ 0 0 3 -4,-0.7 4,-2.8 2,-0.2 -2,-0.2 0.938 110.4 55.3 -70.9 -43.0 54.6 -23.1 33.7 99 127 A K H X S+ 0 0 52 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.915 111.1 42.0 -50.3 -49.4 58.1 -24.7 33.4 100 128 A R H X S+ 0 0 122 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.807 115.1 50.0 -78.3 -24.4 57.5 -26.9 36.4 101 129 A L H X S+ 0 0 9 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.873 106.7 56.7 -73.0 -38.1 54.0 -27.8 35.5 102 130 A R H X S+ 0 0 42 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.884 111.5 40.2 -63.6 -40.9 55.0 -28.8 32.0 103 131 A S H < S+ 0 0 85 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.711 114.3 54.3 -83.3 -17.8 57.6 -31.4 33.1 104 132 A L H < S+ 0 0 38 -4,-0.9 -2,-0.2 -5,-0.2 -1,-0.2 0.862 120.6 30.6 -72.4 -38.5 55.3 -32.6 35.8 105 133 A L H >< S+ 0 0 0 -4,-2.1 3,-1.9 1,-0.1 4,-0.3 0.617 98.0 82.9 -98.3 -18.4 52.4 -33.3 33.4 106 134 A S G >< S+ 0 0 56 -4,-1.5 3,-1.1 1,-0.3 -1,-0.1 0.850 82.2 63.4 -64.7 -34.8 54.2 -34.1 30.1 107 135 A P G > S+ 0 0 51 0, 0.0 3,-0.6 0, 0.0 -1,-0.3 0.442 81.4 88.6 -64.7 2.0 54.8 -37.8 31.0 108 136 A T G < S+ 0 0 2 -3,-1.9 2,-0.5 1,-0.2 -2,-0.2 0.931 91.5 38.8 -62.5 -42.5 50.9 -38.1 31.0 109 137 A F G < S+ 0 0 21 -3,-1.1 -1,-0.2 -4,-0.3 2,-0.2 -0.522 78.1 141.8-118.7 58.3 50.8 -39.0 27.3 110 138 A T <> - 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0 0 26 -3,-0.5 -1,-0.2 -4,-0.5 -2,-0.1 -0.275 24.6-106.1 -66.2 143.2 37.5 -55.6 13.6 308 344 A P - 0 0 89 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.506 35.7-113.2 -73.6 133.4 38.3 -53.6 16.7 309 345 A P - 0 0 6 0, 0.0 2,-0.2 0, 0.0 -187,-0.1 -0.380 32.1-168.2 -64.3 140.7 40.9 -50.8 16.3 310 346 A T > - 0 0 69 -2,-0.1 4,-2.0 -188,-0.0 5,-0.2 -0.644 40.8 -91.3-115.8 177.7 44.3 -51.2 18.1 311 347 A Y H > S+ 0 0 27 -2,-0.2 4,-1.1 1,-0.2 -1,-0.0 0.911 125.3 40.9 -56.7 -46.9 47.0 -48.5 18.5 312 348 A D H > S+ 0 0 87 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.757 109.2 57.4 -80.4 -29.3 48.9 -49.4 15.3 313 349 A T H > S+ 0 0 22 2,-0.2 4,-0.6 1,-0.2 3,-0.3 0.919 105.7 52.6 -66.0 -43.4 45.8 -50.0 13.1 314 350 A V H >< S+ 0 0 1 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.897 111.3 47.8 -51.2 -44.3 44.8 -46.4 13.9 315 351 A L H 3< S+ 0 0 90 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.750 103.1 59.8 -74.8 -27.2 48.2 -45.3 12.8 316 352 A Q H 3< S+ 0 0 133 -4,-1.5 2,-1.1 -3,-0.3 -1,-0.2 0.615 81.7 100.8 -72.7 -13.3 48.3 -47.2 9.6 317 353 A M S+ 0 0 61 -2,-1.1 4,-2.6 1,-0.2 -1,-0.2 0.936 75.0 45.8 -69.2 -50.5 46.4 -42.6 6.0 319 355 A Y H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.786 110.0 53.2 -67.7 -32.5 43.0 -41.3 4.7 320 356 A L H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.899 112.8 47.0 -65.6 -40.6 41.4 -41.1 8.1 321 357 A D H X S+ 0 0 42 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.897 109.9 52.3 -63.0 -47.0 44.4 -39.0 9.1 322 358 A M H X S+ 0 0 8 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.934 109.0 51.8 -52.4 -50.8 44.0 -36.9 5.9 323 359 A V H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.855 110.6 46.8 -55.9 -42.6 40.4 -36.3 6.8 324 360 A V H >X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 3,-0.5 0.935 111.4 49.0 -70.4 -48.6 41.2 -35.1 10.3 325 361 A N H 3X S+ 0 0 31 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.869 109.6 54.7 -55.2 -40.7 44.1 -32.7 9.3 326 362 A E H 3X S+ 0 0 0 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.772 109.0 46.9 -65.7 -31.0 41.8 -31.2 6.7 327 363 A T H - 0 0 19 0, 0.0 3,-1.0 0, 0.0 -12,-0.1 -0.447 26.7 -92.5 -83.6 159.6 59.4 -4.1 21.7 354 390 A K T 3 S+ 0 0 137 1,-0.2 -12,-0.2 -12,-0.1 3,-0.1 -0.335 108.2 34.8 -60.0 146.3 58.7 -5.5 25.2 355 391 A G T 3 S+ 0 0 35 -14,-3.0 -1,-0.2 1,-0.3 -13,-0.1 -0.059 85.0 122.8 98.6 -31.0 55.0 -5.6 26.0 356 392 A V < - 0 0 2 -3,-1.0 -15,-2.9 -16,-0.1 2,-0.7 -0.337 62.0-128.4 -71.0 142.8 53.6 -6.4 22.6 357 393 A V E -dE 53 340A 0 -305,-1.9 -303,-2.4 -17,-0.2 2,-0.6 -0.854 19.7-146.9 -88.3 113.9 51.5 -9.5 22.0 358 394 A V E -dE 54 339A 0 -19,-3.2 -19,-2.4 -2,-0.7 2,-0.4 -0.767 21.9-163.3 -83.4 123.8 53.0 -11.4 19.1 359 395 A M E -dE 55 338A 0 -305,-3.3 -303,-2.3 -2,-0.6 -21,-0.2 -0.936 20.3-162.3-121.5 128.0 50.1 -13.0 17.3 360 396 A I E - E 0 337A 0 -23,-3.3 -23,-2.8 -2,-0.4 2,-1.9 -0.939 18.4-145.8-106.8 112.5 50.0 -15.9 14.8 361 397 A P > + 0 0 0 0, 0.0 4,-2.4 0, 0.0 3,-0.4 -0.481 22.8 175.7 -82.7 71.3 46.7 -15.9 12.9 362 398 A S H > S+ 0 0 1 -2,-1.9 4,-2.6 1,-0.2 -26,-0.2 0.826 76.5 54.0 -44.8 -46.2 46.2 -19.6 12.4 363 399 A Y H > S+ 0 0 28 -28,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.963 113.5 42.3 -54.4 -52.8 42.7 -19.2 10.8 364 400 A A H >4 S+ 0 0 1 -3,-0.4 3,-1.1 -29,-0.3 -2,-0.2 0.938 116.0 47.5 -59.6 -52.9 44.1 -16.8 8.2 365 401 A L H >< S+ 0 0 0 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.788 107.1 57.7 -59.7 -33.9 47.3 -18.8 7.5 366 402 A H H 3< S+ 0 0 0 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.728 116.1 36.9 -67.9 -22.4 45.3 -22.1 7.2 367 403 A R T << S+ 0 0 28 -3,-1.1 -1,-0.2 -4,-0.9 -2,-0.2 0.111 82.0 138.0-117.0 20.2 43.3 -20.4 4.5 368 404 A D X> - 0 0 11 -3,-0.9 4,-1.7 1,-0.2 3,-1.3 -0.549 49.2-146.6 -71.6 117.5 46.0 -18.3 2.7 369 405 A P T 34 S+ 0 0 92 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.708 97.5 68.0 -54.7 -19.8 45.7 -18.5 -1.1 370 406 A K T 34 S+ 0 0 140 1,-0.2 3,-0.1 3,-0.1 -5,-0.0 0.893 113.3 24.3 -61.6 -46.4 49.5 -18.3 -1.1 371 407 A Y T <4 S+ 0 0 96 -3,-1.3 2,-0.4 1,-0.2 -1,-0.2 0.531 123.8 50.3-101.9 -9.8 50.0 -21.7 0.5 372 408 A W < - 0 0 11 -4,-1.7 2,-0.3 19,-0.0 -1,-0.2 -0.986 67.6-143.9-135.9 124.5 46.7 -23.5 -0.5 373 409 A T S S+ 0 0 116 -2,-0.4 -3,-0.1 1,-0.3 -5,-0.0 -0.700 98.1 7.6 -80.0 138.9 45.1 -23.7 -3.9 374 410 A E S > S- 0 0 140 -2,-0.3 3,-1.6 1,-0.1 -1,-0.3 0.961 84.5-179.3 49.2 58.0 41.3 -23.6 -3.4 375 411 A P T 3 + 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.717 68.4 61.9 -63.8 -18.1 42.0 -22.7 0.2 376 412 A E T 3 S+ 0 0 145 -4,-0.1 2,-0.2 -9,-0.1 -2,-0.1 0.544 91.1 78.9 -91.7 -9.8 38.3 -22.5 1.0 377 413 A K S < S- 0 0 118 -3,-1.6 2,-1.0 2,-0.1 0, 0.0 -0.567 82.4-108.7-102.2 167.0 37.3 -26.1 0.2 378 414 A F + 0 0 7 -2,-0.2 -51,-0.1 -94,-0.1 -2,-0.1 -0.789 50.3 152.1 -90.5 98.0 37.5 -29.5 1.9 379 415 A L > - 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0 0 2 -4,-2.6 2,-0.3 -5,-0.1 -16,-0.3 -0.110 57.6-138.4 -64.2 158.2 72.9 -58.4 43.7 555 122 B E >> - 0 0 91 -7,-0.1 4,-1.3 -18,-0.1 3,-1.3 -0.864 42.2 -37.3-124.1 148.3 69.7 -60.5 43.9 556 123 B D H 3> S- 0 0 43 -2,-0.3 4,-1.9 1,-0.2 3,-0.1 -0.054 123.3 -0.1 52.2-128.5 66.1 -60.3 45.2 557 124 B E H 3> S+ 0 0 120 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.761 131.3 60.4 -67.5 -28.9 65.7 -58.5 48.6 558 125 B E H <> S+ 0 0 34 -3,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.950 109.7 41.9 -61.5 -50.1 69.4 -57.8 48.8 559 126 B W H X S+ 0 0 3 -4,-1.3 4,-3.0 1,-0.2 -2,-0.2 0.888 110.0 61.6 -59.2 -39.5 69.2 -55.8 45.5 560 127 B K H X S+ 0 0 111 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.898 106.9 40.9 -56.8 -45.8 65.9 -54.3 46.8 561 128 B R H X S+ 0 0 150 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.805 114.8 51.5 -78.2 -31.9 67.5 -52.6 49.8 562 129 B L H X S+ 0 0 1 -4,-1.6 4,-2.7 -5,-0.2 5,-0.2 0.925 108.5 53.8 -63.6 -45.2 70.6 -51.5 48.0 563 130 B R H X S+ 0 0 54 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.917 113.4 40.1 -59.9 -46.7 68.3 -50.0 45.3 564 131 B S H < S+ 0 0 79 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.855 116.8 51.9 -69.8 -33.2 66.3 -47.9 47.8 565 132 B L H < S+ 0 0 44 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.846 115.8 38.8 -69.3 -34.2 69.5 -47.0 49.7 566 133 B L H >< S+ 0 0 1 -4,-2.7 3,-0.8 1,-0.1 4,-0.2 0.559 97.1 80.9 -93.1 -11.9 71.5 -45.8 46.6 567 134 B S G >< S+ 0 0 55 -4,-1.1 3,-1.8 -5,-0.2 -1,-0.1 0.874 78.6 65.0 -67.8 -41.5 68.6 -44.0 44.8 568 135 B P G > S+ 0 0 51 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.770 82.0 84.4 -52.2 -26.4 68.7 -40.7 46.8 569 136 B T G < S+ 0 0 1 -3,-0.8 133,-0.2 1,-0.3 -2,-0.2 0.758 94.7 41.4 -45.4 -32.5 72.2 -40.1 45.3 570 137 B F G < S+ 0 0 16 -3,-1.8 -1,-0.3 -4,-0.2 300,-0.1 -0.192 74.5 138.9-122.0 40.5 70.6 -38.6 42.2 571 138 B T <> - 0 0 69 -3,-1.6 4,-2.2 1,-0.1 5,-0.1 -0.295 69.5-104.4 -66.4 166.8 67.7 -36.4 43.2 572 139 B S H > S+ 0 0 47 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.905 122.4 57.0 -58.9 -41.3 67.3 -33.1 41.3 573 140 B G H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.923 110.0 41.5 -55.8 -50.3 68.7 -31.4 44.4 574 141 B K H > S+ 0 0 43 -6,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.877 114.8 52.8 -67.1 -37.8 71.9 -33.4 44.4 575 142 B L H >X S+ 0 0 0 -4,-2.2 4,-0.9 2,-0.2 3,-0.8 0.931 109.6 48.3 -60.8 -48.8 72.2 -33.1 40.6 576 143 B K H >< S+ 0 0 107 -4,-3.4 3,-1.1 1,-0.2 -2,-0.2 0.943 109.3 53.1 -55.9 -50.7 71.9 -29.3 40.8 577 144 B E H 3< S+ 0 0 103 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.677 102.3 61.1 -59.5 -19.8 74.5 -29.1 43.5 578 145 B M H XX S+ 0 0 7 -4,-0.8 4,-2.2 -3,-0.8 3,-0.9 0.795 82.3 80.5 -81.1 -26.7 76.9 -31.1 41.3 579 146 B V H S+ 0 0 89 0, 0.0 4,-0.8 0, 0.0 -1,-0.3 0.812 111.4 51.7 -64.4 -26.3 79.6 -26.3 40.1 581 148 B I H X> S+ 0 0 41 -3,-0.9 4,-0.9 -4,-0.4 3,-0.8 0.945 112.4 44.2 -68.9 -47.8 81.9 -29.2 41.0 582 149 B I H 3X S+ 0 0 2 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.683 105.4 66.5 -66.8 -22.1 81.8 -30.5 37.4 583 150 B A H 3X S+ 0 0 33 -4,-1.6 4,-1.7 -5,-0.3 -1,-0.2 0.771 95.0 54.9 -71.7 -32.7 82.4 -26.9 36.2 584 151 B Q H X S+ 0 0 136 -4,-1.0 4,-1.8 1,-0.2 3,-0.9 0.847 105.2 48.1 -61.4 -36.9 97.3 -27.3 24.5 596 163 B E H 3X S+ 0 0 51 -4,-0.6 4,-1.4 1,-0.2 321,-0.3 0.701 104.3 61.5 -77.4 -20.3 96.6 -29.9 21.8 597 164 B A H 3< S+ 0 0 26 -4,-0.7 322,-0.3 2,-0.1 -1,-0.2 0.428 108.2 45.2 -80.2 -1.9 94.9 -27.1 19.8 598 165 B E H <4 S+ 0 0 149 -3,-0.9 -2,-0.2 -4,-0.1 -3,-0.1 0.807 116.1 40.2-100.9 -50.4 98.3 -25.4 19.8 599 166 B T H < S- 0 0 98 -4,-1.8 -3,-0.1 2,-0.1 -2,-0.1 0.910 98.2-125.1 -67.8 -48.2 100.7 -28.2 18.9 600 167 B G < + 0 0 44 -4,-1.4 -3,-0.1 1,-0.3 -4,-0.1 0.285 53.2 156.3 111.2 -3.2 98.6 -30.0 16.2 601 168 B K - 0 0 123 -6,-0.2 316,-0.4 -5,-0.1 -1,-0.3 -0.297 48.4-118.5 -61.8 131.7 98.7 -33.3 18.0 602 169 B P - 0 0 41 0, 0.0 2,-0.4 0, 0.0 314,-0.2 -0.558 37.6-132.5 -58.8 131.0 95.9 -35.9 17.3 603 170 B V E -O 915 0F 6 312,-3.2 312,-1.8 -2,-0.2 2,-0.9 -0.757 3.4-134.1 -99.0 135.3 94.2 -36.5 20.7 604 171 B T E >> -O 914 0F 52 -2,-0.4 4,-1.5 310,-0.2 3,-0.6 -0.811 21.5-160.4 -84.0 105.9 93.3 -39.9 22.2 605 172 B L H 3> S+ 0 0 0 308,-1.8 4,-3.1 -2,-0.9 5,-0.5 0.860 83.2 56.8 -58.5 -44.5 89.8 -39.2 23.3 606 173 B K H 3> S+ 0 0 36 307,-0.4 4,-0.8 1,-0.2 -1,-0.2 0.811 107.4 50.7 -59.9 -33.5 89.4 -42.0 25.9 607 174 B D H <> S+ 0 0 91 -3,-0.6 4,-1.8 3,-0.2 -1,-0.2 0.924 117.2 37.1 -68.8 -46.5 92.5 -40.7 27.7 608 175 B V H X S+ 0 0 21 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.933 125.1 38.6 -76.0 -45.7 91.3 -37.1 28.0 609 176 B F H X S+ 0 0 1 -4,-3.1 4,-2.4 2,-0.2 -3,-0.2 0.750 114.9 58.6 -71.8 -27.0 87.6 -37.9 28.6 610 177 B G H X S+ 0 0 0 -4,-0.8 4,-1.6 -5,-0.5 -2,-0.2 0.911 107.8 43.2 -66.9 -44.1 88.7 -40.8 30.7 611 178 B A H X S+ 0 0 13 -4,-1.8 4,-1.8 2,-0.2 18,-0.2 0.815 115.9 49.4 -73.9 -32.2 90.7 -38.6 33.1 612 179 B Y H X S+ 0 0 1 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.898 110.3 50.1 -68.4 -44.9 87.8 -36.1 33.2 613 180 B S H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.793 111.5 48.7 -65.8 -31.6 85.2 -38.8 33.9 614 181 B M H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 5,-0.3 0.908 111.3 49.2 -73.6 -44.9 87.3 -40.2 36.7 615 182 B D H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 5,-0.2 0.919 113.3 48.4 -57.6 -46.7 87.8 -36.7 38.3 616 183 B V H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.3 0.970 114.2 43.1 -56.8 -57.9 84.0 -36.0 38.0 617 184 B I H X S+ 0 0 4 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.791 116.0 47.2 -70.3 -30.0 82.8 -39.3 39.5 618 185 B T H X S+ 0 0 0 -4,-2.2 4,-1.8 3,-0.2 6,-0.9 0.861 116.1 44.5 -74.0 -37.2 85.3 -39.3 42.4 619 186 B S H X S+ 0 0 6 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.985 118.0 40.8 -71.8 -56.6 84.7 -35.7 43.3 620 187 B T H < S+ 0 0 0 -4,-2.4 82,-0.4 -5,-0.2 -1,-0.2 0.722 126.2 37.7 -61.8 -26.0 80.9 -35.7 43.2 621 188 B S H < S+ 0 0 1 -4,-0.8 82,-1.8 -5,-0.3 -1,-0.2 0.667 133.9 17.7-101.9 -21.4 80.8 -39.2 44.8 622 189 B F H < S- 0 0 3 -4,-1.8 -3,-0.2 80,-0.1 -2,-0.2 0.433 91.0-121.7-131.7 -1.1 83.6 -39.0 47.4 623 190 B G S < S+ 0 0 52 -4,-2.6 2,-0.5 -5,-0.2 -4,-0.2 0.768 71.6 126.4 64.5 27.7 84.4 -35.2 47.9 624 191 B V - 0 0 45 -6,-0.9 2,-0.6 -9,-0.1 -1,-0.2 -0.966 53.1-148.5-126.9 121.1 88.0 -35.9 46.8 625 192 B N + 0 0 84 -2,-0.5 -10,-0.1 1,-0.1 -9,-0.0 -0.771 21.9 167.6 -81.7 122.7 90.1 -34.2 44.2 626 193 B I - 0 0 37 -2,-0.6 -1,-0.1 -11,-0.1 10,-0.1 0.407 38.9-137.0-111.9 -4.6 92.6 -36.6 42.7 627 194 B D >> + 0 0 58 1,-0.1 3,-2.2 -12,-0.1 4,-0.7 0.796 40.1 164.1 56.5 34.3 93.4 -34.3 39.7 628 195 B S T 34 + 0 0 2 1,-0.3 3,-0.3 2,-0.2 6,-0.2 0.720 67.4 67.4 -51.1 -24.7 93.3 -37.3 37.3 629 196 B L T 34 S+ 0 0 15 -18,-0.2 -1,-0.3 1,-0.2 -17,-0.1 0.728 106.2 38.6 -75.0 -22.1 93.2 -34.7 34.5 630 197 B N T <4 S+ 0 0 58 -3,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.394 107.4 64.6-111.4 -2.1 96.7 -33.5 35.2 631 198 B N >< - 0 0 82 -4,-0.7 3,-1.0 -3,-0.3 -1,-0.2 -0.957 56.3-175.2-121.1 112.0 98.5 -36.8 36.0 632 199 B P T 3 S+ 0 0 135 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.733 86.1 53.7 -80.9 -21.3 98.6 -39.1 33.0 633 200 B Q T 3 S+ 0 0 177 4,-0.0 -5,-0.0 5,-0.0 -2,-0.0 0.257 81.8 154.2 -89.4 12.5 100.2 -42.0 35.0 634 201 B D <> - 0 0 13 -3,-1.0 4,-2.4 -6,-0.2 3,-0.1 -0.138 44.1-142.0 -51.0 126.4 97.4 -41.7 37.6 635 202 B P H > S+ 0 0 67 0, 0.0 4,-3.5 0, 0.0 5,-0.3 0.858 95.1 61.0 -53.5 -45.1 96.7 -44.9 39.5 636 203 B F H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.923 114.0 33.1 -53.7 -53.5 92.9 -44.5 39.6 637 204 B V H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.941 117.5 57.3 -66.7 -48.5 92.5 -44.5 35.8 638 205 B E H X S+ 0 0 94 -4,-2.4 4,-0.6 1,-0.2 -2,-0.2 0.906 116.5 34.5 -45.4 -50.8 95.4 -47.0 35.4 639 206 B N H >X S+ 0 0 21 -4,-3.5 4,-1.0 1,-0.2 3,-0.8 0.921 111.7 57.7 -76.9 -43.8 93.7 -49.5 37.7 640 207 B T H 3< S+ 0 0 1 -4,-2.3 4,-0.4 -5,-0.3 -1,-0.2 0.773 103.6 54.3 -64.5 -26.0 90.0 -49.0 36.8 641 208 B K H 3< S+ 0 0 77 -4,-1.9 3,-0.3 1,-0.2 -1,-0.3 0.778 105.2 53.0 -81.3 -22.5 90.6 -49.7 33.1 642 209 B K H << S+ 0 0 100 -3,-0.8 3,-0.3 -4,-0.6 -1,-0.2 0.714 83.7 96.6 -73.0 -22.0 92.2 -53.1 34.0 643 210 B L S < S+ 0 0 7 -4,-1.0 2,-0.4 1,-0.2 -1,-0.2 0.815 94.2 18.7 -39.7 -53.7 89.1 -54.0 36.1 644 211 B L + 0 0 56 -4,-0.4 2,-0.4 -3,-0.3 -1,-0.2 -0.894 51.5 161.6-131.6 111.9 87.4 -55.9 33.3 645 212 B R + 0 0 158 -2,-0.4 2,-0.4 -3,-0.3 -3,-0.0 -0.668 25.5 176.2-110.5 69.6 89.1 -57.4 30.2 646 213 B F + 0 0 60 -2,-0.4 259,-1.2 6,-0.0 2,-0.3 -0.633 8.8 160.9 -72.6 128.7 86.2 -59.9 29.4 647 214 B D > - 0 0 47 -2,-0.4 3,-0.6 257,-0.2 6,-0.4 -0.986 47.2-148.2-153.4 142.1 87.0 -61.7 26.2 648 215 B F T 3 S+ 0 0 26 -2,-0.3 -1,-0.1 1,-0.2 6,-0.1 0.660 105.4 64.3 -78.4 -19.0 85.8 -64.9 24.5 649 216 B L T 3 S+ 0 0 145 -3,-0.1 -1,-0.2 5,-0.0 3,-0.1 0.445 89.8 83.4 -81.1 -4.1 89.3 -65.0 23.0 650 217 B D S <> S- 0 0 59 -3,-0.6 4,-1.8 1,-0.1 3,-0.4 -0.906 79.8-141.2 -98.4 127.7 90.5 -65.5 26.6 651 218 B P H > S+ 0 0 89 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.870 94.4 62.3 -53.6 -42.0 90.2 -69.1 27.9 652 219 B F H > S+ 0 0 59 1,-0.2 4,-0.9 2,-0.2 5,-0.1 0.874 109.6 36.7 -58.6 -45.3 89.0 -68.1 31.4 653 220 B F H > S+ 0 0 12 -6,-0.4 4,-2.6 -3,-0.4 3,-0.4 0.896 114.7 54.9 -78.6 -38.0 85.8 -66.5 30.3 654 221 B L H X S+ 0 0 60 -4,-1.8 4,-1.6 -7,-0.4 5,-0.3 0.925 109.8 49.5 -53.7 -44.9 85.1 -68.9 27.5 655 222 B S H X S+ 0 0 54 -4,-2.8 4,-0.8 1,-0.2 -1,-0.2 0.704 120.2 33.5 -72.0 -24.0 85.4 -71.8 30.1 656 223 B I H < S+ 0 0 9 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.584 110.3 63.6-106.5 -16.8 83.0 -70.2 32.7 657 224 B T H < S+ 0 0 27 -4,-2.6 -145,-0.2 -5,-0.1 -2,-0.2 0.862 120.1 26.8 -71.0 -37.5 80.7 -68.6 30.1 658 225 B V H < S+ 0 0 4 -4,-1.6 -147,-1.5 -5,-0.3 -146,-0.3 0.849 124.9 49.1 -86.9 -40.3 79.8 -72.1 28.9 659 226 B F >< + 0 0 42 -4,-0.8 3,-1.1 -5,-0.3 -1,-0.2 -0.778 52.5 173.7-118.3 94.1 80.5 -74.1 32.1 660 227 B P T 3 + 0 0 66 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.376 67.2 81.5 -82.7 2.8 78.9 -72.9 35.4 661 228 B F T 3 S+ 0 0 128 1,-0.2 4,-0.1 2,-0.1 -5,-0.1 0.511 87.8 58.0 -85.9 -4.3 79.9 -75.9 37.5 662 229 B L S <> S+ 0 0 57 -3,-1.1 4,-2.2 -7,-0.2 3,-0.5 0.609 88.1 77.4 -93.3 -19.2 83.4 -74.4 38.0 663 230 B I H > S+ 0 0 32 -3,-0.4 4,-1.6 1,-0.2 5,-0.2 0.940 92.8 46.7 -63.0 -52.1 82.1 -71.1 39.5 664 231 B P H > S+ 0 0 84 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.674 113.2 53.5 -66.4 -11.9 81.4 -72.4 43.0 665 232 B I H > S+ 0 0 88 -3,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.905 107.2 47.3 -80.9 -49.3 84.8 -74.1 43.0 666 233 B L H <>S+ 0 0 32 -4,-2.2 5,-4.1 2,-0.2 -3,-0.1 0.749 108.6 58.0 -62.7 -28.0 86.8 -71.0 42.1 667 234 B E H ><5S+ 0 0 60 -4,-1.6 3,-0.6 3,-0.2 -1,-0.2 0.900 107.9 44.5 -66.7 -45.0 84.8 -69.2 44.8 668 235 B V H 3<5S+ 0 0 127 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.907 114.0 50.5 -61.2 -42.4 86.1 -71.8 47.3 669 236 B L T 3<5S- 0 0 112 -4,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.532 116.8-122.9 -71.6 -6.3 89.6 -71.3 45.7 670 237 B N T < 5 + 0 0 108 -3,-0.6 2,-0.3 1,-0.2 -3,-0.2 0.881 56.3 155.7 61.5 44.1 89.0 -67.5 46.2 671 238 B I < - 0 0 66 -5,-4.1 2,-0.3 -8,-0.2 -1,-0.2 -0.744 23.0-161.2 -99.7 149.8 89.4 -66.7 42.4 672 239 B C - 0 0 40 -2,-0.3 -128,-0.2 2,-0.2 4,-0.1 -0.973 31.8-136.6-136.4 143.1 87.8 -63.6 40.9 673 240 B V S S+ 0 0 8 -130,-1.6 -28,-0.3 -2,-0.3 -129,-0.1 0.554 97.6 73.2 -67.2 -10.9 86.9 -62.4 37.4 674 241 B F S S- 0 0 14 -131,-0.3 -2,-0.2 -130,-0.1 -30,-0.1 -0.916 100.3-107.3-106.1 131.2 88.4 -59.1 38.6 675 242 B P >> - 0 0 57 0, 0.0 4,-2.5 0, 0.0 3,-0.7 -0.398 21.3-142.6 -59.9 130.5 92.2 -58.9 38.9 676 243 B R H 3> S+ 0 0 150 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.862 102.0 60.7 -66.2 -35.2 93.0 -58.9 42.7 677 244 B E H 3> S+ 0 0 158 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.847 110.7 42.5 -55.2 -35.5 95.8 -56.4 42.0 678 245 B V H <> S+ 0 0 3 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.918 114.2 47.6 -78.8 -47.9 93.1 -54.1 40.8 679 246 B T H X S+ 0 0 6 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.819 109.2 56.6 -63.8 -32.6 90.5 -54.8 43.5 680 247 B N H X S+ 0 0 59 -4,-2.9 4,-3.5 2,-0.2 5,-0.2 0.965 106.4 48.2 -61.0 -55.3 93.1 -54.3 46.2 681 248 B F H X S+ 0 0 40 -4,-1.3 4,-3.1 -5,-0.2 -2,-0.2 0.890 115.9 45.6 -48.5 -46.4 94.0 -50.8 45.0 682 249 B L H X S+ 0 0 2 -4,-1.8 4,-3.2 2,-0.2 5,-0.3 0.953 113.6 46.9 -67.8 -53.4 90.3 -50.0 44.9 683 250 B R H X S+ 0 0 79 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.957 116.7 45.9 -48.0 -55.8 89.5 -51.5 48.3 684 251 B K H X S+ 0 0 132 -4,-3.5 4,-2.2 -5,-0.2 -2,-0.2 0.929 114.7 47.9 -53.5 -50.8 92.6 -49.7 49.7 685 252 B S H X S+ 0 0 5 -4,-3.1 4,-1.8 -5,-0.2 -2,-0.2 0.919 114.3 43.9 -58.3 -52.5 91.6 -46.4 47.9 686 253 B V H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.855 110.6 57.7 -63.6 -37.4 88.0 -46.4 49.0 687 254 B K H X S+ 0 0 114 -4,-2.7 4,-3.3 -5,-0.3 -2,-0.2 0.954 108.4 45.0 -54.2 -53.5 89.0 -47.4 52.6 688 255 B R H X S+ 0 0 135 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.823 113.3 50.8 -62.6 -35.5 91.3 -44.3 52.9 689 256 B M H X S+ 0 0 16 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.868 113.1 44.8 -71.4 -39.2 88.6 -42.1 51.5 690 257 B K H X S+ 0 0 25 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.953 115.2 48.0 -63.2 -51.1 86.0 -43.5 53.9 691 258 B E H < S+ 0 0 91 -4,-3.3 4,-0.3 1,-0.2 -2,-0.2 0.822 111.7 52.0 -61.8 -33.5 88.5 -43.2 56.8 692 259 B S H >X S+ 0 0 56 -4,-2.1 4,-1.9 -5,-0.2 3,-1.2 0.899 105.1 53.3 -65.1 -48.4 89.3 -39.6 55.7 693 260 B R H 3X S+ 0 0 43 -4,-1.9 4,-0.8 1,-0.2 -2,-0.2 0.887 105.9 54.4 -55.7 -40.8 85.7 -38.4 55.6 694 261 B L H 3< S+ 0 0 102 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.606 115.0 39.5 -73.2 -11.5 85.2 -39.6 59.2 695 262 B E H <4 S+ 0 0 148 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.598 109.5 56.7-112.5 -19.9 88.2 -37.6 60.4 696 263 B D H < 0 0 129 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.570 360.0 360.0 -77.6 -14.7 87.6 -34.5 58.3 697 264 B T < 0 0 159 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.1 0.360 360.0 360.0 7.3 360.0 84.1 -34.3 60.0 698 ! 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 0.0 699 268 B R 0 0 138 0, 0.0 2,-0.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 147.8 78.2 -32.5 52.4 700 269 B V + 0 0 69 4,-0.1 2,-0.3 3,-0.1 3,-0.0 -0.454 360.0 133.1 -72.3 111.6 75.7 -35.1 51.5 701 270 B D >> - 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