==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 19-MAY-10 3N2S . COMPND 2 MOLECULE: NADPH-DEPENDENT NITRO/FLAVIN REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.MORERA,V.GUEGUEN-CHAIGNON,P.MEYER,S.CORTIAL,J.OUAZZANI . 991 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37083.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 735 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 100 10.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 51 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 115 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 383 38.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.4 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 6 0 1 5 7 3 7 1 4 0 0 0 0 0 0 0 0 0 2 2 4 0 0 0 0 0 0 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 . 4 0 0 0 4 4 0 4 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 . 0 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 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 2 A N > 0 0 94 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 168.7 49.2 23.0 55.7 2 3 A N H > + 0 0 108 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.750 360.0 55.0 -58.6 -38.4 50.7 21.0 52.7 3 4 A T H > S+ 0 0 5 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.934 110.2 44.4 -65.3 -50.5 47.5 19.1 51.9 4 5 A I H > S+ 0 0 16 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.900 112.4 53.6 -63.3 -38.2 45.4 22.3 51.5 5 6 A E H X S+ 0 0 135 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.927 110.6 46.6 -61.4 -43.8 48.3 23.9 49.5 6 7 A T H < S+ 0 0 23 -4,-2.2 4,-0.5 2,-0.2 -2,-0.2 0.927 113.2 49.4 -61.9 -47.8 48.2 20.9 47.1 7 8 A I H >< S+ 0 0 1 -4,-2.6 3,-1.3 1,-0.2 -2,-0.2 0.944 114.5 43.8 -56.5 -50.4 44.4 21.1 46.8 8 9 A L H 3< S+ 0 0 44 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.725 106.8 61.8 -70.7 -20.4 44.5 24.8 46.1 9 10 A N T 3< S+ 0 0 92 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.521 79.2 134.4 -80.5 -8.9 47.4 24.4 43.6 10 11 A H < + 0 0 13 -3,-1.3 162,-0.3 -4,-0.5 2,-0.3 -0.127 20.1 156.9 -51.0 137.8 45.3 22.2 41.3 11 12 A R - 0 0 42 160,-0.1 120,-0.5 120,-0.1 2,-0.2 -0.943 47.2-101.4-151.3 146.4 45.3 22.6 37.5 12 13 A S - 0 0 24 -2,-0.3 2,-0.5 158,-0.2 120,-0.2 -0.521 33.7-146.3 -68.4 134.9 44.4 20.0 34.8 13 14 A I + 0 0 5 118,-2.1 148,-0.1 -2,-0.2 155,-0.1 -0.938 25.9 168.9-108.5 123.6 47.6 18.6 33.2 14 15 A R + 0 0 81 -2,-0.5 2,-0.4 153,-0.2 54,-0.1 0.228 62.3 67.5-118.6 12.9 47.2 17.7 29.5 15 16 A S + 0 0 27 152,-0.4 151,-2.9 53,-0.1 152,-1.1 -0.948 62.8 170.7-138.1 111.4 50.9 17.2 28.6 16 17 A F B -A 165 0A 3 -2,-0.4 2,-0.1 55,-0.4 147,-0.0 -0.868 31.8-116.9-120.5 157.3 52.6 14.2 30.2 17 18 A T - 0 0 44 147,-2.6 147,-0.3 -2,-0.3 149,-0.1 -0.342 36.7-107.6 -79.9 172.4 56.0 12.4 29.8 18 19 A D S S+ 0 0 133 145,-0.1 2,-0.5 -2,-0.1 54,-0.1 0.428 79.6 124.5 -81.2 1.2 56.1 8.8 28.5 19 20 A Q - 0 0 103 145,-0.1 145,-0.5 1,-0.1 -2,-0.1 -0.507 57.0-139.3 -68.0 115.4 57.1 7.6 32.1 20 21 A L - 0 0 117 -2,-0.5 54,-0.2 1,-0.1 53,-0.2 -0.347 20.2-102.7 -74.0 153.5 54.5 5.0 33.2 21 22 A L - 0 0 13 52,-2.5 -1,-0.1 141,-0.2 2,-0.1 -0.512 40.4-118.4 -69.9 145.1 53.1 4.9 36.8 22 23 A T > - 0 0 66 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.383 22.0-109.8 -78.7 165.5 54.7 2.1 38.9 23 24 A A H > S+ 0 0 83 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.861 122.3 53.4 -63.4 -33.3 52.6 -0.8 40.3 24 25 A E H > S+ 0 0 149 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.880 108.8 47.5 -66.4 -44.7 53.3 0.8 43.8 25 26 A E H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.919 113.8 47.8 -62.6 -45.5 52.0 4.3 42.6 26 27 A I H X S+ 0 0 21 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.909 111.8 51.0 -61.1 -45.9 48.8 2.6 41.0 27 28 A D H X S+ 0 0 51 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.928 111.5 46.4 -56.8 -47.7 48.3 0.6 44.3 28 29 A T H X S+ 0 0 35 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.897 112.7 50.7 -62.3 -43.9 48.5 3.8 46.4 29 30 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.908 112.5 46.1 -61.0 -45.8 46.1 5.7 44.0 30 31 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.936 114.0 47.5 -64.0 -49.5 43.5 2.8 44.1 31 32 A K H X S+ 0 0 97 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.875 111.8 51.6 -58.8 -40.6 43.7 2.5 48.0 32 33 A S H < S+ 0 0 0 -4,-2.4 4,-0.3 2,-0.2 3,-0.3 0.927 110.2 48.6 -62.2 -45.4 43.4 6.3 48.3 33 34 A A H >< S+ 0 0 0 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.941 110.6 51.1 -57.2 -51.0 40.3 6.3 46.0 34 35 A Q H 3< S+ 0 0 10 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.759 96.6 69.7 -60.5 -28.7 38.7 3.4 48.1 35 36 A A T 3< S+ 0 0 12 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.577 76.7 109.0 -68.3 -12.5 39.3 5.3 51.4 36 37 A A S < S- 0 0 2 -3,-1.6 80,-0.1 -4,-0.3 79,-0.0 -0.251 83.9 -91.2 -62.9 152.7 36.6 7.9 50.4 37 38 A S - 0 0 10 78,-0.1 2,-0.3 223,-0.1 -1,-0.1 -0.234 43.9-158.0 -56.8 154.7 33.2 7.9 52.3 38 39 A T > - 0 0 21 -3,-0.1 3,-2.0 344,-0.1 70,-0.0 -0.983 24.0-104.4-146.4 126.7 30.6 5.7 50.7 39 40 A S G > S- 0 0 35 -2,-0.3 3,-2.3 1,-0.3 4,-0.2 -0.325 102.4 -15.1 -55.1 123.2 26.7 5.9 51.0 40 41 A S G 3 S- 0 0 71 1,-0.3 -1,-0.3 2,-0.1 436,-0.1 0.724 115.6 -76.4 48.9 28.9 25.5 3.0 53.3 41 42 A Y G < S+ 0 0 6 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.582 98.4 134.4 64.5 14.4 29.0 1.3 52.9 42 43 A V < - 0 0 3 -3,-2.3 3,-0.1 2,-0.1 -2,-0.1 0.728 47.8-156.7 -66.7 -28.2 27.8 0.2 49.4 43 44 A Q - 0 0 0 -4,-0.2 2,-2.0 1,-0.2 66,-0.1 0.920 15.1-170.6 47.2 54.6 31.1 1.2 47.5 44 45 A A + 0 0 0 -5,-0.2 37,-2.4 64,-0.1 2,-0.3 -0.239 44.9 80.4 -78.1 52.3 29.0 1.4 44.3 45 46 A Y E -B 80 0B 3 -2,-2.0 2,-0.3 35,-0.3 35,-0.2 -0.966 53.5-155.2-150.9 165.1 31.9 1.9 41.9 46 47 A S E -B 79 0B 0 33,-1.9 33,-2.9 -2,-0.3 2,-0.5 -0.949 11.9-146.5-139.8 152.0 34.7 0.2 39.9 47 48 A I E -Bc 78 430B 0 382,-3.2 384,-2.6 -2,-0.3 2,-0.6 -0.993 8.2-160.3-123.4 120.3 37.9 1.5 38.5 48 49 A I E -Bc 77 431B 0 29,-2.8 29,-2.5 -2,-0.5 2,-0.7 -0.918 8.7-150.6-105.6 116.3 39.3 0.1 35.2 49 50 A G E -Bc 76 432B 0 382,-3.2 384,-2.6 -2,-0.6 2,-0.7 -0.774 12.5-157.5 -86.3 112.1 43.0 0.7 34.7 50 51 A V E +B 75 0B 0 25,-4.0 25,-1.3 -2,-0.7 382,-0.1 -0.848 37.2 141.4-100.4 110.7 43.7 1.0 31.0 51 52 A S + 0 0 63 -2,-0.7 -1,-0.2 23,-0.1 25,-0.0 0.511 37.8 110.9-118.3 -17.2 47.3 0.2 29.9 52 53 A D > - 0 0 50 1,-0.1 4,-2.6 2,-0.1 3,-0.3 -0.470 65.2-142.2 -63.8 115.5 46.6 -1.7 26.6 53 54 A P H > S+ 0 0 34 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.873 98.9 50.8 -49.4 -42.5 47.8 0.7 23.8 54 55 A E H > S+ 0 0 45 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.904 113.0 44.6 -64.0 -42.9 44.9 -0.2 21.5 55 56 A K H > S+ 0 0 41 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.898 112.3 51.1 -68.8 -40.3 42.2 0.4 24.2 56 57 A K H X S+ 0 0 14 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.906 112.7 48.7 -60.9 -41.0 43.9 3.7 25.3 57 58 A R H X S+ 0 0 8 -4,-2.2 4,-2.2 -5,-0.3 -2,-0.2 0.931 110.8 48.5 -63.3 -50.7 43.8 4.8 21.6 58 59 A E H X S+ 0 0 53 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.914 112.6 48.6 -57.4 -46.8 40.2 3.8 21.1 59 60 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.888 108.5 53.9 -62.4 -39.1 39.1 5.7 24.2 60 61 A S H <>S+ 0 0 4 -4,-2.1 5,-1.6 2,-0.2 6,-1.0 0.932 112.3 44.6 -58.6 -47.3 41.1 8.8 23.1 61 62 A V H ><5S+ 0 0 50 -4,-2.2 3,-1.9 3,-0.2 4,-0.4 0.946 113.9 48.4 -62.0 -51.2 39.2 8.7 19.8 62 63 A L H 3<5S+ 0 0 16 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.845 106.4 58.9 -58.7 -34.0 35.8 8.2 21.4 63 64 A A T 3<5S- 0 0 0 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.483 134.1 -88.9 -74.6 -3.3 36.6 11.0 23.9 64 65 A G T < 5S- 0 0 12 -3,-1.9 -3,-0.2 -4,-0.2 -2,-0.2 0.748 77.9 -56.1 98.5 33.8 37.0 13.4 20.9 65 66 A N S - 0 0 8 -6,-1.0 3,-1.7 1,-0.1 4,-0.5 -0.931 18.4-164.7-111.4 101.4 42.3 13.7 23.4 67 68 A P G >> S+ 0 0 50 0, 0.0 4,-3.0 0, 0.0 3,-0.7 0.750 83.3 68.4 -62.8 -25.5 46.0 12.7 23.1 68 69 A Y G 34 S+ 0 0 6 1,-0.2 64,-0.1 2,-0.2 94,-0.1 0.466 90.4 65.2 -72.7 -0.1 46.6 12.9 26.9 69 70 A V G <4 S+ 0 0 0 -3,-1.7 -1,-0.2 92,-0.1 3,-0.2 0.815 114.1 30.5 -86.1 -38.6 44.3 9.8 27.2 70 71 A E T <4 S+ 0 0 63 -3,-0.7 2,-1.0 -4,-0.5 -2,-0.2 0.881 118.9 56.5 -83.2 -48.7 46.9 7.7 25.2 71 72 A K S < S+ 0 0 81 -4,-3.0 -55,-0.4 -15,-0.1 2,-0.3 -0.783 85.8 91.7 -94.5 95.7 50.1 9.6 26.4 72 73 A N S S- 0 0 5 -2,-1.0 91,-0.2 -3,-0.2 3,-0.1 -0.909 85.9 -94.1-163.1-178.7 50.1 9.4 30.2 73 74 A G S S- 0 0 2 89,-1.8 -52,-2.5 1,-0.3 2,-0.2 0.731 103.4 -20.2 -79.7 -28.2 51.4 7.3 33.1 74 75 A H E - D 0 162B 12 88,-1.4 88,-2.1 -54,-0.2 2,-0.5 -0.849 59.3-133.8-174.1 148.6 48.1 5.3 33.4 75 76 A F E -BD 50 161B 0 -25,-1.3 -25,-4.0 -2,-0.2 2,-0.4 -0.968 21.6-166.7-117.5 116.0 44.5 5.8 32.3 76 77 A F E -BD 49 160B 0 84,-2.6 84,-2.5 -2,-0.5 2,-0.5 -0.833 6.9-155.9-100.1 138.6 41.8 5.1 34.9 77 78 A V E -BD 48 159B 0 -29,-2.5 -29,-2.8 -2,-0.4 2,-0.5 -0.967 10.0-150.7-115.7 119.0 38.1 4.7 34.0 78 79 A F E -BD 47 158B 0 80,-2.7 79,-2.9 -2,-0.5 80,-1.2 -0.773 18.2-172.0 -89.9 128.6 35.7 5.4 36.9 79 80 A C E -BD 46 156B 0 -33,-2.9 -33,-1.9 -2,-0.5 2,-0.3 -0.961 30.2-124.8-122.0 144.7 32.4 3.5 36.7 80 81 A A E -BD 45 155B 0 75,-2.6 75,-2.6 -2,-0.4 2,-0.4 -0.618 41.1-163.6 -74.0 132.6 29.1 3.5 38.6 81 82 A D E + D 0 154B 0 -37,-2.4 73,-0.2 -2,-0.3 4,-0.1 -0.902 41.0 144.4-135.1 112.7 28.8 -0.1 39.6 82 83 A L > + 0 0 3 71,-3.2 4,-2.2 -2,-0.4 72,-0.2 0.270 63.6 87.6-118.4 2.5 25.7 -1.9 40.9 83 84 A Y H > S+ 0 0 26 70,-0.9 4,-3.1 2,-0.2 5,-0.2 0.884 83.3 57.7 -67.5 -40.2 26.7 -5.2 39.1 84 85 A R H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.915 110.2 44.6 -53.6 -45.2 28.7 -6.2 42.2 85 86 A H H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.880 111.9 51.7 -70.0 -42.1 25.5 -5.9 44.3 86 87 A Q H X S+ 0 0 28 -4,-2.2 4,-1.7 2,-0.2 10,-0.3 0.944 116.5 40.3 -58.6 -51.0 23.4 -7.7 41.6 87 88 A Q H X S+ 0 0 28 -4,-3.1 4,-1.7 2,-0.2 -2,-0.2 0.843 110.1 58.0 -68.1 -37.1 25.9 -10.7 41.7 88 89 A L H X S+ 0 0 1 -4,-2.4 4,-0.6 -5,-0.2 3,-0.2 0.925 110.3 45.3 -56.4 -46.8 26.4 -10.6 45.5 89 90 A A H ><>S+ 0 0 0 -4,-2.0 5,-2.9 1,-0.2 3,-1.1 0.882 107.5 56.9 -68.3 -39.8 22.6 -11.2 45.8 90 91 A E H ><5S+ 0 0 61 -4,-1.7 3,-1.4 1,-0.3 -1,-0.2 0.820 100.3 59.5 -60.9 -32.9 22.5 -14.0 43.1 91 92 A E H 3<5S+ 0 0 64 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.765 107.3 46.5 -63.7 -28.5 25.1 -15.8 45.3 92 93 A K T <<5S- 0 0 91 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.172 126.7-101.8 -98.8 12.2 22.5 -15.8 48.1 93 94 A G T < 5S+ 0 0 56 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.612 83.2 127.9 76.1 15.5 19.8 -17.0 45.7 94 95 A E < - 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0 0 31 -15,-0.1 4,-2.1 1,-0.1 -18,-0.1 -0.444 23.2-110.9 -86.2 167.7 33.9 35.9 29.2 220 221 A W H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.940 116.6 52.3 -65.5 -49.4 32.9 32.8 31.3 221 222 A S H > S+ 0 0 0 1,-0.2 4,-1.7 -24,-0.2 5,-0.2 0.888 112.2 45.8 -59.0 -38.3 29.2 33.1 30.7 222 223 A D H > S+ 0 0 82 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.919 115.1 47.8 -69.7 -41.5 29.7 33.3 26.8 223 224 A Q H X S+ 0 0 8 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.940 113.0 46.2 -62.8 -51.7 32.2 30.3 27.0 224 225 A I H X S+ 0 0 4 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.879 115.3 45.9 -62.8 -39.2 29.9 28.0 29.2 225 226 A L H X S+ 0 0 4 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.881 110.3 54.2 -70.5 -40.7 26.8 28.7 27.1 226 227 A N H < S+ 0 0 95 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.933 116.0 37.9 -57.9 -49.8 28.6 28.2 23.8 227 228 A F H < S+ 0 0 21 -4,-2.2 3,-0.5 1,-0.2 -1,-0.2 0.770 109.0 61.4 -78.3 -22.1 29.9 24.7 24.8 228 229 A X H < S+ 0 0 16 -4,-1.7 2,-1.3 1,-0.3 -1,-0.2 0.923 103.1 52.5 -65.5 -45.3 26.7 23.6 26.7 229 230 A K S < S+ 0 0 57 -4,-1.7 -1,-0.3 -5,-0.1 2,-0.2 -0.530 100.2 79.6 -90.0 61.3 24.7 23.9 23.4 230 231 A Q S S- 0 0 27 -2,-1.3 0, 0.0 -3,-0.5 0, 0.0 -0.818 105.4 -4.6-168.8 128.1 27.2 21.7 21.5 231 232 A K S S- 0 0 47 -2,-0.2 -2,-0.0 1,-0.1 -4,-0.0 0.944 72.9-177.6 43.8 60.0 27.3 17.8 21.7 232 233 A P - 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0 0 66 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.392 22.2-109.7 -79.3 164.4 35.8 30.0 62.4 272 24 B A H > S+ 0 0 80 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.854 122.4 53.0 -61.7 -34.9 35.1 32.3 59.4 273 25 B E H > S+ 0 0 148 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.870 108.8 48.1 -66.6 -42.0 38.7 31.6 58.3 274 26 B E H > S+ 0 0 43 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.940 113.2 47.4 -65.1 -45.2 38.2 27.8 58.5 275 27 B I H X S+ 0 0 20 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.912 111.8 51.6 -61.2 -44.2 34.9 28.0 56.5 276 28 B D H X S+ 0 0 51 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.927 111.4 46.2 -58.0 -48.0 36.7 30.3 53.9 277 29 B T H X S+ 0 0 34 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.896 113.1 50.1 -60.4 -45.4 39.6 27.7 53.5 278 30 B L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.902 112.6 46.7 -60.7 -44.5 37.1 24.8 53.2 279 31 B V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.932 113.4 47.6 -65.4 -47.7 35.0 26.6 50.6 280 32 B K H X S+ 0 0 95 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.873 112.2 51.2 -60.4 -39.3 38.1 27.6 48.5 281 33 B S H < S+ 0 0 0 -4,-2.3 3,-0.3 2,-0.2 4,-0.3 0.930 110.6 48.1 -62.6 -45.8 39.4 24.0 48.8 282 34 B A H >< S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.931 111.2 50.9 -58.9 -47.3 36.0 22.7 47.5 283 35 B Q H 3< S+ 0 0 10 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.772 96.9 69.8 -63.6 -27.7 36.0 25.2 44.6 284 36 B A T 3< S+ 0 0 11 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.571 76.2 108.8 -69.3 -11.4 39.6 24.1 43.6 285 37 B A S < S- 0 0 2 -3,-1.5 80,-0.1 -4,-0.3 79,-0.0 -0.287 84.2 -91.5 -63.7 155.1 38.3 20.7 42.4 286 38 B S - 0 0 9 78,-0.1 2,-0.3 -275,-0.1 -1,-0.1 -0.217 44.1-157.6 -57.9 156.2 38.3 20.0 38.6 287 39 B T > - 0 0 17 -3,-0.1 3,-2.0 -154,-0.1 70,-0.0 -0.980 24.0-103.3-146.8 128.3 34.9 20.9 36.9 288 40 B S G > S- 0 0 26 -2,-0.3 3,-2.3 1,-0.3 4,-0.2 -0.297 102.7 -15.6 -54.4 123.6 33.4 19.5 33.7 289 41 B S G 3 S- 0 0 26 1,-0.3 -1,-0.3 421,-0.1 -62,-0.1 0.729 115.3 -76.6 48.4 27.7 33.8 22.2 30.9 290 42 B Y G < S+ 0 0 7 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.572 98.6 133.9 66.2 13.4 34.6 24.8 33.7 291 43 B V < - 0 0 6 -3,-2.3 3,-0.1 -67,-0.1 -2,-0.1 0.698 48.7-155.7 -67.8 -27.8 30.8 24.9 34.4 292 44 B Q - 0 0 0 -4,-0.2 2,-1.9 1,-0.2 66,-0.1 0.912 15.5-170.3 47.7 55.9 31.2 24.7 38.3 293 45 B A + 0 0 0 -5,-0.2 37,-2.5 64,-0.1 2,-0.3 -0.216 45.8 79.1 -78.1 50.6 27.6 23.2 38.4 294 46 B Y E - G 0 329C 3 -2,-1.9 2,-0.3 35,-0.3 35,-0.2 -0.963 54.1-154.9-149.7 166.9 27.1 23.4 42.2 295 47 B S E - G 0 328C 0 33,-1.9 33,-2.8 -2,-0.3 2,-0.5 -0.955 12.3-146.1-141.1 152.8 26.3 25.5 45.2 296 48 B I E -fG 181 327C 0 -116,-3.3 -114,-2.4 -2,-0.3 2,-0.6 -0.992 8.3-159.7-124.1 121.0 27.2 25.1 48.9 297 49 B I E -fG 182 326C 0 29,-2.8 29,-2.7 -2,-0.5 2,-0.7 -0.925 8.6-150.9-106.3 115.4 24.8 26.3 51.5 298 50 B G E -fG 183 325C 0 -116,-3.0 -114,-3.0 -2,-0.6 2,-0.7 -0.791 11.9-158.0 -87.4 111.9 26.4 26.8 54.9 299 51 B V E + G 0 324C 0 25,-3.9 25,-1.3 -2,-0.7 -116,-0.1 -0.854 36.9 141.6-101.4 108.7 23.8 26.2 57.6 300 52 B S + 0 0 56 -2,-0.7 -1,-0.2 23,-0.1 25,-0.0 0.542 38.0 110.1-116.2 -19.0 24.5 27.8 61.0 301 53 B D > - 0 0 63 1,-0.1 4,-2.6 2,-0.1 3,-0.3 -0.471 65.7-142.4 -61.9 115.1 20.9 28.8 61.9 302 54 B P H > S+ 0 0 95 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.852 98.7 51.7 -51.0 -40.9 20.0 26.5 64.9 303 55 B E H > S+ 0 0 94 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.901 112.4 44.7 -64.0 -41.5 16.4 26.1 63.7 304 56 B K H > S+ 0 0 44 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.906 112.3 51.3 -69.4 -40.4 17.4 25.1 60.1 305 57 B K H X S+ 0 0 13 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.903 113.0 48.3 -61.1 -39.1 20.2 22.7 61.4 306 58 B R H X S+ 0 0 92 -4,-2.2 4,-2.2 -5,-0.3 -2,-0.2 0.936 110.8 48.4 -66.2 -50.1 17.5 21.1 63.7 307 59 B E H X S+ 0 0 58 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.908 112.4 49.7 -56.8 -45.8 14.9 20.8 60.9 308 60 B L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.878 107.8 53.0 -63.8 -39.5 17.6 19.2 58.6 309 61 B S H <>S+ 0 0 6 -4,-2.1 5,-1.6 2,-0.2 6,-1.2 0.921 112.9 45.6 -60.4 -41.3 18.6 16.7 61.3 310 62 B V H ><5S+ 0 0 61 -4,-2.2 3,-1.9 4,-0.2 4,-0.4 0.956 113.7 47.4 -64.4 -51.0 14.9 15.6 61.6 311 63 B L H 3<5S+ 0 0 16 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.832 106.6 59.6 -59.7 -32.4 14.4 15.4 57.8 312 64 B A T 3<5S- 0 0 3 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.454 134.4 -88.2 -75.5 -2.1 17.7 13.4 57.6 313 65 B G T < 5S- 0 0 44 -3,-1.9 -3,-0.2 -4,-0.1 -2,-0.2 0.754 78.3 -56.2 97.7 34.2 16.1 10.8 59.9 314 66 B N S > - 0 0 40 -6,-1.2 3,-1.8 1,-0.1 4,-0.5 -0.931 19.3-163.8-109.2 102.0 20.9 12.4 62.9 316 68 B P H >> S+ 0 0 86 0, 0.0 4,-3.0 0, 0.0 3,-0.9 0.778 83.6 66.9 -62.6 -28.2 22.1 14.6 65.9 317 69 B Y H 34 S+ 0 0 43 1,-0.2 64,-0.1 2,-0.2 94,-0.1 0.490 91.0 64.8 -69.4 -5.3 25.5 15.3 64.3 318 70 B V H <4 S+ 0 0 0 -3,-1.8 -1,-0.2 92,-0.1 3,-0.1 0.815 115.1 30.9 -80.9 -36.4 23.7 17.4 61.6 319 71 B E H << S+ 0 0 85 -3,-0.9 2,-1.0 -4,-0.5 -2,-0.2 0.899 118.6 55.2 -85.9 -50.1 22.7 19.8 64.4 320 72 B K S < S+ 0 0 108 -4,-3.0 -55,-0.4 -15,-0.1 2,-0.3 -0.762 86.2 92.8 -93.9 96.0 25.7 19.4 66.8 321 73 B N S S- 0 0 4 -2,-1.0 91,-0.2 -3,-0.1 3,-0.1 -0.915 85.8 -92.9-163.1-178.7 28.8 20.2 64.7 322 74 B G S S- 0 0 1 89,-1.7 -52,-2.6 1,-0.3 2,-0.2 0.737 103.7 -19.7 -79.1 -27.7 31.2 23.1 63.8 323 75 B H E - H 0 411C 10 88,-1.5 88,-2.1 -54,-0.2 2,-0.5 -0.868 59.2-134.0-173.9 147.9 29.2 23.9 60.6 324 76 B F E -GH 299 410C 0 -25,-1.3 -25,-3.9 -2,-0.2 2,-0.4 -0.964 21.7-167.3-116.4 115.5 26.7 22.1 58.4 325 77 B F E -GH 298 409C 0 84,-2.6 84,-2.4 -2,-0.5 2,-0.5 -0.852 6.6-156.4-100.4 136.8 27.3 22.4 54.6 326 78 B V E -GH 297 408C 0 -29,-2.7 -29,-2.8 -2,-0.4 2,-0.5 -0.962 9.5-150.5-114.2 120.0 24.7 21.4 52.1 327 79 B F E -GH 296 407C 0 80,-2.7 79,-2.9 -2,-0.5 80,-1.2 -0.768 18.4-171.5 -91.1 128.0 26.0 20.5 48.6 328 80 B C E -GH 295 405C 0 -33,-2.8 -33,-1.9 -2,-0.5 2,-0.2 -0.971 29.8-124.4-121.6 143.5 23.6 21.2 45.7 329 81 B A E -GH 294 404C 0 75,-2.5 75,-2.5 -2,-0.4 2,-0.4 -0.586 40.2-163.0 -72.0 132.1 23.6 20.4 42.0 330 82 B D E + H 0 403C 0 -37,-2.5 73,-0.2 -2,-0.2 4,-0.1 -0.912 40.6 143.7-134.8 110.8 23.2 23.9 40.5 331 83 B L > + 0 0 0 71,-3.2 4,-2.2 -2,-0.4 72,-0.2 0.239 62.7 88.0-118.3 4.4 22.1 24.7 37.0 332 84 B Y H > S+ 0 0 26 70,-0.9 4,-3.0 2,-0.2 5,-0.2 0.885 83.8 56.5 -68.3 -41.1 20.1 27.8 38.1 333 85 B R H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 111.1 44.4 -53.8 -46.0 23.2 29.9 37.7 334 86 B H H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.891 112.2 50.8 -69.8 -42.2 23.5 28.7 34.1 335 87 B Q H X S+ 0 0 25 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.922 113.1 46.8 -61.1 -46.3 19.7 29.2 33.4 336 88 B Q H X S+ 0 0 43 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.867 111.6 49.9 -65.2 -38.9 19.9 32.8 34.8 337 89 B L H < S+ 0 0 5 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.906 113.1 47.9 -63.9 -44.1 23.1 33.6 32.8 338 90 B A H >X>S+ 0 0 2 -4,-2.3 5,-2.5 1,-0.2 3,-1.5 0.920 110.2 51.7 -62.1 -47.8 21.2 32.3 29.6 339 91 B E H ><5S+ 0 0 104 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.903 106.9 52.9 -56.1 -46.5 18.1 34.4 30.4 340 92 B E T 3<5S+ 0 0 93 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.421 114.0 44.6 -70.1 -3.0 20.1 37.6 30.8 341 93 B K T <45S- 0 0 87 -3,-1.5 -1,-0.3 2,-0.2 -2,-0.2 0.377 114.9-111.1-119.1 -2.8 21.6 36.9 27.3 342 94 B G T <<5S+ 0 0 71 -3,-1.3 -3,-0.2 -4,-0.5 2,-0.2 0.647 75.0 132.8 76.9 18.8 18.5 36.0 25.4 343 95 B E < - 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0 0 9 -5,-2.3 -1,-0.3 -6,-0.2 2,-0.3 -0.529 50.9-128.3 -85.5 160.8 38.6 18.2 61.9 379 131 B G E -I 412 0C 2 33,-3.3 33,-1.9 -2,-0.2 2,-0.3 -0.762 22.3-163.9-104.4 152.4 36.1 15.3 61.5 380 132 B I E -I 411 0C 0 -120,-0.5 -118,-2.2 -2,-0.3 2,-0.3 -0.979 13.3-175.0-133.5 155.9 33.5 15.0 58.7 381 133 B C E -I 410 0C 4 29,-1.9 29,-2.9 -2,-0.3 2,-0.2 -0.945 22.2-136.6-148.0 122.7 30.3 13.0 58.0 382 134 B Y E -I 409 0C 34 -2,-0.3 2,-0.4 27,-0.2 27,-0.3 -0.539 16.1-151.9 -72.2 145.5 28.4 13.1 54.7 383 135 B I E > +I 408 0C 2 25,-2.8 25,-2.5 -2,-0.2 3,-0.7 -0.798 31.6 158.3-128.0 88.4 24.6 13.3 55.2 384 136 B G G > + 0 0 19 -2,-0.4 3,-2.4 23,-0.2 -1,-0.1 0.593 60.8 91.4 -79.1 -14.5 22.6 11.7 52.3 385 137 B G G > + 0 0 9 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.720 66.6 75.6 -55.3 -26.1 19.7 11.4 54.7 386 138 B I G X S+ 0 0 0 -3,-0.7 3,-1.2 1,-0.3 -1,-0.3 0.769 82.0 71.2 -58.0 -23.7 18.4 14.8 53.6 387 139 B R G X S+ 0 0 2 -3,-2.4 3,-0.5 1,-0.2 -1,-0.3 0.514 76.8 80.0 -71.9 -3.4 17.2 12.9 50.4 388 140 B N G < S+ 0 0 49 -3,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.822 114.1 13.4 -67.9 -34.3 14.5 11.3 52.5 389 141 B E G X> S+ 0 0 87 -3,-1.2 4,-2.0 -4,-0.3 3,-0.6 -0.436 71.2 160.8-142.5 63.6 12.4 14.5 52.3 390 142 B L H <> S+ 0 0 0 -3,-0.5 4,-2.9 1,-0.2 5,-0.2 0.788 74.0 62.4 -58.3 -31.9 13.9 16.8 49.5 391 143 B D H 3> S+ 0 0 70 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.921 110.9 39.3 -60.2 -41.9 10.6 18.8 49.2 392 144 B K H <> S+ 0 0 106 -3,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.855 113.7 54.9 -75.8 -35.0 10.9 19.9 52.8 393 145 B V H X S+ 0 0 0 -4,-2.0 4,-2.6 -7,-0.3 5,-0.2 0.929 106.7 50.8 -62.7 -45.7 14.8 20.4 52.5 394 146 B T H X>S+ 0 0 8 -4,-2.9 5,-1.5 1,-0.2 4,-0.9 0.824 110.9 50.4 -61.4 -32.3 14.3 22.7 49.5 395 147 B E H <5S+ 0 0 107 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.907 110.5 48.2 -71.7 -41.5 11.8 24.7 51.6 396 148 B V H <5S+ 0 0 9 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.921 122.6 34.6 -61.0 -46.3 14.3 24.9 54.6 397 149 B L H <5S- 0 0 0 -4,-2.6 -211,-2.6 -5,-0.1 -1,-0.2 0.521 100.5-135.3 -88.2 -8.2 17.1 26.1 52.2 398 150 B Q T <5 + 0 0 125 -4,-0.9 -3,-0.2 -5,-0.2 -4,-0.1 0.903 36.7 179.8 52.7 44.6 14.7 28.1 49.9 399 151 B T < - 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0 0 13 -287,-2.3 2,-0.8 -2,-0.3 -387,-0.1 -0.479 42.5-123.4 -67.6 131.8 35.8 -5.5 33.8 436 188 B N + 0 0 72 -2,-0.2 -1,-0.1 1,-0.1 -287,-0.0 -0.735 38.0 166.9 -84.7 110.4 36.4 -8.9 35.4 437 189 B V + 0 0 73 -2,-0.8 2,-0.2 4,-0.0 -1,-0.1 0.299 26.4 137.3-102.4 5.4 33.2 -11.0 35.2 438 190 B N > - 0 0 75 1,-0.1 4,-2.2 2,-0.1 5,-0.1 -0.399 45.3-152.4 -59.6 117.5 34.9 -14.3 36.3 439 191 B T H > S+ 0 0 73 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.849 92.6 52.4 -61.6 -40.4 32.5 -16.0 38.8 440 192 B D H > S+ 0 0 108 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.908 111.2 47.5 -63.0 -43.8 35.2 -17.9 40.7 441 193 B D H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.912 112.7 50.2 -62.4 -44.2 37.2 -14.7 41.2 442 194 B F H X S+ 0 0 38 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.925 111.8 46.4 -59.8 -51.3 34.0 -12.9 42.3 443 195 B R H X S+ 0 0 110 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.877 112.8 49.7 -60.4 -42.5 33.1 -15.6 44.9 444 196 B H H X S+ 0 0 129 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.888 114.8 43.3 -63.4 -45.8 36.7 -15.8 46.3 445 197 B T H X S+ 0 0 12 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.908 116.3 47.3 -67.9 -44.4 36.9 -12.0 46.8 446 198 B X H X S+ 0 0 7 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.855 111.8 50.4 -67.1 -36.1 33.4 -11.7 48.2 447 199 B N H X S+ 0 0 102 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.913 112.1 48.0 -66.3 -44.0 33.9 -14.6 50.6 448 200 B T H X S+ 0 0 68 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.930 115.6 44.2 -60.1 -48.9 37.2 -13.0 51.8 449 201 B Y H X S+ 0 0 1 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.907 109.9 55.1 -64.4 -44.2 35.5 -9.6 52.3 450 202 B D H X S+ 0 0 12 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.836 110.7 45.9 -57.1 -36.8 32.4 -11.2 54.0 451 203 B K H X S+ 0 0 127 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.893 111.1 52.3 -71.5 -44.8 34.8 -12.9 56.6 452 204 B T H X S+ 0 0 62 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.909 115.2 42.5 -55.6 -45.3 36.8 -9.6 57.1 453 205 B I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.911 113.6 49.0 -71.2 -46.8 33.4 -7.7 57.8 454 206 B S H X S+ 0 0 16 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.952 114.7 47.0 -58.9 -44.8 31.8 -10.4 60.0 455 207 B D H X S+ 0 0 67 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.876 109.9 55.0 -60.9 -41.8 35.1 -10.5 62.0 456 208 B Y H X S+ 0 0 47 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.919 110.7 42.9 -56.9 -52.1 35.2 -6.7 62.2 457 209 B Y H X S+ 0 0 9 -4,-2.4 4,-2.4 10,-0.3 5,-0.2 0.859 109.6 57.7 -65.1 -36.6 31.6 -6.5 63.7 458 210 B R H X>S+ 0 0 101 -4,-2.2 5,-2.0 -5,-0.2 4,-0.7 0.889 114.3 38.8 -59.8 -40.6 32.4 -9.4 66.1 459 211 B E H <5S+ 0 0 174 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.880 116.0 51.4 -76.4 -41.0 35.3 -7.3 67.5 460 212 B R H <5S+ 0 0 163 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.831 126.7 23.3 -63.8 -39.5 33.5 -3.9 67.3 461 213 B T H ><5S- 0 0 48 -4,-2.4 3,-0.7 4,-0.3 -1,-0.2 0.321 108.8-114.8-111.1 -0.0 30.4 -5.1 69.3 462 214 B N T 3<5S- 0 0 145 -4,-0.7 -3,-0.2 1,-0.2 -4,-0.1 0.971 77.7 -42.4 57.6 64.5 31.9 -8.1 71.1 463 215 B G T 3 - 0 0 29 1,-0.1 4,-1.9 -15,-0.1 -18,-0.1 -0.454 26.7-106.8 -91.6 172.7 28.7 -10.1 56.6 469 221 B W H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.935 122.6 55.0 -66.8 -36.8 28.9 -7.3 54.0 470 222 B S H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.844 108.3 48.5 -58.8 -43.7 26.5 -9.4 51.7 471 223 B D H > S+ 0 0 78 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.901 113.0 48.1 -62.4 -44.6 23.9 -9.5 54.6 472 224 B Q H X S+ 0 0 28 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.898 113.5 44.9 -68.3 -41.6 24.3 -5.8 55.1 473 225 B I H X S+ 0 0 1 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.913 113.2 51.8 -67.7 -44.6 23.9 -4.9 51.4 474 226 B L H X S+ 0 0 18 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.932 112.9 44.6 -57.2 -45.1 21.0 -7.3 51.0 475 227 B N H < S+ 0 0 125 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.835 113.0 51.6 -68.1 -35.0 19.2 -5.7 53.9 476 228 B F H >< S+ 0 0 34 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.942 109.7 50.0 -64.4 -48.4 20.0 -2.2 52.6 477 229 B X H 3< S+ 0 0 6 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.838 109.0 51.0 -58.2 -38.5 18.6 -3.1 49.2 478 230 B K T 3< S+ 0 0 118 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.459 91.2 112.3 -81.0 -2.1 15.3 -4.4 50.6 479 231 B Q S < S- 0 0 56 -3,-1.4 -3,-0.1 -4,-0.3 0, 0.0 0.003 90.3 -68.0 -62.5 171.1 14.9 -1.2 52.7 480 232 B K - 0 0 164 1,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.504 65.2-134.2 -61.8 110.2 12.1 1.5 52.2 481 233 B P - 0 0 68 0, 0.0 2,-1.3 0, 0.0 3,-0.3 -0.485 9.3-128.4 -78.2 151.4 13.2 2.9 48.8 482 234 B R > + 0 0 53 1,-0.2 3,-1.1 -2,-0.1 -378,-0.3 -0.506 53.8 149.0 -90.6 59.1 13.4 6.6 48.0 483 235 B T T > + 0 0 77 -2,-1.3 3,-2.0 1,-0.2 4,-0.4 0.789 55.5 75.0 -64.5 -32.1 11.3 5.9 44.8 484 236 B Y T >> S+ 0 0 75 -3,-0.3 4,-2.9 1,-0.3 3,-0.6 0.689 80.6 73.3 -54.1 -26.2 9.6 9.4 45.0 485 237 B L H <> S+ 0 0 0 -3,-1.1 4,-2.3 1,-0.2 5,-0.3 0.768 80.7 70.5 -63.7 -26.5 13.0 10.9 43.7 486 238 B N H <4 S+ 0 0 17 -3,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.926 116.6 23.4 -53.7 -45.5 12.2 9.5 40.2 487 239 B D H <> S+ 0 0 113 -3,-0.6 4,-1.6 -4,-0.4 -2,-0.2 0.837 119.9 59.8 -89.2 -39.5 9.5 12.2 39.9 488 240 B Y H X S+ 0 0 7 -4,-2.9 4,-1.2 1,-0.2 -3,-0.2 0.882 101.3 52.1 -60.7 -45.2 10.7 14.7 42.5 489 241 B V H <>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 3,-0.4 0.884 109.6 52.5 -57.5 -37.0 14.1 15.4 40.7 490 242 B K H >45S+ 0 0 47 -4,-0.5 3,-1.4 -5,-0.3 -2,-0.2 0.846 103.0 58.2 -63.1 -37.8 12.0 16.1 37.5 491 243 B E H 3<5S+ 0 0 113 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.797 104.8 51.1 -62.9 -30.9 9.9 18.6 39.5 492 244 B K T 3<5S- 0 0 30 -4,-1.2 -90,-2.8 -3,-0.4 -89,-0.3 0.412 128.0 -99.2 -88.3 0.9 13.1 20.5 40.2 493 245 B G T < 5S+ 0 0 0 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.619 86.6 115.1 91.5 16.4 14.0 20.6 36.5 494 246 B F S 0 0 87 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 149.2 38.5 14.5 -10.8 500 3 C N H > + 0 0 86 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.781 360.0 58.8 -74.7 -27.8 37.7 11.6 -8.5 501 4 C T H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.947 107.0 43.4 -64.6 -51.4 41.6 11.5 -8.1 502 5 C I H > S+ 0 0 17 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.905 113.1 53.2 -62.3 -39.6 41.7 15.1 -6.8 503 6 C E H X S+ 0 0 145 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.929 110.7 46.8 -61.8 -43.9 38.7 14.4 -4.6 504 7 C T H X S+ 0 0 31 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.928 113.1 49.3 -61.0 -47.9 40.5 11.4 -3.1 505 8 C I H >< S+ 0 0 0 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.945 115.0 43.1 -56.8 -51.0 43.7 13.5 -2.6 506 9 C L H 3< S+ 0 0 59 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.753 108.1 60.8 -69.9 -22.0 41.8 16.3 -0.9 507 10 C N H 3< S+ 0 0 92 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.537 79.9 134.1 -81.1 -8.5 39.7 13.8 1.2 508 11 C H << + 0 0 13 -3,-1.2 2,-0.3 -4,-0.6 -3,-0.1 -0.089 19.9 156.5 -50.3 138.1 42.8 12.4 2.9 509 12 C R - 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0 0 65 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.403 22.0-110.5 -79.6 163.5 45.3 -9.4 -0.8 521 24 C A H > S+ 0 0 82 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.852 121.7 54.1 -61.3 -34.1 48.4 -10.3 -2.8 522 25 C E H > S+ 0 0 150 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.876 108.6 47.9 -66.0 -41.1 46.8 -8.4 -5.8 523 26 C E H > S+ 0 0 39 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.943 113.2 47.4 -65.7 -46.7 46.3 -5.3 -3.6 524 27 C I H X S+ 0 0 21 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.912 112.2 50.9 -60.1 -44.3 49.9 -5.4 -2.4 525 28 C D H X S+ 0 0 51 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.928 111.8 46.3 -59.3 -48.0 51.1 -5.9 -6.0 526 29 C T H X S+ 0 0 35 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.893 113.0 50.4 -60.5 -44.9 49.1 -2.9 -7.2 527 30 C L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.903 112.5 46.2 -60.8 -45.7 50.4 -0.8 -4.3 528 31 C V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.935 113.6 47.6 -64.5 -49.3 54.0 -1.7 -5.0 529 32 C K H X S+ 0 0 98 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.867 112.2 51.4 -59.0 -39.9 53.7 -1.1 -8.8 530 33 C S H < S+ 0 0 0 -4,-2.3 4,-0.3 2,-0.2 3,-0.3 0.929 110.3 48.6 -62.5 -46.2 52.0 2.3 -8.0 531 34 C A H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.935 111.1 50.3 -57.9 -48.8 54.9 3.2 -5.6 532 35 C Q H 3< S+ 0 0 11 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.772 97.2 69.6 -62.9 -27.1 57.5 2.3 -8.3 533 36 C A T 3< S+ 0 0 12 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.562 76.8 109.4 -69.1 -11.9 55.7 4.4 -11.0 534 37 C A S < S- 0 0 1 -3,-1.6 80,-0.1 -4,-0.3 79,-0.0 -0.285 84.1 -92.0 -62.8 153.4 56.8 7.6 -9.2 535 38 C S - 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0 0 11 -286,-2.7 2,-0.7 -2,-0.3 -386,-0.1 -0.475 42.5-125.2 -67.3 131.0 65.5 -7.3 3.2 933 188 D N + 0 0 72 -2,-0.2 -1,-0.1 -9,-0.1 -286,-0.0 -0.753 35.3 169.9 -87.0 112.0 66.7 -9.9 0.7 934 189 D V + 0 0 71 -2,-0.7 2,-0.2 -287,-0.0 -1,-0.1 0.339 27.6 136.1-100.9 3.8 70.6 -9.9 0.6 935 190 D N > - 0 0 74 1,-0.1 4,-2.1 2,-0.1 5,-0.1 -0.381 45.5-153.0 -60.6 116.9 70.9 -13.1 -1.5 936 191 D T H > S+ 0 0 55 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.848 92.9 52.5 -60.1 -42.3 73.6 -12.4 -4.2 937 192 D D H > S+ 0 0 115 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.903 111.1 47.5 -61.9 -44.1 72.2 -14.9 -6.8 938 193 D D H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.912 113.2 49.2 -61.2 -45.3 68.7 -13.2 -6.5 939 194 D F H X S+ 0 0 25 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.927 112.5 46.6 -60.3 -50.2 70.3 -9.8 -6.8 940 195 D R H X S+ 0 0 116 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.867 112.0 50.5 -62.8 -40.4 72.4 -10.7 -9.9 941 196 D H H X S+ 0 0 128 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.891 114.8 42.9 -64.7 -44.5 69.4 -12.4 -11.7 942 197 D T H X S+ 0 0 11 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.909 116.4 47.1 -69.6 -43.4 67.1 -9.4 -11.1 943 198 D X H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 24,-0.2 0.856 112.3 50.2 -66.7 -36.6 69.8 -6.9 -12.1 944 199 D N H X S+ 0 0 110 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.915 111.8 48.2 -66.1 -44.2 70.8 -8.9 -15.2 945 200 D T H X S+ 0 0 66 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.927 114.8 45.3 -60.8 -48.6 67.1 -9.1 -16.3 946 201 D Y H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.907 110.2 53.4 -62.9 -44.9 66.7 -5.3 -15.7 947 202 D D H X S+ 0 0 18 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.857 111.5 46.8 -59.9 -35.0 69.9 -4.4 -17.6 948 203 D K H X S+ 0 0 129 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.911 111.2 51.4 -71.8 -44.1 68.8 -6.4 -20.6 949 204 D T H X S+ 0 0 61 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.916 116.4 41.4 -55.3 -47.7 65.3 -4.8 -20.4 950 205 D I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.911 114.3 49.0 -69.5 -48.0 66.9 -1.3 -20.4 951 206 D S H X S+ 0 0 19 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.947 115.5 45.9 -58.3 -45.4 69.6 -2.0 -23.0 952 207 D D H X S+ 0 0 33 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.869 108.8 56.6 -61.7 -42.0 66.9 -3.4 -25.3 953 208 D Y H X S+ 0 0 37 -4,-2.0 4,-0.6 -5,-0.2 -1,-0.2 0.917 113.0 40.4 -56.8 -44.6 64.6 -0.4 -24.5 954 209 D Y H >X S+ 0 0 6 -4,-2.3 4,-0.6 10,-0.3 3,-0.6 0.869 113.9 53.1 -72.8 -38.9 67.4 2.0 -25.8 955 210 D R H ><>S+ 0 0 99 -4,-2.5 5,-3.4 1,-0.2 3,-0.7 0.858 102.9 58.4 -63.4 -38.9 68.4 -0.2 -28.8 956 211 D E H 3<5S+ 0 0 132 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.742 110.1 42.3 -63.8 -27.5 64.8 -0.4 -30.1 957 212 D R H <<5S+ 0 0 156 -4,-0.6 -1,-0.2 -3,-0.6 -2,-0.2 0.533 118.8 42.5 -97.3 -8.9 64.6 3.4 -30.4 958 213 D T T X<5S- 0 0 47 -3,-0.7 3,-2.1 -4,-0.6 -1,-0.2 -0.043 115.0 -97.9-129.4 27.5 68.1 4.1 -31.9 959 214 D N T 3 5S- 0 0 145 -3,-0.3 -3,-0.2 1,-0.3 -4,-0.1 0.857 84.9 -57.3 52.8 39.6 68.5 1.3 -34.5 960 215 D G T 3 - 0 0 32 1,-0.1 4,-2.1 -15,-0.1 -18,-0.1 -0.484 23.3-110.2 -85.4 167.1 72.4 -0.9 -19.4 966 221 D W H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.933 116.9 53.3 -63.3 -49.5 70.8 0.7 -16.4 967 222 D S H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.887 111.8 45.5 -57.7 -39.5 73.7 -0.2 -14.0 968 223 D D H > S+ 0 0 75 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.915 114.8 48.3 -68.7 -42.5 76.2 1.4 -16.3 969 224 D Q H X S+ 0 0 10 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.931 112.5 46.5 -62.2 -51.9 74.0 4.5 -16.8 970 225 D I H X S+ 0 0 0 -4,-3.1 4,-1.5 2,-0.2 -1,-0.2 0.864 112.4 49.4 -63.2 -37.8 73.2 5.1 -13.1 971 226 D L H X S+ 0 0 3 -4,-1.6 4,-1.7 -5,-0.3 -1,-0.2 0.874 113.0 48.1 -68.3 -35.8 76.9 4.7 -12.0 972 227 D N H X S+ 0 0 95 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.865 108.7 54.0 -69.1 -40.0 77.9 7.2 -14.8 973 228 D F H < S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 110.0 47.7 -62.5 -37.7 75.2 9.7 -13.7 974 229 D X H < S+ 0 0 11 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.873 108.8 53.0 -70.4 -43.9 76.6 9.6 -10.1 975 230 D K H < S+ 0 0 93 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.912 107.8 58.4 -56.7 -49.6 80.2 10.1 -11.2 976 231 D Q S < S+ 0 0 139 -4,-2.0 0, 0.0 1,-0.2 0, 0.0 -0.481 117.2 11.6 -78.4 153.5 79.2 13.2 -13.2 977 232 D K + 0 0 94 -2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.893 68.4 166.1 40.9 60.6 77.5 16.0 -11.1 978 233 D P - 0 0 48 0, 0.0 -376,-0.2 0, 0.0 -375,-0.2 0.820 32.3-148.0 -71.1 -25.7 78.3 14.6 -7.5 979 234 D R > + 0 0 28 -377,-0.1 3,-1.5 -378,-0.1 -377,-0.3 0.883 32.5 165.3 58.4 46.3 77.3 18.1 -6.0 980 235 D T T > + 0 0 85 1,-0.3 3,-2.0 2,-0.2 4,-0.4 0.812 63.7 72.8 -59.2 -33.3 79.9 17.6 -3.1 981 236 D Y T >> S+ 0 0 75 1,-0.3 4,-2.9 2,-0.2 3,-0.6 0.687 81.2 74.0 -54.3 -25.9 79.6 21.4 -2.3 982 237 D L H <> S+ 0 0 0 -3,-1.5 4,-2.4 1,-0.2 5,-0.3 0.757 79.8 71.4 -63.3 -25.8 76.1 20.6 -0.8 983 238 D N H <4 S+ 0 0 21 -3,-2.0 4,-0.5 -4,-0.2 -1,-0.2 0.925 116.2 23.0 -54.0 -45.6 77.8 19.0 2.3 984 239 D D H <> S+ 0 0 111 -3,-0.6 4,-1.7 -4,-0.4 -2,-0.2 0.830 119.6 60.5 -89.8 -39.0 78.8 22.5 3.4 985 240 D Y H X S+ 0 0 10 -4,-2.9 4,-1.2 1,-0.2 -3,-0.2 0.876 101.7 51.9 -60.2 -43.1 76.1 24.6 1.5 986 241 D V H <>S+ 0 0 0 -4,-2.4 5,-2.2 1,-0.2 3,-0.4 0.897 109.9 51.3 -60.1 -37.8 73.1 22.9 3.3 987 242 D K H >45S+ 0 0 45 -4,-0.5 3,-1.4 -5,-0.3 -1,-0.2 0.849 103.6 58.5 -63.5 -37.5 74.9 23.7 6.7 988 243 D E H 3<5S+ 0 0 123 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.808 105.2 50.6 -62.1 -31.7 75.2 27.4 5.5 989 244 D K T 3<5S- 0 0 27 -4,-1.2 -90,-2.9 -3,-0.4 -89,-0.3 0.421 128.0-100.0 -87.6 0.4 71.4 27.5 5.1 990 245 D G T < 5S+ 0 0 0 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.618 82.8 119.5 91.6 18.3 70.9 26.1 8.7 991 246 D F S