==== 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 15-AUG-10 2XOF . COMPND 2 MOLECULE: RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE 1 SUBUNIT BE . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.YOKOYAMA,U.UHLIN,J.STUBBE . 680 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24182.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 526 77.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 3.2 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 . 4 0.6 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 . 14 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 403 59.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 1 0 2 2 0 2 0 2 0 0 0 2 0 2 0 1 0 0 0 1 1 4 2 1 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 5 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A A 0 0 103 0, 0.0 2,-0.2 0, 0.0 168,-0.1 0.000 360.0 360.0 360.0 -49.0 97.8 -4.0 -6.4 2 2 A Y - 0 0 26 497,-0.1 2,-0.3 19,-0.1 501,-0.1 -0.436 360.0-178.6 -70.8 138.1 94.2 -3.2 -7.4 3 3 A T - 0 0 25 -2,-0.2 3,-0.4 94,-0.1 493,-0.1 -0.999 32.6-139.6-138.2 141.5 92.3 -5.7 -9.4 4 4 A T S S+ 0 0 0 -2,-0.3 2,-0.2 491,-0.3 426,-0.2 0.605 103.7 26.1 -73.7 -15.2 88.7 -5.6 -10.8 5 5 A F S S- 0 0 1 487,-0.1 -1,-0.3 490,-0.0 2,-0.2 -0.658 81.6-148.1-148.3 96.8 88.3 -9.2 -9.9 6 6 A S - 0 0 5 -3,-0.4 19,-0.1 17,-0.3 -4,-0.0 -0.426 6.9-150.4 -66.2 128.5 90.4 -10.6 -7.0 7 7 A Q + 0 0 105 -2,-0.2 2,-0.4 2,-0.1 -1,-0.1 0.667 66.7 89.2 -81.4 -20.3 91.2 -14.2 -7.6 8 8 A T S S- 0 0 90 1,-0.1 2,-0.4 475,-0.0 16,-0.1 -0.655 80.2-120.1 -85.7 132.1 91.5 -15.5 -4.0 9 9 A K + 0 0 117 -2,-0.4 2,-0.3 473,-0.1 -2,-0.1 -0.554 41.9 176.7 -70.6 123.8 88.3 -16.7 -2.3 10 10 A N - 0 0 23 -2,-0.4 2,-0.9 11,-0.0 14,-0.1 -0.921 40.1-112.4-130.4 152.4 87.6 -14.6 0.8 11 11 A D > - 0 0 75 -2,-0.3 3,-1.2 1,-0.2 4,-0.2 -0.791 28.7-163.7 -80.3 108.2 85.0 -14.3 3.5 12 12 A Q G > S+ 0 0 7 -2,-0.9 3,-0.6 1,-0.3 20,-0.2 0.676 82.3 68.3 -70.9 -18.2 83.5 -10.9 2.6 13 13 A L G 3 S+ 0 0 68 1,-0.2 -1,-0.3 18,-0.1 -2,-0.0 0.681 102.4 45.4 -73.2 -17.5 81.9 -10.7 6.0 14 14 A K G < S+ 0 0 153 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.322 88.6 104.9-111.7 5.9 85.3 -10.4 7.7 15 15 A E S < S- 0 0 27 -3,-0.6 2,-0.1 -4,-0.2 4,-0.1 -0.520 75.5-113.6 -74.0 151.0 86.8 -7.8 5.3 16 16 A P - 0 0 34 0, 0.0 84,-0.3 0, 0.0 4,-0.3 -0.415 28.3-108.8 -73.0 165.4 87.1 -4.2 6.6 17 17 A M S S+ 0 0 0 82,-0.1 83,-2.7 -2,-0.1 84,-0.5 0.932 100.4 20.4 -56.1 -47.9 85.0 -1.6 4.8 18 18 A F B S+A 99 0A 4 81,-0.3 81,-0.2 82,-0.2 3,-0.1 -0.839 118.7 20.9-125.5 158.0 88.2 -0.1 3.2 19 19 A F S S+ 0 0 26 79,-2.6 80,-0.1 -2,-0.3 -1,-0.1 0.321 90.7 110.7 70.2 -4.2 91.7 -1.2 2.4 20 20 A G S S- 0 0 25 78,-0.3 -1,-0.2 -4,-0.3 81,-0.1 0.149 85.7 -43.4 -75.0-160.0 91.0 -4.9 2.5 21 21 A Q S S- 0 0 37 79,-0.2 -1,-0.2 1,-0.1 3,-0.1 -0.557 72.8-101.5 -69.5 130.7 90.9 -7.3 -0.5 22 22 A P - 0 0 28 0, 0.0 -16,-0.2 0, 0.0 78,-0.2 -0.227 48.1 -94.7 -51.3 140.8 89.2 -5.7 -3.5 23 23 A V + 0 0 2 76,-0.8 -17,-0.3 1,-0.1 3,-0.1 -0.359 45.4 174.9 -60.2 131.0 85.6 -7.0 -3.9 24 24 A N + 0 0 3 1,-0.3 2,-0.4 -19,-0.2 -1,-0.1 0.723 63.7 38.1 -93.9 -84.5 85.3 -10.0 -6.3 25 25 A V S S- 0 0 3 -19,-0.1 2,-1.0 453,-0.1 -1,-0.3 -0.542 73.0-142.1 -74.4 124.1 81.7 -11.4 -6.3 26 26 A A + 0 0 2 -2,-0.4 2,-0.3 396,-0.4 438,-0.1 -0.791 39.1 159.7 -83.4 102.1 79.0 -8.8 -6.0 27 27 A R - 0 0 10 -2,-1.0 434,-0.1 3,-0.1 433,-0.0 -0.931 29.8-174.2-128.0 151.0 76.5 -10.6 -3.8 28 28 A Y + 0 0 6 -2,-0.3 3,-0.1 432,-0.2 -1,-0.0 0.095 61.6 96.1-134.0 20.4 73.7 -9.1 -1.6 29 29 A D S S+ 0 0 28 1,-0.1 2,-0.3 445,-0.0 -1,-0.1 0.578 94.1 27.5 -88.8 -12.8 72.4 -12.1 0.3 30 30 A Q - 0 0 41 -3,-0.0 2,-0.3 4,-0.0 73,-0.1 -0.951 68.2-165.5-143.6 158.8 74.5 -11.3 3.3 31 31 A Q - 0 0 61 -2,-0.3 3,-0.2 1,-0.1 -18,-0.1 -0.983 26.5-152.1-152.4 138.7 76.1 -8.2 4.8 32 32 A K S S+ 0 0 59 -2,-0.3 2,-0.5 1,-0.3 -1,-0.1 0.919 102.0 27.5 -67.0 -46.3 78.7 -7.2 7.4 33 33 A Y S >> S- 0 0 37 1,-0.1 3,-1.0 0, 0.0 4,-0.6 -0.960 70.5-154.4-124.5 115.6 76.7 -4.0 8.0 34 34 A D H 3> S+ 0 0 89 -2,-0.5 4,-2.0 1,-0.2 3,-0.2 0.749 85.3 73.3 -52.2 -33.2 72.9 -3.9 7.5 35 35 A I H 3> S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.847 90.4 53.5 -57.5 -42.8 72.9 -0.1 6.9 36 36 A F H <> S+ 0 0 1 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.888 110.8 45.8 -65.8 -40.7 74.5 -0.1 3.4 37 37 A E H X S+ 0 0 16 -4,-0.6 4,-2.8 -3,-0.2 -1,-0.2 0.908 112.2 53.3 -62.5 -43.6 72.0 -2.6 1.9 38 38 A K H X S+ 0 0 123 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.894 109.2 48.0 -59.4 -43.1 69.2 -0.6 3.6 39 39 A L H X S+ 0 0 8 -4,-2.4 4,-3.3 2,-0.2 5,-0.2 0.905 110.8 50.9 -65.5 -44.9 70.4 2.6 1.9 40 40 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.978 112.7 46.5 -52.4 -57.3 70.6 0.9 -1.5 41 41 A E H X S+ 0 0 80 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.906 115.5 46.3 -53.0 -48.1 67.1 -0.4 -1.1 42 42 A K H X S+ 0 0 110 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.930 112.5 49.1 -60.2 -50.5 65.8 3.0 0.0 43 43 A Q H < S+ 0 0 11 -4,-3.3 4,-0.3 1,-0.2 3,-0.3 0.893 111.9 49.8 -57.5 -42.0 67.7 4.9 -2.7 44 44 A L H >< S+ 0 0 5 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.876 108.4 52.6 -64.0 -39.1 66.3 2.5 -5.4 45 45 A S H 3< S+ 0 0 62 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.745 106.8 54.8 -69.2 -22.3 62.8 2.9 -4.0 46 46 A F T 3< S+ 0 0 29 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.480 76.3 147.6 -86.7 -6.0 63.2 6.7 -4.3 47 47 A F < + 0 0 55 -3,-1.1 2,-0.3 -4,-0.3 -3,-0.1 0.020 19.2 165.1 -42.4 127.1 64.1 6.7 -8.0 48 48 A W - 0 0 23 185,-0.0 3,-0.1 3,-0.0 -1,-0.1 -0.941 32.2-137.1-141.6 162.8 62.9 9.8 -9.8 49 49 A R > - 0 0 50 -2,-0.3 3,-1.5 1,-0.1 4,-0.1 -0.993 7.9-150.3-125.0 122.8 63.4 11.6 -13.1 50 50 A P G > S+ 0 0 0 0, 0.0 3,-2.9 0, 0.0 -1,-0.1 0.872 95.9 66.5 -58.6 -39.0 63.8 15.4 -13.2 51 51 A E G 3 S+ 0 0 62 1,-0.3 4,-0.1 -3,-0.1 70,-0.0 0.660 92.0 63.9 -59.1 -17.8 62.3 15.6 -16.7 52 52 A E G < S+ 0 0 140 -3,-1.5 2,-0.5 2,-0.1 -1,-0.3 0.469 86.5 90.4 -83.6 -4.4 59.0 14.4 -15.1 53 53 A V S < S- 0 0 10 -3,-2.9 2,-0.8 -4,-0.1 173,-0.1 -0.858 81.2-127.9 -98.5 125.2 58.8 17.6 -13.1 54 54 A D + 0 0 95 -2,-0.5 3,-0.1 1,-0.2 175,-0.1 -0.588 40.5 158.6 -69.7 105.4 57.0 20.5 -14.6 55 55 A V > + 0 0 3 -2,-0.8 3,-1.2 171,-0.1 4,-0.4 0.205 44.0 103.8-109.9 13.6 59.4 23.5 -14.3 56 56 A S T 3 S+ 0 0 53 1,-0.3 3,-0.5 2,-0.2 4,-0.4 0.775 77.1 53.4 -70.1 -27.4 57.7 25.5 -17.1 57 57 A R T 3> S+ 0 0 173 1,-0.2 4,-0.9 -3,-0.1 -1,-0.3 0.508 94.5 74.3 -84.1 -4.4 55.9 27.9 -14.7 58 58 A D H <> S+ 0 0 4 -3,-1.2 4,-2.8 2,-0.2 -1,-0.2 0.736 82.0 65.7 -81.0 -26.4 59.3 28.7 -13.0 59 59 A R H > S+ 0 0 103 -3,-0.5 4,-2.5 -4,-0.4 5,-0.3 0.912 100.2 49.8 -65.1 -44.2 60.6 30.9 -15.8 60 60 A I H > S+ 0 0 123 -4,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.907 113.5 48.0 -59.8 -42.6 58.0 33.6 -15.4 61 61 A D H X S+ 0 0 33 -4,-0.9 4,-0.8 2,-0.2 -2,-0.2 0.963 113.6 46.1 -59.3 -54.4 58.8 33.6 -11.6 62 62 A Y H >< S+ 0 0 19 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.930 114.4 44.8 -58.0 -54.1 62.6 33.8 -12.1 63 63 A Q H 3< S+ 0 0 72 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.817 111.2 57.0 -60.3 -30.8 62.6 36.6 -14.7 64 64 A A H 3< S+ 0 0 76 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.635 86.2 103.6 -73.8 -17.2 60.0 38.5 -12.6 65 65 A L S << S- 0 0 11 -3,-1.3 5,-0.1 -4,-0.8 -3,-0.0 -0.394 82.4-105.3 -69.1 141.1 62.3 38.5 -9.5 66 66 A P >> - 0 0 60 0, 0.0 4,-2.2 0, 0.0 3,-0.9 -0.290 41.0-100.2 -60.2 155.7 64.1 41.7 -8.6 67 67 A E H 3> S+ 0 0 146 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.833 123.1 49.7 -52.6 -42.2 67.8 41.6 -9.5 68 68 A H H 3> S+ 0 0 47 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.838 110.8 50.5 -66.7 -32.2 69.0 40.9 -5.9 69 69 A E H <> S+ 0 0 17 -3,-0.9 4,-2.7 2,-0.2 -2,-0.2 0.844 109.3 50.9 -74.2 -34.2 66.5 38.0 -5.7 70 70 A K H X S+ 0 0 28 -4,-2.2 4,-2.9 2,-0.2 5,-0.4 0.918 110.0 51.3 -60.7 -45.3 67.8 36.7 -9.0 71 71 A H H X S+ 0 0 23 -4,-2.4 4,-1.8 -5,-0.2 5,-0.2 0.907 111.8 46.5 -58.2 -45.0 71.2 36.9 -7.5 72 72 A I H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.944 117.7 41.9 -61.2 -52.4 70.1 35.0 -4.4 73 73 A F H X S+ 0 0 2 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.935 118.4 42.4 -62.8 -49.5 68.3 32.2 -6.4 74 74 A I H X S+ 0 0 16 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.812 111.9 53.5 -74.5 -32.6 70.9 31.8 -9.2 75 75 A S H X S+ 0 0 0 -4,-1.8 4,-2.0 -5,-0.4 -1,-0.2 0.902 111.2 48.2 -63.6 -43.1 74.0 31.9 -6.8 76 76 A N H X S+ 0 0 3 -4,-1.7 4,-2.6 -5,-0.2 -2,-0.2 0.942 112.3 47.9 -60.3 -50.1 72.3 29.1 -4.8 77 77 A L H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.873 110.9 51.4 -60.7 -39.6 71.6 27.0 -7.9 78 78 A K H X S+ 0 0 20 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.898 111.2 47.6 -65.1 -42.7 75.1 27.4 -9.2 79 79 A Y H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.903 111.3 50.8 -63.5 -44.7 76.6 26.3 -5.9 80 80 A Q H X S+ 0 0 1 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.900 111.9 47.9 -57.4 -42.7 74.2 23.3 -5.8 81 81 A T H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 286,-0.3 0.913 110.7 51.7 -67.9 -43.8 75.3 22.4 -9.3 82 82 A L H >X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 3,-0.7 0.965 109.1 50.1 -52.1 -56.2 79.0 22.8 -8.4 83 83 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.3 -2,-0.2 0.868 113.6 43.3 -57.7 -42.6 78.6 20.5 -5.3 84 84 A D H 3X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.3 -1,-0.3 0.624 104.0 63.4 -85.8 -12.1 76.9 17.7 -7.2 85 85 A S H S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.3 5,-0.6 0.828 92.4 52.6 -69.3 -43.9 84.1 11.7 -6.7 91 91 A P H >>S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 5,-1.3 0.907 116.0 46.5 -55.5 -36.4 82.6 8.9 -4.6 92 92 A N H 45S+ 0 0 0 -3,-0.4 4,-0.3 -4,-0.3 -2,-0.2 0.927 119.2 37.2 -68.3 -46.4 83.3 6.7 -7.6 93 93 A V H <5S+ 0 0 13 -4,-2.2 -3,-0.2 3,-0.1 -1,-0.1 0.887 127.4 33.5 -75.2 -38.9 86.9 7.8 -8.3 94 94 A A H <5S+ 0 0 1 -4,-3.3 -2,-0.2 -5,-0.2 -1,-0.1 0.881 128.9 25.9 -87.0 -41.1 88.0 8.3 -4.7 95 95 A L T >X4 S- 0 0 5 -84,-0.5 4,-2.1 1,-0.1 3,-0.3 -0.999 70.9-140.9-139.1 125.2 83.0 -5.0 1.1 102 102 A P H > S+ 0 0 7 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.849 98.4 52.4 -61.5 -40.8 80.3 -5.6 -1.7 103 103 A E H > S+ 0 0 4 1,-0.2 4,-1.9 2,-0.2 -63,-0.1 0.879 113.8 44.9 -64.4 -38.0 77.3 -3.8 -0.0 104 104 A L H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.861 110.3 55.2 -70.1 -39.9 79.4 -0.7 0.5 105 105 A E H X S+ 0 0 6 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.956 112.7 42.0 -55.0 -52.1 80.8 -0.9 -3.1 106 106 A T H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.859 111.4 55.4 -67.7 -35.9 77.3 -1.0 -4.5 107 107 A W H X S+ 0 0 0 -4,-1.9 4,-3.4 -5,-0.2 -1,-0.2 0.940 106.8 50.9 -60.4 -46.0 76.1 1.8 -2.1 108 108 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.872 112.7 45.5 -58.4 -39.1 78.8 4.1 -3.3 109 109 A E H X S+ 0 0 1 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.787 114.7 47.9 -75.8 -28.6 77.9 3.5 -7.0 110 110 A T H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.905 112.6 48.9 -76.9 -45.2 74.2 3.9 -6.2 111 111 A W H X S+ 0 0 0 -4,-3.4 4,-1.4 2,-0.2 -2,-0.2 0.925 112.9 47.5 -55.4 -51.3 75.0 7.1 -4.3 112 112 A A H X S+ 0 0 0 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.880 111.3 51.6 -61.9 -38.6 77.1 8.5 -7.1 113 113 A F H >X S+ 0 0 9 -4,-1.6 4,-1.4 1,-0.2 3,-0.7 0.924 105.9 53.7 -62.6 -44.8 74.5 7.6 -9.7 114 114 A S H 3X S+ 0 0 5 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.827 104.6 57.7 -61.4 -29.6 71.8 9.4 -7.7 115 115 A E H 3X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.813 99.8 55.6 -69.2 -32.9 74.0 12.5 -7.8 116 116 A T H X S+ 0 0 0 -4,-1.9 4,-0.7 2,-0.2 3,-0.5 0.955 114.9 50.3 -73.1 -54.3 66.0 23.9 -14.1 126 126 A I H >X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 3,-1.1 0.900 110.6 49.8 -53.5 -48.8 68.7 26.2 -15.6 127 127 A R H 3< S+ 0 0 125 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.814 112.1 48.8 -56.9 -37.5 67.5 25.6 -19.2 128 128 A N H << S+ 0 0 61 -4,-0.8 -1,-0.2 -3,-0.5 -69,-0.2 0.467 118.9 35.2 -88.5 -2.9 63.9 26.4 -18.4 129 129 A I H << S+ 0 0 0 -3,-1.1 2,-0.3 -4,-0.7 -2,-0.2 0.678 106.8 58.7-121.3 -28.7 64.6 29.6 -16.4 130 130 A V < - 0 0 18 -4,-2.2 -1,-0.1 -5,-0.2 -71,-0.0 -0.713 66.9-133.8-108.1 158.9 67.5 31.5 -18.1 131 131 A N S S+ 0 0 130 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.0 0.924 99.8 23.5 -69.4 -49.0 68.1 32.9 -21.6 132 132 A D >> - 0 0 86 1,-0.1 3,-1.8 -6,-0.0 4,-0.8 -0.805 62.7-172.6-128.1 89.1 71.7 31.6 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5,-0.2 0.938 110.0 50.1 -60.1 -48.0 87.7 13.1 3.2 197 197 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.869 110.1 50.9 -58.4 -40.3 84.7 11.3 4.6 198 198 A M H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.854 110.7 49.4 -62.6 -39.8 84.3 14.1 7.3 199 199 A S H X S+ 0 0 5 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.901 112.1 47.0 -65.4 -42.5 84.5 16.7 4.5 200 200 A V H X S+ 0 0 3 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.847 109.4 54.9 -71.5 -34.5 81.8 14.9 2.5 201 201 A N H X S+ 0 0 0 -4,-2.3 4,-2.9 -5,-0.2 5,-0.4 0.953 110.4 45.5 -57.8 -49.6 79.7 14.6 5.6 202 202 A A H X>S+ 0 0 1 -4,-2.1 5,-2.2 3,-0.2 4,-1.7 0.873 112.0 53.4 -61.7 -38.9 79.9 18.3 6.1 203 203 A L H <>S+ 0 0 0 -4,-2.2 5,-2.0 3,-0.2 6,-0.2 0.960 120.5 29.0 -60.7 -52.6 79.1 18.9 2.4 204 204 A E H <5S+ 0 0 0 -4,-2.4 5,-0.3 3,-0.2 -2,-0.2 0.895 126.0 43.5 -79.2 -40.5 75.9 16.8 2.2 205 205 A A H <5S+ 0 0 0 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.777 134.7 9.1 -79.2 -28.3 74.7 17.2 5.9 206 206 A I T X5S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.4 5,-0.2 0.763 123.5 50.6-114.5 -63.6 75.4 21.0 6.2 207 207 A R H > S+ 0 0 14 -5,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.867 104.6 53.5 -66.9 -34.1 70.8 21.9 3.7 210 210 A V H X S+ 0 0 2 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.890 111.1 47.7 -59.9 -40.9 71.8 25.6 3.8 211 211 A S H X S+ 0 0 2 -4,-1.3 4,-2.1 -5,-0.2 -2,-0.2 0.869 107.1 55.0 -71.0 -36.3 71.1 25.6 0.1 212 212 A F H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.882 103.6 57.1 -61.0 -40.3 67.7 23.8 0.5 213 213 A A H X S+ 0 0 0 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.890 107.5 47.1 -56.4 -43.3 66.7 26.6 3.0 214 214 A C H X S+ 0 0 0 -4,-1.3 4,-1.0 2,-0.2 -2,-0.2 0.934 114.3 46.7 -65.4 -46.0 67.3 29.2 0.2 215 215 A S H >X S+ 0 0 1 -4,-2.1 4,-1.5 1,-0.2 3,-0.6 0.917 112.8 48.2 -62.2 -47.2 65.4 27.2 -2.3 216 216 A F H 3X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.715 99.6 67.7 -71.5 -20.5 62.4 26.5 -0.0 217 217 A A H 3X S+ 0 0 2 -4,-1.3 4,-0.8 -5,-0.2 -1,-0.2 0.876 102.9 46.1 -63.6 -39.5 62.3 30.2 1.0 218 218 A F H X<>S+ 0 0 1 -4,-1.0 5,-1.8 -3,-0.6 3,-1.0 0.929 109.3 55.8 -64.3 -45.2 61.1 31.0 -2.6 219 219 A A H ><5S+ 0 0 2 -4,-1.5 3,-1.4 1,-0.3 -2,-0.2 0.779 98.9 60.5 -57.9 -31.7 58.7 28.1 -2.4 220 220 A E H 3<5S+ 0 0 87 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.834 104.9 48.7 -64.4 -32.6 57.1 29.6 0.8 221 221 A R T <<5S- 0 0 62 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.251 124.0-109.3 -86.1 10.3 56.2 32.6 -1.3 222 222 A E T < 5S+ 0 0 144 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.882 79.5 129.0 56.3 42.6 54.8 30.2 -4.0 223 223 A L < + 0 0 36 -5,-1.8 -1,-0.3 1,-0.2 -2,-0.2 -0.929 62.7 13.0-122.5 149.8 57.6 31.0 -6.3 224 224 A M S > S+ 0 0 0 -2,-0.3 4,-2.0 -167,-0.2 -5,-0.2 0.905 73.4 161.5 54.1 49.2 60.0 28.6 -8.2 225 225 A E H > + 0 0 94 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.731 67.6 54.5 -78.0 -25.1 57.6 25.7 -7.3 226 226 A G H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.928 110.3 46.7 -69.1 -49.4 59.0 23.4 -10.0 227 227 A N H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.892 110.8 54.9 -53.7 -43.2 62.5 23.8 -8.6 228 228 A A H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.890 104.6 51.4 -60.4 -44.5 60.9 23.3 -5.1 229 229 A K H X S+ 0 0 120 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.884 112.1 48.2 -60.0 -40.1 59.4 19.9 -6.1 230 230 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.905 108.6 52.7 -65.2 -45.1 62.9 18.9 -7.4 231 231 A I H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.865 104.2 57.9 -60.8 -37.2 64.6 20.0 -4.2 232 232 A R H X S+ 0 0 101 -4,-2.2 4,-1.5 2,-0.2 108,-0.2 0.892 110.2 42.6 -57.2 -43.3 62.2 17.9 -2.2 233 233 A L H X S+ 0 0 29 -4,-1.2 4,-1.5 -3,-0.2 -2,-0.2 0.870 115.4 50.0 -71.3 -38.8 63.3 14.8 -4.1 234 234 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.911 110.1 49.2 -63.5 -45.8 66.9 15.8 -3.9 235 235 A A H X S+ 0 0 4 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.859 106.8 56.4 -65.0 -37.8 66.8 16.4 -0.1 236 236 A R H X S+ 0 0 78 -4,-1.5 4,-0.8 -5,-0.2 -1,-0.2 0.885 111.5 43.2 -60.6 -40.8 65.2 13.0 0.4 237 237 A D H >X S+ 0 0 2 -4,-1.5 4,-2.1 1,-0.2 3,-0.6 0.900 109.9 57.9 -67.4 -43.6 68.2 11.5 -1.4 238 238 A E H 3X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.816 98.9 58.5 -57.1 -34.7 70.6 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-4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.893 112.2 49.9 -62.1 -45.1 67.0 5.4 -22.5 384 43 B Q H < S+ 0 0 10 -4,-2.8 3,-0.4 2,-0.2 4,-0.4 0.909 111.2 49.3 -62.5 -42.9 68.6 3.7 -19.5 385 44 B L H >< S+ 0 0 6 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.885 108.6 53.2 -64.5 -37.9 66.8 5.9 -17.1 386 45 B S H 3< S+ 0 0 59 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.750 106.6 54.4 -68.2 -24.1 63.5 5.2 -18.9 387 46 B F T 3< S+ 0 0 29 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.499 76.3 146.7 -85.8 -5.7 64.2 1.4 -18.5 388 47 B F < + 0 0 52 -3,-1.2 2,-0.3 -4,-0.4 -3,-0.1 -0.011 20.0 163.1 -45.0 124.2 64.7 1.6 -14.7 389 48 B W - 0 0 23 185,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.939 33.0-133.9-141.4 161.0 63.6 -1.6 -13.0 390 49 B R > - 0 0 33 -2,-0.3 3,-1.1 1,-0.1 4,-0.0 -0.980 7.3-149.7-122.4 124.6 63.9 -3.5 -9.7 391 50 B P G > S+ 0 0 6 0, 0.0 3,-2.9 0, 0.0 -1,-0.1 0.908 93.3 64.4 -54.6 -48.6 64.7 -7.3 -9.6 392 51 B E G 3 S+ 0 0 100 1,-0.3 4,-0.1 3,-0.1 70,-0.0 0.629 93.3 64.0 -58.3 -14.6 62.8 -7.9 -6.3 393 52 B E G < S+ 0 0 138 -3,-1.1 2,-0.5 2,-0.1 -1,-0.3 0.352 84.0 91.8 -90.7 4.3 59.5 -7.0 -8.0 394 53 B V S < S- 0 0 11 -3,-2.9 2,-0.8 -4,-0.0 173,-0.1 -0.895 83.2-124.5 -98.5 127.9 59.9 -10.0 -10.3 395 54 B D + 0 0 118 -2,-0.5 3,-0.1 1,-0.1 175,-0.1 -0.609 39.1 163.8 -74.6 108.2 58.1 -13.1 -9.1 396 55 B V >> + 0 0 5 -2,-0.8 4,-0.5 -4,-0.1 3,-0.5 0.103 40.5 111.2-109.1 20.2 60.8 -15.8 -9.0 397 56 B S H >> S+ 0 0 77 1,-0.2 3,-0.8 2,-0.2 4,-0.6 0.895 76.5 45.6 -67.3 -44.0 58.7 -18.2 -6.7 398 57 B R H 3> S+ 0 0 116 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.605 97.3 78.6 -74.8 -8.1 57.9 -21.0 -9.2 399 58 B D H <> S+ 0 0 4 -3,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.798 87.0 55.8 -70.7 -29.6 61.6 -20.9 -10.4 400 59 B R H < S+ 0 0 16 -4,-2.7 3,-0.6 1,-0.2 -2,-0.2 0.896 111.8 47.1 -59.6 -46.1 65.1 -25.6 -10.8 404 63 B Q H 3< S+ 0 0 62 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.820 110.2 54.4 -67.4 -31.1 64.9 -28.4 -8.2 405 64 B A H 3< S+ 0 0 83 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.669 86.3 104.7 -76.1 -18.3 63.0 -30.6 -10.7 406 65 B L S << S- 0 0 9 -4,-1.0 2,-0.0 -3,-0.6 -3,-0.0 -0.356 79.8-111.6 -61.1 141.1 65.8 -30.2 -13.3 407 66 B P >> - 0 0 57 0, 0.0 4,-2.4 0, 0.0 3,-0.9 -0.341 38.9 -94.1 -67.0 160.3 68.0 -33.3 -13.8 408 67 B E H 3> S+ 0 0 159 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.837 123.9 47.0 -43.4 -51.8 71.7 -32.9 -12.6 409 68 B H H 3> S+ 0 0 42 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.794 112.2 49.9 -68.4 -30.6 73.1 -31.9 -16.1 410 69 B E H <> S+ 0 0 18 -3,-0.9 4,-2.9 2,-0.2 -1,-0.2 0.867 109.7 50.9 -75.1 -38.1 70.3 -29.3 -16.7 411 70 B K H X S+ 0 0 49 -4,-2.4 4,-3.3 2,-0.2 5,-0.3 0.920 111.0 51.2 -54.7 -45.6 71.0 -27.8 -13.2 412 71 B H H X S+ 0 0 31 -4,-2.3 4,-1.9 -5,-0.3 5,-0.2 0.880 110.5 46.8 -60.5 -44.2 74.6 -27.7 -14.3 413 72 B I H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.957 117.7 43.2 -61.7 -52.0 73.8 -25.9 -17.6 414 73 B F H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.934 118.7 40.5 -60.8 -51.3 71.5 -23.4 -15.7 415 74 B I H X S+ 0 0 16 -4,-3.3 4,-2.8 2,-0.2 5,-0.2 0.846 112.5 54.4 -74.2 -35.1 73.7 -22.7 -12.7 416 75 B S H X S+ 0 0 1 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.922 112.0 46.6 -59.4 -45.5 77.0 -22.6 -14.7 417 76 B N H X S+ 0 0 2 -4,-1.8 4,-2.4 -5,-0.2 -2,-0.2 0.918 112.6 48.7 -59.7 -48.0 75.4 -20.0 -16.9 418 77 B L H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.911 110.7 50.4 -62.3 -43.5 74.0 -18.0 -13.9 419 78 B K H X S+ 0 0 23 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.840 110.2 51.0 -61.8 -36.8 77.5 -18.0 -12.2 420 79 B Y H X S+ 0 0 1 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.929 110.0 48.3 -67.7 -45.1 79.1 -16.8 -15.4 421 80 B Q H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.875 111.9 50.6 -59.4 -40.9 76.6 -13.9 -15.7 422 81 B T H X S+ 0 0 0 -4,-2.3 4,-1.3 2,-0.2 -396,-0.4 0.893 111.2 48.6 -64.4 -43.0 77.2 -13.0 -12.0 423 82 B L H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 3,-0.5 0.957 110.5 51.1 -57.5 -52.4 81.0 -13.0 -12.6 424 83 B L H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.3 -2,-0.2 0.866 114.9 40.5 -59.8 -42.1 80.7 -10.8 -15.7 425 84 B D H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -1,-0.3 0.589 104.2 65.1 -89.0 -10.7 78.6 -8.1 -14.0 426 85 B S H X S+ 0 0 1 -4,-1.3 4,-1.1 -3,-0.5 -1,-0.2 0.906 112.4 39.5 -62.6 -44.8 80.5 -8.2 -10.8 427 86 B I H X S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 -2,-0.2 0.913 116.9 48.1 -66.7 -48.4 83.3 -6.9 -13.1 428 87 B Q H < S+ 0 0 0 -4,-2.0 28,-0.2 1,-0.2 -1,-0.2 0.715 103.1 64.9 -70.2 -24.2 81.0 -4.6 -15.1 429 88 B G H < S+ 0 0 4 -4,-1.5 4,-0.2 27,-0.2 28,-0.2 0.958 121.7 14.6 -59.2 -52.7 79.5 -3.2 -11.9 430 89 B R H >X S+ 0 0 1 -4,-1.1 4,-2.1 -426,-0.2 3,-0.8 0.832 113.1 73.0 -92.1 -36.7 82.8 -1.6 -10.7 431 90 B S H 3X>S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.3 5,-0.5 0.807 90.9 52.2 -65.1 -44.7 85.1 -1.6 -13.7 432 91 B P H 3>>S+ 0 0 0 0, 0.0 4,-1.2 0, 0.0 5,-1.2 0.853 115.5 46.1 -58.0 -32.7 83.7 1.1 -16.0 433 92 B N H <45S+ 0 0 1 -3,-0.8 4,-0.4 -4,-0.2 -2,-0.2 0.931 118.2 39.6 -71.8 -47.5 83.8 3.5 -13.0 434 93 B V H <5S+ 0 0 12 -4,-2.1 -3,-0.2 1,-0.1 -1,-0.1 0.862 127.8 31.6 -71.5 -36.5 87.3 2.5 -11.9 435 94 B A H <5S+ 0 0 1 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.1 0.870 129.5 27.0 -90.7 -41.7 88.9 2.3 -15.3 436 95 B L T >X4 S- 0 0 6 -84,-0.7 4,-1.9 1,-0.1 3,-0.3 -0.991 72.8-137.0-123.7 139.1 83.2 15.2 -21.7 443 102 B P H > S+ 0 0 8 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.850 99.2 54.8 -63.0 -41.4 80.2 15.3 -19.3 444 103 B E H > S+ 0 0 6 1,-0.2 4,-1.7 2,-0.2 -63,-0.1 0.852 112.3 44.8 -62.5 -37.4 77.7 13.2 -21.3 445 104 B L H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.882 110.9 54.1 -71.2 -41.3 80.2 10.4 -21.5 446 105 B E H X S+ 0 0 6 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.944 113.7 41.3 -57.0 -50.7 81.1 10.7 -17.8 447 106 B T H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.845 112.1 55.8 -70.1 -33.9 77.5 10.4 -16.7 448 107 B W H X S+ 0 0 0 -4,-1.7 4,-3.1 -5,-0.2 -2,-0.2 0.953 107.2 49.4 -60.0 -49.2 76.8 7.7 -19.2 449 108 B V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.886 113.5 46.3 -56.3 -41.2 79.7 5.6 -17.8 450 109 B E H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.844 114.5 46.5 -70.9 -36.8 78.3 6.1 -14.2 451 110 B T H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.876 112.8 51.3 -70.4 -41.5 74.7 5.3 -15.3 452 111 B W H X S+ 0 0 1 -4,-3.1 4,-1.4 2,-0.2 -2,-0.2 0.938 111.5 45.9 -59.5 -51.9 76.0 2.2 -17.2 453 112 B A H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.884 111.0 53.9 -62.2 -39.0 77.9 0.9 -14.2 454 113 B F H X S+ 0 0 7 -4,-1.8 4,-1.5 1,-0.2 3,-0.3 0.912 104.4 53.8 -60.5 -45.1 74.9 1.6 -11.9 455 114 B S H X S+ 0 0 5 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.829 104.3 57.3 -60.2 -31.9 72.6 -0.4 -14.1 456 115 B E H X S+ 0 0 0 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.859 99.8 56.7 -66.7 -37.7 75.1 -3.3 -13.8 457 116 B T H X S+ 0 0 1 -4,-1.4 4,-2.4 -3,-0.3 -1,-0.2 0.890 105.1 53.1 -59.4 -37.2 74.8 -3.2 -10.0 458 117 B I H X S+ 0 0 4 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.910 108.3 49.6 -61.4 -43.3 71.0 -3.8 -10.6 459 118 B H H X S+ 0 0 0 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.927 110.8 49.2 -60.3 -49.6 71.9 -6.8 -12.7 460 119 B S H X S+ 0 0 0 -4,-2.7 4,-1.9 -35,-0.2 -2,-0.2 0.897 110.0 52.0 -52.1 -45.0 74.2 -8.2 -10.0 461 120 B R H X S+ 0 0 25 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.866 106.4 53.8 -62.8 -36.5 71.3 -7.6 -7.5 462 121 B S H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.839 104.9 54.3 -68.2 -32.1 69.0 -9.6 -9.7 463 122 B X H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.916 108.3 48.5 -67.6 -44.1 71.4 -12.5 -9.7 464 123 B T H X S+ 0 0 2 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.911 109.9 53.8 -57.0 -42.7 71.4 -12.6 -5.9 465 124 B H H X S+ 0 0 31 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.873 113.6 41.4 -59.0 -41.6 67.6 -12.4 -6.1 466 125 B I H >X S+ 0 0 0 -4,-1.9 4,-0.8 2,-0.2 3,-0.7 0.966 115.9 48.0 -71.3 -55.5 67.5 -15.5 -8.4 467 126 B I H >X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 3,-1.2 0.911 111.2 48.7 -53.4 -52.2 70.2 -17.5 -6.6 468 127 B R H 3< S+ 0 0 119 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.734 114.6 48.7 -64.9 -19.7 68.7 -17.0 -3.1 469 128 B N H << S+ 0 0 62 -3,-0.7 -1,-0.3 -4,-0.6 -69,-0.2 0.502 120.3 31.1 -97.7 -6.4 65.3 -18.0 -4.4 470 129 B I H << S+ 0 0 0 -3,-1.2 2,-0.2 -4,-0.8 -2,-0.2 0.619 108.7 65.2-121.0 -23.5 66.2 -21.2 -6.3 471 130 B V < - 0 0 18 -4,-2.2 -71,-0.0 -5,-0.2 -67,-0.0 -0.684 66.3-139.2-109.9 154.9 69.2 -22.7 -4.4 472 131 B N S S+ 0 0 120 1,-0.3 -1,-0.1 -2,-0.2 -4,-0.0 0.918 98.4 26.5 -76.8 -48.3 69.5 -24.2 -0.9 473 132 B D >> - 0 0 87 1,-0.1 3,-1.4 2,-0.0 4,-0.9 -0.827 65.2-173.4-121.5 89.5 72.9 -22.7 0.0 474 133 B P H 3> S+ 0 0 24 0, 0.0 4,-2.3 0, 0.0 3,-0.2 0.781 82.5 65.7 -49.8 -33.4 73.6 -19.5 -1.9 475 134 B S H 3> S+ 0 0 34 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.843 93.6 58.4 -61.1 -37.8 77.1 -19.3 -0.6 476 135 B V H <> S+ 0 0 90 -3,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.916 109.8 44.8 -56.7 -44.9 78.1 -22.5 -2.4 477 136 B V H X S+ 0 0 10 -4,-0.9 4,-1.3 -3,-0.2 -2,-0.2 0.947 115.3 45.8 -63.9 -51.9 77.1 -20.8 -5.7 478 137 B F H X S+ 0 0 2 -4,-2.3 4,-0.8 1,-0.2 3,-0.3 0.893 112.8 50.0 -63.5 -42.1 78.9 -17.5 -4.9 479 138 B D H >X S+ 0 0 51 -4,-3.0 4,-1.7 1,-0.2 3,-0.7 0.894 106.4 56.4 -61.1 -41.3 82.1 -19.2 -3.7 480 139 B D H 3X S+ 0 0 41 -4,-1.8 4,-3.2 -5,-0.3 -1,-0.2 0.801 94.7 66.5 -64.6 -30.1 82.2 -21.3 -6.8 481 140 B I H 3< S+ 0 0 0 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.904 109.5 38.2 -55.1 -41.6 82.2 -18.2 -9.0 482 141 B V H << S+ 0 0 5 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.861 126.2 35.5 -76.9 -37.5 85.7 -17.4 -7.6 483 142 B T H < S+ 0 0 71 -4,-1.7 -2,-0.2 -475,-0.1 -3,-0.2 0.702 82.4 111.9 -96.6 -22.9 87.1 -20.9 -7.4 484 143 B N X - 0 0 13 -4,-3.2 4,-2.4 -5,-0.2 5,-0.2 -0.353 59.4-147.9 -56.9 121.1 85.6 -22.6 -10.5 485 144 B E H > S+ 0 0 152 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.817 94.8 51.3 -67.4 -33.6 88.6 -23.2 -12.9 486 145 B Q H > S+ 0 0 63 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.873 113.0 46.5 -67.8 -39.4 86.5 -22.8 -16.1 487 146 B I H >> S+ 0 0 0 1,-0.2 4,-2.3 -7,-0.2 3,-0.7 0.925 107.8 53.9 -70.3 -46.8 85.1 -19.5 -14.9 488 147 B Q H 3X S+ 0 0 36 -4,-2.4 4,-3.7 1,-0.2 5,-0.2 0.807 97.8 65.7 -62.2 -32.2 88.4 -17.9 -13.6 489 148 B K H 3X S+ 0 0 126 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.928 110.6 36.8 -50.2 -48.8 90.1 -18.5 -17.0 490 149 B R H S+ 0 0 41 -4,-1.7 4,-2.7 1,-0.2 5,-0.7 0.869 113.4 48.8 -62.8 -37.9 101.7 6.0 -13.8 508 167 B W H X5S+ 0 0 48 -4,-1.6 4,-0.6 3,-0.2 -2,-0.2 0.851 113.6 44.9 -71.0 -38.8 100.4 8.6 -16.3 509 168 B H H <5S+ 0 0 41 -4,-2.4 -2,-0.2 2,-0.1 -1,-0.2 0.859 122.4 38.2 -71.6 -36.0 98.6 10.7 -13.7 510 169 B L H <5S+ 0 0 30 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.877 134.0 16.1 -84.9 -41.6 101.5 10.4 -11.2 511 170 B L H <5S- 0 0 33 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.1 0.685 90.5-147.5-107.6 -24.2 104.6 10.7 -13.5 512 171 B G << - 0 0 24 -5,-0.7 -1,-0.1 -4,-0.6 -3,-0.1 -0.132 46.4 -29.0 73.3-179.7 103.3 12.1 -16.8 513 172 B E S S+ 0 0 122 -5,-0.1 13,-0.2 11,-0.1 2,-0.2 -0.150 98.8 49.7 -64.3 159.4 104.8 11.2 -20.2 514 173 B G E S- D 0 525B 36 11,-2.1 11,-2.3 2,-0.0 2,-0.4 -0.469 92.6 -46.8 106.8-177.6 108.4 10.3 -20.7 515 174 B T E + D 0 524B 105 9,-0.2 2,-0.2 -2,-0.2 9,-0.2 -0.812 60.0 179.3-100.0 133.2 111.0 8.0 -19.2 516 175 B H E - D 0 523B 22 7,-2.9 7,-2.4 -2,-0.4 2,-0.5 -0.735 28.1-120.3-130.5 170.3 111.3 7.8 -15.4 517 176 B T E - D 0 522B 59 5,-0.3 -339,-2.1 -2,-0.2 2,-0.5 -0.975 22.9-179.1-118.8 122.5 113.1 6.1 -12.5 518 177 B V E > S-CD 177 521B 16 3,-3.6 3,-0.9 -2,-0.5 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X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.823 109.5 52.0 -59.2 -34.5 87.0 -1.1 -24.9 539 198 B M H X S+ 0 0 1 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.860 110.6 48.3 -69.9 -38.7 87.2 -3.8 -27.6 540 199 B S H X S+ 0 0 5 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.889 111.7 49.1 -66.6 -41.4 87.3 -6.5 -24.9 541 200 B V H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.839 107.8 54.8 -71.8 -34.3 84.2 -4.9 -23.1 542 201 B N H X S+ 0 0 0 -4,-1.9 4,-3.0 -5,-0.2 5,-0.4 0.940 110.5 45.9 -60.0 -47.0 82.4 -4.7 -26.4 543 202 B A H X>S+ 0 0 0 -4,-1.8 5,-2.1 3,-0.2 4,-2.1 0.901 111.8 52.8 -61.7 -43.1 83.0 -8.5 -26.9 544 203 B L H <>S+ 0 0 0 -4,-2.4 5,-2.3 3,-0.2 6,-0.2 0.959 121.1 29.6 -58.0 -53.1 81.9 -9.2 -23.2 545 204 B E H <5S+ 0 0 0 -4,-2.4 5,-0.2 3,-0.2 -2,-0.2 0.903 127.3 41.3 -76.9 -42.0 78.6 -7.3 -23.5 546 205 B A H <5S+ 0 0 0 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.753 134.7 11.6 -79.8 -27.3 77.8 -7.9 -27.2 547 206 B I T X5S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.4 -3,-0.2 0.770 124.4 47.1-113.6 -62.3 79.0 -11.5 -27.4 548 207 B R H > S+ 0 0 11 -5,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.840 104.2 53.2 -68.5 -33.8 74.3 -12.9 -25.5 551 210 B V H X S+ 0 0 1 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.902 110.9 47.9 -60.9 -42.7 75.5 -16.5 -25.5 552 211 B S H X S+ 0 0 2 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.854 106.3 56.5 -68.3 -35.8 74.3 -16.6 -21.8 553 212 B F H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.885 103.4 56.1 -61.5 -39.6 71.0 -15.0 -22.8 554 213 B A H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.910 107.4 48.2 -56.6 -46.4 70.5 -17.9 -25.2 555 214 B C H X S+ 0 0 0 -4,-1.4 4,-1.0 2,-0.2 -2,-0.2 0.952 114.0 45.4 -60.5 -50.9 71.0 -20.5 -22.4 556 215 B S H >X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 3,-0.5 0.898 113.8 48.5 -60.4 -44.3 68.5 -18.8 -20.1 557 216 B F H 3X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.786 100.5 66.0 -71.9 -26.8 65.9 -18.3 -22.8 558 217 B A H 3X S+ 0 0 1 -4,-1.8 4,-0.5 -5,-0.2 -1,-0.2 0.857 102.1 48.7 -58.8 -37.7 66.2 -21.9 -23.9 559 218 B F H X<>S+ 0 0 0 -4,-1.0 5,-2.1 -3,-0.5 3,-1.0 0.898 109.4 52.2 -66.7 -41.4 64.7 -22.9 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99.8 59.5 -63.4 -31.8 96.2 9.9 -32.9 602 261 B M H <> S+ 0 0 1 -3,-0.9 4,-3.4 2,-0.2 -1,-0.2 0.852 97.9 56.3 -66.2 -37.8 93.5 7.3 -32.1 603 262 B A H X S+ 0 0 29 -4,-1.0 4,-1.8 -3,-0.3 -1,-0.2 0.887 109.1 47.7 -61.6 -40.2 92.9 6.5 -35.8 604 263 B E H X S+ 0 0 102 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.939 115.2 45.1 -61.2 -49.9 96.6 5.7 -36.1 605 264 B I H X S+ 0 0 4 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.896 110.2 54.8 -61.9 -43.6 96.5 3.5 -33.0 606 265 B A H >X S+ 0 0 6 -4,-3.4 4,-0.9 1,-0.2 3,-0.5 0.871 109.4 47.2 -58.5 -41.4 93.2 1.9 -34.1 607 266 B E H 3< S+ 0 0 138 -4,-1.8 3,-0.4 1,-0.2 4,-0.3 0.876 110.6 50.9 -69.7 -39.2 94.8 0.8 -37.4 608 267 B E H 3< S+ 0 0 123 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.534 112.7 50.1 -74.0 -6.7 97.9 -0.5 -35.7 609 268 B C H XX S+ 0 0 0 -4,-0.6 4,-2.2 -3,-0.5 3,-0.9 0.629 76.8 103.3-101.9 -21.9 95.6 -2.5 -33.4 610 269 B K H 3X S+ 0 0 69 -4,-0.9 4,-2.8 -3,-0.4 5,-0.2 0.752 83.1 46.9 -32.7 -52.6 93.4 -4.1 -36.0 611 270 B Q H 3> S+ 0 0 127 -4,-0.3 4,-2.8 1,-0.2 -1,-0.3 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