==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-JUN-98 1BIQ . COMPND 2 MOLECULE: PROTEIN R2 OF RIBONUCLEOTIDE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.T.LOGAN,F.DEMARE,B.O.PERSSON,A.SLABY,B.M.SJOBERG, . 681 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24228.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 529 77.7 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 . 20 2.9 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 . 3 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 19 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 394 57.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.1 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 0 1 2 2 0 1 2 0 2 0 2 0 0 0 4 0 2 0 1 0 0 0 2 0 0 4 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 . 4 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 0 101 0, 0.0 2,-0.4 0, 0.0 168,-0.1 0.000 360.0 360.0 360.0 -0.6 13.9 -14.3 28.8 2 2 A Y - 0 0 19 497,-0.1 2,-0.4 166,-0.1 501,-0.1 -0.698 360.0-168.9 -86.1 139.0 14.4 -11.1 30.8 3 3 A T - 0 0 32 -2,-0.4 3,-0.4 94,-0.1 493,-0.1 -0.991 30.9-147.0-135.6 143.9 17.9 -9.7 30.4 4 4 A T S S+ 0 0 0 -2,-0.4 2,-0.2 491,-0.3 426,-0.1 0.642 101.4 24.4 -74.4 -18.5 19.8 -6.9 32.2 5 5 A F S S- 0 0 6 490,-0.0 -1,-0.3 20,-0.0 2,-0.2 -0.623 78.7-152.2-150.2 86.6 21.7 -6.1 28.9 6 6 A S - 0 0 9 -3,-0.4 19,-0.1 17,-0.3 15,-0.0 -0.376 6.2-152.9 -58.2 121.2 19.9 -7.0 25.7 7 7 A Q + 0 0 92 -2,-0.2 2,-0.4 2,-0.1 -1,-0.2 0.528 61.7 102.8 -80.9 1.0 22.5 -7.6 23.1 8 8 A T S S- 0 0 93 1,-0.1 2,-1.0 475,-0.0 16,-0.1 -0.685 75.2-126.8 -84.7 136.1 20.4 -6.7 20.0 9 9 A K + 0 0 116 -2,-0.4 2,-0.3 15,-0.1 -2,-0.1 -0.737 44.0 176.4 -80.4 101.1 21.1 -3.2 18.6 10 10 A N - 0 0 24 -2,-1.0 2,-1.2 11,-0.0 3,-0.1 -0.737 41.3-114.7-110.0 153.3 17.5 -1.8 18.6 11 11 A D > - 0 0 85 -2,-0.3 3,-2.1 1,-0.2 4,-0.2 -0.767 29.4-166.2 -87.7 104.4 16.0 1.6 17.6 12 12 A Q G > S+ 0 0 12 -2,-1.2 3,-1.0 1,-0.3 -1,-0.2 0.715 81.4 71.2 -65.1 -20.7 14.8 2.5 21.1 13 13 A L G 3 S+ 0 0 54 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.744 100.9 47.2 -69.5 -17.1 12.8 5.3 19.5 14 14 A K G < S+ 0 0 158 -3,-2.1 -1,-0.2 2,-0.0 -2,-0.2 0.376 84.6 105.1-107.9 11.0 10.5 2.6 18.1 15 15 A E S < S- 0 0 31 -3,-1.0 4,-0.1 -4,-0.2 2,-0.0 -0.573 74.0-112.3 -85.1 158.9 9.9 0.3 21.0 16 16 A P - 0 0 31 0, 0.0 4,-0.3 0, 0.0 84,-0.2 -0.335 35.6-105.5 -72.3 171.3 6.5 0.4 22.8 17 17 A M S S+ 0 0 0 82,-0.1 83,-2.3 1,-0.1 84,-0.6 0.879 101.0 20.0 -63.8 -40.3 6.7 1.7 26.4 18 18 A F B S+A 99 0A 4 81,-0.3 81,-0.2 82,-0.2 -1,-0.1 -0.916 118.4 24.3-131.1 162.0 6.3 -1.8 27.8 19 19 A F S S+ 0 0 25 79,-2.9 80,-0.1 -2,-0.3 -1,-0.1 0.454 90.2 113.5 66.6 2.4 6.7 -5.3 26.7 20 20 A G S S- 0 0 23 78,-0.4 -1,-0.2 -4,-0.3 81,-0.1 0.114 85.7 -47.1 -82.9-157.8 9.2 -4.3 24.0 21 21 A Q S S- 0 0 38 79,-0.2 -1,-0.2 1,-0.1 3,-0.1 -0.621 73.8-102.1 -73.3 136.6 12.9 -5.3 24.0 22 22 A P - 0 0 29 0, 0.0 78,-0.2 0, 0.0 -16,-0.2 -0.117 46.0 -93.5 -54.8 145.0 14.3 -4.7 27.5 23 23 A V + 0 0 3 76,-0.8 -17,-0.3 1,-0.1 3,-0.1 -0.406 47.1 170.9 -64.1 134.6 16.4 -1.5 27.6 24 24 A N + 0 0 3 1,-0.3 2,-0.3 -19,-0.2 -1,-0.1 0.678 64.2 40.9-101.1 -80.2 20.2 -2.0 27.1 25 25 A V S S- 0 0 3 -19,-0.1 2,-1.0 453,-0.1 -1,-0.3 -0.506 71.7-145.4 -74.2 124.9 21.8 1.4 26.7 26 26 A A + 0 0 2 -2,-0.3 2,-0.3 396,-0.3 438,-0.1 -0.805 36.6 156.3 -92.9 99.6 20.6 4.1 29.0 27 27 A R - 0 0 11 -2,-1.0 434,-0.1 3,-0.1 76,-0.1 -0.918 29.0-171.4-122.3 151.1 20.9 7.3 26.9 28 28 A Y + 0 0 6 -2,-0.3 3,-0.1 432,-0.2 -2,-0.0 0.019 62.3 97.9-129.9 25.3 18.9 10.6 27.4 29 29 A D S S+ 0 0 32 1,-0.1 2,-0.3 445,-0.0 -1,-0.1 0.706 94.4 21.8 -86.0 -23.8 19.9 12.5 24.2 30 30 A Q - 0 0 48 3,-0.0 2,-0.3 -3,-0.0 -1,-0.1 -0.929 67.3-166.1-140.3 160.2 16.6 11.5 22.5 31 31 A Q - 0 0 49 -2,-0.3 3,-0.3 1,-0.1 -18,-0.1 -0.991 28.1-148.0-146.5 149.1 13.2 10.3 23.6 32 32 A K S S+ 0 0 59 1,-0.3 2,-0.5 -2,-0.3 -1,-0.1 0.871 108.6 21.7 -78.2 -42.2 10.1 8.6 22.0 33 33 A Y >> - 0 0 32 1,-0.1 3,-1.3 -3,-0.1 4,-0.6 -0.910 69.6-167.4-128.1 103.9 8.2 10.6 24.6 34 34 A D H 3> S+ 0 0 87 -2,-0.5 4,-2.6 -3,-0.3 5,-0.2 0.674 77.2 81.5 -67.7 -11.4 9.9 13.6 26.1 35 35 A I H 3> S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.880 91.0 53.5 -59.7 -38.4 7.3 14.0 28.9 36 36 A F H <> S+ 0 0 0 -3,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.913 107.8 48.1 -65.3 -36.0 9.2 11.3 30.7 37 37 A E H X S+ 0 0 11 -4,-0.6 4,-3.1 1,-0.2 5,-0.2 0.919 111.2 53.1 -65.8 -42.4 12.6 13.2 30.4 38 38 A K H X S+ 0 0 108 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.922 107.6 49.0 -63.3 -38.7 10.9 16.3 31.6 39 39 A L H X S+ 0 0 9 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.899 110.4 52.4 -67.8 -37.7 9.5 14.6 34.7 40 40 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.971 110.6 46.9 -60.7 -50.3 12.9 13.2 35.5 41 41 A E H X S+ 0 0 80 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.911 114.5 47.0 -57.1 -44.1 14.5 16.7 35.2 42 42 A K H X S+ 0 0 106 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.918 111.2 50.1 -64.4 -43.0 11.7 18.2 37.4 43 43 A Q H >< S+ 0 0 9 -4,-2.7 3,-0.7 -5,-0.2 -2,-0.2 0.954 111.9 47.3 -60.5 -48.2 11.9 15.5 40.0 44 44 A L H >< S+ 0 0 18 -4,-2.5 3,-1.9 1,-0.3 -2,-0.2 0.910 109.1 56.4 -58.8 -40.9 15.7 15.9 40.3 45 45 A S H 3< S+ 0 0 67 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.740 106.6 50.9 -63.7 -23.5 15.2 19.7 40.5 46 46 A F T << S+ 0 0 19 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.379 76.8 146.0 -93.9 2.3 13.0 19.1 43.5 47 47 A F < + 0 0 49 -3,-1.9 2,-0.3 -4,-0.2 -3,-0.1 -0.117 22.7 171.2 -41.7 124.4 15.4 16.9 45.4 48 48 A W - 0 0 26 185,-0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.971 30.9-134.7-141.2 158.5 15.0 17.5 49.2 49 49 A R > - 0 0 44 -2,-0.3 3,-1.6 1,-0.1 4,-0.3 -0.962 10.2-154.8-120.3 110.6 16.2 16.0 52.5 50 50 A P G > S+ 0 0 0 0, 0.0 3,-3.2 0, 0.0 -1,-0.1 0.821 88.7 62.1 -49.4 -52.9 13.6 15.4 55.2 51 51 A E G 3 S+ 0 0 53 1,-0.3 4,-0.1 3,-0.1 70,-0.0 0.693 96.4 64.1 -54.2 -19.2 15.9 15.5 58.2 52 52 A E G < S+ 0 0 161 -3,-1.6 -1,-0.3 2,-0.1 2,-0.3 0.695 82.3 97.1 -79.1 -16.7 16.7 19.1 57.3 53 53 A V S < S- 0 0 22 -3,-3.2 2,-0.8 -4,-0.3 173,-0.1 -0.554 83.3-118.7 -74.4 132.7 13.1 20.1 57.8 54 54 A D + 0 0 100 -2,-0.3 175,-0.1 1,-0.2 4,-0.1 -0.665 45.8 156.9 -80.7 111.5 12.4 21.6 61.2 55 55 A V > + 0 0 4 -2,-0.8 4,-0.6 -4,-0.1 -1,-0.2 0.081 36.0 117.1-114.4 12.7 9.9 19.5 63.2 56 56 A S T >4 S+ 0 0 73 1,-0.2 3,-1.3 2,-0.2 4,-0.5 0.945 76.0 43.8 -50.1 -57.9 11.0 20.7 66.6 57 57 A R T >> S+ 0 0 124 1,-0.2 3,-1.9 2,-0.2 4,-1.9 0.868 94.3 80.3 -58.3 -38.0 7.7 22.4 67.6 58 58 A D H 3> S+ 0 0 3 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.692 86.1 60.6 -43.3 -27.1 5.5 19.5 66.3 59 59 A R H S+ 0 0 69 -3,-1.9 4,-2.7 -4,-0.5 -2,-0.2 0.971 116.4 50.9 -70.2 -49.4 4.8 20.2 71.7 61 61 A D H X S+ 0 0 16 -4,-1.9 4,-1.1 1,-0.2 -2,-0.2 0.945 112.0 48.0 -49.8 -51.8 1.9 20.8 69.3 62 62 A Y H >< S+ 0 0 28 -4,-2.5 3,-0.7 -5,-0.2 -1,-0.2 0.896 110.0 49.6 -59.0 -43.9 1.3 17.1 69.3 63 63 A Q H 3< S+ 0 0 105 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.850 109.1 55.5 -63.4 -35.5 1.4 16.7 73.0 64 64 A A H 3< S+ 0 0 74 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.707 88.1 103.8 -70.0 -23.1 -1.0 19.6 73.3 65 65 A L S << S- 0 0 6 -4,-1.1 2,-0.2 -3,-0.7 -3,-0.0 -0.243 82.5-106.3 -62.0 148.0 -3.6 17.9 71.0 66 66 A P >> - 0 0 59 0, 0.0 3,-2.6 0, 0.0 4,-2.3 -0.603 38.1-109.6 -74.1 137.2 -6.7 16.3 72.3 67 67 A E H 3> S+ 0 0 139 1,-0.3 4,-3.0 -2,-0.2 5,-0.1 0.733 120.0 53.6 -39.4 -34.6 -6.3 12.6 72.2 68 68 A H H 3> S+ 0 0 55 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.817 108.6 47.0 -76.3 -28.3 -8.9 12.4 69.5 69 69 A E H <> S+ 0 0 23 -3,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.799 111.8 52.6 -77.3 -30.1 -7.0 14.9 67.4 70 70 A K H X S+ 0 0 28 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.995 109.3 49.9 -65.6 -54.3 -3.9 12.9 68.1 71 71 A H H X S+ 0 0 25 -4,-3.0 4,-1.7 1,-0.3 5,-0.2 0.806 111.8 47.3 -49.2 -40.8 -5.8 9.8 66.9 72 72 A I H X S+ 0 0 1 -4,-1.4 4,-2.1 2,-0.2 -1,-0.3 0.955 113.6 48.0 -70.8 -47.3 -6.8 11.5 63.8 73 73 A F H X S+ 0 0 4 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.955 116.8 40.4 -55.9 -53.3 -3.3 12.8 63.1 74 74 A I H X S+ 0 0 13 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.900 110.3 55.9 -66.4 -43.2 -1.5 9.6 63.7 75 75 A S H X S+ 0 0 1 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.948 111.0 47.6 -57.6 -43.4 -4.0 7.3 61.9 76 76 A N H >X S+ 0 0 4 -4,-2.1 4,-2.2 -5,-0.2 3,-0.6 0.959 111.7 48.6 -58.4 -53.8 -3.5 9.5 58.9 77 77 A L H 3X S+ 0 0 2 -4,-2.4 4,-3.6 1,-0.3 5,-0.2 0.925 107.8 57.0 -53.3 -44.7 0.3 9.5 59.1 78 78 A K H 3X S+ 0 0 20 -4,-3.1 4,-1.9 1,-0.2 -1,-0.3 0.860 107.6 45.5 -56.8 -41.0 0.2 5.7 59.5 79 79 A Y H S+ 0 0 0 -4,-2.2 4,-3.4 1,-0.2 5,-0.7 0.861 90.8 51.6 -50.8 -54.8 6.7 -1.4 43.9 91 91 A P H >>S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 5,-1.1 0.915 116.0 45.7 -56.8 -32.7 7.3 0.6 40.8 92 92 A N H >5S+ 0 0 1 -3,-0.4 4,-0.6 -4,-0.3 -2,-0.2 0.952 117.6 40.0 -74.7 -50.4 10.8 -0.9 40.6 93 93 A V H <5S+ 0 0 14 -4,-2.3 -1,-0.2 1,-0.1 -3,-0.2 0.858 127.5 32.8 -69.0 -33.9 9.8 -4.5 41.2 94 94 A A H <5S+ 0 0 2 -4,-3.4 -2,-0.2 -5,-0.2 -1,-0.1 0.881 129.1 28.7 -92.1 -40.8 6.6 -4.5 39.1 95 95 A L H >X< S- 0 0 0 -84,-0.6 4,-1.6 1,-0.1 3,-0.3 -0.997 73.6-134.8-131.8 137.4 12.2 2.6 26.5 102 102 A P H > S+ 0 0 3 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.870 99.2 55.0 -60.8 -40.7 15.1 4.3 28.5 103 103 A E H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.914 112.5 43.0 -59.9 -38.8 13.3 7.5 29.5 104 104 A L H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.856 111.9 55.2 -76.2 -33.9 10.4 5.7 31.1 105 105 A E H X S+ 0 0 5 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.958 113.5 39.8 -63.3 -51.8 12.8 3.2 32.7 106 106 A T H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.880 112.0 58.3 -66.9 -33.0 14.8 6.0 34.4 107 107 A W H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.3 5,-0.2 0.956 108.0 47.2 -59.1 -49.0 11.5 7.9 35.2 108 108 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.896 112.2 48.0 -62.2 -38.5 10.3 4.9 37.1 109 109 A E H X S+ 0 0 4 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.875 114.2 47.7 -69.1 -36.7 13.6 4.5 39.0 110 110 A T H X S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.926 111.8 50.1 -68.3 -41.6 13.5 8.2 39.9 111 111 A W H X S+ 0 0 0 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.961 112.6 46.1 -59.6 -54.3 9.9 8.1 41.0 112 112 A A H X S+ 0 0 0 -4,-2.5 4,-1.7 -5,-0.2 3,-0.4 0.946 110.0 54.1 -56.5 -45.6 10.5 5.1 43.2 113 113 A F H X S+ 0 0 10 -4,-1.9 4,-1.2 1,-0.2 3,-0.5 0.947 106.0 53.6 -55.0 -46.3 13.6 6.7 44.7 114 114 A S H X S+ 0 0 6 -4,-2.6 4,-1.8 1,-0.3 -1,-0.2 0.844 104.5 55.6 -59.7 -29.2 11.5 9.9 45.5 115 115 A E H X S+ 0 0 0 -4,-1.6 4,-2.7 -3,-0.4 -1,-0.3 0.878 101.0 56.4 -72.6 -36.3 9.1 7.7 47.4 116 116 A T H X S+ 0 0 2 -4,-1.7 4,-1.5 -3,-0.5 -1,-0.2 0.805 105.1 53.8 -66.8 -22.3 11.8 6.3 49.6 117 117 A I H X S+ 0 0 6 -4,-1.2 4,-2.6 -5,-0.2 -1,-0.2 0.927 105.0 53.5 -74.3 -37.5 12.5 9.8 50.5 118 118 A H H X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.3 -2,-0.2 0.965 109.0 49.5 -56.1 -47.2 8.8 10.2 51.5 119 119 A S H X S+ 0 0 1 -4,-2.7 4,-1.6 1,-0.2 -1,-0.3 0.855 106.8 54.1 -61.1 -35.2 9.2 7.3 53.7 120 120 A R H X S+ 0 0 2 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.919 105.2 57.0 -64.2 -40.6 12.4 8.8 55.3 121 121 A S H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.817 104.9 49.6 -60.9 -32.0 10.3 11.9 56.0 122 122 A F H X S+ 0 0 2 -4,-1.6 4,-3.5 2,-0.2 5,-0.3 0.888 108.0 51.9 -76.5 -34.7 7.8 9.9 58.0 123 123 A T H X S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.940 110.7 50.8 -62.4 -41.0 10.4 8.3 60.1 124 124 A H H X S+ 0 0 17 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.908 115.3 41.5 -61.7 -41.0 11.7 11.8 60.8 125 125 A I H >< S+ 0 0 0 -4,-1.9 3,-0.7 2,-0.2 4,-0.3 0.971 115.1 49.8 -73.0 -50.8 8.3 13.1 61.8 126 126 A I H >X S+ 0 0 0 -4,-3.5 3,-2.4 1,-0.2 4,-1.6 0.958 110.2 48.8 -54.9 -52.9 7.3 10.1 63.8 127 127 A R H 3< S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.752 110.6 53.4 -60.7 -21.0 10.5 9.9 65.8 128 128 A N T << S+ 0 0 58 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.392 116.4 35.5 -94.4 5.9 10.2 13.6 66.6 129 129 A I T <4 S+ 0 0 10 -3,-2.4 2,-0.3 -4,-0.3 -2,-0.2 0.549 112.3 45.1-132.6 -8.6 6.7 13.4 67.9 130 130 A V S < S- 0 0 36 -4,-1.6 -1,-0.1 -5,-0.2 -71,-0.0 -0.848 70.6-124.2-131.0 166.6 6.3 10.1 69.8 131 131 A N S S+ 0 0 172 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 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52.8 -9.6 43.3 668 327 B T + 0 0 108 -2,-0.4 2,-0.3 -4,-0.1 -1,-0.1 -0.416 49.9 154.2 -67.2 134.8 52.7 -7.0 46.1 669 328 B R - 0 0 126 -2,-0.1 2,-0.1 -18,-0.1 -3,-0.0 -0.955 44.0-102.4-157.8 158.9 53.8 -3.6 44.9 670 329 B S - 0 0 104 -2,-0.3 -19,-0.1 1,-0.2 0, 0.0 -0.274 64.5 -65.2 -79.3 166.2 53.1 0.0 45.9 671 330 B N - 0 0 21 1,-0.2 -1,-0.2 -2,-0.1 -23,-0.1 -0.362 41.4-155.0 -60.0 127.1 50.7 2.1 43.8 672 331 B P S S+ 0 0 44 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.729 88.7 37.8 -74.0 -21.4 52.2 2.7 40.3 673 332 B I > + 0 0 2 1,-0.1 3,-2.9 -29,-0.1 4,-0.3 -0.477 60.1 163.5-131.0 63.0 50.2 5.9 39.7 674 333 B P G > + 0 0 81 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.693 69.8 77.0 -51.1 -21.9 50.0 7.8 42.9 675 334 B W G > S+ 0 0 66 1,-0.3 3,-1.3 2,-0.2 4,-0.2 0.774 80.1 71.9 -63.5 -22.3 49.0 10.9 40.8 676 335 B I G X> S+ 0 0 0 -3,-2.9 3,-2.8 1,-0.2 4,-0.8 0.865 79.2 75.1 -59.4 -34.3 45.6 9.3 40.7 677 336 B N G <4 S+ 0 0 96 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.715 81.1 69.0 -52.1 -22.7 45.0 10.1 44.3 678 337 B T G <4 S+ 0 0 81 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.746 108.4 37.4 -69.6 -22.8 44.4 13.7 43.5 679 338 B W T <4 S+ 0 0 45 -3,-2.8 2,-1.0 -4,-0.2 -1,-0.2 0.520 101.4 72.9-106.2 -14.8 41.2 12.7 41.8 680 339 B L < + 0 0 24 -4,-0.8 -1,-0.2 1,-0.2 -107,-0.1 -0.803 57.2 172.6-100.9 83.9 40.0 10.0 44.1 681 340 B V 0 0 76 -2,-1.0 -1,-0.2 -108,-0.2 -4,-0.0 0.705 360.0 360.0 -66.3 -18.3 39.0 12.2 47.0 682 341 B S 0 0 89 -3,-0.1 -2,-0.1 0, 0.0 -105,-0.0 -0.258 360.0 360.0 -72.6 360.0 37.5 9.2 48.8