==== 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 06-SEP-10 3OR1 . COMPND 2 MOLECULE: SULFITE REDUCTASE ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO GIGAS; . AUTHOR Y.C.HSIEH,M.Y.LIU,V.C.C.WANG,Y.L.CHIANG,E.H.LIU,W.G.WU,S.I.C . 1848 6 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 60017.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1132 61.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 226 12.2 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 . 12 0.6 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 . 111 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 201 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 448 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 10 8 3 9 8 2 2 4 1 0 7 2 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 3 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 PARALLEL BRIDGES PER LADDER . 18 8 4 8 6 4 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 8 0 0 4 2 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 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 3 A K 0 0 184 0, 0.0 46,-0.1 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 127.8 65.6 26.5 -34.3 2 4 A H - 0 0 57 44,-0.3 2,-0.4 1,-0.0 48,-0.0 -0.549 360.0 -89.8 -94.7 161.9 62.3 28.4 -35.0 3 5 A P - 0 0 93 0, 0.0 -1,-0.0 0, 0.0 50,-0.0 -0.638 42.1-176.3 -77.8 133.8 60.4 30.3 -32.4 4 6 A T > + 0 0 13 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.513 16.2 158.8-129.4 72.0 58.0 28.0 -30.8 5 7 A P H > S+ 0 0 85 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.921 79.0 41.9 -55.9 -54.1 55.9 30.1 -28.3 6 8 A M H >4 S+ 0 0 61 1,-0.2 3,-0.6 2,-0.2 4,-0.5 0.903 114.3 49.2 -66.4 -45.3 52.9 27.7 -28.0 7 9 A L H >4 S+ 0 0 0 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.831 102.9 63.8 -62.2 -32.8 55.0 24.4 -27.9 8 10 A D H >< S+ 0 0 65 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.855 92.3 63.7 -58.9 -35.2 57.1 25.9 -25.2 9 11 A E G X< S+ 0 0 58 -4,-0.9 3,-0.9 -3,-0.6 -1,-0.2 0.802 95.2 61.2 -58.1 -26.6 54.0 26.1 -23.0 10 12 A L G < S+ 0 0 0 -3,-1.4 9,-0.4 -4,-0.5 10,-0.3 0.160 86.2 71.6 -88.4 17.8 54.0 22.3 -23.2 11 13 A E G < S+ 0 0 30 -3,-1.8 551,-0.5 8,-0.1 -1,-0.2 0.480 87.1 85.6-103.2 -12.1 57.4 21.9 -21.5 12 14 A K < + 0 0 127 -3,-0.9 3,-0.1 -4,-0.3 549,-0.1 -0.509 68.2 52.2 -81.7 153.2 55.6 23.0 -18.3 13 15 A G S S- 0 0 35 -2,-0.2 4,-0.1 1,-0.1 589,-0.1 -0.237 89.1 -86.9 102.2 161.3 53.8 20.5 -16.1 14 16 A P S S+ 0 0 37 0, 0.0 549,-2.6 0, 0.0 -1,-0.1 0.825 92.8 95.1 -77.6 -36.2 54.9 17.2 -14.5 15 17 A W S S- 0 0 3 547,-0.2 547,-0.1 583,-0.2 587,-0.1 -0.323 95.6 -87.9 -61.8 135.7 54.2 14.8 -17.3 16 18 A P - 0 0 5 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.202 47.7-133.0 -48.2 119.6 57.1 13.9 -19.5 17 19 A S > - 0 0 1 -6,-0.2 4,-1.8 1,-0.2 5,-0.1 -0.670 14.5-159.2 -84.1 122.5 57.1 16.6 -22.3 18 20 A F H > S+ 0 0 5 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.776 96.7 57.5 -68.1 -24.5 57.5 15.4 -25.9 19 21 A V H > S+ 0 0 0 -9,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.946 105.8 46.6 -70.8 -47.5 58.6 18.9 -26.7 20 22 A S H > S+ 0 0 7 -10,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.863 114.9 49.1 -61.5 -35.5 61.5 18.9 -24.2 21 23 A D H X S+ 0 0 4 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.936 111.5 46.7 -70.5 -47.0 62.5 15.5 -25.5 22 24 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.905 111.6 52.8 -61.6 -40.3 62.4 16.5 -29.1 23 25 A K H X S+ 0 0 55 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.894 105.3 54.6 -62.0 -39.0 64.4 19.6 -28.3 24 26 A Q H X S+ 0 0 58 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.860 108.2 49.4 -62.6 -35.2 67.0 17.5 -26.5 25 27 A E H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.830 107.4 54.0 -73.2 -31.9 67.4 15.5 -29.7 26 28 A C H X S+ 0 0 5 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.938 110.4 47.4 -64.4 -46.2 67.7 18.7 -31.8 27 29 A D H X S+ 0 0 90 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.915 110.8 52.5 -59.4 -45.5 70.5 19.8 -29.4 28 30 A N H X S+ 0 0 40 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.927 111.3 44.2 -58.4 -49.3 72.2 16.3 -29.8 29 31 A R H < S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.788 111.1 56.9 -67.8 -26.6 72.2 16.3 -33.6 30 32 A A H < S+ 0 0 65 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.912 115.8 34.8 -69.6 -43.3 73.4 19.9 -33.5 31 33 A K H < S- 0 0 155 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.835 90.9-161.6 -77.7 -31.9 76.4 19.0 -31.4 32 34 A N >< - 0 0 36 -4,-3.0 3,-1.8 -5,-0.3 -3,-0.1 0.929 7.7-172.3 46.8 64.1 76.7 15.7 -33.1 33 35 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.737 81.2 47.4 -55.1 -35.0 78.9 14.0 -30.4 34 36 A K T 3 S- 0 0 125 2,-0.0 -2,-0.1 0, 0.0 -3,-0.0 0.347 106.0-125.1 -86.4 -8.7 79.5 11.0 -32.5 35 37 A G < + 0 0 58 -3,-1.8 2,-0.1 1,-0.1 -3,-0.1 0.849 44.3 175.1 64.2 39.2 80.4 12.8 -35.6 36 38 A L - 0 0 51 1,-0.1 2,-0.9 -7,-0.0 -1,-0.1 -0.396 36.8-129.4 -71.4 154.8 77.8 11.1 -37.8 37 39 A D - 0 0 75 -2,-0.1 402,-0.1 400,-0.0 -1,-0.1 -0.781 34.2-139.3 -98.9 91.1 77.2 12.0 -41.3 38 40 A Y - 0 0 24 -2,-0.9 85,-0.2 1,-0.1 4,-0.1 -0.232 8.2-151.7 -59.0 127.4 73.5 12.4 -41.1 39 41 A Q S S+ 0 0 22 83,-2.3 -1,-0.1 82,-0.1 84,-0.1 0.606 85.0 35.6 -82.1 -9.3 71.8 11.0 -44.1 40 42 A I S S- 0 0 8 82,-0.3 4,-0.1 84,-0.2 84,-0.1 -0.897 118.4 -60.3-132.6 161.8 69.0 13.4 -43.7 41 43 A P > - 0 0 52 0, 0.0 3,-2.0 0, 0.0 -2,-0.1 -0.106 38.7-138.0 -44.4 129.1 69.2 17.0 -42.5 42 44 A A T 3 S+ 0 0 31 1,-0.3 4,-0.2 -4,-0.1 -13,-0.1 0.853 106.0 58.2 -57.3 -31.9 70.7 17.3 -39.0 43 45 A E T 3> S+ 0 0 78 1,-0.2 4,-1.9 2,-0.1 -1,-0.3 0.153 70.3 113.1 -86.1 19.1 67.9 19.9 -38.4 44 46 A C H <> S+ 0 0 1 -3,-2.0 4,-1.5 1,-0.2 3,-0.3 0.945 79.5 45.3 -55.2 -53.0 65.1 17.5 -39.3 45 47 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.828 107.6 60.2 -60.5 -33.1 63.7 17.5 -35.7 46 48 A D H > S+ 0 0 18 1,-0.2 4,-2.1 -4,-0.2 -44,-0.3 0.911 107.6 45.3 -64.1 -40.5 64.0 21.2 -35.6 47 49 A D H X S+ 0 0 18 -4,-1.9 4,-2.6 -3,-0.3 -1,-0.2 0.767 104.7 59.2 -69.6 -32.1 61.7 21.5 -38.6 48 50 A L H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.936 110.9 43.5 -64.4 -44.3 59.1 19.0 -37.3 49 51 A L H X S+ 0 0 8 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.950 112.6 54.1 -67.6 -39.5 58.7 21.3 -34.2 50 52 A G H X S+ 0 0 5 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.923 114.4 39.0 -58.1 -47.0 58.7 24.3 -36.5 51 53 A I H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.812 114.1 54.5 -74.0 -28.1 55.9 22.9 -38.6 52 54 A L H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.891 106.7 52.8 -69.0 -38.7 54.1 21.5 -35.5 53 55 A E H X S+ 0 0 4 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.926 107.8 50.9 -63.0 -41.9 54.2 25.1 -34.1 54 56 A L H X S+ 0 0 25 -4,-1.7 4,-1.9 1,-0.3 -1,-0.2 0.893 107.1 54.0 -63.0 -38.0 52.6 26.4 -37.4 55 57 A S H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 5,-0.5 0.868 104.5 54.5 -67.3 -32.8 49.9 23.8 -37.0 56 58 A F H < S+ 0 0 3 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.901 110.5 47.3 -65.6 -37.0 49.2 25.0 -33.5 57 59 A H H < S+ 0 0 97 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.910 120.9 33.1 -68.4 -47.1 48.7 28.5 -34.8 58 60 A E H < S- 0 0 66 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.575 96.6-130.9 -88.5 -15.7 46.5 27.8 -37.7 59 61 A G S < S+ 0 0 8 -4,-2.0 2,-0.3 -5,-0.2 651,-0.2 0.661 72.7 98.0 69.5 23.5 44.6 24.8 -36.3 60 62 A E S S- 0 0 10 -5,-0.5 -2,-0.2 -6,-0.2 -1,-0.2 -0.963 76.1-103.1-145.6 142.1 45.2 22.6 -39.3 61 63 A T - 0 0 5 528,-0.3 526,-0.1 -2,-0.3 522,-0.1 -0.374 17.9-154.6 -68.3 151.2 47.7 19.8 -40.4 62 64 A H + 0 0 0 521,-0.3 22,-2.4 524,-0.1 2,-0.4 0.054 56.4 109.2-119.5 24.6 50.5 20.7 -42.7 63 65 A W B -A 83 0A 4 523,-0.4 20,-0.2 20,-0.3 3,-0.1 -0.858 68.4-119.0 -96.6 134.0 51.1 17.3 -44.3 64 66 A K - 0 0 27 18,-2.4 18,-0.3 -2,-0.4 2,-0.1 -0.295 43.7 -82.4 -66.4 157.6 50.2 16.6 -47.8 65 67 A H S S- 0 0 27 639,-0.1 -1,-0.1 522,-0.1 636,-0.0 -0.390 81.0 -40.1 -60.1 134.4 47.6 13.9 -48.6 66 68 A G - 0 0 14 -2,-0.1 16,-0.3 -3,-0.1 2,-0.1 -0.124 55.0-150.1 61.2-148.0 49.0 10.4 -48.7 67 69 A G - 0 0 12 855,-0.3 2,-0.4 859,-0.1 13,-0.4 -0.274 7.3-141.2 136.2 138.7 52.3 9.1 -50.2 68 70 A I + 0 0 18 -2,-0.1 2,-0.2 11,-0.1 11,-0.1 -0.828 41.4 135.2-130.9 96.1 53.3 5.9 -51.7 69 71 A V + 0 0 15 -2,-0.4 9,-0.3 9,-0.4 2,-0.3 -0.827 14.9 128.7-133.4 170.4 56.8 4.7 -50.9 70 72 A G - 0 0 14 -2,-0.2 2,-0.3 7,-0.1 78,-0.1 -0.972 48.4 -71.0 167.3-174.3 58.3 1.3 -49.8 71 73 A V > - 0 0 3 5,-0.3 3,-1.5 -2,-0.3 5,-0.1 -0.832 51.8 -96.1-114.9 150.8 60.9 -1.3 -50.3 72 74 A F T 3 S+ 0 0 14 -2,-0.3 835,-0.2 1,-0.2 3,-0.1 -0.352 109.4 30.0 -66.5 148.5 61.2 -3.7 -53.1 73 75 A G T 3 S+ 0 0 2 833,-3.0 2,-0.3 1,-0.2 -1,-0.2 0.059 110.8 78.6 91.4 -26.3 59.7 -7.1 -52.5 74 76 A Y < - 0 0 5 -3,-1.5 -1,-0.2 1,-0.1 131,-0.2 -0.851 61.6-154.4-116.9 153.7 57.1 -5.7 -50.1 75 77 A G S S+ 0 0 26 129,-3.1 2,-0.3 -2,-0.3 130,-0.2 0.267 78.6 2.7-105.2 9.1 53.8 -3.8 -50.7 76 78 A G + 0 0 5 128,-0.5 -5,-0.3 -5,-0.1 90,-0.1 -0.948 61.6 111.1-169.6-170.7 53.9 -2.0 -47.4 77 79 A G S S+ 0 0 0 -2,-0.3 22,-2.3 1,-0.1 2,-0.4 0.142 75.7 81.2 108.6 -14.2 55.5 -1.2 -44.1 78 80 A V E -B 98 0B 6 -9,-0.3 2,-0.8 20,-0.2 -9,-0.4 -0.995 63.0-151.6-125.7 125.1 56.3 2.4 -44.8 79 81 A I E -B 97 0B 22 18,-2.2 18,-2.0 -2,-0.4 -11,-0.1 -0.862 20.9-147.1-100.5 103.7 53.9 5.4 -44.5 80 82 A G + 0 0 1 -2,-0.8 2,-0.3 -13,-0.4 846,-0.1 -0.327 23.2 172.6 -61.3 144.5 55.0 8.0 -46.9 81 83 A R - 0 0 19 -2,-0.1 14,-2.1 505,-0.0 2,-0.3 -0.966 14.8-168.9-161.9 137.5 54.5 11.7 -45.9 82 84 A Y B -G 94 0C 5 -2,-0.3 -18,-2.4 -18,-0.3 12,-0.2 -0.995 25.9-121.8-126.0 130.2 55.5 15.0 -47.4 83 85 A C B -A 63 0A 2 9,-0.9 -20,-0.3 10,-0.9 -2,-0.0 -0.411 14.8-138.2 -72.2 153.6 55.2 18.4 -45.7 84 86 A D S S+ 0 0 4 -22,-2.4 1277,-1.0 1,-0.2 -21,-0.1 0.198 98.6 52.8 -93.7 4.2 53.1 21.0 -47.6 85 87 A Q > + 0 0 32 -23,-0.3 4,-2.0 4,-0.1 3,-0.3 -0.409 63.4 158.5-128.0 64.5 55.5 23.8 -46.9 86 88 A P T 4 S+ 0 0 35 0, 0.0 7,-0.2 0, 0.0 6,-0.1 0.756 71.7 54.7 -63.2 -24.2 58.7 22.3 -48.1 87 89 A E T 4 S+ 0 0 165 1,-0.2 -2,-0.0 2,-0.1 6,-0.0 0.896 111.9 43.6 -77.7 -35.5 60.4 25.7 -48.6 88 90 A M T 4 S+ 0 0 100 -3,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.862 128.2 27.0 -72.8 -38.7 59.7 26.7 -45.1 89 91 A F >< + 0 0 7 -4,-2.0 3,-2.0 1,-0.1 -1,-0.2 -0.582 65.0 169.6-129.4 70.7 60.7 23.4 -43.5 90 92 A P G > S+ 0 0 78 0, 0.0 3,-1.3 0, 0.0 4,-0.4 0.814 73.7 68.1 -53.3 -21.9 63.2 21.6 -45.7 91 93 A G G 3 S+ 0 0 5 1,-0.3 -43,-0.1 -48,-0.2 -47,-0.0 0.625 107.1 34.1 -81.4 -14.5 63.9 19.1 -43.0 92 94 A V G < S+ 0 0 0 -3,-2.0 -9,-0.9 -45,-0.1 -1,-0.3 0.000 76.6 114.9-118.4 21.0 60.5 17.5 -43.2 93 95 A A S < S+ 0 0 29 -3,-1.3 -10,-0.9 1,-0.2 2,-0.4 0.951 95.8 26.8 -52.3 -47.0 59.9 17.8 -46.9 94 96 A H B S+G 82 0C 53 -4,-0.4 -12,-0.2 -12,-0.2 -1,-0.2 -0.940 75.0 163.6-109.4 131.3 60.0 14.1 -46.8 95 97 A F + 0 0 0 -14,-2.1 48,-0.2 -2,-0.4 -13,-0.1 -0.239 14.3 172.8-150.4 52.2 59.0 12.7 -43.4 96 98 A H - 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0 0 29 -2,-0.3 3,-0.1 -3,-0.1 2,-0.1 -0.556 53.2-104.3 -77.3 146.5 -2.0 5.5 -58.1 1812 64 F P - 0 0 16 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.381 35.0-100.6 -73.0 152.6 -1.0 8.9 -56.7 1813 65 F M >> - 0 0 25 1,-0.1 4,-2.5 -2,-0.1 3,-0.9 -0.401 34.1-113.8 -66.5 149.3 -0.9 9.6 -53.0 1814 66 F V H 3> S+ 0 0 38 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.861 117.3 56.4 -53.9 -35.3 -3.9 11.5 -51.7 1815 67 F R H 3> S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.825 108.1 45.1 -64.6 -39.5 -1.6 14.4 -50.9 1816 68 F I H <> S+ 0 0 48 -3,-0.9 4,-2.5 2,-0.2 5,-0.3 0.879 109.5 55.7 -70.8 -41.8 -0.3 14.6 -54.4 1817 69 F L H X S+ 0 0 4 -4,-2.5 4,-1.9 1,-0.2 6,-0.4 0.920 113.4 41.7 -57.4 -44.9 -3.8 14.3 -55.9 1818 70 F S H X S+ 0 0 25 -4,-2.2 4,-1.7 -5,-0.2 5,-0.2 0.898 112.9 52.9 -70.7 -41.3 -5.0 17.3 -53.8 1819 71 F K H < S+ 0 0 164 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.911 115.8 38.3 -61.8 -45.2 -1.9 19.4 -54.4 1820 72 F N H < S+ 0 0 106 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.942 122.9 38.8 -73.4 -50.7 -2.0 19.1 -58.2 1821 73 F T H < S- 0 0 3 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.707 101.2-132.2 -73.7 -19.8 -5.7 19.3 -58.8 1822 74 F G < + 0 0 53 -4,-1.7 2,-0.5 1,-0.3 -3,-0.2 0.538 64.2 130.0 79.4 6.3 -6.0 21.9 -56.1 1823 75 F F - 0 0 21 -6,-0.4 -1,-0.3 -5,-0.2 -2,-0.2 -0.818 52.4-138.7 -95.7 124.2 -9.0 20.0 -54.6 1824 76 F A > - 0 0 52 -2,-0.5 4,-2.5 -3,-0.1 3,-0.4 -0.334 32.8 -99.6 -72.7 166.2 -8.9 19.2 -50.9 1825 77 F L H > S+ 0 0 23 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.900 123.9 57.9 -56.0 -39.8 -10.0 15.9 -49.7 1826 78 F K H > S+ 0 0 144 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.928 109.2 44.1 -55.8 -47.2 -13.4 17.3 -48.8 1827 79 F E H > S+ 0 0 82 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.916 108.5 58.5 -63.7 -44.0 -14.0 18.5 -52.3 1828 80 F I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.898 109.1 44.7 -51.7 -43.2 -12.7 15.1 -53.7 1829 81 F Y H < S+ 0 0 8 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.782 107.3 57.7 -74.1 -27.0 -15.4 13.4 -51.7 1830 82 F E H < S+ 0 0 130 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.856 115.8 38.5 -69.0 -31.8 -18.1 15.9 -52.8 1831 83 F L H < S+ 0 0 25 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.893 132.2 25.3 -81.6 -45.6 -17.1 14.8 -56.3 1832 84 F F >< - 0 0 0 -4,-2.8 3,-2.2 -5,-0.2 -1,-0.3 -0.852 68.2-167.1-125.0 96.8 -16.6 11.1 -55.6 1833 85 F P T 3 S+ 0 0 12 0, 0.0 -833,-2.8 0, 0.0 -1,-0.1 0.738 87.9 55.7 -54.3 -27.6 -18.7 10.0 -52.6 1834 86 F S T 3 S- 0 0 5 -49,-0.4 4,-0.4 1,-0.3 3,-0.2 0.589 116.3-109.6 -83.8 -13.5 -16.9 6.7 -52.3 1835 87 F G <>> - 0 0 1 -3,-2.2 5,-1.6 -7,-0.2 4,-1.2 -0.349 38.2 -62.3 108.2 170.8 -13.5 8.4 -52.1 1836 88 F P T 4>S+ 0 0 16 0, 0.0 5,-2.7 0, 0.0 -1,-0.2 0.830 130.0 41.3 -62.6 -30.2 -10.4 8.8 -54.3 1837 89 F G T 4>S+ 0 0 21 3,-0.2 5,-1.4 -3,-0.2 4,-0.2 0.970 122.7 28.3 -80.2 -78.8 -9.9 5.0 -54.3 1838 90 F K T 45S+ 0 0 40 -4,-0.4 -3,-0.2 3,-0.2 -1,-0.1 0.785 136.7 31.5 -55.2 -27.8 -13.1 3.1 -54.6 1839 91 F G T X5S+ 0 0 0 -4,-1.2 4,-2.4 -7,-0.2 5,-0.2 0.912 127.2 26.2 -96.6 -77.9 -14.6 6.0 -56.5 1840 92 F A H >XS+ 0 0 12 -5,-2.7 5,-1.5 -4,-0.2 4,-0.6 0.923 113.2 49.2 -56.7 -43.7 -9.6 5.3 -59.2 1842 94 F K H >4