==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 31-JUL-09 3II3 . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ACIDIANUS FILAMENTOUS VIRUS 1; . AUTHOR A.GOULET,P.REDDER,M.PINA,D.PRANGISHVILI,H.VAN TILBEURGH,C.CA . 150 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8856.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 112 74.7 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 . 53 35.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 15 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 . 0 1 2 0 0 1 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 5 A S 0 0 128 0, 0.0 2,-0.2 0, 0.0 77,-0.1 0.000 360.0 360.0 360.0 74.2 9.7 -0.6 8.1 2 6 A V - 0 0 86 45,-0.1 2,-0.3 76,-0.0 45,-0.2 -0.722 360.0-156.1-114.1 163.1 13.3 0.4 7.5 3 7 A V E -A 46 0A 25 43,-1.4 43,-2.8 -2,-0.2 2,-0.3 -0.993 11.0-135.5-140.7 141.4 15.5 1.3 4.5 4 8 A E E +A 45 0A 120 -2,-0.3 2,-0.3 41,-0.2 41,-0.2 -0.760 23.3 179.0-101.5 146.8 19.2 1.2 3.7 5 9 A Y E -A 44 0A 25 39,-1.8 39,-2.5 -2,-0.3 2,-0.5 -0.997 17.3-138.0-151.2 145.7 21.1 4.0 2.0 6 10 A E E +A 43 0A 105 -2,-0.3 2,-0.3 37,-0.2 37,-0.2 -0.909 17.7 175.1-115.5 118.2 24.7 4.6 1.0 7 11 A V E -A 42 0A 0 35,-0.6 35,-2.1 -2,-0.5 2,-0.4 -0.762 33.8-109.4-113.4 165.2 26.8 7.8 1.2 8 12 A V E +A 41 0A 47 -2,-0.3 11,-2.3 33,-0.2 2,-0.4 -0.753 34.0 170.7 -96.9 136.3 30.5 8.3 0.3 9 13 A S E +C 18 0B 0 31,-3.1 2,-0.3 -2,-0.4 9,-0.2 -0.900 22.4 135.6-145.7 104.8 33.0 8.9 3.0 10 14 A K E -C 17 0B 82 7,-3.2 7,-2.8 -2,-0.4 2,-0.6 -0.895 33.5-166.9-159.8 132.6 36.6 8.7 1.9 11 15 A N E +C 16 0B 20 109,-0.6 108,-3.4 106,-0.4 109,-0.3 -0.937 25.2 174.5-117.8 101.5 39.7 10.7 2.4 12 16 A L - 0 0 61 3,-2.9 -2,-0.1 -2,-0.6 106,-0.0 -0.631 47.3 -99.6-104.9 164.0 42.4 9.7 -0.2 13 17 A T S S+ 0 0 103 -2,-0.2 3,-0.1 1,-0.2 -1,-0.0 0.842 122.9 27.2 -48.2 -41.8 45.9 11.2 -0.9 14 18 A S S S+ 0 0 65 1,-0.2 46,-1.1 46,-0.1 47,-0.5 0.904 128.6 11.8 -91.9 -52.3 44.5 13.1 -3.9 15 19 A K E - D 0 59B 54 44,-0.2 -3,-2.9 45,-0.1 2,-0.4 -0.868 53.9-148.0-130.0 162.6 40.7 13.7 -3.1 16 20 A M E -CD 11 58B 4 42,-2.0 42,-2.4 -2,-0.3 2,-0.5 -0.989 6.1-173.1-131.0 130.0 38.1 13.6 -0.3 17 21 A S E +CD 10 57B 18 -7,-2.8 -7,-3.2 -2,-0.4 2,-0.4 -0.988 13.0 175.5-119.8 124.3 34.4 12.9 -0.6 18 22 A H E +CD 9 56B 0 38,-1.7 38,-1.8 -2,-0.5 2,-0.4 -0.953 3.9 166.0-134.2 103.1 32.5 13.3 2.7 19 23 A E E + D 0 55B 18 -11,-2.3 2,-0.3 -2,-0.4 36,-0.2 -0.956 6.7 177.9-116.1 145.7 28.8 13.0 2.9 20 24 A L E - D 0 54B 0 34,-2.0 34,-2.1 -2,-0.4 2,-0.4 -0.995 25.2-123.4-145.6 146.7 26.8 12.7 6.0 21 25 A L E - D 0 53B 0 -2,-0.3 9,-2.6 32,-0.2 2,-0.5 -0.728 18.2-162.8 -93.6 129.1 23.1 12.4 6.8 22 26 A F E -ED 29 52B 3 30,-3.4 30,-2.6 -2,-0.4 2,-0.4 -0.961 20.6-127.6-109.6 124.8 21.3 14.8 9.1 23 27 A S E >> -ED 28 51B 7 5,-1.6 4,-1.0 -2,-0.5 5,-0.5 -0.605 8.7-156.7 -71.0 121.3 17.9 13.9 10.5 24 28 A V T 45S+ 0 0 28 26,-1.1 111,-0.3 -2,-0.4 27,-0.2 0.890 94.8 44.2 -59.4 -42.6 15.2 16.5 10.0 25 29 A K T 45S+ 0 0 177 25,-0.6 -1,-0.2 1,-0.2 26,-0.1 0.928 117.2 40.2 -72.6 -48.6 13.2 15.1 13.0 26 30 A K T 45S- 0 0 133 2,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.485 97.3-137.0 -83.4 -4.5 16.0 14.7 15.5 27 31 A R T <5S+ 0 0 92 -4,-1.0 104,-1.5 103,-0.1 2,-0.3 0.723 74.8 74.5 56.0 25.2 17.6 18.0 14.5 28 32 A W E +B 41 0A 11 5,-3.3 5,-2.5 -2,-0.6 4,-0.3 -0.860 19.4 167.5-104.2 109.6 33.0 0.7 5.4 37 41 A R T > 5 + 0 0 120 -2,-0.7 3,-0.7 3,-0.2 -1,-0.2 0.868 69.1 69.0 -87.0 -42.0 36.7 1.6 5.1 38 42 A Q T 3 5S+ 0 0 178 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.767 122.4 16.8 -47.4 -34.5 37.8 -0.8 2.4 39 43 A L T 3 5S- 0 0 106 2,-0.2 -1,-0.3 -30,-0.1 -2,-0.2 0.278 108.3-109.7-127.3 6.9 35.7 1.2 -0.1 40 44 A G T < 5S+ 0 0 3 -3,-0.7 -31,-3.1 -4,-0.3 2,-0.3 0.918 70.3 129.2 64.7 50.3 35.1 4.6 1.6 41 45 A K E < -AB 8 36A 60 -5,-2.5 -5,-3.3 -33,-0.3 2,-0.2 -0.974 44.3-151.4-140.4 146.5 31.4 4.3 2.4 42 46 A L E -AB 7 35A 0 -35,-2.1 -35,-0.6 -2,-0.3 2,-0.4 -0.638 15.5-146.0-108.7 166.5 29.0 4.7 5.2 43 47 A H E -AB 6 34A 30 -9,-0.9 -10,-1.7 -2,-0.2 -9,-1.5 -0.981 11.5-166.9-142.7 124.2 25.7 2.8 5.6 44 48 A Y E -A 5 0A 0 -39,-2.5 -39,-1.8 -2,-0.4 2,-0.5 -0.844 16.1-153.2-110.7 150.7 22.6 4.1 7.1 45 49 A K E -A 4 0A 119 -14,-0.4 2,-0.4 -2,-0.3 -41,-0.2 -0.894 31.3-165.0-120.8 95.8 19.4 2.4 8.2 46 50 A L E -A 3 0A 2 -43,-2.8 -43,-1.4 -2,-0.5 3,-0.1 -0.681 17.5-138.9 -98.8 137.0 16.7 5.1 7.9 47 51 A L - 0 0 103 -2,-0.4 -45,-0.1 -45,-0.2 27,-0.1 -0.552 49.6 -80.8 -80.1 149.2 13.2 5.3 9.3 48 52 A P S S+ 0 0 57 0, 0.0 2,-0.3 0, 0.0 27,-0.1 -0.255 93.9 80.9 -45.2 123.5 10.5 6.8 6.9 49 53 A G E S- F 0 74B 29 25,-0.9 25,-1.8 -3,-0.1 2,-0.4 -0.953 82.7 -63.5 167.3-159.2 10.9 10.5 7.1 50 54 A N E + F 0 73B 53 -2,-0.3 -26,-1.1 23,-0.2 -25,-0.6 -0.860 45.7 167.7-115.0 148.1 13.0 13.3 5.7 51 55 A Y E -DF 23 72B 19 21,-1.9 21,-2.0 -2,-0.4 2,-0.4 -0.831 26.5-126.6-140.3 176.0 16.7 13.8 6.2 52 56 A I E -DF 22 71B 2 -30,-2.6 -30,-3.4 -2,-0.3 2,-0.7 -0.999 9.3-145.8-131.9 131.9 19.3 16.0 4.6 53 57 A K E -DF 21 70B 25 17,-1.8 17,-1.5 -2,-0.4 2,-0.2 -0.838 10.8-160.8 -98.1 108.4 22.6 14.9 3.0 54 58 A F E -DF 20 69B 2 -34,-2.1 -34,-2.0 -2,-0.7 2,-0.4 -0.600 14.0-163.3 -84.2 142.6 25.5 17.4 3.4 55 59 A G E -DF 19 68B 0 13,-2.4 13,-2.1 -2,-0.2 2,-0.4 -0.986 16.9-177.0-130.1 138.9 28.3 16.9 0.9 56 60 A L E -DF 18 67B 0 -38,-1.8 -38,-1.7 -2,-0.4 2,-0.5 -0.909 6.2-177.9-138.4 104.9 31.9 18.1 0.8 57 61 A Y E -DF 17 66B 25 9,-2.2 9,-2.7 -2,-0.4 2,-0.5 -0.878 10.1-171.1-105.9 132.3 33.9 17.1 -2.3 58 62 A V E -DF 16 65B 0 -42,-2.4 -42,-2.0 -2,-0.5 2,-0.9 -0.969 25.7-165.7-135.8 126.6 37.5 18.3 -2.2 59 63 A L E > > -DF 15 64B 72 5,-2.6 5,-3.3 -2,-0.5 3,-0.7 -0.885 20.0-166.0-102.9 100.4 40.2 18.3 -4.8 60 64 A K G > 5S+ 0 0 69 -46,-1.1 3,-2.7 -2,-0.9 -1,-0.2 0.950 79.8 45.8 -51.4 -63.0 43.2 19.0 -2.5 61 65 A N G 3 5S+ 0 0 144 -47,-0.5 -1,-0.2 1,-0.3 -46,-0.1 0.619 113.6 49.7 -66.2 -15.1 45.9 19.9 -5.0 62 66 A Q G < 5S- 0 0 152 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.072 110.2-122.8 -98.8 11.0 43.6 22.3 -6.9 63 67 A D T < 5 + 0 0 50 -3,-2.7 29,-0.7 1,-0.2 2,-0.5 0.868 61.8 156.8 48.6 37.6 42.5 23.9 -3.6 64 68 A Y E < +FG 59 91B 55 -5,-3.3 -5,-2.6 27,-0.2 2,-0.4 -0.858 22.7 168.0-107.8 131.4 39.0 22.9 -4.6 65 69 A A E -FG 58 90B 1 25,-3.3 25,-2.8 -2,-0.5 2,-0.4 -0.991 9.3-173.1-132.9 128.0 36.0 22.4 -2.4 66 70 A R E -FG 57 89B 61 -9,-2.7 -9,-2.2 -2,-0.4 2,-0.4 -0.937 8.5-161.6-112.8 142.0 32.4 22.0 -3.4 67 71 A F E -FG 56 88B 7 21,-2.7 21,-2.1 -2,-0.4 2,-0.3 -0.992 11.0-176.9-126.9 129.8 29.6 21.9 -0.8 68 72 A E E -FG 55 87B 35 -13,-2.1 -13,-2.4 -2,-0.4 2,-0.4 -0.907 17.9-157.9-124.6 152.0 26.2 20.5 -1.6 69 73 A I E -FG 54 86B 1 17,-2.3 16,-3.8 -2,-0.3 17,-1.1 -0.981 18.8-178.5-129.8 120.7 22.9 20.1 0.3 70 74 A A E -FG 53 84B 4 -17,-1.5 -17,-1.8 -2,-0.4 2,-0.6 -0.830 23.4-128.9-118.2 152.4 20.5 17.5 -1.0 71 75 A W E -FG 52 83B 48 12,-3.0 12,-1.0 -2,-0.3 2,-0.6 -0.907 18.3-155.7-108.6 125.1 17.1 16.6 0.3 72 76 A V E -FG 51 82B 0 -21,-2.0 -21,-1.9 -2,-0.6 2,-0.6 -0.886 8.6-169.3-107.7 122.7 16.5 13.0 1.0 73 77 A H E -FG 50 81B 57 8,-2.1 8,-1.3 -2,-0.6 2,-0.6 -0.914 5.3-177.7-116.5 113.3 12.9 11.8 0.9 74 78 A V E -FG 49 80B 5 -25,-1.8 -25,-0.9 -2,-0.6 6,-0.2 -0.931 8.2-175.7-117.3 115.5 11.9 8.3 2.1 75 79 A D > - 0 0 67 4,-1.6 3,-1.3 -2,-0.6 4,-0.1 -0.311 42.1 -82.6-101.0-173.9 8.3 7.2 1.8 76 80 A K T 3 S+ 0 0 196 1,-0.3 -2,-0.0 2,-0.2 -1,-0.0 0.828 118.8 60.9 -64.8 -37.8 6.4 4.1 3.0 77 81 A D T 3 S- 0 0 126 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.428 120.2-104.3 -71.4 2.4 7.2 1.6 0.2 78 82 A G S < S+ 0 0 28 -3,-1.3 2,-0.2 1,-0.3 -2,-0.2 0.672 72.5 155.4 80.4 21.2 10.8 2.1 1.2 79 83 A K - 0 0 135 -4,-0.1 -4,-1.6 -76,-0.0 2,-0.4 -0.522 29.3-151.5 -90.5 147.4 11.3 4.3 -1.9 80 84 A I E +G 74 0B 52 -2,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.955 15.5 175.4-128.0 134.2 14.0 6.9 -2.2 81 85 A E E -G 73 0B 105 -8,-1.3 -8,-2.1 -2,-0.4 2,-0.3 -0.999 9.8-165.1-139.5 136.3 14.2 10.2 -4.1 82 86 A E E +G 72 0B 84 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.943 12.0 171.2-127.3 146.2 16.9 12.9 -4.1 83 87 A R E -G 71 0B 129 -12,-1.0 -12,-3.0 -2,-0.3 2,-0.2 -0.956 32.6-123.7-149.9 133.5 17.3 16.5 -5.3 84 88 A T E -G 70 0B 79 -2,-0.3 -14,-0.3 -14,-0.3 3,-0.1 -0.563 23.5-178.5 -71.3 137.2 20.1 19.0 -4.6 85 89 A V E + 0 0 67 -16,-3.8 2,-0.3 1,-0.4 -15,-0.2 0.369 69.9 13.7-116.3 -3.8 18.7 22.1 -3.0 86 90 A Y E +G 69 0B 21 -17,-1.1 -17,-2.3 2,-0.0 -1,-0.4 -0.936 58.3 174.0-169.4 146.2 22.1 24.0 -2.8 87 91 A S E +G 68 0B 62 -2,-0.3 2,-0.3 -19,-0.3 -19,-0.2 -0.906 6.8 178.2-160.2 137.6 25.5 23.6 -4.3 88 92 A I E -G 67 0B 28 -21,-2.1 -21,-2.7 -2,-0.3 2,-0.4 -0.995 15.8-148.0-148.6 137.4 28.6 26.0 -4.0 89 93 A E E +G 66 0B 130 -2,-0.3 2,-0.3 -23,-0.2 -23,-0.2 -0.861 33.0 138.7-107.1 141.2 32.2 25.9 -5.2 90 94 A T E -G 65 0B 28 -25,-2.8 -25,-3.3 -2,-0.4 -2,-0.0 -0.981 53.7 -68.1-168.4 168.3 35.1 27.4 -3.4 91 95 A Y E > -G 64 0B 142 -2,-0.3 4,-1.5 -27,-0.2 -27,-0.2 -0.327 38.1-134.9 -63.3 147.3 38.7 27.1 -2.3 92 96 A W H > S+ 0 0 34 -29,-0.7 4,-2.8 2,-0.2 5,-0.3 0.853 100.7 61.6 -74.7 -40.4 39.4 24.3 0.3 93 97 A H H > S+ 0 0 100 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.779 106.7 49.5 -58.4 -28.2 41.6 26.4 2.6 94 98 A I H >> S+ 0 0 39 2,-0.2 4,-1.1 -3,-0.2 3,-0.8 0.963 110.0 50.0 -69.2 -57.1 38.6 28.7 3.1 95 99 A F H >X S+ 0 0 5 -4,-1.5 3,-1.2 1,-0.3 4,-0.5 0.893 109.8 49.5 -46.6 -50.9 36.3 25.8 3.8 96 100 A I H >< S+ 0 0 61 -4,-2.8 3,-0.8 1,-0.3 4,-0.4 0.819 106.6 56.8 -62.3 -33.0 38.7 24.3 6.4 97 101 A D H X< S+ 0 0 74 -4,-1.0 3,-0.8 -3,-0.8 4,-0.4 0.710 88.0 77.5 -71.8 -19.8 39.0 27.7 8.1 98 102 A I H X< S+ 0 0 1 -3,-1.2 3,-1.2 -4,-1.1 -1,-0.2 0.817 82.3 67.9 -59.6 -31.6 35.2 27.8 8.6 99 103 A E T << S+ 0 0 60 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.895 102.1 45.1 -46.7 -50.7 35.7 25.4 11.5 100 104 A N T < S+ 0 0 123 -3,-0.8 2,-0.7 -4,-0.4 -1,-0.2 0.438 80.7 119.8 -74.6 -6.9 37.4 28.1 13.4 101 105 A D < - 0 0 44 -3,-1.2 3,-0.2 -4,-0.4 8,-0.1 -0.560 54.1-155.6 -68.0 109.9 34.8 30.8 12.6 102 106 A L S S+ 0 0 162 -2,-0.7 2,-0.8 1,-0.2 -1,-0.2 0.923 82.7 37.4 -54.4 -54.5 33.6 31.7 16.0 103 107 A N S S+ 0 0 149 -3,-0.1 -1,-0.2 2,-0.0 -3,-0.0 -0.836 90.2 106.4-108.7 96.7 30.1 33.0 14.9 104 108 A C S S- 0 0 23 -2,-0.8 5,-0.2 -3,-0.2 38,-0.1 -0.953 81.6 -58.6-166.8 151.9 28.9 30.8 12.1 105 109 A P > - 0 0 24 0, 0.0 4,-2.6 0, 0.0 5,-0.1 -0.034 45.4-145.0 -48.3 132.9 26.3 28.0 11.8 106 110 A Y H > S+ 0 0 113 2,-0.2 4,-3.9 1,-0.2 5,-0.3 0.980 95.3 51.6 -60.8 -65.1 27.1 25.3 14.2 107 111 A V H > S+ 0 0 5 1,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.858 113.6 49.1 -45.5 -36.1 25.9 22.2 12.2 108 112 A L H > S+ 0 0 3 2,-0.2 4,-1.9 1,-0.2 5,-0.3 0.968 112.1 46.5 -67.8 -50.3 28.1 23.6 9.4 109 113 A A H X S+ 0 0 12 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.954 115.8 47.0 -52.6 -48.5 31.0 24.0 11.9 110 114 A K H X S+ 0 0 28 -4,-3.9 4,-2.1 2,-0.2 -2,-0.2 0.925 109.4 54.3 -58.3 -46.3 30.3 20.5 13.1 111 115 A F H < S+ 0 0 1 -4,-3.1 3,-0.5 -5,-0.3 4,-0.3 0.931 108.8 45.0 -53.7 -60.3 30.1 19.0 9.6 112 116 A I H >< S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.3 -1,-0.2 0.850 112.6 54.3 -50.2 -41.0 33.4 20.2 8.4 113 117 A E H 3< S+ 0 0 96 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.832 102.0 57.3 -72.1 -32.2 35.0 19.1 11.7 114 118 A M T 3< S+ 0 0 18 -4,-2.1 9,-0.3 -3,-0.5 -1,-0.3 0.382 76.1 136.8 -79.7 6.1 33.6 15.6 11.3 115 119 A R < - 0 0 79 -3,-1.3 2,-0.1 -4,-0.3 8,-0.1 -0.111 64.4 -91.2 -42.6 146.7 35.4 15.0 7.9 116 120 A P - 0 0 3 0, 0.0 6,-0.2 0, 0.0 3,-0.1 -0.415 35.2-119.3 -73.0 141.1 37.0 11.5 7.6 117 121 A E > - 0 0 144 4,-0.5 3,-1.4 1,-0.2 -106,-0.4 -0.136 58.4 -56.1 -63.0 164.2 40.6 10.8 8.7 118 122 A F T 3 S- 0 0 105 1,-0.2 -106,-0.2 -108,-0.1 -1,-0.2 -0.233 122.2 -3.6 -49.0 131.8 43.1 9.5 6.0 119 123 A H T 3 S+ 0 0 116 -108,-3.4 2,-0.3 1,-0.2 -1,-0.2 0.816 120.8 97.6 53.0 36.4 42.0 6.3 4.2 120 124 A K S < S- 0 0 72 -3,-1.4 -109,-0.6 -109,-0.3 2,-0.2 -0.914 73.1-110.6-145.7 170.1 39.0 6.2 6.4 121 125 A T - 0 0 9 -2,-0.3 -4,-0.5 -111,-0.1 2,-0.1 -0.586 33.4-121.9 -95.6 169.9 35.3 6.8 6.9 122 126 A A - 0 0 7 -2,-0.2 2,-0.3 -6,-0.2 -1,-0.1 -0.271 28.6-146.8 -93.4-174.1 34.0 9.5 9.3 123 127 A W - 0 0 93 -9,-0.3 2,-0.5 -2,-0.1 -92,-0.1 -0.929 6.4-129.2-160.4 140.2 31.7 8.4 12.1 124 128 A V - 0 0 0 -2,-0.3 2,-0.0 -94,-0.1 3,-0.0 -0.771 24.7-126.9 -95.7 128.4 28.7 9.9 13.9 125 129 A E - 0 0 114 -2,-0.5 2,-1.7 1,-0.1 -1,-0.0 -0.286 29.3-104.8 -62.5 149.6 28.5 9.9 17.8 126 130 A E + 0 0 169 -95,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.659 61.7 175.5 -75.2 91.9 25.5 8.5 19.7 127 131 A S - 0 0 58 -2,-1.7 -96,-0.1 -98,-0.2 -99,-0.1 -0.814 38.5-173.9-104.6 155.9 24.2 12.0 20.4 128 132 A N + 0 0 158 -2,-0.3 -1,-0.1 2,-0.0 -2,-0.0 0.406 56.0 112.0-119.7 -7.6 21.1 13.2 22.1 129 133 A Y - 0 0 110 1,-0.0 2,-0.3 0, 0.0 -2,-0.1 -0.250 44.6-171.4 -64.9 149.7 21.7 16.9 21.4 130 134 A S - 0 0 38 -102,-0.1 2,-0.3 -2,-0.0 -102,-0.2 -0.976 20.8-118.4-137.4 157.9 19.5 19.0 19.0 131 135 A I - 0 0 8 -104,-1.5 7,-0.1 -2,-0.3 -103,-0.0 -0.757 20.8-123.1 -97.7 146.8 19.8 22.4 17.5 132 136 A A S S+ 0 0 95 -2,-0.3 -1,-0.1 2,-0.0 -105,-0.0 0.854 87.8 78.2 -46.3 -48.7 17.3 25.2 18.1 133 137 A E S S- 0 0 78 1,-0.1 2,-0.2 -106,-0.1 -2,-0.2 -0.118 74.6-129.7 -68.7 160.4 16.6 25.7 14.4 134 138 A D > - 0 0 72 1,-0.0 4,-2.5 0, 0.0 5,-0.2 -0.522 40.7 -86.0-101.1 174.0 14.4 23.6 12.1 135 139 A D H > S+ 0 0 35 -111,-0.3 4,-2.5 1,-0.2 5,-0.2 0.887 125.8 47.0 -49.9 -48.6 15.4 22.2 8.7 136 140 A I H > S+ 0 0 103 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.978 115.1 42.1 -58.9 -62.6 14.4 25.4 6.8 137 141 A Q H > S+ 0 0 110 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.849 114.0 56.3 -53.8 -35.0 16.1 28.0 9.0 138 142 A M H X S+ 0 0 4 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.969 109.3 42.0 -66.3 -54.1 19.1 25.7 9.3 139 143 A V H X S+ 0 0 19 -4,-2.5 4,-2.8 -5,-0.2 -1,-0.2 0.908 115.6 51.5 -57.9 -43.9 19.7 25.5 5.6 140 144 A E H X S+ 0 0 102 -4,-2.6 4,-4.1 1,-0.2 5,-0.4 0.979 108.3 49.2 -59.5 -59.7 19.0 29.2 5.1 141 145 A S H X S+ 0 0 42 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.850 113.1 49.1 -44.3 -45.3 21.5 30.3 7.8 142 146 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.3 0.933 115.9 42.5 -58.1 -51.6 24.1 28.1 6.2 143 147 A K H X S+ 0 0 83 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.975 115.3 49.3 -57.4 -56.9 23.3 29.5 2.8 144 148 A R H X S+ 0 0 168 -4,-4.1 4,-1.3 1,-0.2 -1,-0.2 0.748 113.2 50.8 -54.7 -29.8 23.2 33.1 4.2 145 149 A Y H X S+ 0 0 17 -4,-1.6 4,-2.3 -5,-0.4 -1,-0.2 0.913 109.8 43.2 -78.7 -48.4 26.5 32.4 5.9 146 150 A L H X S+ 0 0 7 -4,-2.4 4,-0.7 2,-0.2 -2,-0.2 0.857 107.3 64.0 -69.0 -35.5 28.6 31.1 3.1 147 151 A E H >< S+ 0 0 88 -4,-2.5 3,-1.4 -5,-0.3 -1,-0.2 0.965 110.0 37.1 -49.5 -61.7 27.2 33.8 0.8 148 152 A R H 3< S+ 0 0 161 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.894 113.3 57.1 -56.0 -45.7 28.9 36.5 3.1 149 153 A K H 3< 0 0 68 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.607 360.0 360.0 -57.4 -11.8 32.0 34.3 3.7 150 154 A I << 0 0 102 -3,-1.4 -3,-0.2 -4,-0.7 -2,-0.1 0.370 360.0 360.0-133.5 360.0 32.3 34.3 -0.2