==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 21-MAR-08 2ZKI . COMPND 2 MOLECULE: 199AA LONG HYPOTHETICAL TRP REPRESSOR BINDING . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TOKODAII; . AUTHOR T.KAWANO,N.TESHIMA,A.SUZUKI,S.KURAMITSU,T.YAMANE . 1555 10 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58137.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 995 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 208 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 2.2 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 . 16 1.0 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 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 184 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 453 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 1.4 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 11 8 22 0 5 3 0 0 0 0 0 6 2 0 0 0 0 0 8 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 18 6 0 3 8 13 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 . 17 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 0 0 0 0 0 3 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 a 0 0 123 0, 0.0 193,-0.1 0, 0.0 189,-0.0 0.000 360.0 360.0 360.0 126.4 43.9 65.1 35.8 2 4 A K - 0 0 103 187,-0.0 2,-0.2 191,-0.0 29,-0.1 -0.994 360.0-129.4-142.0 127.3 42.3 62.5 33.5 3 5 A P - 0 0 5 0, 0.0 29,-1.2 0, 0.0 2,-0.5 -0.525 14.0-132.2 -83.7 143.5 39.3 60.1 34.2 4 6 A N E -a 32 0A 28 -2,-0.2 66,-3.0 64,-0.2 67,-1.5 -0.826 20.7-161.7 -92.8 124.5 39.4 56.3 33.6 5 7 A I E -ab 33 71A 0 27,-2.9 29,-1.9 -2,-0.5 2,-0.6 -0.932 2.9-161.6-112.7 119.7 36.3 55.0 31.8 6 8 A L E -ab 34 72A 0 65,-2.6 67,-3.0 -2,-0.5 2,-0.8 -0.890 3.5-159.4 -99.6 120.5 35.4 51.4 31.9 7 9 A V E -ab 35 73A 0 27,-2.5 29,-2.8 -2,-0.6 2,-0.4 -0.882 18.8-176.7 -98.5 105.5 33.0 50.1 29.3 8 10 A L E +ab 36 74A 0 65,-1.8 67,-2.7 -2,-0.8 2,-0.3 -0.872 9.6 156.9-108.0 135.3 31.6 46.9 30.7 9 11 A F E -ab 37 75A 0 27,-1.4 29,-1.3 -2,-0.4 2,-0.4 -0.999 35.7-140.0-155.4 151.6 29.1 44.7 28.7 10 12 A Y + 0 0 6 65,-1.3 2,-0.2 -2,-0.3 29,-0.1 -0.867 59.3 64.2-100.5 147.9 27.6 41.3 28.1 11 13 A G - 0 0 6 -2,-0.4 -2,-0.1 27,-0.2 27,-0.1 -0.528 56.8-130.6 130.7 172.9 27.0 40.1 24.6 12 14 A Y S S+ 0 0 24 -2,-0.2 -1,-0.1 42,-0.0 42,-0.1 0.394 83.2 51.5-137.2 -8.8 28.2 39.1 21.1 13 15 A G S >> S- 0 0 31 42,-0.0 3,-1.1 3,-0.0 4,-0.7 0.381 115.6 -24.2-107.2-127.0 26.1 41.1 18.7 14 16 A S H 3> S+ 0 0 6 153,-0.3 4,-1.6 1,-0.2 5,-0.1 0.631 122.4 72.1 -70.2 -16.2 25.2 44.8 18.2 15 17 A I H 3> S+ 0 0 2 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.814 92.7 57.5 -66.7 -31.2 25.8 45.5 21.9 16 18 A V H <> S+ 0 0 10 -3,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.926 105.8 47.5 -64.4 -47.6 29.6 45.1 21.2 17 19 A E H X S+ 0 0 52 -4,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.850 109.7 54.5 -64.3 -34.7 29.5 47.9 18.5 18 20 A L H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.872 107.1 51.5 -61.6 -38.8 27.5 50.0 21.0 19 21 A A H X S+ 0 0 0 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.848 108.4 50.3 -68.0 -37.7 30.3 49.5 23.5 20 22 A K H X S+ 0 0 101 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.859 110.0 50.2 -68.0 -38.4 33.0 50.5 21.0 21 23 A E H X S+ 0 0 30 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.880 109.4 49.7 -69.1 -41.4 31.2 53.8 20.1 22 24 A I H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.878 112.3 50.5 -62.6 -38.0 30.7 54.8 23.8 23 25 A G H X S+ 0 0 2 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.910 110.5 48.5 -62.7 -44.7 34.5 54.1 24.2 24 26 A K H X S+ 0 0 104 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.913 110.5 50.3 -63.0 -46.3 35.2 56.3 21.1 25 27 A G H X S+ 0 0 4 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.818 110.9 49.8 -62.2 -34.1 33.1 59.1 22.4 26 28 A A H X S+ 0 0 0 -4,-1.6 4,-0.6 2,-0.2 5,-0.4 0.840 110.0 50.5 -72.8 -36.2 34.8 59.0 25.8 27 29 A E H < S+ 0 0 121 -4,-1.9 3,-0.5 2,-0.2 -2,-0.2 0.863 108.6 51.7 -67.3 -39.0 38.2 59.0 24.1 28 30 A E H < S+ 0 0 133 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.713 107.5 54.1 -69.6 -22.0 37.2 62.1 22.1 29 31 A A H < S- 0 0 43 -4,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.634 129.5 -98.9 -82.2 -18.6 36.2 63.6 25.4 30 32 A G S < S+ 0 0 34 -4,-0.6 2,-0.3 -3,-0.5 -3,-0.2 0.893 75.1 124.9 101.0 62.7 39.7 62.9 26.7 31 33 A A - 0 0 4 -5,-0.4 2,-0.5 -4,-0.1 -1,-0.3 -0.990 62.1-107.8-147.3 151.0 39.7 59.7 28.8 32 34 A E E -a 4 0A 102 -29,-1.2 -27,-2.9 -2,-0.3 2,-0.5 -0.712 41.2-156.9 -79.2 126.4 41.5 56.4 29.1 33 35 A V E -a 5 0A 27 -2,-0.5 2,-0.6 -29,-0.2 -27,-0.2 -0.931 17.7-174.5-118.1 119.7 39.1 53.7 27.9 34 36 A K E -a 6 0A 72 -29,-1.9 -27,-2.5 -2,-0.5 2,-0.6 -0.957 12.3-157.9-106.4 118.4 39.2 50.0 28.8 35 37 A I E +a 7 0A 38 -2,-0.6 2,-0.3 -29,-0.2 -27,-0.2 -0.875 22.2 171.4 -96.3 118.6 36.5 47.9 27.0 36 38 A R E -a 8 0A 41 -29,-2.8 -27,-1.4 -2,-0.6 2,-0.2 -0.953 19.5-154.6-130.3 147.2 35.8 44.7 28.9 37 39 A R E -ac 9 60A 35 22,-1.7 24,-2.8 -2,-0.3 2,-0.2 -0.747 21.3-114.9-113.3 165.8 33.3 41.9 28.6 38 40 A V - 0 0 4 -29,-1.3 -27,-0.2 -2,-0.2 49,-0.1 -0.629 32.8 -93.0-100.5 160.0 31.9 39.4 31.2 39 41 A R - 0 0 138 -2,-0.2 2,-0.3 47,-0.2 51,-0.2 -0.347 43.7-108.9 -65.1 145.4 32.2 35.6 31.6 40 42 A E + 0 0 33 1,-0.1 -1,-0.1 -2,-0.1 -30,-0.0 -0.599 33.1 177.6 -79.0 138.7 29.4 33.5 30.1 41 43 A T + 0 0 24 -2,-0.3 -1,-0.1 2,-0.1 441,-0.0 0.528 42.0 113.6-117.0 -14.9 27.1 31.7 32.6 42 44 A L S S- 0 0 17 1,-0.1 441,-0.1 4,-0.1 -2,-0.0 -0.326 75.0-104.5 -59.8 139.1 24.7 30.0 30.3 43 45 A P > - 0 0 23 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.305 35.0-101.5 -63.1 152.3 24.9 26.1 30.3 44 46 A P G > S+ 0 0 92 0, 0.0 3,-1.7 0, 0.0 -2,-0.1 0.753 116.9 66.3 -44.7 -37.9 26.6 24.4 27.3 45 47 A E G > S+ 0 0 122 1,-0.3 3,-0.5 2,-0.1 -3,-0.0 0.872 102.3 45.9 -53.5 -43.6 23.2 23.4 25.7 46 48 A F G < S+ 0 0 67 -3,-1.5 -1,-0.3 1,-0.2 3,-0.1 0.066 95.4 77.7 -94.9 24.1 22.3 27.1 25.0 47 49 A Q G X + 0 0 61 -3,-1.7 3,-0.5 1,-0.1 -1,-0.2 -0.035 60.0 107.3-116.3 26.8 25.8 27.9 23.6 48 50 A S T < S+ 0 0 114 -3,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.884 84.9 33.2 -71.4 -41.7 25.1 26.3 20.2 49 51 A R T 3 S+ 0 0 248 -3,-0.1 -1,-0.2 2,-0.0 -3,-0.0 -0.532 84.9 125.0-119.9 62.3 24.8 29.5 18.2 50 52 A I < - 0 0 37 -3,-0.5 2,-1.4 -2,-0.3 3,-0.2 -0.979 50.6-145.3-124.8 121.5 27.2 32.0 19.8 51 53 A P > + 0 0 55 0, 0.0 3,-1.1 0, 0.0 4,-0.2 -0.662 25.9 167.8 -86.4 87.5 29.9 33.8 17.9 52 54 A F G > S+ 0 0 68 -2,-1.4 3,-1.9 1,-0.2 4,-0.5 0.788 70.2 72.6 -65.5 -29.5 32.7 34.1 20.4 53 55 A D G 3 S+ 0 0 99 1,-0.3 -1,-0.2 2,-0.2 4,-0.2 0.660 87.2 63.0 -61.4 -20.3 35.1 35.1 17.6 54 56 A K G < S+ 0 0 102 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.695 114.0 32.9 -74.2 -20.9 33.3 38.5 17.5 55 57 A V S X S+ 0 0 0 -3,-1.9 3,-0.9 -4,-0.2 -2,-0.2 0.288 86.5 101.8-120.0 5.5 34.5 39.2 21.1 56 58 A K T 3 S+ 0 0 153 -4,-0.5 -3,-0.1 1,-0.3 -2,-0.1 0.696 80.3 56.4 -70.4 -18.8 37.9 37.4 21.2 57 59 A D T 3 S+ 0 0 155 -4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.727 94.7 78.5 -78.9 -24.7 39.8 40.7 20.8 58 60 A I S < S- 0 0 13 -3,-0.9 -22,-0.1 -22,-0.0 -21,-0.1 -0.793 81.9-135.0 -91.7 117.4 38.0 42.1 23.9 59 61 A P - 0 0 66 0, 0.0 -22,-1.7 0, 0.0 2,-0.2 -0.203 25.4 -97.5 -66.9 157.7 39.6 40.8 27.2 60 62 A E B -c 37 0A 92 -24,-0.2 -22,-0.2 1,-0.1 2,-0.1 -0.488 42.5-105.8 -74.6 146.9 37.5 39.6 30.1 61 63 A V - 0 0 17 -24,-2.8 2,-0.3 -2,-0.2 -22,-0.1 -0.448 34.0-164.0 -73.4 143.0 36.8 42.0 33.0 62 64 A T >> - 0 0 69 -2,-0.1 4,-0.6 -24,-0.0 3,-0.6 -0.792 35.2-109.5-118.1 167.2 38.6 41.6 36.3 63 65 A L H 3> S+ 0 0 34 -2,-0.3 4,-0.9 1,-0.2 3,-0.1 0.675 118.3 64.1 -69.6 -17.6 37.9 43.1 39.7 64 66 A D H 3> S+ 0 0 105 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.824 93.3 61.9 -69.7 -33.9 41.0 45.3 39.3 65 67 A D H <> S+ 0 0 16 -3,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.804 101.7 51.3 -61.3 -32.7 39.2 47.0 36.3 66 68 A M H < S+ 0 0 0 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.832 111.6 46.5 -73.8 -35.2 36.5 48.2 38.7 67 69 A R H < S+ 0 0 107 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.857 111.1 53.8 -71.7 -37.8 39.1 49.7 41.0 68 70 A W H < S+ 0 0 73 -4,-2.4 -64,-0.2 -5,-0.1 -2,-0.2 0.893 94.2 86.4 -61.9 -45.0 40.9 51.3 38.1 69 71 A A < - 0 0 0 -4,-1.6 -64,-0.2 -5,-0.1 3,-0.1 -0.198 49.5-171.4 -68.5 146.9 37.9 53.1 36.7 70 72 A D S S+ 0 0 22 -66,-3.0 2,-0.3 1,-0.3 -65,-0.2 0.408 82.4 23.0-106.2 -8.5 36.6 56.6 37.7 71 73 A G E S-b 5 0A 0 -67,-1.5 -65,-2.6 35,-0.2 2,-0.4 -0.983 72.6-140.7-158.7 152.6 33.5 56.1 35.7 72 74 A F E -bd 6 108A 0 35,-2.0 37,-2.5 -2,-0.3 2,-0.5 -0.942 15.1-171.2-128.9 136.3 31.4 53.2 34.2 73 75 A A E -bd 7 109A 0 -67,-3.0 -65,-1.8 -2,-0.4 2,-0.5 -0.855 25.4-176.6-118.8 91.1 29.5 52.4 31.0 74 76 A I E +bd 8 110A 2 35,-2.0 37,-1.3 -2,-0.5 2,-0.3 -0.800 8.9 167.0 -98.3 124.4 27.6 49.2 31.9 75 77 A G E +bd 9 111A 0 -67,-2.7 -65,-1.3 -2,-0.5 37,-0.2 -0.902 16.0 165.0-138.4 162.6 25.6 47.5 29.2 76 78 A S E - d 0 112A 0 35,-1.5 37,-0.5 -2,-0.3 -65,-0.1 -0.895 42.1-100.4-170.3 141.5 23.7 44.3 28.2 77 79 A P E - d 0 113A 5 0, 0.0 7,-0.2 0, 0.0 37,-0.2 -0.455 59.7 -88.2 -65.4 143.8 21.2 43.2 25.6 78 80 A T - 0 0 22 35,-2.9 2,-0.2 -2,-0.1 5,-0.2 -0.242 38.1-170.8 -57.8 134.8 17.7 43.1 27.1 79 81 A R B > S-L 82 0B 73 3,-3.0 3,-0.6 -3,-0.1 -1,-0.1 -0.665 76.7 -46.5-126.2 76.2 16.7 39.8 28.7 80 82 A Y T 3 S- 0 0 26 39,-0.3 447,-0.2 -2,-0.2 446,-0.2 0.904 118.5 -41.3 63.7 47.3 13.0 40.3 29.4 81 83 A G T 3 S+ 0 0 0 1,-0.3 46,-0.3 38,-0.3 2,-0.2 0.293 129.5 78.0 89.3 -8.6 13.3 43.7 30.9 82 84 A N B < S-L 79 0B 1 -3,-0.6 -3,-3.0 1,-0.1 -1,-0.3 -0.716 87.5 -87.2-121.1 173.2 16.5 42.9 32.9 83 85 A M - 0 0 1 -2,-0.2 -1,-0.1 -5,-0.2 -5,-0.1 -0.272 57.0 -83.5 -71.5 166.0 20.2 42.5 32.2 84 86 A A > - 0 0 0 -7,-0.2 4,-2.2 1,-0.1 3,-0.3 -0.306 34.8-113.5 -70.2 156.8 21.6 39.1 31.0 85 87 A G H > S+ 0 0 0 396,-0.3 4,-2.1 1,-0.2 397,-0.3 0.796 114.1 59.5 -60.7 -32.3 22.5 36.4 33.5 86 88 A G H > S+ 0 0 2 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.887 109.8 40.0 -63.8 -43.9 26.2 36.7 32.6 87 89 A L H > S+ 0 0 0 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.870 114.0 54.6 -73.2 -38.5 26.4 40.4 33.7 88 90 A K H X S+ 0 0 2 -4,-2.2 4,-1.2 2,-0.2 390,-0.4 0.871 107.8 50.0 -63.2 -38.4 24.2 39.8 36.7 89 91 A T H X S+ 0 0 2 -4,-2.1 4,-1.1 389,-0.3 3,-0.2 0.920 110.7 48.4 -67.4 -44.5 26.5 37.0 37.9 90 92 A F H < S+ 0 0 24 -4,-1.5 4,-0.5 1,-0.2 3,-0.4 0.883 109.9 52.5 -61.6 -39.9 29.6 39.2 37.6 91 93 A L H >< S+ 0 0 2 -4,-2.2 3,-0.5 1,-0.2 -1,-0.2 0.778 104.6 57.0 -67.8 -26.1 27.9 42.0 39.4 92 94 A D H >< S+ 0 0 15 -4,-1.2 3,-0.6 1,-0.2 -1,-0.2 0.790 100.4 58.2 -71.8 -28.9 27.1 39.6 42.2 93 95 A T T >< S+ 0 0 9 -4,-1.1 3,-0.7 -3,-0.4 -1,-0.2 0.614 85.8 80.0 -75.4 -13.0 30.8 38.8 42.6 94 96 A T T <> + 0 0 0 -3,-0.5 4,-1.3 -4,-0.5 3,-0.3 0.126 56.1 115.9 -81.6 23.0 31.5 42.6 43.3 95 97 A A H <> S+ 0 0 36 -3,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.788 72.0 53.6 -63.3 -30.8 30.4 42.0 46.9 96 98 A I H <> S+ 0 0 71 -3,-0.7 4,-1.3 2,-0.2 -1,-0.2 0.845 105.8 52.6 -72.4 -34.6 33.9 42.9 48.2 97 99 A L H 4>S+ 0 0 1 -3,-0.3 5,-1.8 1,-0.2 6,-0.5 0.800 108.7 52.7 -68.5 -29.2 33.9 46.2 46.3 98 100 A W H ><5S+ 0 0 55 -4,-1.3 3,-0.7 2,-0.2 -2,-0.2 0.892 109.6 46.3 -71.3 -42.4 30.5 46.9 48.0 99 101 A K H 3<5S+ 0 0 149 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.730 114.9 47.8 -74.3 -22.6 31.8 46.3 51.5 100 102 A D T 3<5S- 0 0 115 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.410 104.1-128.9 -96.9 -0.8 35.0 48.4 50.9 101 103 A N T < 5 + 0 0 64 -3,-0.7 3,-0.3 -4,-0.3 -3,-0.2 0.799 57.0 147.4 55.1 35.9 33.0 51.3 49.3 102 104 A V S S+ 0 0 0 -6,-0.5 3,-2.1 2,-0.1 -1,-0.2 0.443 84.8 133.2 -92.3 -2.1 32.7 52.5 43.8 104 106 A Y T 3 S+ 0 0 46 -3,-0.3 33,-0.2 1,-0.3 32,-0.2 -0.290 78.4 7.2 -58.1 123.5 30.9 54.9 46.2 105 107 A G T 3 S+ 0 0 7 31,-1.1 -1,-0.3 1,-0.3 32,-0.1 0.278 96.0 132.5 90.7 -9.3 30.3 58.2 44.5 106 108 A K < - 0 0 42 -3,-2.1 32,-1.6 1,-0.1 -1,-0.3 -0.494 58.6-114.0 -77.2 142.0 31.4 57.1 41.1 107 109 A P E - e 0 138A 0 0, 0.0 -35,-2.0 0, 0.0 2,-0.4 -0.509 31.7-171.3 -76.2 144.7 29.3 57.9 38.0 108 110 A V E -de 72 139A 0 30,-2.7 32,-3.3 -37,-0.2 2,-0.3 -0.999 6.7-169.8-137.8 137.1 27.6 55.1 36.0 109 111 A T E -d 73 0A 0 -37,-2.5 -35,-2.0 -2,-0.4 2,-0.4 -0.948 13.0-143.5-125.4 149.9 25.7 55.1 32.7 110 112 A F E +d 74 0A 5 49,-0.4 51,-0.4 30,-0.4 2,-0.3 -0.884 15.6 178.5-120.5 145.0 23.6 52.3 31.1 111 113 A F E +d 75 0A 0 -37,-1.3 -35,-1.5 -2,-0.4 2,-0.2 -0.982 7.5 168.3-141.3 152.5 23.0 51.1 27.6 112 114 A T E -d 76 0A 0 49,-1.8 51,-0.5 -2,-0.3 2,-0.3 -0.812 20.5-135.9-150.4-176.3 21.0 48.2 26.1 113 115 A E E -d 77 0A 28 -37,-0.5 -35,-2.9 -2,-0.2 2,-0.3 -0.981 14.5-178.2-154.8 140.2 19.6 46.6 23.0 114 116 A A B -m 164 0C 1 49,-1.9 51,-1.5 -2,-0.3 6,-0.1 -0.996 26.3-142.3-143.2 147.4 16.2 45.0 22.0 115 117 A S S S+ 0 0 70 -2,-0.3 2,-0.2 4,-0.2 51,-0.2 0.893 86.8 57.5 -74.2 -42.5 14.9 43.4 18.8 116 118 A T S > S- 0 0 18 3,-0.1 3,-1.5 49,-0.1 5,-0.1 -0.591 93.1-110.4 -93.0 156.5 11.3 44.9 19.0 117 119 A V T 3 S+ 0 0 3 624,-0.7 4,-0.1 1,-0.3 629,-0.1 0.796 115.3 15.8 -57.7 -37.3 10.5 48.6 19.1 118 120 A H T 3 S+ 0 0 3 627,-0.3 630,-0.4 1,-0.1 -1,-0.3 -0.247 91.3 118.4-129.6 47.0 9.3 48.6 22.8 119 121 A G S < S- 0 0 4 -3,-1.5 -38,-0.3 627,-0.1 -39,-0.3 -0.085 100.7 -41.6-106.3 32.7 10.8 45.2 24.0 120 122 A G S S+ 0 0 0 -6,-0.1 4,-0.4 -40,-0.1 -7,-0.2 0.652 89.5 131.4 120.5 27.2 13.1 46.5 26.7 121 123 A H S S+ 0 0 2 -5,-0.1 -9,-0.2 -4,-0.1 35,-0.1 0.724 91.1 14.7 -75.4 -23.0 14.8 49.6 25.4 122 124 A E S > S+ 0 0 1 2,-0.1 4,-1.4 3,-0.1 -1,-0.1 0.658 120.0 58.9-126.7 -30.4 14.1 51.6 28.5 123 125 A T H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.858 99.5 60.8 -71.1 -37.1 13.0 49.2 31.3 124 126 A T H > S+ 0 0 0 -4,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.889 106.9 46.6 -56.1 -42.0 16.3 47.3 31.1 125 127 A I H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.885 111.7 50.4 -68.2 -40.5 18.1 50.5 32.1 126 128 A L H < S+ 0 0 4 -4,-1.4 4,-0.3 2,-0.2 -2,-0.2 0.861 114.0 45.0 -66.3 -36.5 15.7 51.3 34.9 127 129 A T H >< S+ 0 0 0 -4,-2.7 3,-1.2 -46,-0.3 4,-0.3 0.912 111.3 52.3 -73.3 -43.5 16.1 47.8 36.3 128 130 A M H >< S+ 0 0 1 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.772 97.0 70.3 -59.2 -28.6 19.9 47.8 36.0 129 131 A S T >X S+ 0 0 0 -4,-1.3 3,-0.9 1,-0.3 4,-0.8 0.668 75.1 79.8 -71.6 -17.4 20.1 51.1 37.8 130 132 A T H <> S+ 0 0 1 -3,-1.2 4,-1.4 -4,-0.3 3,-0.4 0.800 84.4 65.6 -59.2 -29.5 19.1 49.5 41.2 131 133 A Y H <> S+ 0 0 5 -3,-1.3 4,-1.7 -4,-0.3 -1,-0.3 0.908 96.2 55.3 -53.6 -46.5 22.8 48.4 41.4 132 134 A A H <>>S+ 0 0 0 -3,-0.9 5,-1.4 -4,-0.3 4,-0.6 0.776 103.3 55.0 -63.2 -30.7 23.9 52.1 41.6 133 135 A Y H <5S+ 0 0 1 -4,-0.8 207,-0.3 -3,-0.4 3,-0.3 0.899 108.8 46.0 -69.9 -42.0 21.6 52.8 44.6 134 136 A H H <5S+ 0 0 7 -4,-1.4 -2,-0.2 339,-0.2 -1,-0.2 0.811 118.1 42.6 -72.1 -31.4 23.1 49.9 46.8 135 137 A F H <5S- 0 0 9 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.513 110.5-120.1 -90.0 -8.4 26.7 50.9 45.9 136 138 A G T <5 + 0 0 0 -4,-0.6 -31,-1.1 1,-0.3 -3,-0.2 0.621 60.3 154.1 74.8 14.3 26.0 54.6 46.3 137 139 A M < - 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