==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 06-AUG-04 1U8S . COMPND 2 MOLECULE: GLYCINE CLEAVAGE SYSTEM TRANSCRIPTIONAL . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; . AUTHOR D.KUMARAN,S.SWAMINATHAN . 343 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16601.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 273 79.6 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 . 122 35.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 34 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 0 0 0 0 0 0 2 2 0 0 1 1 1 0 1 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 . 2 0 0 0 0 0 2 4 4 2 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 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 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 2 A S 0 0 123 0, 0.0 3,-0.1 0, 0.0 52,-0.0 0.000 360.0 360.0 360.0 77.8 65.6 22.9 24.3 2 3 A L - 0 0 136 52,-0.1 2,-0.2 1,-0.1 51,-0.1 0.978 360.0-131.3 52.9 80.5 63.7 19.6 24.8 3 4 A T - 0 0 83 51,-0.1 2,-0.4 49,-0.1 51,-0.2 -0.407 20.6-156.5 -64.7 129.9 60.4 21.0 26.0 4 5 A Q E -A 53 0A 44 49,-3.5 49,-1.8 -2,-0.2 2,-0.4 -0.864 2.4-147.2-110.8 144.8 59.0 19.3 29.1 5 6 A H E -AB 52 81A 14 76,-0.8 76,-1.8 -2,-0.4 2,-0.4 -0.912 11.9-171.3-113.9 136.3 55.3 19.3 30.1 6 7 A L E -AB 51 80A 0 45,-2.8 45,-2.7 -2,-0.4 2,-0.5 -0.986 12.9-151.6-132.0 126.3 54.0 19.4 33.6 7 8 A V E -AB 50 79A 0 72,-3.0 72,-1.5 -2,-0.4 2,-0.4 -0.831 20.3-169.0 -93.8 124.6 50.4 18.9 34.8 8 9 A I E -AB 49 78A 0 41,-3.9 41,-2.4 -2,-0.5 2,-0.4 -0.917 8.9-177.2-117.5 142.9 49.7 20.7 38.0 9 10 A T E +AB 48 77A 0 68,-2.1 68,-2.3 -2,-0.4 2,-0.3 -0.994 6.5 175.2-140.3 132.0 46.7 20.4 40.3 10 11 A A E -AB 47 76A 1 37,-1.8 37,-2.7 -2,-0.4 2,-0.3 -0.958 13.8-176.6-137.3 155.3 46.0 22.4 43.4 11 12 A V E +AB 46 75A 3 64,-1.5 64,-1.6 -2,-0.3 2,-0.3 -0.872 24.1 142.4-152.5 113.1 43.2 22.7 46.0 12 13 A G E -A 45 0A 0 33,-1.7 33,-3.1 -2,-0.3 2,-0.3 -0.880 58.7 -66.1-143.6 175.1 43.3 25.2 48.8 13 14 A T E -A 44 0A 70 60,-0.4 2,-0.3 59,-0.3 31,-0.3 -0.512 62.3-108.5 -67.9 125.3 41.0 27.5 50.8 14 15 A D + 0 0 70 29,-2.1 -1,-0.1 -2,-0.3 26,-0.0 -0.378 57.2 151.9 -61.6 116.7 39.9 30.2 48.4 15 16 A R > - 0 0 105 -2,-0.3 3,-0.9 -3,-0.0 4,-0.3 -0.853 50.0 -77.1-135.7 168.7 41.6 33.5 49.3 16 17 A P T 3 S+ 0 0 103 0, 0.0 271,-0.0 0, 0.0 0, 0.0 -0.465 110.5 7.9 -75.6 143.9 42.6 36.5 47.3 17 18 A G T 3> S+ 0 0 22 -2,-0.2 4,-2.3 266,-0.1 5,-0.1 0.434 88.2 122.0 71.2 -2.2 45.7 36.4 45.1 18 19 A I H <> S+ 0 0 3 -3,-0.9 4,-1.3 1,-0.2 -1,-0.1 0.920 79.5 44.2 -58.4 -41.3 46.0 32.7 45.7 19 20 A C H > S+ 0 0 14 -4,-0.3 4,-2.2 1,-0.2 5,-0.2 0.893 107.9 59.6 -68.2 -39.6 45.8 32.1 41.9 20 21 A N H > S+ 0 0 22 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.894 100.7 56.5 -53.2 -44.2 48.2 35.0 41.3 21 22 A E H X S+ 0 0 60 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.943 107.6 46.5 -53.2 -54.6 50.8 33.2 43.4 22 23 A V H X S+ 0 0 1 -4,-1.3 4,-2.5 1,-0.2 5,-0.2 0.926 114.2 46.3 -54.8 -52.1 50.7 30.1 41.2 23 24 A V H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.813 114.2 50.3 -62.4 -32.3 50.8 32.0 37.9 24 25 A R H X S+ 0 0 113 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.951 110.3 47.6 -71.6 -50.1 53.7 34.1 39.3 25 26 A L H X S+ 0 0 29 -4,-3.1 4,-0.9 1,-0.2 -2,-0.2 0.915 115.9 45.0 -57.8 -44.8 55.8 31.2 40.5 26 27 A V H <>S+ 0 0 0 -4,-2.5 5,-2.0 -5,-0.2 3,-0.3 0.926 115.9 44.3 -67.4 -46.8 55.3 29.4 37.2 27 28 A T H ><5S+ 0 0 13 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.863 111.4 52.8 -67.6 -37.5 56.0 32.4 34.9 28 29 A Q H 3<5S+ 0 0 110 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.733 101.1 61.9 -70.0 -21.3 59.0 33.6 36.9 29 30 A A T 3<5S- 0 0 1 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.401 123.7-108.9 -82.6 3.3 60.5 30.1 36.6 30 31 A G T < 5S+ 0 0 34 -3,-1.5 24,-0.2 1,-0.3 -3,-0.2 0.644 73.8 137.6 80.1 16.9 60.5 30.8 32.8 31 32 A C < - 0 0 1 -5,-2.0 2,-0.3 26,-0.1 -1,-0.3 -0.552 49.0-127.9 -96.9 161.5 57.6 28.4 32.0 32 33 A N E -C 52 0A 34 20,-2.9 20,-1.8 -2,-0.2 2,-0.8 -0.816 10.4-139.2-104.9 144.7 54.6 28.8 29.8 33 34 A I E +CD 51 298A 0 265,-3.5 265,-1.6 -2,-0.3 18,-0.2 -0.911 22.1 179.0-104.6 105.0 51.1 28.1 30.9 34 35 A I E - 0 0 26 16,-1.8 2,-0.3 -2,-0.8 17,-0.2 0.838 63.2 -28.3 -75.8 -34.9 49.5 26.3 27.9 35 36 A D E +C 50 0A 25 15,-1.4 15,-2.3 263,-0.1 2,-0.3 -0.969 60.7 178.1-170.1 170.2 46.1 25.8 29.4 36 37 A S E -C 49 0A 0 -2,-0.3 2,-0.4 13,-0.2 13,-0.3 -0.970 22.3-131.8-173.9 165.5 44.3 25.5 32.8 37 38 A R E -C 48 0A 56 11,-3.2 11,-2.6 -2,-0.3 2,-0.4 -0.999 22.2-171.9-133.9 128.8 41.0 25.1 34.5 38 39 A I E +C 47 0A 11 256,-2.7 2,-0.3 -2,-0.4 9,-0.2 -0.970 11.7 160.7-124.1 138.6 40.0 27.2 37.4 39 40 A A E -C 46 0A 7 7,-1.9 7,-2.1 -2,-0.4 2,-0.7 -0.994 35.5-137.1-155.2 151.6 37.0 26.8 39.6 40 41 A M E -C 45 0A 75 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.911 29.8-176.2-112.9 100.4 35.7 27.9 43.0 41 42 A F E > -C 44 0A 1 3,-1.5 3,-2.8 -2,-0.7 2,-1.0 -0.886 61.2 -39.8-102.6 125.2 34.0 24.8 44.5 42 43 A G T 3 S- 0 0 3 -2,-0.5 216,-0.4 1,-0.3 -2,-0.0 -0.498 125.5 -32.9 63.6-102.0 32.3 25.2 47.9 43 44 A K T 3 S+ 0 0 112 -2,-1.0 -29,-2.1 212,-0.2 2,-0.3 0.125 116.3 103.3-135.4 18.0 34.9 27.4 49.5 44 45 A E E < -AC 13 41A 9 -3,-2.8 -3,-1.5 -31,-0.3 2,-0.4 -0.820 68.2-127.7-109.9 144.8 38.1 26.1 47.9 45 46 A F E -AC 12 40A 7 -33,-3.1 -33,-1.7 -2,-0.3 2,-0.4 -0.719 33.8-160.9 -82.3 134.8 40.2 27.5 45.1 46 47 A T E -AC 11 39A 0 -7,-2.1 -7,-1.9 -2,-0.4 2,-0.4 -0.978 9.9-175.5-127.7 128.6 40.6 24.7 42.5 47 48 A L E +AC 10 38A 1 -37,-2.7 -37,-1.8 -2,-0.4 2,-0.4 -0.961 20.7 175.0-135.5 134.9 43.2 24.4 39.7 48 49 A L E +AC 9 37A 0 -11,-2.6 -11,-3.2 -2,-0.4 2,-0.3 -0.996 26.2 170.4-122.7 129.5 44.1 22.2 36.8 49 50 A M E -AC 8 36A 1 -41,-2.4 -41,-3.9 -2,-0.4 2,-0.5 -0.994 26.9-160.3-149.6 138.4 47.1 23.5 34.8 50 51 A L E +AC 7 35A 0 -15,-2.3 -16,-1.8 -2,-0.3 -15,-1.4 -0.974 24.4 170.4-118.4 114.0 49.4 22.3 32.1 51 52 A I E -AC 6 33A 0 -45,-2.7 -45,-2.8 -2,-0.5 2,-0.3 -0.703 11.2-166.7-117.0 170.6 52.7 24.2 31.8 52 53 A S E +AC 5 32A 11 -20,-1.8 -20,-2.9 -47,-0.2 2,-0.3 -0.975 20.4 131.6-154.4 157.8 55.8 23.5 29.8 53 54 A G E -A 4 0A 13 -49,-1.8 -49,-3.5 -2,-0.3 -22,-0.1 -0.961 59.1 -46.6 176.4-172.3 59.4 24.7 29.7 54 55 A S > - 0 0 21 -2,-0.3 4,-2.9 -24,-0.2 5,-0.3 -0.318 60.5-104.2 -73.6 163.8 62.9 23.5 29.6 55 56 A P H > S+ 0 0 40 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.897 122.7 54.3 -57.1 -36.7 63.9 20.7 32.0 56 57 A S H > S+ 0 0 93 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.934 112.8 41.3 -62.4 -45.8 65.7 23.2 34.2 57 58 A N H > S+ 0 0 48 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.902 115.4 48.8 -70.2 -43.2 62.6 25.4 34.5 58 59 A I H X S+ 0 0 0 -4,-2.9 4,-3.3 1,-0.2 5,-0.2 0.927 112.3 49.8 -62.8 -42.5 60.1 22.6 34.9 59 60 A T H X S+ 0 0 65 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.885 108.8 54.0 -62.7 -36.0 62.4 21.0 37.5 60 61 A R H X S+ 0 0 123 -4,-1.7 4,-2.6 -5,-0.2 -2,-0.2 0.937 111.7 43.1 -62.7 -46.7 62.5 24.5 39.2 61 62 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.926 111.2 54.0 -65.2 -45.6 58.7 24.6 39.3 62 63 A E H < S+ 0 0 50 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.888 113.9 46.1 -55.8 -35.0 58.5 21.0 40.5 63 64 A T H < S+ 0 0 84 -4,-2.1 4,-0.5 -5,-0.2 -2,-0.2 0.918 121.3 31.5 -74.0 -45.6 60.9 22.0 43.2 64 65 A T H X S+ 0 0 43 -4,-2.6 4,-1.9 2,-0.1 -2,-0.2 0.620 101.3 74.8 -93.8 -13.6 59.3 25.3 44.4 65 66 A L H X S+ 0 0 1 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.959 94.8 51.1 -64.6 -50.8 55.6 24.7 43.8 66 67 A P H > S+ 0 0 55 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.911 109.8 52.5 -51.8 -42.8 55.1 22.4 46.8 67 68 A L H > S+ 0 0 110 -4,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.919 106.0 52.0 -58.6 -47.7 56.8 25.0 49.0 68 69 A L H X S+ 0 0 22 -4,-1.9 4,-2.1 1,-0.2 3,-0.3 0.924 110.2 51.2 -55.0 -45.2 54.5 27.7 47.8 69 70 A G H X>S+ 0 0 1 -4,-2.4 5,-2.6 1,-0.2 4,-0.7 0.922 104.1 54.8 -58.5 -46.3 51.6 25.4 48.7 70 71 A Q H <5S+ 0 0 162 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.839 109.4 51.9 -56.5 -32.0 53.0 24.8 52.2 71 72 A Q H <5S+ 0 0 147 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.953 118.1 32.2 -68.9 -52.9 53.0 28.6 52.5 72 73 A H H <5S- 0 0 25 -4,-2.1 -59,-0.3 2,-0.1 -1,-0.2 0.128 111.3-108.4 -94.7 19.6 49.3 29.1 51.5 73 74 A D T <5S+ 0 0 127 -4,-0.7 2,-0.6 -3,-0.4 -60,-0.4 0.845 71.4 151.1 56.2 34.2 47.9 25.9 52.9 74 75 A L < - 0 0 9 -5,-2.6 2,-0.6 -6,-0.2 -1,-0.2 -0.864 38.5-149.5-100.7 119.1 47.6 24.8 49.3 75 76 A I E -B 11 0A 74 -64,-1.6 -64,-1.5 -2,-0.6 2,-0.3 -0.790 23.2-175.5 -92.5 123.8 47.8 21.1 48.6 76 77 A T E -B 10 0A 33 -2,-0.6 2,-0.3 -66,-0.2 -66,-0.2 -0.788 18.4-163.9-119.5 163.1 49.3 20.3 45.2 77 78 A M E -B 9 0A 18 -68,-2.3 -68,-2.1 -2,-0.3 2,-0.3 -0.994 12.6-169.7-141.8 138.1 50.0 17.3 42.9 78 79 A M E +B 8 0A 55 -2,-0.3 2,-0.3 -70,-0.2 -70,-0.2 -0.950 11.3 170.7-135.1 156.0 52.2 17.2 39.8 79 80 A K E -B 7 0A 43 -72,-1.5 -72,-3.0 -2,-0.3 2,-0.1 -0.913 27.5-127.0-163.2 132.2 53.0 14.8 37.0 80 81 A R E +B 6 0A 86 -2,-0.3 2,-0.3 -74,-0.2 -74,-0.2 -0.480 33.5 173.9 -79.8 152.9 55.0 15.2 33.8 81 82 A T E -B 5 0A 18 -76,-1.8 -76,-0.8 -2,-0.1 134,-0.1 -0.889 31.0 -82.7-149.4 177.8 53.5 14.2 30.4 82 83 A S - 0 0 58 -2,-0.3 135,-0.2 1,-0.2 134,-0.1 -0.533 66.0 -60.5 -89.7 157.8 54.1 14.3 26.7 83 84 A P - 0 0 82 0, 0.0 2,-0.6 0, 0.0 -1,-0.2 0.164 58.3-108.2 -34.1 144.1 53.5 17.2 24.3 84 85 A H - 0 0 39 -3,-0.1 2,-1.8 1,-0.1 132,-0.1 -0.733 16.5-155.2 -88.1 114.4 50.0 18.6 24.0 85 86 A D - 0 0 73 -2,-0.6 2,-0.1 130,-0.3 -1,-0.1 -0.457 26.1-147.7 -84.7 62.7 48.1 17.9 20.8 86 87 A H - 0 0 115 -2,-1.8 2,-0.2 1,-0.1 128,-0.1 -0.073 14.9-153.9 -41.0 99.6 45.9 21.0 21.3 87 88 A Q - 0 0 129 -2,-0.1 2,-0.4 55,-0.0 -1,-0.1 -0.497 6.3-149.1 -83.4 145.4 42.6 20.0 19.7 88 89 A T - 0 0 117 -2,-0.2 2,-0.5 0, 0.0 -1,-0.0 -0.927 11.4-150.6-113.5 137.9 40.0 22.4 18.3 89 90 A H - 0 0 79 -2,-0.4 83,-0.2 53,-0.1 53,-0.2 -0.939 12.8-158.9-117.0 128.4 36.3 21.6 18.4 90 91 A A S S+ 0 0 26 -2,-0.5 82,-1.1 1,-0.1 2,-0.3 0.808 78.6 26.7 -69.8 -31.8 33.7 22.8 15.9 91 92 A Y E -HI 141 171B 79 50,-2.1 50,-2.4 80,-0.2 2,-0.5 -0.963 58.9-148.5-136.7 153.6 30.8 22.3 18.3 92 93 A T E -HI 140 170B 9 78,-3.3 78,-3.2 -2,-0.3 2,-0.6 -0.973 20.8-156.2-116.1 128.0 29.9 22.3 22.0 93 94 A V E -HI 139 169B 1 46,-3.1 46,-2.6 -2,-0.5 2,-0.6 -0.928 1.7-158.2-112.2 117.5 27.1 20.0 22.9 94 95 A E E -HI 138 168B 74 74,-2.4 74,-2.2 -2,-0.6 2,-0.4 -0.827 13.6-163.9 -94.9 125.2 25.1 20.6 26.0 95 96 A V E -HI 137 167B 5 42,-3.7 42,-2.4 -2,-0.6 2,-0.4 -0.896 8.9-174.7-110.5 137.7 23.4 17.5 27.2 96 97 A Y E -HI 136 166B 85 70,-1.6 70,-1.2 -2,-0.4 2,-0.4 -0.979 1.7-178.0-137.3 123.6 20.5 17.4 29.8 97 98 A V E -HI 135 165B 0 38,-2.4 38,-2.4 -2,-0.4 2,-0.5 -0.979 4.3-170.8-124.2 129.1 19.0 14.3 31.2 98 99 A E E +HI 134 164B 63 66,-2.4 66,-2.2 -2,-0.4 2,-0.3 -0.981 18.4 156.4-122.3 123.0 16.1 14.1 33.7 99 100 A S E -H 133 0B 9 34,-1.5 34,-1.8 -2,-0.5 64,-0.1 -0.897 46.7-130.9-139.4 167.2 15.1 10.9 35.3 100 101 A D S S+ 0 0 127 -2,-0.3 2,-0.3 32,-0.3 32,-0.1 -0.082 89.7 65.0-109.5 31.6 13.3 9.6 38.4 101 102 A D - 0 0 68 32,-0.2 32,-0.1 1,-0.1 -2,-0.1 -0.984 52.8-168.6-152.7 142.4 16.1 7.2 39.3 102 103 A K > + 0 0 39 -2,-0.3 3,-2.2 3,-0.1 4,-0.5 0.860 48.8 123.1 -95.1 -48.2 19.7 7.5 40.3 103 104 A L T 3 S- 0 0 133 1,-0.3 98,-0.1 2,-0.1 -2,-0.0 0.201 95.5 -38.1 -25.1 105.1 20.9 3.9 39.9 104 105 A G T 3> S+ 0 0 19 1,-0.1 4,-0.5 93,-0.1 -1,-0.3 0.675 98.3 126.1 43.1 31.5 23.8 3.6 37.5 105 106 A L H <> + 0 0 9 -3,-2.2 4,-1.1 2,-0.1 3,-0.4 0.899 64.0 57.6 -81.5 -42.2 22.5 6.2 35.2 106 107 A T H >> S+ 0 0 2 -4,-0.5 4,-1.9 1,-0.2 3,-1.0 0.942 100.5 53.5 -55.3 -56.6 25.6 8.4 35.1 107 108 A E H 3> S+ 0 0 22 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.844 102.1 64.3 -49.5 -34.1 28.1 5.8 33.9 108 109 A K H 3X S+ 0 0 99 -4,-0.5 4,-2.2 -3,-0.4 -1,-0.3 0.924 106.7 39.6 -56.9 -46.0 25.7 5.2 31.0 109 110 A F H S+ 0 0 1 -4,-1.7 5,-3.1 -3,-0.2 -1,-0.2 0.858 116.1 52.9 -83.1 -35.8 30.5 9.7 24.9 114 115 A A H ><5S+ 0 0 36 -4,-3.0 3,-2.5 3,-0.2 -2,-0.2 0.958 107.6 53.2 -62.2 -49.2 33.8 7.9 25.8 115 116 A Q H 3<5S+ 0 0 126 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.883 112.2 44.9 -51.4 -42.4 32.8 5.1 23.4 116 117 A R T 3<5S- 0 0 67 -4,-0.9 -1,-0.3 -5,-0.4 -2,-0.2 0.240 114.5-117.6 -88.2 13.3 32.3 7.7 20.6 117 118 A Q T < 5 + 0 0 184 -3,-2.5 2,-0.6 1,-0.2 -3,-0.2 0.870 65.7 144.7 52.4 41.2 35.5 9.5 21.5 118 119 A I < - 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