==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 30-JUN-05 2A5L . COMPND 2 MOLECULE: TRP REPRESSOR BINDING PROTEIN WRBA; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR V.V.LUNIN,E.EVDOKIMOVA,M.KUDRITSKA,J.OSIPIUK,A.JOACHIMIAK, . 346 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15356.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 16.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 2.0 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 . 0 0.0 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 . 12 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 32.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 3 1 0 2 0 0 0 0 0 2 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 2 0 0 3 3 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 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 1 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 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 S 0 0 140 0, 0.0 30,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 -55.7 18.2 35.6 82.4 2 4 A P - 0 0 78 0, 0.0 30,-1.6 0, 0.0 2,-0.3 -0.383 360.0-165.9 -63.5 151.4 21.0 36.3 85.0 3 5 A Y E -a 32 0A 15 52,-0.4 54,-3.4 28,-0.2 55,-0.7 -0.958 27.6-128.7-140.3 153.1 23.9 38.2 83.3 4 6 A I E -ab 33 58A 0 28,-2.6 30,-2.8 -2,-0.3 2,-0.5 -0.903 32.4-134.2 -94.1 129.9 27.5 39.3 83.7 5 7 A L E -ab 34 59A 0 53,-2.6 55,-2.8 -2,-0.5 2,-0.7 -0.761 13.5-161.8 -88.2 126.0 27.8 43.0 83.1 6 8 A V E -ab 35 60A 0 28,-3.1 30,-2.9 -2,-0.5 2,-0.5 -0.936 18.9-179.1-108.6 100.0 30.7 43.9 80.8 7 9 A L E +ab 36 61A 0 53,-3.0 55,-2.6 -2,-0.7 2,-0.3 -0.919 10.6 149.0-114.7 122.7 31.2 47.6 81.6 8 10 A Y E - b 0 62A 12 28,-2.0 30,-0.5 -2,-0.5 2,-0.4 -0.927 39.2-138.5-146.7 165.2 33.9 49.6 79.8 9 11 A Y - 0 0 31 53,-1.6 2,-0.4 -2,-0.3 62,-0.1 -0.985 25.9-178.1-121.9 140.2 35.1 52.9 78.4 10 12 A S + 0 0 26 -2,-0.4 28,-0.1 28,-0.2 -2,-0.0 -0.999 19.8 179.6-136.5 139.8 36.9 53.0 75.0 11 13 A R S S+ 0 0 145 -2,-0.4 -1,-0.1 134,-0.0 52,-0.0 0.832 91.2 15.2 -98.4 -46.8 38.4 55.9 73.1 12 14 A H S S- 0 0 101 133,-0.0 -2,-0.0 0, 0.0 132,-0.0 0.294 112.4 -97.4-117.7 7.4 39.8 54.1 70.0 13 15 A G S > S+ 0 0 33 133,-0.0 4,-1.9 4,-0.0 5,-0.2 0.226 90.0 110.5 108.1 -14.9 38.0 50.8 70.2 14 16 A A H > S+ 0 0 12 131,-0.2 4,-2.5 1,-0.2 5,-0.2 0.942 85.3 43.3 -61.4 -49.5 40.5 48.3 71.8 15 17 A T H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.826 109.7 58.6 -69.1 -27.1 38.6 47.9 75.1 16 18 A A H > S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.907 108.5 45.4 -62.3 -41.7 35.3 47.7 73.1 17 19 A E H X S+ 0 0 63 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.910 111.5 51.5 -70.2 -40.4 36.7 44.7 71.3 18 20 A X H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.907 107.3 54.7 -55.1 -40.4 38.0 43.2 74.5 19 21 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.909 106.6 50.8 -65.7 -40.2 34.5 43.7 76.0 20 22 A R H X S+ 0 0 102 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.892 112.4 46.3 -62.9 -39.5 33.0 41.7 73.1 21 23 A Q H X S+ 0 0 21 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.884 111.1 50.8 -71.1 -38.6 35.5 38.8 73.6 22 24 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.934 109.5 52.8 -60.4 -40.3 34.9 38.8 77.4 23 25 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.899 105.5 53.7 -63.8 -40.7 31.1 38.7 76.5 24 26 A R H X S+ 0 0 94 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.920 109.8 48.1 -58.9 -40.0 31.8 35.6 74.3 25 27 A G H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.903 106.1 56.6 -64.5 -44.7 33.5 34.0 77.3 26 28 A V H ><>S+ 0 0 0 -4,-2.6 5,-1.8 1,-0.2 3,-0.6 0.934 108.0 49.3 -50.3 -48.5 30.6 34.8 79.6 27 29 A E H ><5S+ 0 0 81 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.861 105.8 55.4 -60.6 -38.0 28.4 32.9 77.1 28 30 A Q H 3<5S+ 0 0 102 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.773 104.7 56.5 -63.3 -27.7 30.8 29.9 77.1 29 31 A G T <<5S- 0 0 13 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.211 125.3-102.3 -89.7 10.5 30.3 29.9 80.9 30 32 A G T < 5S+ 0 0 70 -3,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.645 84.7 108.0 83.7 17.5 26.5 29.6 80.6 31 33 A F < - 0 0 32 -5,-1.8 -1,-0.3 -30,-0.1 2,-0.2 -0.862 69.1-111.3-119.5 157.6 25.5 33.2 81.3 32 34 A E E -a 3 0A 116 -30,-1.6 -28,-2.6 -2,-0.3 2,-0.4 -0.591 31.4-139.8 -76.7 148.0 24.1 36.1 79.3 33 35 A A E -a 4 0A 25 -30,-0.2 2,-0.6 -2,-0.2 -28,-0.2 -0.946 9.3-160.7-109.7 133.9 26.4 39.0 78.8 34 36 A R E -a 5 0A 77 -30,-2.8 -28,-3.1 -2,-0.4 2,-0.6 -0.947 12.3-162.5-112.0 108.2 25.3 42.6 79.0 35 37 A V E +a 6 0A 30 -2,-0.6 11,-0.5 -30,-0.2 2,-0.3 -0.822 20.0 162.9 -96.4 120.4 27.9 44.8 77.3 36 38 A R E -a 7 0A 55 -30,-2.9 -28,-2.0 -2,-0.6 11,-0.2 -0.973 18.9-163.7-136.9 152.4 27.6 48.5 78.2 37 39 A T B -f 47 0B 17 9,-2.7 11,-3.0 -2,-0.3 -28,-0.2 -0.467 18.2-120.9-118.3-168.7 29.7 51.6 78.0 38 40 A V - 0 0 6 -30,-0.5 -28,-0.2 9,-0.2 36,-0.1 -0.977 28.4-105.4-135.8 150.7 29.6 55.1 79.6 39 41 A P - 0 0 28 0, 0.0 38,-0.1 0, 0.0 9,-0.0 -0.339 39.2 -97.9 -73.4 154.7 29.4 58.6 78.0 40 42 A A - 0 0 53 1,-0.1 178,-0.8 -2,-0.0 2,-0.3 -0.258 39.8-141.6 -55.4 156.2 32.4 61.0 77.7 41 43 A V E +G 217 0C 10 176,-0.2 2,-0.3 177,-0.1 176,-0.2 -0.834 22.6 170.0-118.8 163.3 32.6 63.7 80.3 42 44 A S E G 216 0C 50 174,-2.0 174,-1.8 -2,-0.3 209,-0.0 -0.979 360.0 360.0-160.0 167.1 33.6 67.4 80.2 43 45 A T 0 0 103 -2,-0.3 172,-0.2 172,-0.2 171,-0.0 -0.481 360.0 360.0 -83.3 360.0 33.5 70.5 82.3 44 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 45 59 A A 0 0 78 0, 0.0 -9,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 150.5 27.1 49.9 73.1 46 60 A L - 0 0 118 -11,-0.5 -9,-2.7 1,-0.1 2,-0.3 -0.306 360.0 -96.3 -66.0 159.1 24.3 51.3 75.1 47 61 A Y B -f 37 0B 142 -11,-0.2 -9,-0.2 1,-0.1 -1,-0.1 -0.612 39.6-113.6 -82.5 142.0 25.2 53.3 78.2 48 62 A A - 0 0 14 -11,-3.0 2,-0.3 -2,-0.3 -1,-0.1 -0.386 27.4-158.4 -72.5 147.3 25.2 51.6 81.6 49 63 A T > - 0 0 70 -2,-0.1 4,-1.5 1,-0.1 5,-0.2 -0.772 32.7-108.4-113.5 167.5 22.7 52.4 84.3 50 64 A L H > S+ 0 0 65 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.898 120.5 56.5 -59.4 -40.6 22.9 51.9 88.1 51 65 A E H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.878 101.9 56.3 -59.8 -37.7 20.2 49.2 87.7 52 66 A D H 4 S+ 0 0 15 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.914 112.5 42.0 -55.3 -42.8 22.5 47.4 85.2 53 67 A L H >< S+ 0 0 1 -4,-1.5 3,-0.9 1,-0.2 -2,-0.2 0.915 113.5 51.8 -75.2 -43.3 25.2 47.3 87.8 54 68 A K H 3< S+ 0 0 67 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.868 113.5 43.3 -60.4 -36.4 22.9 46.4 90.7 55 69 A N T 3< S+ 0 0 96 -4,-2.1 -52,-0.4 -5,-0.2 -1,-0.2 0.401 86.1 115.0 -98.0 3.5 21.3 43.5 89.0 56 70 A C < - 0 0 2 -3,-0.9 -52,-0.2 -4,-0.4 3,-0.1 -0.355 60.9-144.0 -70.5 150.9 24.4 41.9 87.5 57 71 A A S S- 0 0 27 -54,-3.4 2,-0.3 1,-0.3 -53,-0.2 0.622 84.5 -15.0 -82.0 -18.3 25.5 38.4 88.6 58 72 A G E S-b 4 0A 0 -55,-0.7 -53,-2.6 35,-0.2 2,-0.4 -0.945 70.8-124.5-176.0 170.6 29.1 39.6 88.2 59 73 A L E -bc 5 95A 2 35,-2.1 37,-2.2 -2,-0.3 2,-0.5 -0.988 10.4-166.1-139.4 133.4 31.1 42.4 86.6 60 74 A A E -bc 6 96A 0 -55,-2.8 -53,-3.0 -2,-0.4 2,-0.5 -0.996 20.3-163.0-115.1 125.5 34.0 42.8 84.1 61 75 A L E -bc 7 97A 0 35,-2.6 37,-2.2 -2,-0.5 2,-0.4 -0.946 10.3-174.3-117.2 122.3 35.3 46.4 84.3 62 76 A G E +bc 8 98A 0 -55,-2.6 -53,-1.6 -2,-0.5 37,-0.2 -0.919 12.8 152.4-127.8 140.9 37.4 47.7 81.4 63 77 A S E - c 0 99A 0 35,-2.2 37,-0.9 -2,-0.4 -53,-0.1 -0.980 42.6-109.2-155.9 150.4 39.4 50.8 80.5 64 78 A P E - c 0 100A 10 0, 0.0 7,-0.4 0, 0.0 2,-0.2 -0.454 56.4 -93.1 -67.2 154.2 42.4 52.0 78.4 65 79 A T - 0 0 19 35,-2.4 2,-0.3 5,-0.1 37,-0.2 -0.534 41.8-174.2 -70.4 136.1 45.3 52.9 80.7 66 80 A R B > S-H 69 0D 65 3,-2.1 3,-1.1 -2,-0.2 188,-0.1 -0.779 71.8 -43.9-134.1 87.9 45.3 56.6 81.6 67 81 A F T 3 S- 0 0 22 -2,-0.3 229,-0.2 1,-0.2 230,-0.1 0.877 117.7 -46.6 56.6 45.0 48.5 57.4 83.6 68 82 A G T 3 S+ 0 0 0 1,-0.3 2,-0.3 225,-0.1 -1,-0.2 0.529 127.3 75.2 80.5 3.9 48.2 54.4 85.8 69 83 A N B < S-H 66 0D 1 -3,-1.1 -3,-2.1 223,-0.1 -1,-0.3 -0.903 89.4 -82.5-133.8 170.7 44.5 54.7 86.6 70 84 A X - 0 0 0 -2,-0.3 -5,-0.1 41,-0.2 2,-0.1 -0.213 60.7 -78.8 -66.9 164.5 41.2 54.1 84.7 71 85 A A >> - 0 0 0 -7,-0.4 4,-2.1 1,-0.1 3,-1.0 -0.385 39.0-118.7 -66.7 141.6 39.8 56.7 82.3 72 86 A S H 3> S+ 0 0 3 1,-0.2 4,-2.5 178,-0.2 5,-0.2 0.806 110.0 59.0 -54.3 -36.5 37.9 59.6 83.9 73 87 A P H 3> S+ 0 0 10 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.888 110.0 44.0 -62.8 -33.1 34.5 58.9 82.2 74 88 A L H <> S+ 0 0 0 -3,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.903 112.1 52.2 -76.9 -38.8 34.5 55.4 83.8 75 89 A K H X S+ 0 0 2 -4,-2.1 4,-2.4 1,-0.2 172,-0.2 0.897 107.0 54.7 -58.3 -38.8 35.6 56.9 87.2 76 90 A Y H X S+ 0 0 78 -4,-2.5 4,-0.9 2,-0.2 -1,-0.2 0.917 106.8 50.2 -63.1 -43.8 32.7 59.4 86.9 77 91 A F H >< S+ 0 0 28 -4,-1.7 3,-1.3 1,-0.2 -1,-0.2 0.958 113.0 46.1 -56.1 -49.2 30.3 56.5 86.5 78 92 A L H >< S+ 0 0 5 -4,-2.3 3,-2.0 1,-0.3 -2,-0.2 0.844 102.7 64.1 -65.4 -31.8 31.7 54.8 89.6 79 93 A D H 3< S+ 0 0 26 -4,-2.4 3,-0.4 1,-0.3 -1,-0.3 0.747 97.0 59.5 -64.1 -20.1 31.6 58.1 91.5 80 94 A G T << S+ 0 0 47 -3,-1.3 3,-0.4 -4,-0.9 -1,-0.3 0.320 82.9 86.7 -87.8 9.8 27.8 57.9 91.2 81 95 A T <> + 0 0 0 -3,-2.0 4,-1.9 1,-0.2 3,-0.5 0.154 44.7 117.1-100.9 16.8 27.5 54.5 93.0 82 96 A S H > S+ 0 0 58 -3,-0.4 4,-2.9 1,-0.2 5,-0.2 0.866 75.4 54.4 -50.2 -42.5 27.3 55.8 96.6 83 97 A S H > S+ 0 0 60 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.881 107.9 49.4 -62.6 -38.6 23.8 54.3 97.1 84 98 A L H >>S+ 0 0 0 -3,-0.5 5,-2.2 2,-0.2 4,-0.5 0.871 111.7 49.2 -62.2 -41.8 25.0 50.9 96.0 85 99 A W H ><5S+ 0 0 87 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.950 112.0 48.1 -66.7 -46.2 27.9 51.1 98.4 86 100 A L H 3<5S+ 0 0 132 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.831 117.8 40.2 -63.6 -34.3 25.7 52.2 101.3 87 101 A T H 3<5S- 0 0 103 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.388 108.4-119.0 -96.5 2.7 23.1 49.4 100.7 88 102 A G T X<5 + 0 0 33 -3,-1.0 3,-1.0 -4,-0.5 -3,-0.2 0.809 55.0 157.7 66.4 31.0 25.6 46.7 99.9 89 103 A S T 3 S+ 0 0 3 -6,-0.4 3,-1.9 32,-0.2 -1,-0.3 0.410 83.9 135.0-104.4 3.6 27.3 44.6 94.9 91 105 A V T < S+ 0 0 91 -3,-1.0 33,-0.2 1,-0.3 32,-0.2 -0.246 76.5 7.6 -58.6 125.7 28.6 42.7 98.0 92 106 A G T 3 S+ 0 0 42 31,-2.9 -1,-0.3 1,-0.3 32,-0.2 0.417 93.1 129.0 87.1 -3.0 29.6 39.1 97.2 93 107 A K < - 0 0 41 -3,-1.9 32,-2.5 1,-0.1 -1,-0.3 -0.662 63.2-112.5 -83.4 138.5 29.4 39.4 93.4 94 108 A P E - d 0 125A 2 0, 0.0 -35,-2.1 0, 0.0 2,-0.3 -0.443 40.5-179.3 -69.2 149.1 32.4 38.3 91.4 95 109 A A E +cd 59 126A 0 30,-2.5 32,-2.8 -37,-0.2 2,-0.3 -0.999 13.2 172.6-151.5 148.7 34.4 40.9 89.6 96 110 A A E -c 60 0A 0 -37,-2.2 -35,-2.6 -2,-0.3 2,-0.3 -0.935 18.4-133.5-147.1 170.2 37.4 41.3 87.3 97 111 A V E -c 61 0A 0 38,-0.4 40,-2.0 30,-0.4 2,-0.3 -0.865 10.3-166.1-129.6 162.5 39.1 44.0 85.2 98 112 A F E -ce 62 137A 0 -37,-2.2 -35,-2.2 -2,-0.3 2,-0.3 -0.995 7.3-174.8-148.6 146.9 40.6 44.5 81.8 99 113 A T E -c 63 0A 0 38,-2.7 2,-0.3 -2,-0.3 40,-0.2 -0.947 13.2-157.6-138.2 162.0 42.8 47.1 80.2 100 114 A S E -c 64 0A 8 -37,-0.9 -35,-2.4 -2,-0.3 2,-0.4 -0.987 14.0-167.9-133.0 144.8 44.3 48.2 76.9 101 115 A T B -i 140 0E 9 38,-2.4 40,-3.2 -2,-0.3 41,-0.5 -0.988 24.7-164.4-135.0 145.6 47.4 50.4 76.4 102 116 A A S S+ 0 0 53 -2,-0.4 2,-0.3 38,-0.2 43,-0.1 0.341 70.1 97.2 -99.2 1.3 49.0 52.1 73.4 103 117 A S - 0 0 51 3,-0.1 3,-0.4 1,-0.1 39,-0.1 -0.684 62.8-151.8-100.2 145.4 52.2 52.6 75.3 104 118 A L S S+ 0 0 131 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.581 83.7 66.9 -86.1 -10.8 55.3 50.4 75.2 105 119 A H S S- 0 0 162 1,-0.3 -1,-0.2 2,-0.0 2,-0.0 -0.210 101.4 -97.9-118.7 44.3 56.6 51.0 78.7 106 120 A G + 0 0 45 -3,-0.4 -1,-0.3 1,-0.1 -3,-0.1 -0.143 61.3 136.8 86.0-172.8 54.1 49.4 81.1 107 121 A G > + 0 0 13 -3,-0.1 4,-2.2 -40,-0.1 5,-0.2 0.063 53.8 96.7 117.1 -24.9 51.2 50.6 83.2 108 122 A Q H > S+ 0 0 28 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.923 83.3 50.2 -64.6 -44.7 48.6 47.9 82.7 109 123 A E H > S+ 0 0 105 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.933 116.1 41.0 -61.9 -42.2 49.3 45.9 85.8 110 124 A T H > S+ 0 0 57 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.886 113.5 53.9 -76.7 -31.7 49.2 48.8 88.1 111 125 A T H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.949 110.0 49.0 -59.7 -48.3 46.2 50.3 86.3 112 126 A Q H X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 3,-0.4 0.946 110.8 49.3 -55.3 -49.3 44.5 46.9 86.8 113 127 A L H >X S+ 0 0 82 -4,-2.7 4,-0.9 1,-0.2 3,-0.6 0.929 108.1 53.6 -55.5 -44.5 45.4 47.0 90.5 114 128 A S H 3< S+ 0 0 2 -4,-2.7 3,-0.3 1,-0.3 -1,-0.2 0.815 107.8 52.1 -61.3 -31.9 44.1 50.5 90.8 115 129 A X H 3X S+ 0 0 0 -4,-1.7 4,-0.9 -3,-0.4 -1,-0.3 0.721 98.8 63.2 -76.1 -25.8 40.8 49.3 89.3 116 130 A L H S+ 0 0 1 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.855 111.8 56.9 -59.7 -32.2 36.7 50.3 93.9 119 133 A L H <>S+ 0 0 4 -4,-0.9 5,-2.3 2,-0.2 -2,-0.2 0.930 110.1 44.5 -62.9 -43.5 35.5 46.7 93.4 120 134 A L H ><5S+ 0 0 94 -4,-2.5 3,-1.9 1,-0.2 -1,-0.2 0.883 107.3 57.9 -69.0 -36.1 36.8 45.9 96.9 121 135 A H H 3<5S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.884 105.9 51.6 -57.3 -35.4 35.2 49.0 98.3 122 136 A H T 3<5S- 0 0 10 -4,-1.7 -1,-0.3 -5,-0.2 -32,-0.2 0.339 119.7-113.8 -82.8 3.3 31.9 47.6 97.0 123 137 A G T < 5 + 0 0 34 -3,-1.9 -31,-2.9 1,-0.2 -3,-0.2 0.712 60.7 159.4 74.6 22.6 32.6 44.3 98.8 124 138 A X < - 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0 0 29 -2,-0.3 2,-0.3 -43,-0.2 -41,-0.2 -0.823 11.2-176.9-125.4 163.1 45.1 62.6 105.6 317 164 B H - 0 0 2 -43,-0.3 -41,-2.0 -2,-0.3 2,-0.6 -0.949 22.7-139.8-158.6 134.7 41.9 64.0 107.2 318 165 B F B -q 276 0H 65 -2,-0.3 -41,-0.2 -43,-0.2 -39,-0.1 -0.889 19.8-172.0 -94.9 123.3 38.7 62.6 108.5 319 166 B A - 0 0 3 -43,-3.3 6,-2.9 -2,-0.6 -42,-0.2 0.476 33.4-117.0 -99.2 -5.0 35.9 64.9 107.4 320 167 B G > - 0 0 10 -44,-0.5 3,-1.5 3,-0.2 -1,-0.2 0.026 40.9 -70.6 80.2 162.8 32.9 63.6 109.3 321 168 B A T 3 S+ 0 0 100 1,-0.3 -1,-0.1 2,-0.1 -44,-0.1 0.859 139.2 43.0 -59.0 -36.7 29.7 62.1 107.7 322 169 B D T 3 S- 0 0 108 -3,-0.1 -1,-0.3 -136,-0.0 -2,-0.1 0.436 111.9-122.0 -87.9 -0.4 28.7 65.6 106.5 323 170 B G S < S+ 0 0 7 -3,-1.5 -135,-0.3 -46,-0.2 -3,-0.2 0.655 86.4 106.9 68.4 18.8 32.2 66.3 105.4 324 171 B K + 0 0 125 -5,-0.1 -4,-0.2 -137,-0.1 2,-0.1 0.493 34.5 125.2-108.7 -4.3 32.3 69.4 107.6 325 172 B R - 0 0 92 -6,-2.9 3,-0.1 1,-0.1 -5,-0.0 -0.351 61.8-122.9 -55.5 126.6 34.6 68.2 110.5 326 173 B S - 0 0 98 1,-0.1 2,-0.3 -2,-0.1 -8,-0.1 -0.277 28.2 -94.4 -67.4 156.3 37.4 70.8 110.8 327 174 B L - 0 0 20 -10,-0.1 -1,-0.1 -139,-0.1 2,-0.1 -0.596 45.1-137.5 -65.7 132.3 41.1 69.8 110.5 328 175 B D > - 0 0 59 -2,-0.3 4,-2.7 -3,-0.1 5,-0.2 -0.302 29.6 -90.6 -80.9 177.7 42.4 69.1 114.0 329 176 B E H > S+ 0 0 160 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.883 126.0 48.3 -54.3 -48.4 45.8 70.3 115.3 330 177 B H H > S+ 0 0 114 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.908 113.1 47.8 -63.1 -44.0 47.6 67.2 114.2 331 178 B E H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.902 113.4 47.6 -65.6 -43.0 46.1 67.2 110.8 332 179 B L H X S+ 0 0 40 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.933 112.0 50.2 -62.1 -46.4 46.9 70.9 110.3 333 180 B T H X S+ 0 0 75 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.893 111.3 48.9 -58.7 -44.2 50.5 70.4 111.5 334 181 B L H X S+ 0 0 26 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.899 109.0 52.1 -67.9 -37.9 50.9 67.4 109.1 335 182 B C H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.944 112.5 46.0 -60.0 -44.7 49.6 69.4 106.1 336 183 B R H X S+ 0 0 70 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.917 111.1 52.7 -65.7 -38.5 52.0 72.2 106.8 337 184 B A H X S+ 0 0 38 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.881 108.7 50.4 -65.2 -37.3 54.9 69.7 107.3 338 185 B L H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.941 111.8 46.4 -67.0 -45.7 54.2 68.1 103.9 339 186 B G H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.903 112.8 50.3 -60.7 -42.1 54.1 71.4 102.1 340 187 B K H X S+ 0 0 81 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.925 111.7 48.7 -63.2 -41.4 57.3 72.5 103.9 341 188 B R H X S+ 0 0 93 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.899 110.4 49.6 -65.7 -45.4 59.0 69.2 102.9 342 189 B L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.942 114.0 46.7 -57.3 -47.2 57.9 69.5 99.2 343 190 B A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.940 112.1 48.6 -62.1 -47.3 59.3 73.1 99.1 344 191 B E H X S+ 0 0 92 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.859 111.2 51.6 -63.3 -38.3 62.6 72.2 100.8 345 192 B T H X S+ 0 0 32 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.934 110.5 47.2 -63.1 -47.2 63.0 69.2 98.4 346 193 B A H X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.893 110.2 55.6 -60.0 -37.1 62.4 71.5 95.4 347 194 B G H X S+ 0 0 22 -4,-2.6 4,-0.7 2,-0.2 -2,-0.2 0.915 109.0 45.9 -59.3 -45.4 64.9 74.0 97.0 348 195 B K H >< S+ 0 0 171 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.939 112.7 49.5 -66.1 -44.2 67.6 71.3 97.2 349 196 B L H 3< S+ 0 0 98 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.863 110.5 50.6 -61.9 -35.7 67.0 70.1 93.6 350 197 B G H 3< 0 0 65 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.467 360.0 360.0 -89.7 -9.7 67.2 73.7 92.2 351 198 B S << 0 0 161 -3,-0.9 -3,-0.1 -4,-0.7 -4,-0.1 -0.529 360.0 360.0 155.3 360.0 70.4 74.3 94.0