==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 30-JUL-10 3O74 . COMPND 2 MOLECULE: FRUCTOSE TRANSPORT SYSTEM REPRESSOR FRUR; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR M.CHAVARRIA,C.SANTIAGO,R.PLATERO,T.KRELL,J.M.CASASNOVAS,V.DE . 541 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22092.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 398 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 98 18.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.8 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 . 0 0.0 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 . 43 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.8 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 2 0 0 0 0 2 6 0 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 8 2 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 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 0 0 0 0 0 1 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 60 A H 0 0 154 0, 0.0 58,-0.1 0, 0.0 57,-0.0 0.000 360.0 360.0 360.0 110.8 27.3 -0.2 59.0 2 61 A T - 0 0 43 56,-0.4 3,-0.1 2,-0.2 32,-0.1 0.661 360.0-137.2 -80.1 -17.9 25.5 -2.8 57.0 3 62 A R + 0 0 108 1,-0.2 31,-2.0 30,-0.1 2,-0.4 0.874 65.3 117.3 58.6 38.1 26.9 -1.6 53.7 4 63 A T E -a 34 0A 3 29,-0.2 56,-2.3 54,-0.2 57,-0.7 -0.999 49.8-156.1-137.3 138.8 23.5 -2.1 52.1 5 64 A L E -ab 35 61A 0 29,-3.5 31,-2.8 -2,-0.4 2,-0.3 -0.850 12.8-139.2-110.7 148.4 21.1 0.4 50.6 6 65 A G E -ab 36 62A 0 55,-2.6 57,-3.5 -2,-0.3 2,-0.4 -0.823 11.9-168.3-106.4 148.2 17.3 -0.1 50.3 7 66 A F E -ab 37 63A 0 29,-2.0 31,-2.3 -2,-0.3 2,-0.5 -0.908 1.6-170.1-137.5 110.9 15.1 0.8 47.3 8 67 A I E +ab 38 64A 0 55,-2.5 57,-2.3 -2,-0.4 31,-0.2 -0.881 18.5 173.4 -98.6 125.0 11.4 0.9 47.5 9 68 A L E -a 39 0A 1 29,-2.4 31,-2.2 -2,-0.5 32,-0.5 -0.903 36.2-128.8-134.8 158.6 9.7 1.3 44.1 10 69 A P S S+ 0 0 2 0, 0.0 31,-0.9 0, 0.0 2,-0.3 0.848 88.3 14.3 -76.3 -36.7 6.2 1.2 42.8 11 70 A D > - 0 0 20 30,-0.1 3,-1.0 3,-0.1 6,-0.2 -0.908 46.3-164.3-154.0 113.1 6.4 -1.2 39.9 12 71 A L T 3 S+ 0 0 10 -2,-0.3 278,-0.1 1,-0.2 6,-0.1 0.794 97.4 55.9 -66.2 -29.2 9.2 -3.7 38.9 13 72 A E T 3 S+ 0 0 59 276,-0.2 -1,-0.2 277,-0.1 277,-0.1 0.527 80.9 100.6 -83.9 -8.3 7.7 -4.0 35.4 14 73 A N X> - 0 0 12 -3,-1.0 4,-2.1 1,-0.2 3,-0.8 -0.735 69.4-147.9 -78.2 112.8 7.9 -0.3 34.8 15 74 A P H 3> S+ 0 0 50 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.741 93.4 59.9 -55.3 -28.5 11.1 0.1 32.6 16 75 A S H 3> S+ 0 0 22 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.923 109.6 40.4 -66.5 -45.3 11.9 3.5 34.2 17 76 A Y H <> S+ 0 0 9 -3,-0.8 4,-2.7 -6,-0.2 5,-0.2 0.892 113.6 53.6 -71.0 -39.7 12.1 2.1 37.7 18 77 A A H X S+ 0 0 11 -4,-2.1 4,-2.4 -7,-0.2 -2,-0.2 0.898 110.1 49.1 -60.4 -40.6 14.0 -1.0 36.6 19 78 A R H X S+ 0 0 112 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.937 112.7 45.2 -64.7 -49.5 16.5 1.2 34.8 20 79 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.885 113.4 51.4 -61.9 -40.4 17.1 3.5 37.8 21 80 A A H X S+ 0 0 1 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.930 110.3 48.9 -62.7 -45.4 17.3 0.4 40.1 22 81 A K H X S+ 0 0 22 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.909 113.2 46.5 -60.2 -43.8 19.9 -1.2 37.9 23 82 A Q H X S+ 0 0 58 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.890 112.6 50.3 -66.9 -39.8 21.9 2.0 37.7 24 83 A L H X S+ 0 0 1 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.911 110.4 50.2 -64.2 -43.9 21.7 2.4 41.5 25 84 A E H X S+ 0 0 6 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.956 113.1 45.8 -58.0 -50.7 22.8 -1.2 42.0 26 85 A Q H X S+ 0 0 76 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.903 115.9 45.9 -61.0 -43.7 25.7 -0.7 39.7 27 86 A G H X S+ 0 0 23 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.909 112.2 50.4 -66.2 -44.7 26.7 2.6 41.3 28 87 A A H ><>S+ 0 0 0 -4,-3.1 5,-3.1 1,-0.2 3,-1.1 0.897 105.8 56.4 -61.5 -41.8 26.3 1.3 44.9 29 88 A R H ><5S+ 0 0 53 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.879 102.1 56.2 -59.3 -39.2 28.5 -1.7 44.2 30 89 A A H 3<5S+ 0 0 76 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.703 108.3 48.1 -67.2 -21.2 31.4 0.5 43.0 31 90 A R T <<5S- 0 0 163 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.265 127.9 -97.6-101.5 9.3 31.2 2.3 46.4 32 91 A G T < 5S+ 0 0 50 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.622 84.2 126.3 87.5 15.3 31.2 -0.9 48.3 33 92 A Y < - 0 0 2 -5,-3.1 2,-0.4 -6,-0.2 -1,-0.3 -0.801 49.5-144.1-110.5 148.9 27.4 -1.0 48.9 34 93 A Q E -a 4 0A 26 -31,-2.0 -29,-3.5 -2,-0.3 2,-0.5 -0.880 15.8-142.1-106.6 141.5 24.8 -3.7 48.1 35 94 A L E -a 5 0A 6 -2,-0.4 2,-0.5 -31,-0.2 275,-0.3 -0.906 10.0-165.6-109.7 124.4 21.3 -2.7 47.0 36 95 A L E -a 6 0A 0 -31,-2.8 -29,-2.0 -2,-0.5 2,-0.4 -0.924 13.3-157.5-106.1 131.9 18.1 -4.5 48.1 37 96 A I E +aC 7 308A 0 271,-3.0 271,-3.0 -2,-0.5 2,-0.3 -0.862 14.2 174.4-115.4 139.8 15.0 -3.8 46.1 38 97 A A E -a 8 0A 0 -31,-2.3 -29,-2.4 -2,-0.4 2,-0.4 -0.980 19.7-136.1-141.0 153.5 11.3 -4.2 47.0 39 98 A S E -a 9 0A 0 -2,-0.3 267,-0.2 267,-0.3 -28,-0.1 -0.914 12.9-173.2-117.7 139.9 8.0 -3.3 45.3 40 99 A S > - 0 0 0 -31,-2.2 3,-1.6 -2,-0.4 6,-0.3 0.617 33.7-134.7 -98.6 -19.4 4.9 -1.6 46.8 41 100 A D T 3 - 0 0 36 -31,-0.9 -30,-0.1 -32,-0.5 -2,-0.0 0.706 64.0 -75.5 65.6 20.0 2.6 -2.0 43.7 42 101 A D T 3 S+ 0 0 18 1,-0.2 -1,-0.3 -33,-0.2 -31,-0.1 0.700 101.0 138.4 61.5 18.1 1.7 1.6 44.5 43 102 A Q <> - 0 0 114 -3,-1.6 4,-2.4 1,-0.1 -1,-0.2 -0.870 51.1-147.9 -94.8 119.2 -0.3 0.2 47.4 44 103 A P H > S+ 0 0 38 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.856 97.6 49.6 -54.8 -40.7 0.1 2.3 50.5 45 104 A D H > S+ 0 0 105 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.881 110.0 50.0 -69.5 -38.2 -0.3 -0.7 52.9 46 105 A S H > S+ 0 0 11 -6,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.909 110.3 51.3 -63.6 -41.9 2.2 -2.7 51.0 47 106 A E H X S+ 0 0 0 -4,-2.4 4,-1.4 -7,-0.3 -2,-0.2 0.870 107.0 53.7 -63.3 -37.0 4.7 0.2 51.1 48 107 A R H X S+ 0 0 79 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.885 106.4 51.3 -67.5 -38.7 4.2 0.5 54.9 49 108 A Q H X S+ 0 0 72 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.879 108.4 53.2 -62.3 -38.4 5.0 -3.2 55.5 50 109 A L H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 5,-0.3 0.794 99.3 63.4 -67.8 -29.1 8.2 -2.6 53.4 51 110 A Q H X S+ 0 0 17 -4,-1.4 4,-0.8 1,-0.2 -1,-0.2 0.930 100.7 51.0 -59.5 -45.7 9.1 0.3 55.7 52 111 A Q H X S+ 0 0 126 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.809 106.4 58.9 -59.7 -30.7 9.4 -2.1 58.6 53 112 A L H X S+ 0 0 16 -4,-0.9 4,-3.4 2,-0.2 5,-0.2 0.969 110.5 35.9 -67.3 -57.8 11.6 -4.3 56.5 54 113 A F H <>S+ 0 0 1 -4,-1.8 5,-1.0 1,-0.2 -1,-0.2 0.522 115.0 61.9 -74.8 -5.8 14.4 -1.8 55.7 55 114 A R H <5S+ 0 0 131 -4,-0.8 -2,-0.2 -5,-0.3 -1,-0.2 0.853 112.7 34.0 -77.4 -42.7 13.7 -0.6 59.3 56 115 A A H <5S+ 0 0 77 -4,-2.1 -2,-0.2 -3,-0.2 -3,-0.2 0.901 113.1 57.6 -79.0 -45.1 14.7 -4.0 60.6 57 116 A R T <5S- 0 0 28 -4,-3.4 -1,-0.2 -5,-0.2 -3,-0.2 0.720 99.1-140.9 -56.4 -21.2 17.4 -4.8 58.0 58 117 A R T 5 - 0 0 109 -5,-0.2 -56,-0.4 -4,-0.2 -54,-0.2 0.941 25.6-170.0 53.8 51.2 19.0 -1.5 59.3 59 118 A C < - 0 0 0 -5,-1.0 -54,-0.2 1,-0.1 -1,-0.1 -0.390 28.9-122.3 -64.1 151.1 20.1 -0.5 55.8 60 119 A D S S+ 0 0 9 -56,-2.3 2,-0.3 1,-0.2 -55,-0.2 0.836 89.4 2.3 -67.7 -32.8 22.4 2.5 55.8 61 120 A A E -b 5 0A 0 -57,-0.7 -55,-2.6 22,-0.1 2,-0.5 -0.991 66.8-139.1-155.6 148.4 20.1 4.6 53.5 62 121 A L E -bd 6 85A 1 22,-2.8 24,-2.9 -2,-0.3 2,-0.3 -0.945 7.5-163.7-120.0 118.8 16.7 4.2 51.9 63 122 A F E +bd 7 86A 0 -57,-3.5 -55,-2.5 -2,-0.5 2,-0.3 -0.764 21.6 179.9 -89.1 144.7 15.7 5.3 48.4 64 123 A V E -bd 8 87A 0 22,-2.0 24,-1.9 -2,-0.3 2,-0.8 -0.964 37.1-163.4-155.4 130.0 12.0 5.4 47.8 65 124 A A - 0 0 0 -57,-2.3 26,-0.1 -2,-0.3 24,-0.1 -0.888 43.9-156.2-103.4 94.7 9.4 6.3 45.1 66 125 A S - 0 0 8 -2,-0.8 -2,-0.0 24,-0.5 -57,-0.0 -0.278 35.4-172.4 -83.7 157.4 6.5 6.6 47.5 67 126 A C + 0 0 8 -24,-0.1 -1,-0.1 -23,-0.1 65,-0.0 0.181 52.3 120.4-123.2 10.0 2.7 6.3 47.0 68 127 A L - 0 0 22 1,-0.1 -2,-0.1 -25,-0.1 -25,-0.0 -0.489 67.9-103.6 -81.4 148.4 1.8 7.6 50.5 69 128 A P - 0 0 63 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 -0.109 27.9-113.9 -60.1 163.0 -0.4 10.7 51.1 70 129 A P S S+ 0 0 131 0, 0.0 23,-0.1 0, 0.0 -2,-0.0 0.732 117.0 63.2 -71.5 -22.7 1.2 13.9 52.3 71 130 A E S S+ 0 0 172 2,-0.0 2,-0.2 0, 0.0 -3,-0.0 0.806 82.3 95.9 -69.3 -30.2 -0.6 13.5 55.6 72 131 A D + 0 0 39 -3,-0.4 3,-0.2 1,-0.1 4,-0.1 -0.450 49.3 179.5 -64.8 125.5 1.4 10.3 56.2 73 132 A D >> + 0 0 92 -2,-0.2 4,-1.8 1,-0.1 3,-0.7 0.161 45.0 115.2-113.4 15.6 4.5 11.1 58.4 74 133 A S H 3> S+ 0 0 21 1,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.843 78.4 51.3 -56.0 -36.3 5.9 7.6 58.5 75 134 A Y H 3> S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.806 104.0 59.0 -72.6 -28.7 9.0 8.7 56.6 76 135 A R H <> S+ 0 0 78 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.946 106.3 47.0 -60.5 -50.8 9.5 11.6 59.1 77 136 A E H X S+ 0 0 95 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.933 110.9 51.2 -57.5 -49.3 9.7 9.2 62.0 78 137 A L H <>S+ 0 0 14 -4,-1.8 5,-1.9 1,-0.2 -1,-0.2 0.868 111.6 49.3 -57.3 -37.6 12.2 7.0 60.2 79 138 A Q H ><5S+ 0 0 37 -4,-1.9 3,-2.0 1,-0.2 -1,-0.2 0.910 106.7 53.8 -68.0 -44.1 14.3 10.0 59.4 80 139 A D H 3<5S+ 0 0 121 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.814 101.3 61.3 -61.0 -30.6 14.3 11.3 63.0 81 140 A K T 3<5S- 0 0 119 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.415 129.9 -95.6 -78.6 2.2 15.6 7.8 64.0 82 141 A G T < 5S+ 0 0 55 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.2 0.504 78.5 138.4 101.9 5.8 18.6 8.5 61.9 83 142 A L < - 0 0 5 -5,-1.9 2,-0.5 -22,-0.1 -1,-0.3 -0.758 51.9-131.6 -87.2 118.6 17.8 6.9 58.6 84 143 A P - 0 0 19 0, 0.0 -22,-2.8 0, 0.0 2,-0.5 -0.571 25.7-164.3 -64.8 118.4 18.8 8.9 55.5 85 144 A V E -d 62 0A 0 -2,-0.5 13,-0.8 -24,-0.2 2,-0.5 -0.948 5.7-171.0-111.4 121.7 15.7 8.8 53.3 86 145 A I E -de 63 98A 1 -24,-2.9 -22,-2.0 -2,-0.5 13,-0.2 -0.943 13.1-143.8-118.2 116.8 16.2 9.8 49.6 87 146 A A E -de 64 99A 0 11,-2.7 13,-2.8 -2,-0.5 2,-0.4 -0.509 14.6-164.8 -75.5 143.1 13.2 10.4 47.4 88 147 A I E - e 0 100A 0 -24,-1.9 2,-3.3 2,-0.3 13,-0.2 -0.999 64.8 -22.1-130.8 134.0 13.4 9.3 43.7 89 148 A D S S+ 0 0 12 11,-2.6 2,-0.7 -2,-0.4 13,-0.3 -0.196 129.0 65.2 67.2 -51.6 11.1 10.3 40.9 90 149 A R S S- 0 0 14 -2,-3.3 -24,-0.5 -26,-0.2 -2,-0.3 -0.875 89.0-134.8-105.7 105.8 8.3 11.1 43.4 91 150 A R - 0 0 106 -2,-0.7 2,-0.2 -4,-0.1 42,-0.2 -0.182 13.3-152.8 -62.4 143.1 9.3 14.1 45.6 92 151 A L - 0 0 25 165,-0.1 165,-0.1 1,-0.1 5,-0.1 -0.653 55.1 -48.8-103.5 171.4 8.8 14.0 49.3 93 152 A D >> - 0 0 77 -2,-0.2 4,-3.4 1,-0.2 3,-2.0 -0.137 50.7-151.9 -45.9 107.3 8.3 17.1 51.5 94 153 A P T 34 S+ 0 0 42 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.571 91.2 68.2 -62.4 -8.8 11.2 19.4 50.3 95 154 A A T 34 S+ 0 0 63 161,-0.1 -2,-0.1 1,-0.1 3,-0.1 0.780 122.5 9.8 -78.4 -28.7 11.1 21.0 53.8 96 155 A H T <4 S+ 0 0 66 -3,-2.0 2,-0.3 1,-0.1 -3,-0.1 0.604 121.3 62.7-121.8 -24.6 12.4 17.8 55.4 97 156 A F < - 0 0 8 -4,-3.4 160,-2.3 -5,-0.1 2,-0.5 -0.815 65.8-132.0-118.3 149.4 13.4 15.4 52.6 98 157 A C E -ef 86 257A 2 -13,-0.8 -11,-2.7 -2,-0.3 2,-0.4 -0.824 31.3-173.0 -91.8 131.1 16.0 15.3 49.8 99 158 A S E -ef 87 258A 0 158,-2.5 160,-3.4 -2,-0.5 2,-0.6 -0.985 21.1-158.9-131.4 137.4 14.5 14.3 46.5 100 159 A V E +ef 88 259A 0 -13,-2.8 -11,-2.6 -2,-0.4 2,-0.2 -0.951 34.6 155.0-110.9 112.7 16.0 13.5 43.0 101 160 A I E - f 0 260A 27 158,-2.0 160,-2.5 -2,-0.6 2,-0.2 -0.747 41.0 -97.6-131.2 174.3 13.4 13.9 40.3 102 161 A S E - f 0 261A 4 -13,-0.3 2,-2.4 158,-0.2 3,-0.2 -0.625 38.2-107.4 -92.7 157.3 12.9 14.6 36.6 103 162 A D > + 0 0 68 158,-2.0 4,-2.2 -2,-0.2 160,-0.3 -0.384 58.7 159.1 -77.1 61.5 12.2 18.0 35.1 104 163 A D H > + 0 0 8 -2,-2.4 4,-2.8 1,-0.2 5,-0.2 0.844 59.5 52.6 -65.2 -43.8 8.6 16.8 34.3 105 164 A R H > S+ 0 0 104 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.958 115.5 41.9 -57.9 -51.7 6.6 20.1 33.9 106 165 A D H > S+ 0 0 70 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 114.9 51.5 -59.9 -44.1 9.1 21.5 31.4 107 166 A A H X S+ 0 0 6 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.901 110.4 48.9 -61.1 -41.3 9.4 18.1 29.6 108 167 A S H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.877 109.5 52.3 -68.2 -38.6 5.6 17.8 29.3 109 168 A R H X S+ 0 0 83 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.966 112.8 43.9 -58.6 -54.1 5.3 21.3 27.9 110 169 A Q H X S+ 0 0 109 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.883 113.4 52.3 -59.8 -40.6 7.9 20.7 25.2 111 170 A L H X S+ 0 0 0 -4,-2.3 4,-1.0 -5,-0.2 -1,-0.2 0.939 112.5 43.7 -62.6 -48.5 6.3 17.3 24.5 112 171 A A H >X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-0.6 0.895 111.2 54.7 -64.4 -41.8 2.8 18.7 24.0 113 172 A A H 3X S+ 0 0 39 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.870 101.3 59.5 -59.5 -38.2 4.1 21.6 22.0 114 173 A S H 3< S+ 0 0 16 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.832 110.1 42.4 -61.2 -33.6 5.8 19.2 19.6 115 174 A L H X< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.6 -1,-0.2 0.850 110.6 54.9 -79.2 -39.1 2.5 17.6 18.8 116 175 A L H >< S+ 0 0 33 -4,-2.2 3,-2.5 1,-0.3 -2,-0.2 0.815 92.6 72.9 -62.8 -31.1 0.6 21.0 18.6 117 176 A S T 3< S+ 0 0 105 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.1 0.646 89.7 60.2 -62.7 -14.0 3.0 22.2 16.0 118 177 A S T < S- 0 0 59 -3,-1.4 -1,-0.3 -4,-0.1 -2,-0.2 0.276 114.9-115.6 -96.3 8.8 1.4 19.8 13.5 119 178 A A < - 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