==== 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 SIGNALING PROTEIN 11-FEB-03 1NXV . COMPND 2 MOLECULE: DNA-BINDING RESPONSE REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR C.J.BENT,N.W.ISAACS,T.J.MITCHELL,A.RIBOLDI-TUNNICLIFFE . 118 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 17.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 8 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.5 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 1 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 K 0 0 153 0, 0.0 25,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 153.9 53.7 61.9 -3.4 2 3 A K E -a 26 0A 35 23,-0.2 44,-1.7 42,-0.2 45,-1.3 -0.893 360.0-164.8-112.9 129.1 55.4 63.2 -0.2 3 4 A I E -ab 27 47A 0 23,-2.3 25,-2.2 -2,-0.4 2,-0.6 -0.966 9.7-151.7-110.0 130.9 58.7 62.0 1.3 4 5 A L E -ab 28 48A 1 43,-2.4 45,-2.2 -2,-0.4 2,-0.6 -0.916 14.8-159.1 -97.0 116.9 59.8 62.8 4.8 5 6 A I E -ab 29 49A 0 23,-2.6 25,-2.0 -2,-0.6 2,-0.6 -0.903 7.4-170.8-102.1 120.5 63.6 62.8 4.9 6 7 A V E +ab 30 50A 2 43,-3.1 45,-2.2 -2,-0.6 2,-0.3 -0.916 28.5 132.2-120.5 100.6 65.0 62.3 8.4 7 8 A D - 0 0 1 23,-1.6 47,-0.1 -2,-0.6 23,-0.1 -0.968 45.1-151.9-149.3 129.5 68.8 62.9 8.5 8 9 A D S S+ 0 0 62 45,-0.4 2,-0.7 -2,-0.3 23,-0.1 0.599 79.5 87.2 -77.3 -14.8 70.8 65.0 11.0 9 10 A E > - 0 0 82 1,-0.2 4,-2.4 2,-0.0 3,-0.4 -0.812 67.4-158.0 -88.6 111.7 73.6 65.6 8.4 10 11 A K H > S+ 0 0 112 -2,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.864 87.7 54.3 -62.8 -40.6 72.5 68.7 6.4 11 12 A P H > S+ 0 0 95 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.851 112.6 43.7 -58.9 -37.8 74.6 68.0 3.3 12 13 A I H > S+ 0 0 38 -3,-0.4 4,-2.4 2,-0.2 5,-0.3 0.908 110.9 54.6 -72.5 -45.4 73.2 64.5 2.9 13 14 A S H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.896 109.7 48.6 -51.6 -42.2 69.7 65.8 3.6 14 15 A D H X S+ 0 0 65 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.849 108.1 52.4 -72.4 -37.7 70.2 68.3 0.8 15 16 A I H X S+ 0 0 77 -4,-1.4 4,-2.2 2,-0.2 5,-0.2 0.931 114.9 42.2 -62.3 -46.6 71.5 65.7 -1.7 16 17 A I H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.897 113.8 51.4 -68.1 -37.8 68.4 63.5 -1.1 17 18 A K H X S+ 0 0 93 -4,-2.3 4,-2.2 -5,-0.3 5,-0.2 0.974 111.5 49.9 -62.9 -47.9 66.0 66.5 -1.1 18 19 A F H X S+ 0 0 128 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.908 114.6 41.2 -56.1 -50.7 67.5 67.6 -4.4 19 20 A N H X S+ 0 0 26 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.867 115.0 50.6 -72.9 -37.2 67.2 64.2 -6.2 20 21 A M H <>S+ 0 0 2 -4,-2.7 5,-1.9 -5,-0.2 4,-0.3 0.850 110.1 51.6 -64.5 -33.0 63.8 63.4 -4.8 21 22 A T H ><5S+ 0 0 77 -4,-2.2 3,-2.2 -5,-0.3 -2,-0.2 0.949 104.7 56.5 -68.6 -43.7 62.6 66.9 -6.0 22 23 A K H 3<5S+ 0 0 144 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.756 103.4 55.3 -56.2 -27.7 63.9 66.1 -9.4 23 24 A E T 3<5S- 0 0 91 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.485 123.5-104.4 -81.7 -7.4 61.7 63.1 -9.4 24 25 A G T < 5S+ 0 0 65 -3,-2.2 2,-0.2 1,-0.3 -3,-0.2 0.470 74.5 137.2 97.1 3.7 58.6 65.2 -8.7 25 26 A Y < - 0 0 34 -5,-1.9 2,-0.5 -23,-0.0 -1,-0.3 -0.537 56.1-121.6 -77.7 149.1 58.1 64.3 -5.0 26 27 A E E -a 2 0A 119 -25,-2.4 -23,-2.3 -2,-0.2 2,-0.5 -0.784 33.4-148.8 -80.9 130.0 57.2 66.9 -2.4 27 28 A V E +a 3 0A 25 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.882 22.2 177.2-113.6 127.9 60.0 66.9 0.3 28 29 A V E -a 4 0A 19 -25,-2.2 -23,-2.6 -2,-0.5 2,-0.3 -0.952 18.7-154.2-119.5 140.5 59.7 67.6 4.0 29 30 A T E -a 5 0A 30 -2,-0.4 2,-0.3 -25,-0.2 -23,-0.2 -0.872 13.9-174.8-118.0 149.3 62.8 67.3 6.1 30 31 A A E -a 6 0A 0 -25,-2.0 -23,-1.6 -2,-0.3 3,-0.1 -0.973 11.8-159.9-141.5 141.5 63.4 66.6 9.8 31 32 A F S S+ 0 0 53 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.1 0.337 71.5 24.9-114.4 6.8 66.8 66.7 11.5 32 33 A N S > S- 0 0 23 22,-0.1 4,-2.7 -25,-0.1 24,-0.1 -0.975 85.4 -96.5-155.6 173.3 66.1 64.6 14.6 33 34 A G H > S+ 0 0 0 22,-1.8 4,-2.0 24,-0.4 23,-0.1 0.800 120.3 50.0 -61.8 -33.5 63.9 61.9 16.0 34 35 A R H > S+ 0 0 129 21,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.946 112.6 44.4 -71.0 -50.9 61.5 64.4 17.7 35 36 A E H > S+ 0 0 73 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.892 111.6 58.9 -55.4 -41.3 61.1 66.6 14.6 36 37 A A H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.945 108.0 42.4 -53.8 -53.9 60.6 63.3 12.6 37 38 A L H X S+ 0 0 37 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.837 115.3 50.9 -63.7 -31.4 57.7 62.1 14.7 38 39 A E H X S+ 0 0 116 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.933 112.6 44.9 -72.3 -43.4 56.2 65.6 14.6 39 40 A Q H X>S+ 0 0 57 -4,-3.0 4,-2.6 1,-0.2 5,-0.6 0.861 110.0 57.2 -69.2 -33.2 56.5 65.9 10.8 40 41 A F H X5S+ 0 0 21 -4,-2.4 4,-1.5 -5,-0.3 -1,-0.2 0.945 111.2 41.5 -60.4 -49.9 55.1 62.4 10.5 41 42 A E H <5S+ 0 0 152 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.933 122.4 38.7 -65.6 -44.7 52.0 63.4 12.4 42 43 A A H <5S+ 0 0 81 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.757 125.8 32.2 -84.5 -24.7 51.5 66.7 10.7 43 44 A E H <5S- 0 0 61 -4,-2.6 -3,-0.2 -5,-0.2 -1,-0.2 0.658 83.9-147.2-103.3 -24.3 52.5 66.0 7.1 44 45 A Q << - 0 0 152 -4,-1.5 -42,-0.2 -5,-0.6 -4,-0.1 0.942 23.2-151.6 52.1 59.5 51.4 62.4 6.7 45 46 A P - 0 0 9 0, 0.0 -42,-0.2 0, 0.0 3,-0.1 -0.165 18.3-138.3 -53.1 148.3 54.2 61.4 4.3 46 47 A D S S+ 0 0 56 -44,-1.7 2,-0.3 1,-0.3 -43,-0.2 0.725 90.9 7.4 -76.6 -26.7 53.8 58.6 1.8 47 48 A I E -b 3 0A 0 -45,-1.3 -43,-2.4 25,-0.1 2,-0.4 -0.971 67.0-149.2-154.0 149.1 57.3 57.4 2.6 48 49 A I E -bc 4 74A 0 25,-1.8 27,-2.3 -2,-0.3 2,-0.5 -0.995 4.6-155.4-120.3 130.9 60.0 58.2 5.2 49 50 A I E -bc 5 75A 3 -45,-2.2 -43,-3.1 -2,-0.4 2,-0.5 -0.954 30.1-177.7-102.6 119.2 63.8 57.9 4.6 50 51 A L E -bc 6 76A 0 25,-2.3 27,-1.9 -2,-0.5 -43,-0.1 -0.964 19.6-144.7-132.5 116.6 64.9 57.5 8.1 51 52 A D E - c 0 77A 3 -45,-2.2 27,-0.2 -2,-0.5 3,-0.1 -0.481 15.6-130.6 -97.8 157.6 68.3 57.2 9.2 52 53 A L S S+ 0 0 4 25,-1.2 7,-2.0 1,-0.2 2,-0.7 0.834 90.4 57.1 -71.5 -38.7 69.2 55.0 12.1 53 54 A M + 0 0 94 5,-0.2 -45,-0.4 6,-0.1 -1,-0.2 -0.896 68.4 151.5-100.8 113.0 71.4 57.4 14.2 54 55 A L - 0 0 19 -2,-0.7 -22,-0.1 -47,-0.1 -23,-0.0 -0.985 43.4-107.6-137.1 149.8 69.5 60.6 15.2 55 56 A P S S+ 0 0 62 0, 0.0 2,-2.3 0, 0.0 -22,-1.8 -0.161 96.6 13.4 -61.7 165.4 69.7 63.1 18.1 56 57 A E S S+ 0 0 131 -24,-0.1 2,-0.4 -23,-0.1 -24,-0.0 -0.392 136.7 18.7 70.4 -77.0 66.9 63.2 20.7 57 58 A I S S- 0 0 42 -2,-2.3 -24,-0.4 3,-0.0 -23,-0.0 -0.995 87.5-118.2-128.8 137.6 65.3 59.9 19.7 58 59 A D > - 0 0 76 -2,-0.4 4,-2.7 1,-0.1 -5,-0.2 -0.217 24.2-110.7 -73.4 154.9 67.0 57.2 17.7 59 60 A G H > S+ 0 0 0 -7,-2.0 4,-2.6 2,-0.2 5,-0.2 0.813 115.8 56.0 -44.7 -42.1 65.9 55.8 14.3 60 61 A L H > S+ 0 0 40 -8,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.958 110.5 42.6 -64.3 -47.8 64.9 52.5 15.8 61 62 A E H > S+ 0 0 76 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.913 112.4 55.2 -66.6 -38.6 62.5 54.1 18.3 62 63 A V H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.978 112.8 42.2 -54.8 -52.1 61.2 56.5 15.6 63 64 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.917 115.3 50.1 -63.4 -41.5 60.4 53.5 13.4 64 65 A K H X S+ 0 0 71 -4,-2.9 4,-0.8 -5,-0.2 -1,-0.2 0.937 112.6 45.9 -64.0 -45.3 59.0 51.5 16.4 65 66 A T H >X S+ 0 0 39 -4,-3.6 3,-1.2 1,-0.2 4,-0.6 0.966 111.7 52.5 -64.4 -42.2 56.7 54.4 17.5 66 67 A I H >X S+ 0 0 2 -4,-2.9 4,-1.6 -5,-0.3 3,-1.4 0.878 103.8 57.3 -54.1 -46.0 55.5 55.1 13.9 67 68 A R H 3< S+ 0 0 69 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.693 89.0 74.9 -65.4 -21.1 54.5 51.4 13.4 68 69 A K H << S+ 0 0 162 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.878 120.3 9.5 -55.5 -35.1 52.2 51.6 16.5 69 70 A T H << S+ 0 0 115 -3,-1.4 2,-0.3 -4,-0.6 -2,-0.2 0.507 125.7 47.6-121.0 -10.0 49.7 53.6 14.3 70 71 A S < - 0 0 34 -4,-1.6 -1,-0.2 -5,-0.1 0, 0.0 -0.992 44.9-158.9-143.8 140.2 50.9 53.5 10.7 71 72 A S + 0 0 105 -2,-0.3 -4,-0.1 -3,-0.1 3,-0.1 0.231 43.9 149.1-102.3 21.7 52.2 51.2 8.0 72 73 A V - 0 0 13 -6,-0.2 -25,-0.1 1,-0.1 -26,-0.1 -0.144 58.4-102.0 -48.0 130.5 53.8 54.0 6.0 73 74 A P - 0 0 10 0, 0.0 -25,-1.8 0, 0.0 2,-0.4 -0.437 39.0-161.7 -58.6 137.3 56.8 52.5 4.2 74 75 A I E -c 48 0A 0 19,-0.3 21,-3.1 -27,-0.2 22,-0.9 -0.994 9.6-165.4-127.1 129.8 60.2 53.3 5.9 75 76 A L E -cd 49 96A 0 -27,-2.3 -25,-2.3 -2,-0.4 2,-0.2 -0.977 18.2-146.2-116.9 109.6 63.5 53.1 4.2 76 77 A M E -cd 50 97A 0 20,-2.8 22,-2.4 -2,-0.6 2,-0.4 -0.578 13.9-167.8 -78.4 147.2 66.3 53.2 6.7 77 78 A L E +cd 51 98A 0 -27,-1.9 -25,-1.2 -2,-0.2 2,-0.3 -0.996 18.4 146.7-137.9 127.2 69.5 54.8 5.7 78 79 A S E - d 0 99A 4 20,-2.0 22,-1.6 -2,-0.4 -27,-0.0 -0.985 54.7-131.4-164.8 147.0 72.8 54.6 7.6 79 80 A A S S+ 0 0 67 -2,-0.3 2,-0.5 20,-0.3 -1,-0.1 0.746 88.2 98.2 -67.4 -24.3 76.6 54.5 7.4 80 81 A K + 0 0 104 1,-0.1 -2,-0.1 -3,-0.1 -28,-0.1 -0.562 49.4 171.6 -68.4 118.5 76.2 51.5 9.8 81 82 A D + 0 0 109 -2,-0.5 2,-0.2 18,-0.1 -1,-0.1 -0.046 24.2 123.8-126.3 30.0 76.5 48.4 7.5 82 83 A S > - 0 0 47 1,-0.1 4,-2.2 4,-0.0 5,-0.3 -0.514 69.8-113.8 -91.3 161.5 76.7 45.3 9.7 83 84 A E H > S+ 0 0 167 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.914 118.7 53.0 -55.7 -46.8 74.4 42.3 9.6 84 85 A F H > S+ 0 0 146 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.931 108.5 51.3 -57.8 -43.0 73.1 43.1 13.1 85 86 A D H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.928 113.3 41.9 -62.5 -48.7 72.3 46.7 12.0 86 87 A K H X S+ 0 0 79 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.928 115.0 51.5 -66.2 -43.8 70.3 45.8 8.9 87 88 A V H X S+ 0 0 61 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.913 111.6 45.0 -60.0 -44.8 68.5 43.0 10.7 88 89 A I H X S+ 0 0 33 -4,-2.5 4,-3.3 -5,-0.2 6,-0.2 0.948 111.6 54.3 -71.9 -40.3 67.4 45.0 13.7 89 90 A G H <>S+ 0 0 0 -4,-2.1 5,-2.3 -5,-0.3 4,-0.3 0.942 113.6 41.3 -49.7 -55.4 66.3 47.9 11.4 90 91 A L H ><5S+ 0 0 79 -4,-2.5 3,-1.1 3,-0.2 -1,-0.2 0.885 114.6 51.2 -63.6 -41.1 64.1 45.6 9.4 91 92 A E H 3<5S+ 0 0 143 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.914 106.2 56.0 -61.5 -42.0 62.8 43.7 12.6 92 93 A L T 3<5S- 0 0 46 -4,-3.3 -1,-0.2 -5,-0.2 -25,-0.2 0.520 136.5 -84.0 -75.1 -0.5 62.0 47.1 14.1 93 94 A G T < 5S+ 0 0 17 -3,-1.1 -19,-0.3 1,-0.3 -3,-0.2 0.336 78.4 142.6 122.5 -1.6 59.8 47.8 11.1 94 95 A A < - 0 0 8 -5,-2.3 -1,-0.3 -6,-0.2 -19,-0.2 -0.299 38.0-154.0 -53.7 143.8 62.0 49.2 8.2 95 96 A D S S+ 0 0 79 -21,-3.1 2,-0.3 1,-0.3 -20,-0.2 0.600 77.9 5.1 -88.6 -23.1 60.9 48.0 4.8 96 97 A D E -d 75 0A 31 -22,-0.9 -20,-2.8 -7,-0.1 2,-0.4 -0.971 62.9-149.9-158.6 158.8 64.4 48.5 3.4 97 98 A Y E -d 76 0A 19 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.988 14.3-176.2-143.7 130.8 67.8 49.5 4.6 98 99 A V E -d 77 0A 10 -22,-2.4 -20,-2.0 -2,-0.4 2,-0.3 -0.987 18.4-129.6-136.1 137.0 70.4 51.2 2.5 99 100 A T E -d 78 0A 46 -2,-0.4 -20,-0.3 -22,-0.2 -18,-0.1 -0.668 29.5 -90.5 -98.0 148.8 73.9 52.2 3.4 100 101 A K S S+ 0 0 23 -22,-1.6 2,-0.1 -2,-0.3 3,-0.0 -0.786 106.5 45.8 -96.0 132.9 75.8 55.4 3.1 101 102 A P S S+ 0 0 129 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.447 87.5 171.9 -82.1 150.2 77.3 56.3 0.8 102 103 A F - 0 0 38 -4,-0.1 2,-0.5 -2,-0.1 -2,-0.1 -0.635 38.3-103.6-119.4 168.7 74.7 55.3 -1.7 103 104 A S > - 0 0 56 -2,-0.2 4,-2.4 1,-0.1 5,-0.1 -0.862 24.3-141.3 -92.8 131.5 74.0 55.7 -5.3 104 105 A N H > S+ 0 0 66 -2,-0.5 4,-2.1 2,-0.2 5,-0.2 0.892 102.0 51.2 -60.5 -40.8 71.4 58.3 -6.0 105 106 A R H > S+ 0 0 200 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 109.6 47.6 -67.4 -45.3 69.9 56.2 -8.8 106 107 A E H > S+ 0 0 85 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.912 110.5 54.1 -59.2 -45.6 69.6 53.1 -6.6 107 108 A L H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.929 109.5 47.2 -49.4 -52.7 68.0 55.2 -3.8 108 109 A Q H X S+ 0 0 33 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.840 111.1 51.2 -57.8 -39.0 65.4 56.5 -6.2 109 110 A A H X S+ 0 0 55 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.925 109.9 48.7 -74.2 -33.6 64.6 53.1 -7.5 110 111 A R H X S+ 0 0 89 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.936 110.5 51.7 -69.7 -39.3 64.1 51.7 -4.0 111 112 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 5,-0.2 0.969 111.9 48.1 -57.8 -49.0 61.8 54.6 -3.1 112 113 A K H X S+ 0 0 129 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.927 110.1 50.6 -54.7 -51.4 59.9 53.8 -6.3 113 114 A A H X S+ 0 0 34 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.925 111.7 48.1 -58.4 -43.2 59.7 50.1 -5.5 114 115 A L H < S+ 0 0 19 -4,-2.7 3,-0.3 1,-0.2 4,-0.2 0.906 113.1 46.7 -62.7 -42.7 58.4 50.8 -1.9 115 116 A L H >< S+ 0 0 26 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.886 109.3 55.3 -68.0 -36.0 55.7 53.3 -3.1 116 117 A R H 3< S+ 0 0 188 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.762 108.3 50.9 -64.1 -25.9 54.6 50.8 -5.8 117 118 A R T 3< 0 0 213 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.359 360.0 360.0-102.0 2.0 54.1 48.2 -3.2 118 119 A S < 0 0 100 -3,-1.2 -46,-0.1 -4,-0.2 -72,-0.0 -0.624 360.0 360.0-130.5 360.0 51.9 50.3 -0.8