==== 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 23-SEP-05 2B4A . COMPND 2 MOLECULE: BH3024; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 116 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6300.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 84 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 19.8 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 . 13 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 25.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 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 Q 0 0 144 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.7 26.6 25.5 56.6 2 3 A P - 0 0 75 0, 0.0 2,-0.7 0, 0.0 25,-0.1 -0.362 360.0-128.1 -76.6 165.4 29.1 24.5 59.2 3 4 A F - 0 0 14 23,-0.4 25,-2.4 -2,-0.1 2,-0.5 -0.923 28.3-161.8-112.7 95.1 28.7 21.5 61.6 4 5 A R E -a 28 0A 64 -2,-0.7 45,-3.1 43,-0.2 46,-1.6 -0.755 10.8-177.4 -88.4 120.8 29.2 23.1 65.0 5 6 A V E -ab 29 50A 0 23,-2.2 25,-2.3 -2,-0.5 2,-0.5 -0.971 14.2-156.2-122.5 134.0 30.0 20.4 67.7 6 7 A T E -ab 30 51A 9 44,-2.5 46,-3.1 -2,-0.4 2,-0.5 -0.957 8.0-162.3-113.2 128.6 30.6 21.1 71.4 7 8 A L E -ab 31 52A 0 23,-3.3 25,-2.8 -2,-0.5 2,-0.6 -0.961 6.4-173.2-114.0 117.5 32.7 18.6 73.3 8 9 A V E +ab 32 53A 0 44,-3.1 46,-2.0 -2,-0.5 2,-0.3 -0.912 30.0 138.2-113.2 101.3 32.4 18.6 77.1 9 10 A E - 0 0 3 23,-1.6 -2,-0.1 -2,-0.6 6,-0.0 -0.988 38.5-163.4-151.4 131.9 35.0 16.2 78.4 10 11 A D S S+ 0 0 39 -2,-0.3 3,-0.1 5,-0.0 -1,-0.1 0.533 72.1 85.1-102.2 -7.3 37.4 16.4 81.4 11 12 A E >> - 0 0 100 1,-0.2 4,-2.4 2,-0.0 3,-0.7 -0.861 69.3-155.7 -83.5 111.0 39.9 13.7 80.5 12 13 A P H 3> S+ 0 0 93 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.829 89.5 54.3 -67.2 -26.8 42.2 15.7 78.3 13 14 A S H 3> S+ 0 0 77 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.783 112.2 43.2 -73.5 -28.5 43.5 12.6 76.4 14 15 A H H <> S+ 0 0 71 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.822 115.8 51.0 -78.4 -37.1 39.9 11.5 75.5 15 16 A A H X S+ 0 0 8 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.937 111.5 44.8 -63.6 -50.7 39.1 15.1 74.7 16 17 A T H X S+ 0 0 85 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.854 114.3 50.4 -65.7 -36.3 42.0 15.6 72.3 17 18 A L H X S+ 0 0 73 -4,-1.1 4,-1.3 2,-0.2 -2,-0.2 0.922 113.2 44.9 -65.0 -49.3 41.4 12.2 70.7 18 19 A I H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 3,-0.5 0.939 112.0 53.4 -61.4 -44.3 37.8 12.9 70.1 19 20 A Q H X S+ 0 0 66 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.823 103.8 56.7 -58.1 -34.2 38.7 16.4 68.8 20 21 A Y H X S+ 0 0 129 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.884 110.7 43.2 -64.3 -39.2 41.1 14.9 66.3 21 22 A H H X S+ 0 0 20 -4,-1.3 4,-1.3 -3,-0.5 -2,-0.2 0.872 109.1 56.2 -78.4 -39.9 38.4 12.8 64.8 22 23 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 3,-0.5 0.928 108.1 50.0 -48.9 -46.5 35.8 15.6 64.8 23 24 A N H ><5S+ 0 0 84 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.863 109.2 50.8 -69.2 -27.4 38.3 17.7 62.8 24 25 A Q H 3<5S+ 0 0 108 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.640 109.0 51.2 -81.0 -17.5 38.8 14.8 60.3 25 26 A L T <<5S- 0 0 24 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.372 125.5-105.6 -96.1 6.2 35.1 14.5 59.9 26 27 A G T < 5 + 0 0 55 -3,-0.6 -23,-0.4 -4,-0.3 -3,-0.2 0.763 63.6 155.1 83.8 29.9 35.0 18.3 59.2 27 28 A A < - 0 0 9 -5,-2.6 2,-0.8 -6,-0.1 -1,-0.2 -0.560 46.8-134.2 -87.4 147.7 33.5 19.8 62.5 28 29 A E E -a 4 0A 79 -25,-2.4 -23,-2.2 -2,-0.2 2,-0.4 -0.925 43.4-156.9 -88.9 105.1 33.9 23.3 63.9 29 30 A V E -a 5 0A 30 -2,-0.8 2,-0.5 -25,-0.2 -23,-0.2 -0.731 24.6-167.7-102.9 134.1 34.6 22.1 67.5 30 31 A T E -a 6 0A 61 -25,-2.3 -23,-3.3 -2,-0.4 2,-0.5 -0.986 15.8-158.4-113.7 125.2 34.3 23.9 70.9 31 32 A V E -a 7 0A 48 -2,-0.5 -23,-0.2 -25,-0.2 -25,-0.0 -0.912 8.4-167.7-111.1 123.7 35.9 22.1 73.7 32 33 A H E -a 8 0A 11 -25,-2.8 -23,-1.6 -2,-0.5 6,-0.1 -0.985 8.2-159.2-108.2 119.3 34.9 22.7 77.3 33 34 A P S S+ 0 0 88 0, 0.0 2,-0.3 0, 0.0 -25,-0.1 0.491 72.9 18.4 -79.0 -3.8 37.4 21.2 79.7 34 35 A S S > S- 0 0 33 1,-0.1 4,-2.0 23,-0.1 5,-0.1 -0.982 77.6-108.4-155.2 168.4 34.9 21.1 82.5 35 36 A G H > S+ 0 0 1 -2,-0.3 4,-2.7 2,-0.2 5,-0.1 0.787 120.6 53.8 -64.6 -33.7 31.2 21.3 83.4 36 37 A S H > S+ 0 0 70 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.867 106.7 52.3 -71.7 -37.8 31.8 24.8 84.8 37 38 A A H > S+ 0 0 10 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.941 111.5 47.4 -57.1 -47.2 33.3 25.8 81.5 38 39 A F H >< S+ 0 0 0 -4,-2.0 3,-0.8 2,-0.2 -2,-0.2 0.937 110.3 51.4 -59.8 -48.3 30.2 24.4 79.8 39 40 A F H >< S+ 0 0 89 -4,-2.7 3,-2.7 1,-0.2 4,-0.3 0.967 104.7 55.2 -56.3 -51.9 27.8 26.2 82.2 40 41 A Q H 3< S+ 0 0 139 -4,-2.4 -1,-0.2 1,-0.3 3,-0.2 0.757 115.3 41.2 -63.1 -14.7 29.4 29.6 81.7 41 42 A H T X< S+ 0 0 63 -4,-1.0 3,-2.2 -3,-0.8 -1,-0.3 0.209 75.0 124.5-112.3 16.3 28.8 29.1 77.9 42 43 A R G X + 0 0 79 -3,-2.7 3,-1.7 1,-0.3 4,-0.2 0.799 66.8 66.4 -29.0 -48.1 25.3 27.6 78.2 43 44 A S G > S+ 0 0 82 1,-0.3 3,-1.0 -4,-0.3 -1,-0.3 0.779 87.8 64.4 -64.2 -26.7 24.1 30.3 75.9 44 45 A Q G X S+ 0 0 100 -3,-2.2 3,-0.8 1,-0.2 -1,-0.3 0.330 75.9 88.5 -82.6 9.6 26.0 29.1 72.8 45 46 A L G < S+ 0 0 1 -3,-1.7 -1,-0.2 1,-0.2 3,-0.2 0.564 72.4 74.1 -79.5 -11.3 24.1 25.8 72.6 46 47 A S G < S+ 0 0 43 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.651 103.9 38.5 -74.3 -14.6 21.6 27.6 70.4 47 48 A T S < S+ 0 0 89 -3,-0.8 2,-0.3 -4,-0.1 -43,-0.2 0.353 95.1 105.1-112.0 -2.3 24.2 27.5 67.6 48 49 A C - 0 0 7 -3,-0.2 -43,-0.2 26,-0.2 3,-0.1 -0.643 47.5-169.3 -82.3 135.5 25.5 24.0 68.4 49 50 A D S S+ 0 0 57 -45,-3.1 28,-1.8 -2,-0.3 2,-0.4 0.817 76.4 15.4 -88.9 -38.6 24.5 21.1 66.1 50 51 A L E -bc 5 77A 0 -46,-1.6 -44,-2.5 26,-0.2 2,-0.6 -0.990 62.5-158.3-141.3 129.6 25.8 18.2 68.3 51 52 A L E -bc 6 78A 0 26,-2.8 28,-3.1 -2,-0.4 2,-0.6 -0.941 6.6-167.4-108.9 119.8 26.9 18.1 72.0 52 53 A I E +bc 7 79A 0 -46,-3.1 -44,-3.1 -2,-0.6 2,-0.4 -0.966 19.6 173.6-105.4 121.2 29.2 15.3 73.0 53 54 A V E -bc 8 80A 0 26,-2.3 28,-2.6 -2,-0.6 2,-0.3 -0.946 31.5-118.0-132.1 143.0 29.3 15.1 76.7 54 55 A S E > - c 0 81A 2 -46,-2.0 3,-0.8 -2,-0.4 28,-0.2 -0.681 14.9-138.5 -80.9 141.6 30.9 12.8 79.2 55 56 A D T 3 S+ 0 0 42 26,-2.3 7,-0.5 -2,-0.3 8,-0.1 0.420 98.0 45.3 -65.5 -14.1 28.6 10.9 81.7 56 57 A Q T 3 + 0 0 105 25,-0.2 -1,-0.2 5,-0.1 5,-0.1 -0.053 63.3 161.2-143.2 48.4 31.0 11.5 84.4 57 58 A L X - 0 0 11 -3,-0.8 3,-0.5 3,-0.4 5,-0.1 -0.432 41.3-132.4 -62.5 139.1 32.4 15.0 84.6 58 59 A V T 3 S+ 0 0 135 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.659 102.0 37.5 -69.3 -20.3 33.8 15.5 88.1 59 60 A D T 3 S+ 0 0 56 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.272 118.8 38.4-121.0 2.6 32.0 18.9 88.6 60 61 A L S < S- 0 0 35 -3,-0.5 -3,-0.4 -25,-0.0 -1,-0.2 -0.894 71.7-130.8-154.0 133.1 28.6 18.3 86.9 61 62 A S > - 0 0 53 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.483 25.2-120.8 -77.8 150.5 26.2 15.4 86.7 62 63 A I H > S+ 0 0 9 -7,-0.5 4,-2.9 1,-0.2 5,-0.2 0.855 114.5 57.3 -56.9 -32.1 24.9 14.3 83.4 63 64 A F H > S+ 0 0 127 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.938 109.4 41.9 -65.9 -47.0 21.4 15.0 84.8 64 65 A S H > S+ 0 0 53 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.895 115.3 52.1 -62.2 -46.2 22.1 18.7 85.7 65 66 A L H >X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 3,-0.6 0.963 110.3 46.7 -56.7 -50.8 23.9 19.0 82.4 66 67 A L H 3X S+ 0 0 14 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.810 111.2 52.7 -65.3 -27.0 21.0 17.7 80.5 67 68 A D H 3< S+ 0 0 90 -4,-1.5 4,-0.3 2,-0.2 -1,-0.2 0.770 107.3 52.0 -79.2 -26.5 18.5 19.9 82.4 68 69 A I H X< S+ 0 0 13 -4,-1.6 3,-0.9 -3,-0.6 4,-0.5 0.847 108.2 51.3 -72.1 -39.6 20.7 22.9 81.6 69 70 A V H >< S+ 0 0 2 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.892 104.7 58.1 -62.3 -38.6 20.5 22.0 77.9 70 71 A K T 3< S+ 0 0 81 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.587 95.4 63.6 -65.7 -19.6 16.7 21.7 78.2 71 72 A E T < S+ 0 0 127 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.664 85.9 94.8 -76.0 -22.9 16.5 25.4 79.3 72 73 A Q S < S- 0 0 30 -3,-1.3 3,-0.1 -4,-0.5 -29,-0.0 -0.363 75.5-136.0 -73.4 153.0 17.8 26.5 75.9 73 74 A T S S+ 0 0 144 1,-0.2 2,-0.5 -2,-0.0 -1,-0.1 0.767 97.2 39.3 -84.1 -25.9 15.4 27.5 73.1 74 75 A K S S- 0 0 93 -5,-0.1 -1,-0.2 0, 0.0 -26,-0.2 -0.987 81.4-162.3-116.8 121.7 17.3 25.6 70.4 75 76 A Q - 0 0 59 -2,-0.5 -29,-0.1 -3,-0.1 3,-0.1 -0.872 7.1-139.3-104.9 136.6 18.6 22.2 71.6 76 77 A P - 0 0 6 0, 0.0 -26,-0.2 0, 0.0 2,-0.2 -0.274 32.1 -90.4 -74.4 166.2 21.3 20.2 69.9 77 78 A S E -c 50 0A 48 -28,-1.8 -26,-2.8 37,-0.1 2,-0.4 -0.542 49.0-143.2 -60.7 144.5 21.5 16.5 69.3 78 79 A V E -cd 51 95A 0 16,-2.9 18,-2.2 -28,-0.2 2,-0.5 -0.980 17.8-168.5-122.3 136.2 23.3 15.0 72.3 79 80 A L E -cd 52 96A 3 -28,-3.1 -26,-2.3 -2,-0.4 2,-0.5 -0.994 13.5-156.7-122.9 120.5 25.8 12.1 72.3 80 81 A I E -cd 53 97A 0 16,-2.3 18,-2.4 -2,-0.5 2,-0.7 -0.911 8.0-145.4-108.7 125.1 26.6 10.9 75.8 81 82 A L E +cd 54 98A 0 -28,-2.6 -26,-2.3 -2,-0.5 2,-0.2 -0.802 34.8 179.2 -90.5 117.8 29.9 9.0 76.3 82 83 A T E - d 0 99A 15 16,-1.9 18,-3.1 -2,-0.7 -28,-0.0 -0.739 36.7-172.9-124.6 162.2 29.2 6.4 79.0 83 84 A T S S+ 0 0 72 -2,-0.2 -1,-0.1 16,-0.2 16,-0.0 0.726 79.9 43.6-110.4 -59.8 30.6 3.6 81.0 84 85 A G 0 0 63 1,-0.2 -2,-0.0 15,-0.0 15,-0.0 0.959 360.0 360.0 -58.5 -78.6 27.9 1.8 83.0 85 86 A R 0 0 103 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.943 360.0 360.0 112.1 360.0 24.7 1.2 80.9 86 ! 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 87 89 A L 0 0 105 0, 0.0 2,-0.1 0, 0.0 10,-0.0 0.000 360.0 360.0 360.0 106.8 20.3 4.9 79.6 88 90 A I - 0 0 43 1,-0.1 2,-0.8 0, 0.0 7,-0.1 -0.277 360.0-124.5 -55.4 119.5 18.7 8.3 80.9 89 91 A E + 0 0 108 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.578 43.4 163.6 -72.5 104.5 14.9 8.5 80.4 90 92 A S - 0 0 49 -2,-0.8 5,-0.1 2,-0.1 0, 0.0 -0.894 37.3-158.1-119.0 152.8 14.1 11.6 78.4 91 93 A S S S+ 0 0 100 -2,-0.3 2,-0.4 2,-0.0 -1,-0.1 0.219 81.8 83.2-113.8 -2.5 10.9 12.8 76.4 92 94 A E S S- 0 0 75 0, 0.0 3,-0.3 0, 0.0 2,-0.2 -0.842 85.7-138.9 -76.4 149.1 12.9 15.1 74.3 93 95 A H S S+ 0 0 182 -2,-0.4 -2,-0.0 1,-0.2 -16,-0.0 -0.217 72.8 95.8-111.4 44.1 14.1 12.7 71.7 94 96 A N + 0 0 31 -2,-0.2 -16,-2.9 -18,-0.1 2,-0.5 0.228 47.1 110.8-126.7 13.5 17.7 13.8 71.2 95 97 A L E +d 78 0A 33 -3,-0.3 2,-0.3 -18,-0.2 -16,-0.2 -0.795 34.5 170.4 -94.3 126.0 19.9 11.6 73.4 96 98 A S E -d 79 0A 44 -18,-2.2 -16,-2.3 -2,-0.5 2,-0.3 -0.902 18.5-144.2-123.7 159.8 22.1 9.1 71.7 97 99 A Y E -d 80 0A 86 -2,-0.3 2,-0.3 -18,-0.2 -16,-0.2 -0.935 16.2-170.0-130.4 149.3 24.8 7.1 73.5 98 100 A L E -d 81 0A 12 -18,-2.4 -16,-1.9 -2,-0.3 2,-0.5 -0.953 23.4-138.8-137.0 116.1 28.4 5.7 72.9 99 101 A Q E -d 82 0A 95 -2,-0.3 -16,-0.2 -18,-0.2 -18,-0.1 -0.646 25.8-111.5 -81.2 119.1 29.9 3.2 75.4 100 102 A K S S+ 0 0 39 -18,-3.1 2,-0.1 -2,-0.5 3,-0.0 -0.630 102.3 55.4 -79.1 145.4 33.6 3.6 76.4 101 103 A P S S+ 0 0 105 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.596 90.4 167.7 -58.6 133.1 35.9 1.6 75.7 102 104 A F - 0 0 46 -2,-0.1 2,-0.2 -4,-0.1 -2,-0.1 -0.923 39.5-112.5-123.3 155.4 34.7 2.2 72.1 103 105 A A >> - 0 0 41 -2,-0.3 4,-1.3 1,-0.1 3,-0.6 -0.536 27.9-124.2 -77.6 146.8 36.1 1.4 68.7 104 106 A I H 3> S+ 0 0 65 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.850 111.1 61.7 -62.4 -34.8 37.2 4.6 66.7 105 107 A S H 3> S+ 0 0 88 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.875 103.1 50.0 -59.0 -36.9 34.9 3.4 63.8 106 108 A E H <> S+ 0 0 97 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.847 108.4 52.2 -67.7 -41.5 31.9 3.7 66.2 107 109 A L H X S+ 0 0 0 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.944 113.4 44.6 -59.1 -45.9 32.8 7.2 67.3 108 110 A R H X S+ 0 0 76 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.816 110.8 51.2 -76.9 -29.9 33.1 8.3 63.7 109 111 A A H X S+ 0 0 35 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.961 111.8 50.6 -64.7 -47.4 29.9 6.7 62.6 110 112 A A H X S+ 0 0 17 -4,-2.3 4,-0.5 2,-0.2 -2,-0.2 0.926 112.3 44.2 -50.7 -56.8 28.1 8.4 65.5 111 113 A I H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.941 114.6 50.0 -61.1 -47.8 29.5 11.8 64.6 112 114 A D H >< S+ 0 0 46 -4,-2.1 3,-1.5 1,-0.3 -1,-0.2 0.852 103.3 59.1 -60.3 -36.8 28.8 11.4 60.9 113 115 A Y H 3< S+ 0 0 192 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.611 103.6 54.2 -72.4 -5.2 25.2 10.3 61.5 114 116 A H T << S+ 0 0 38 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.330 86.7 108.8-105.6 3.9 24.6 13.7 63.3 115 117 A K < - 0 0 82 -3,-1.5 -112,-0.1 -4,-0.2 2,-0.0 -0.519 65.5 -76.2 -70.1 144.5 25.8 15.9 60.3 116 118 A P 0 0 76 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.205 360.0 360.0 -39.3 153.9 23.5 18.0 58.1 117 119 A S 0 0 171 -2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.267 360.0 360.0 -99.1 360.0 21.5 18.2 56.0