==== 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 SIGNALING PROTEIN 12-JUL-05 2A9P . COMPND 2 MOLECULE: RESPONSE REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR A.RIBOLDI-TUNNICLIFFE,N.W.ISAACS,T.J.MITCHELL . 117 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6480.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 17.1 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 . 9 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 40.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 0 1 1 1 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 1 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 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 0 151 0, 0.0 25,-2.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 149.3 24.5 31.0 -3.5 2 3 A K E -a 26 0A 38 23,-0.2 44,-2.3 42,-0.1 45,-1.2 -0.910 360.0-163.4-113.4 131.2 22.8 29.6 -0.4 3 4 A I E -ab 27 47A 0 23,-3.1 25,-2.8 -2,-0.5 2,-0.7 -0.936 7.5-155.5-116.3 123.0 19.5 30.7 1.1 4 5 A L E -ab 28 48A 0 43,-2.5 45,-2.9 -2,-0.5 2,-0.5 -0.887 13.3-163.4 -90.3 118.5 18.2 30.0 4.5 5 6 A I E -ab 29 49A 1 23,-2.8 25,-2.3 -2,-0.7 2,-0.6 -0.927 1.8-165.3-106.5 129.0 14.4 30.2 4.6 6 7 A V E +ab 30 50A 2 43,-3.0 45,-2.3 -2,-0.5 2,-0.3 -0.953 29.6 131.0-115.2 111.7 12.9 30.5 8.1 7 8 A D - 0 0 2 23,-2.3 47,-0.1 -2,-0.6 23,-0.1 -0.896 45.9-148.8-161.7 134.2 9.1 29.8 8.4 8 9 A D S S+ 0 0 63 45,-0.4 2,-0.9 -2,-0.3 23,-0.1 0.648 81.6 83.8 -78.2 -17.7 7.1 27.7 10.7 9 10 A E > - 0 0 100 1,-0.2 4,-2.6 2,-0.0 3,-0.5 -0.786 66.0-159.0 -92.8 111.2 4.4 27.0 8.1 10 11 A K H > S+ 0 0 108 -2,-0.9 4,-2.8 1,-0.2 5,-0.2 0.850 88.7 57.4 -56.8 -43.2 5.6 24.1 5.9 11 12 A P H > S+ 0 0 89 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.910 113.2 42.0 -54.2 -40.0 3.2 25.0 2.9 12 13 A I H > S+ 0 0 36 -3,-0.5 4,-2.4 2,-0.2 5,-0.2 0.926 112.8 52.0 -69.8 -50.7 4.9 28.5 2.7 13 14 A S H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.906 110.5 50.4 -49.0 -46.6 8.4 27.2 3.3 14 15 A D H X S+ 0 0 65 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.883 108.3 50.9 -62.3 -43.0 7.8 24.8 0.4 15 16 A I H X S+ 0 0 79 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.925 114.7 43.2 -61.5 -44.6 6.6 27.5 -1.9 16 17 A I H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.914 113.1 51.9 -71.5 -42.1 9.6 29.7 -1.2 17 18 A K H X S+ 0 0 91 -4,-3.0 4,-2.5 -5,-0.2 -1,-0.2 0.889 109.0 51.6 -55.9 -45.6 12.0 26.7 -1.4 18 19 A F H X S+ 0 0 125 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.954 112.2 46.2 -59.0 -49.6 10.5 25.7 -4.8 19 20 A N H X S+ 0 0 20 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.854 113.6 46.5 -63.2 -37.6 11.1 29.3 -6.1 20 21 A M H <>S+ 0 0 0 -4,-2.5 5,-2.1 2,-0.2 3,-0.3 0.869 110.0 54.1 -73.0 -37.7 14.7 29.6 -4.9 21 22 A T H ><5S+ 0 0 77 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.904 103.8 56.5 -60.7 -43.8 15.6 26.2 -6.2 22 23 A K H 3<5S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.798 102.9 55.8 -57.3 -32.1 14.3 27.3 -9.6 23 24 A E T 3<5S- 0 0 72 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.437 122.7-106.2 -78.5 -4.3 16.8 30.3 -9.4 24 25 A G T < 5S+ 0 0 63 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.555 73.4 141.9 89.9 7.8 19.7 27.8 -8.9 25 26 A Y < - 0 0 29 -5,-2.1 2,-0.4 -23,-0.1 -1,-0.3 -0.559 55.2-120.7 -81.8 150.0 20.1 28.6 -5.2 26 27 A E E -a 2 0A 121 -25,-2.7 -23,-3.1 -2,-0.2 2,-0.4 -0.715 34.9-146.8 -80.4 132.3 21.0 26.0 -2.6 27 28 A V E +a 3 0A 30 -2,-0.4 2,-0.4 -25,-0.2 -23,-0.2 -0.926 21.8 179.3-112.3 132.7 18.2 26.0 0.0 28 29 A V E -a 4 0A 15 -25,-2.8 -23,-2.8 -2,-0.4 2,-0.3 -0.946 17.8-153.3-118.0 146.0 18.4 25.3 3.8 29 30 A T E -a 5 0A 31 -2,-0.4 2,-0.3 -25,-0.2 -23,-0.2 -0.907 14.5-175.1-121.8 149.7 15.2 25.5 5.9 30 31 A A E -a 6 0A 0 -25,-2.3 -23,-2.3 -2,-0.3 3,-0.1 -0.994 10.7-161.2-136.4 144.8 14.4 26.2 9.6 31 32 A F S S+ 0 0 59 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.1 0.429 72.9 18.1-113.0 3.5 10.9 25.9 11.2 32 33 A N S > S- 0 0 23 22,-0.1 4,-2.0 -25,-0.1 24,-0.2 -0.942 87.9 -93.2-156.6 178.9 11.3 28.0 14.3 33 34 A G H > S+ 0 0 0 22,-2.2 4,-2.0 24,-0.6 5,-0.2 0.806 122.2 52.5 -70.5 -34.4 13.7 30.8 15.7 34 35 A R H > S+ 0 0 123 21,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.945 111.3 45.6 -63.2 -50.5 15.9 28.2 17.5 35 36 A E H > S+ 0 0 71 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.862 109.2 59.1 -57.1 -36.1 16.4 26.2 14.3 36 37 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.941 108.5 42.4 -62.4 -46.1 17.0 29.5 12.4 37 38 A L H X S+ 0 0 37 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.882 115.0 50.5 -67.8 -39.2 20.0 30.4 14.6 38 39 A E H X S+ 0 0 118 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.919 113.8 44.7 -65.1 -42.6 21.3 26.8 14.5 39 40 A Q H X S+ 0 0 59 -4,-3.1 4,-3.0 2,-0.2 5,-0.5 0.893 110.7 54.8 -67.5 -42.1 21.1 26.7 10.7 40 41 A F H X S+ 0 0 15 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.935 112.2 43.6 -54.7 -45.6 22.6 30.1 10.4 41 42 A E H < S+ 0 0 121 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.902 120.7 39.1 -71.1 -40.2 25.6 29.0 12.5 42 43 A A H < S+ 0 0 78 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.844 126.8 32.1 -75.7 -39.3 26.1 25.6 10.7 43 44 A E H < S- 0 0 62 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.707 80.7-149.9 -97.7 -24.2 25.3 26.7 7.2 44 45 A Q < - 0 0 155 -4,-1.9 -42,-0.1 -5,-0.5 -4,-0.1 0.956 26.8-155.7 48.1 61.1 26.5 30.3 6.9 45 46 A P - 0 0 8 0, 0.0 -42,-0.2 0, 0.0 3,-0.1 -0.219 20.4-131.1 -65.8 158.5 23.9 31.2 4.3 46 47 A D S S+ 0 0 58 -44,-2.3 2,-0.3 1,-0.2 -43,-0.2 0.646 91.2 8.1 -78.4 -20.2 24.5 34.1 1.8 47 48 A I E -b 3 0A 0 -45,-1.2 -43,-2.5 25,-0.1 2,-0.4 -0.973 66.9-143.7-159.7 149.2 21.0 35.4 2.6 48 49 A I E -bc 4 74A 0 25,-2.2 27,-3.1 -2,-0.3 2,-0.6 -0.978 2.1-157.5-120.5 130.6 18.1 34.7 5.1 49 50 A I E -bc 5 75A 2 -45,-2.9 -43,-3.0 -2,-0.4 2,-0.6 -0.939 28.5-161.3-102.5 121.0 14.4 35.0 4.3 50 51 A L E -bc 6 76A 0 25,-2.9 27,-2.3 -2,-0.6 -43,-0.1 -0.894 18.9-160.5-125.5 109.2 12.9 35.5 7.7 51 52 A D - 0 0 5 -45,-2.3 27,-0.2 -2,-0.6 3,-0.1 -0.385 12.4-151.6 -69.1 158.8 9.3 34.9 8.9 52 53 A L S S+ 0 0 14 25,-0.2 7,-2.3 1,-0.2 2,-1.3 0.819 77.3 67.8-109.4 -45.1 8.5 36.8 12.2 53 54 A M S S+ 0 0 119 5,-0.2 -45,-0.4 6,-0.1 -1,-0.2 -0.662 74.0 147.0 -80.5 98.3 5.7 34.8 14.0 54 55 A L - 0 0 20 -2,-1.3 -22,-0.1 -3,-0.1 -23,-0.0 -0.942 49.8-105.3-131.1 147.4 7.8 31.7 14.9 55 56 A P S S+ 0 0 62 0, 0.0 2,-2.5 0, 0.0 -22,-2.2 -0.303 95.1 8.0 -63.9 158.4 7.9 29.2 17.8 56 57 A E S S+ 0 0 123 -24,-0.2 2,-0.4 -23,-0.1 -24,-0.0 -0.324 136.8 19.8 75.8 -61.4 10.7 29.3 20.4 57 58 A I S S- 0 0 54 -2,-2.5 -24,-0.6 3,-0.0 -21,-0.1 -0.992 85.1-128.8-137.9 125.3 12.3 32.6 19.3 58 59 A D > - 0 0 72 -2,-0.4 4,-2.3 1,-0.1 3,-0.2 -0.376 27.4-106.6 -76.2 165.1 10.5 35.1 17.2 59 60 A G H > S+ 0 0 0 -7,-2.3 4,-2.7 1,-0.2 5,-0.2 0.753 116.7 56.5 -63.6 -31.4 12.0 36.5 14.0 60 61 A L H > S+ 0 0 43 -8,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.945 110.7 45.5 -65.5 -43.3 12.8 40.0 15.4 61 62 A E H > S+ 0 0 88 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.904 112.0 52.3 -63.5 -41.0 14.8 38.3 18.1 62 63 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.944 112.1 45.9 -58.3 -49.3 16.5 36.0 15.5 63 64 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.925 112.7 50.3 -60.2 -47.1 17.4 39.1 13.4 64 65 A K H X S+ 0 0 88 -4,-2.6 4,-0.8 2,-0.2 -1,-0.2 0.917 113.4 45.4 -59.5 -43.9 18.7 41.0 16.4 65 66 A T H >< S+ 0 0 46 -4,-2.7 3,-1.1 2,-0.2 4,-0.5 0.945 111.3 51.2 -73.4 -36.3 20.8 38.1 17.6 66 67 A I H >X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.3 3,-2.1 0.927 105.0 59.1 -58.8 -44.1 22.3 37.4 14.1 67 68 A R H 3< S+ 0 0 62 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.706 88.7 72.8 -61.2 -22.2 23.2 41.1 13.8 68 69 A K T << S+ 0 0 143 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.774 121.1 9.9 -57.8 -29.6 25.4 40.8 17.0 69 70 A T T <4 S+ 0 0 110 -3,-2.1 2,-0.3 -4,-0.5 -2,-0.2 0.609 123.3 48.0-125.3 -18.3 27.9 38.8 14.8 70 71 A S < - 0 0 32 -4,-2.5 -1,-0.2 -5,-0.1 0, 0.0 -0.968 44.5-157.9-136.8 145.8 27.0 39.0 11.1 71 72 A S + 0 0 108 -2,-0.3 3,-0.1 -3,-0.1 -4,-0.1 0.096 45.5 149.9-100.8 19.8 26.0 41.4 8.4 72 73 A V - 0 0 12 -6,-0.1 -25,-0.1 1,-0.1 -26,-0.1 -0.267 59.1 -99.2 -49.3 133.0 24.4 38.6 6.3 73 74 A P - 0 0 34 0, 0.0 -25,-2.2 0, 0.0 2,-0.5 -0.334 41.3-161.9 -57.6 137.4 21.5 40.1 4.3 74 75 A I E -c 48 0A 0 19,-0.3 21,-2.8 -27,-0.2 22,-1.2 -0.989 11.2-170.0-127.4 125.6 18.1 39.5 5.9 75 76 A L E -cd 49 96A 0 -27,-3.1 -25,-2.9 -2,-0.5 2,-0.3 -0.955 17.1-148.1-110.7 109.1 14.9 39.8 4.0 76 77 A M E -cd 50 97A 0 20,-2.6 22,-3.1 -2,-0.6 2,-0.4 -0.620 14.2-173.2 -79.0 145.7 11.9 39.6 6.4 77 78 A L E + d 0 98A 1 -27,-2.3 2,-0.3 -2,-0.3 -25,-0.2 -0.918 23.3 143.7-142.0 105.6 8.8 38.0 5.0 78 79 A S E - d 0 99A 1 20,-2.0 22,-2.0 -2,-0.4 -27,-0.1 -0.967 61.6-128.7-148.0 153.0 5.7 38.2 7.2 79 80 A A S S+ 0 0 62 -2,-0.3 2,-0.7 20,-0.3 -1,-0.1 0.706 88.1 100.8 -69.3 -22.5 2.0 38.6 7.4 80 81 A K + 0 0 90 1,-0.1 -2,-0.2 5,-0.1 -28,-0.0 -0.563 46.9 161.7 -65.2 107.2 2.8 41.4 10.0 81 82 A D + 0 0 103 -2,-0.7 -1,-0.1 4,-0.1 18,-0.1 0.196 19.1 121.9-123.6 16.9 2.4 44.4 7.7 82 83 A S S > S- 0 0 48 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.336 72.7-110.9 -79.6 161.6 1.9 47.6 9.9 83 84 A E H > S+ 0 0 163 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.930 121.8 51.2 -52.6 -48.6 4.2 50.7 9.8 84 85 A F H > S+ 0 0 137 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.913 108.7 50.7 -56.2 -48.1 5.4 49.7 13.2 85 86 A D H > S+ 0 0 31 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.920 114.6 42.4 -57.1 -50.4 6.3 46.1 12.1 86 87 A K H X S+ 0 0 77 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.927 115.0 50.4 -64.1 -48.6 8.2 47.2 9.0 87 88 A V H X S+ 0 0 63 -4,-2.7 4,-2.8 -5,-0.2 -2,-0.2 0.949 114.4 41.9 -58.9 -50.1 10.1 50.1 10.8 88 89 A I H X S+ 0 0 28 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.908 112.2 55.8 -71.9 -33.6 11.2 48.0 13.7 89 90 A G H X>S+ 0 0 0 -4,-2.3 5,-2.0 -5,-0.3 4,-0.5 0.948 114.4 39.8 -53.7 -54.2 12.1 45.0 11.4 90 91 A L H ><5S+ 0 0 83 -4,-2.8 3,-1.0 3,-0.2 -2,-0.2 0.890 114.4 53.1 -65.2 -41.7 14.4 47.3 9.4 91 92 A E H 3<5S+ 0 0 145 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.902 104.2 55.7 -60.9 -40.0 15.7 49.1 12.5 92 93 A L H 3<5S- 0 0 58 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.618 135.8 -81.3 -67.7 -14.7 16.7 45.9 14.1 93 94 A G T <<5S+ 0 0 17 -3,-1.0 -19,-0.3 -4,-0.5 -3,-0.2 0.386 78.8 142.0 134.8 -3.7 18.8 45.1 11.0 94 95 A A < - 0 0 8 -5,-2.0 -1,-0.3 -6,-0.2 -19,-0.2 -0.382 38.5-153.2 -67.0 144.7 16.7 43.7 8.2 95 96 A D S S+ 0 0 84 -21,-2.8 2,-0.3 1,-0.2 -20,-0.2 0.658 77.8 4.9 -90.0 -20.9 17.7 44.9 4.7 96 97 A D E -d 75 0A 29 -22,-1.2 -20,-2.6 -7,-0.1 2,-0.3 -0.955 60.6-152.5-157.0 164.9 14.2 44.4 3.3 97 98 A Y E -d 76 0A 18 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.926 13.0-176.7-150.5 117.5 10.8 43.5 4.5 98 99 A V E -d 77 0A 10 -22,-3.1 -20,-2.0 -2,-0.3 2,-0.3 -0.910 19.1-133.1-119.2 140.8 8.1 41.9 2.2 99 100 A T E -d 78 0A 38 -2,-0.4 -20,-0.3 -22,-0.2 -18,-0.1 -0.666 28.1 -87.4-100.5 155.5 4.6 41.2 3.3 100 101 A K S S+ 0 0 32 -22,-2.0 2,-0.1 -2,-0.3 3,-0.0 -0.809 106.2 52.0 -96.3 139.7 2.5 38.0 2.9 101 102 A P S S+ 0 0 132 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.570 90.4 177.5 -72.7 148.2 0.7 37.2 0.6 102 103 A F - 0 0 45 -2,-0.1 2,-0.5 -4,-0.1 -2,-0.1 -0.856 34.9-110.4-125.5 155.6 3.6 37.9 -1.7 103 104 A S > - 0 0 58 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.750 19.4-146.7 -79.7 129.0 4.6 37.6 -5.4 104 105 A N H > S+ 0 0 60 -2,-0.5 4,-2.3 1,-0.2 -1,-0.1 0.899 100.0 50.5 -59.3 -45.5 7.1 34.8 -6.1 105 106 A R H > S+ 0 0 177 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 110.5 48.3 -62.1 -43.5 8.6 36.9 -8.9 106 107 A E H > S+ 0 0 82 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.929 109.4 53.1 -63.2 -44.1 9.0 39.9 -6.7 107 108 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.951 110.1 48.5 -53.4 -49.3 10.6 37.8 -3.9 108 109 A Q H X S+ 0 0 17 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.902 111.7 49.1 -55.9 -45.4 13.1 36.4 -6.5 109 110 A A H X S+ 0 0 47 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.885 111.3 49.7 -64.4 -38.2 13.9 40.0 -7.7 110 111 A R H X S+ 0 0 88 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.895 109.3 51.0 -69.7 -36.1 14.4 41.2 -4.1 111 112 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.943 112.3 47.6 -64.7 -45.6 16.7 38.3 -3.3 112 113 A K H X S+ 0 0 103 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.934 111.0 51.3 -60.9 -44.7 18.7 39.2 -6.4 113 114 A A H X S+ 0 0 32 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.891 111.7 46.4 -60.4 -42.2 18.8 42.9 -5.5 114 115 A L H < S+ 0 0 27 -4,-2.5 3,-0.3 2,-0.2 -1,-0.2 0.961 112.8 49.6 -62.6 -49.1 20.1 42.2 -1.9 115 116 A L H < S+ 0 0 53 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.853 109.2 53.8 -56.9 -37.2 22.7 39.7 -3.2 116 117 A R H < 0 0 193 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.881 360.0 360.0 -62.4 -44.1 23.8 42.4 -5.8 117 118 A R < 0 0 258 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.551 360.0 360.0 -97.9 360.0 24.3 45.0 -3.1