==== 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 1NXT . 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 . 116 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6572.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 18.1 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 . 8 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 40.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.6 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 0 137 0, 0.0 25,-2.8 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 149.0 54.7 62.1 -3.3 2 3 A K E -a 26 0A 41 23,-0.2 44,-1.9 42,-0.2 45,-1.4 -0.910 360.0-167.7-106.0 122.4 56.1 63.5 0.0 3 4 A I E -ab 27 47A 0 23,-2.6 25,-2.5 -2,-0.5 2,-0.5 -0.920 8.7-155.4-108.0 131.3 59.5 62.2 1.4 4 5 A L E -ab 28 48A 0 43,-2.0 45,-2.1 -2,-0.4 2,-0.6 -0.950 10.2-158.9-102.2 118.9 60.7 63.0 5.0 5 6 A I E -ab 29 49A 0 23,-2.3 25,-1.7 -2,-0.5 2,-0.7 -0.942 4.0-167.2-103.4 115.1 64.5 62.9 5.2 6 7 A V E +ab 30 50A 0 43,-2.9 45,-2.6 -2,-0.6 2,-0.3 -0.934 31.1 139.6-105.3 104.2 65.7 62.4 8.8 7 8 A D - 0 0 1 23,-2.4 23,-0.1 -2,-0.7 47,-0.1 -0.963 45.2-154.4-153.4 129.1 69.4 63.1 8.8 8 9 A D S S+ 0 0 64 45,-0.4 2,-0.6 -2,-0.3 23,-0.1 0.487 78.3 80.9 -88.8 -1.7 71.6 64.9 11.2 9 10 A E > - 0 0 75 1,-0.1 4,-2.7 2,-0.0 3,-0.4 -0.927 65.9-156.9-105.7 113.4 74.3 65.9 8.7 10 11 A K H > S+ 0 0 113 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.827 91.5 56.4 -59.1 -37.2 73.2 69.0 6.7 11 12 A P H > S+ 0 0 91 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.918 113.0 39.5 -60.4 -42.8 75.5 68.1 3.8 12 13 A I H > S+ 0 0 40 -3,-0.4 4,-2.5 2,-0.2 5,-0.3 0.902 113.5 55.0 -73.4 -41.9 74.0 64.6 3.3 13 14 A S H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.945 108.9 48.9 -54.2 -49.3 70.5 65.9 3.9 14 15 A D H X S+ 0 0 61 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.885 108.6 52.5 -61.2 -36.6 70.9 68.5 1.2 15 16 A I H X S+ 0 0 80 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.955 114.7 41.6 -65.0 -46.9 72.3 65.9 -1.3 16 17 A I H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.926 115.0 51.2 -64.7 -43.9 69.2 63.7 -0.8 17 18 A K H X S+ 0 0 89 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.963 111.4 48.4 -57.2 -51.9 66.8 66.7 -0.8 18 19 A F H X S+ 0 0 120 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.893 114.6 45.2 -55.6 -45.2 68.3 68.0 -4.1 19 20 A N H X S+ 0 0 23 -4,-2.2 4,-1.2 -5,-0.2 -1,-0.2 0.886 113.6 47.3 -71.8 -41.0 68.0 64.6 -5.7 20 21 A M H <>S+ 0 0 0 -4,-2.8 5,-2.4 2,-0.2 4,-0.2 0.866 111.4 52.8 -67.7 -36.2 64.5 63.8 -4.6 21 22 A T H ><5S+ 0 0 78 -4,-2.7 3,-2.0 -5,-0.3 -2,-0.2 0.953 105.9 53.3 -63.6 -42.2 63.3 67.3 -5.6 22 23 A K H 3<5S+ 0 0 139 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.828 106.2 54.5 -58.9 -30.5 64.8 66.8 -9.1 23 24 A E T 3<5S- 0 0 106 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.411 125.3-104.1 -83.6 -2.9 62.7 63.6 -9.3 24 25 A G T < 5S+ 0 0 63 -3,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.613 73.8 138.5 92.2 13.4 59.6 65.5 -8.5 25 26 A Y < - 0 0 31 -5,-2.4 2,-0.5 -6,-0.1 -1,-0.3 -0.647 54.6-123.6 -82.5 146.5 59.1 64.5 -4.8 26 27 A E E -a 2 0A 120 -25,-2.8 -23,-2.6 -2,-0.3 2,-0.4 -0.830 34.0-151.0 -80.0 131.4 58.0 67.0 -2.1 27 28 A V E +a 3 0A 25 -2,-0.5 2,-0.3 -25,-0.2 -23,-0.2 -0.866 22.0 179.0-112.1 129.3 60.7 67.0 0.6 28 29 A V E -a 4 0A 19 -25,-2.5 -23,-2.3 -2,-0.4 2,-0.3 -0.925 20.4-152.6-116.1 148.7 60.4 67.7 4.4 29 30 A T E -a 5 0A 37 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.801 16.1-176.0-122.1 158.0 63.5 67.4 6.5 30 31 A A E -a 6 0A 0 -25,-1.7 -23,-2.4 -2,-0.3 3,-0.1 -0.962 12.4-162.2-154.0 145.2 64.3 66.7 10.1 31 32 A F S S+ 0 0 58 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.1 0.394 72.0 23.6-117.5 2.8 67.7 66.7 11.9 32 33 A N S > S- 0 0 31 22,-0.1 4,-2.1 23,-0.1 5,-0.1 -0.943 85.9 -93.5-157.2 176.9 67.0 64.7 15.0 33 34 A G H > S+ 0 0 15 -2,-0.3 4,-1.9 2,-0.2 5,-0.1 0.833 119.8 51.4 -67.8 -37.0 64.7 62.1 16.4 34 35 A R H > S+ 0 0 178 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.950 111.9 46.3 -67.0 -49.3 62.3 64.5 18.0 35 36 A E H > S+ 0 0 70 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.845 109.3 57.2 -57.2 -38.1 61.9 66.5 14.7 36 37 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.931 108.8 45.1 -60.9 -47.7 61.4 63.2 12.8 37 38 A L H X S+ 0 0 40 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.895 114.6 47.6 -63.9 -36.9 58.5 62.3 15.0 38 39 A E H X S+ 0 0 111 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.911 114.9 45.6 -71.9 -43.0 56.9 65.8 14.8 39 40 A Q H X>S+ 0 0 57 -4,-2.7 4,-3.3 1,-0.2 5,-0.6 0.951 110.2 55.6 -67.2 -45.7 57.3 65.9 11.0 40 41 A F H X5S+ 0 0 22 -4,-2.8 4,-1.6 -5,-0.3 -2,-0.2 0.913 114.0 38.6 -46.5 -51.7 56.0 62.4 10.7 41 42 A E H <5S+ 0 0 143 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.867 123.5 40.0 -73.1 -41.9 52.7 63.2 12.6 42 43 A A H <5S+ 0 0 82 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.800 126.2 31.7 -77.0 -36.2 52.2 66.7 11.1 43 44 A E H <5S- 0 0 60 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.637 83.3-150.1-101.1 -17.9 53.3 66.0 7.5 44 45 A Q << - 0 0 158 -4,-1.6 -42,-0.2 -5,-0.6 -4,-0.1 0.942 23.4-155.4 42.7 63.6 52.2 62.4 7.0 45 46 A P - 0 0 9 0, 0.0 -42,-0.2 0, 0.0 3,-0.1 -0.232 20.5-134.0 -63.8 155.1 54.9 61.6 4.5 46 47 A D S S+ 0 0 59 -44,-1.9 2,-0.3 1,-0.2 -43,-0.2 0.765 90.8 11.1 -76.0 -24.6 54.5 58.7 2.0 47 48 A I E -b 3 0A 0 -45,-1.4 -43,-2.0 24,-0.1 2,-0.4 -0.991 65.1-150.4-153.6 151.9 58.1 57.5 2.8 48 49 A I E -bc 4 73A 0 24,-2.0 26,-2.9 -2,-0.3 2,-0.6 -1.000 3.6-158.1-126.7 127.5 60.8 58.2 5.3 49 50 A I E -bc 5 74A 1 -45,-2.1 -43,-2.9 -2,-0.4 2,-0.5 -0.948 27.0-171.5-100.4 118.4 64.6 58.0 4.7 50 51 A L E -bc 6 75A 0 24,-2.4 26,-1.6 -2,-0.6 -43,-0.2 -0.930 19.4-145.7-125.5 108.1 65.9 57.6 8.2 51 52 A X E - c 0 76A 3 -45,-2.6 26,-0.2 -2,-0.5 3,-0.1 -0.364 17.1-135.1 -64.7 151.8 69.5 57.6 9.3 52 53 A L S S+ 0 0 5 24,-1.2 6,-2.0 1,-0.2 7,-0.7 0.747 89.6 62.1 -79.9 -27.2 70.2 55.2 12.2 53 54 A M + 0 0 97 4,-0.2 -45,-0.4 5,-0.1 -1,-0.2 -0.920 66.7 155.7-113.6 110.9 72.4 57.7 14.2 54 55 A L 0 0 19 -2,-0.6 -22,-0.1 1,-0.1 -23,-0.0 -0.980 360.0 360.0-136.7 142.5 70.6 60.9 15.3 55 56 A P 0 0 122 0, 0.0 -23,-0.1 0, 0.0 -1,-0.1 0.886 360.0 360.0 -50.7 360.0 71.1 63.6 18.1 56 ! 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 57 59 A D > 0 0 97 0, 0.0 4,-2.5 0, 0.0 -4,-0.2 0.000 360.0 360.0 360.0 165.8 68.3 57.1 17.7 58 60 A G H > + 0 0 0 -6,-2.0 4,-2.2 2,-0.2 5,-0.2 0.838 360.0 56.6 -47.9 -39.6 67.0 56.0 14.3 59 61 A L H > S+ 0 0 40 -7,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.950 109.0 45.5 -63.0 -48.7 66.1 52.6 15.8 60 62 A E H > S+ 0 0 78 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.894 111.8 51.8 -58.1 -44.0 64.0 54.3 18.4 61 63 A V H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.929 112.0 46.0 -60.5 -45.1 62.2 56.6 15.9 62 64 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.898 109.9 54.9 -69.2 -42.5 61.3 53.7 13.6 63 65 A K H X S+ 0 0 87 -4,-2.3 4,-0.8 -5,-0.2 -1,-0.2 0.939 112.1 42.6 -49.7 -49.5 60.1 51.6 16.6 64 66 A T H >X S+ 0 0 32 -4,-2.2 3,-0.9 1,-0.2 4,-0.5 0.928 110.5 55.6 -75.9 -36.3 57.7 54.4 17.7 65 67 A I H >X S+ 0 0 1 -4,-2.4 4,-1.9 1,-0.2 3,-1.8 0.916 103.1 56.4 -51.5 -50.0 56.5 55.1 14.1 66 68 A R H 3< S+ 0 0 71 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.630 90.0 74.9 -62.5 -20.7 55.6 51.4 13.7 67 69 A K H << S+ 0 0 158 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.837 119.7 9.9 -53.5 -36.9 53.3 51.7 16.7 68 70 A T H << S+ 0 0 117 -3,-1.8 2,-0.4 -4,-0.5 -2,-0.2 0.633 123.2 50.4-119.3 -16.1 50.8 53.6 14.6 69 71 A S < - 0 0 35 -4,-1.9 -1,-0.2 -5,-0.1 0, 0.0 -0.942 44.6-157.5-141.4 143.7 51.9 53.5 11.0 70 72 A S + 0 0 108 -2,-0.4 3,-0.1 -3,-0.1 -4,-0.1 0.241 47.7 147.2 -96.4 17.2 52.9 51.2 8.1 71 73 A V - 0 0 12 -6,-0.2 -24,-0.1 1,-0.1 -25,-0.1 -0.204 58.7-102.8 -54.8 129.5 54.7 54.1 6.3 72 74 A P - 0 0 8 0, 0.0 -24,-2.0 0, 0.0 2,-0.4 -0.353 37.5-161.2 -57.6 133.4 57.7 52.8 4.4 73 75 A I E -c 48 0A 0 19,-0.3 21,-2.7 -26,-0.2 22,-1.0 -0.987 8.8-165.4-120.2 125.8 61.0 53.4 6.1 74 76 A L E -cd 49 95A 0 -26,-2.9 -24,-2.4 -2,-0.4 2,-0.3 -0.951 17.5-146.7-111.6 110.2 64.4 53.2 4.2 75 77 A M E -cd 50 96A 0 20,-3.1 22,-3.1 -2,-0.6 2,-0.4 -0.591 13.6-168.1 -79.9 135.6 67.2 53.1 6.7 76 78 A L E +cd 51 97A 0 -26,-1.6 -24,-1.2 -2,-0.3 2,-0.3 -0.991 18.8 150.4-124.4 129.3 70.5 54.8 5.7 77 79 A S E - d 0 98A 4 20,-1.8 22,-1.8 -2,-0.4 -26,-0.0 -0.985 54.4-134.3-163.0 145.7 73.8 54.3 7.6 78 80 A A S S+ 0 0 68 -2,-0.3 2,-0.4 20,-0.3 -1,-0.1 0.735 88.0 95.2 -59.9 -31.0 77.5 54.2 7.4 79 81 A K + 0 0 92 1,-0.1 -2,-0.1 -3,-0.1 20,-0.1 -0.563 49.5 171.1 -70.5 125.5 77.2 51.0 9.6 80 82 A D + 0 0 106 -2,-0.4 2,-0.1 18,-0.1 -1,-0.1 0.065 27.4 119.5-129.7 21.0 77.3 48.2 7.2 81 83 A S S > S- 0 0 53 1,-0.1 4,-2.2 4,-0.0 3,-0.3 -0.507 72.8-111.6 -88.0 164.2 77.6 45.0 9.3 82 84 A E H > S+ 0 0 164 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.849 118.2 56.0 -55.6 -45.4 75.1 42.2 9.3 83 85 A F H > S+ 0 0 134 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.868 108.3 48.0 -61.3 -38.4 74.1 43.0 12.8 84 86 A D H > S+ 0 0 21 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.954 115.4 43.1 -66.9 -45.6 73.2 46.7 11.8 85 87 A K H X S+ 0 0 72 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.918 115.0 49.1 -67.8 -45.3 71.2 45.7 8.8 86 88 A V H X S+ 0 0 69 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.907 113.1 45.3 -66.2 -43.7 69.4 42.9 10.5 87 89 A I H X S+ 0 0 45 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.889 112.0 52.4 -73.3 -33.7 68.4 45.0 13.5 88 90 A G H <>S+ 0 0 0 -4,-2.4 5,-2.1 -5,-0.2 4,-0.2 0.978 114.2 43.6 -57.2 -47.9 67.3 47.9 11.4 89 91 A L H ><5S+ 0 0 77 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.903 115.0 48.3 -65.0 -39.5 65.1 45.6 9.3 90 92 A E H 3<5S+ 0 0 150 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.794 106.4 56.9 -73.1 -29.3 63.7 43.8 12.4 91 93 A L T 3<5S- 0 0 58 -4,-2.1 -1,-0.3 -5,-0.2 -25,-0.2 0.392 136.7 -80.5 -82.3 2.9 63.0 47.1 14.2 92 94 A G T < 5S+ 0 0 18 -3,-1.1 -19,-0.3 1,-0.3 -3,-0.2 0.195 80.1 141.8 124.8 -16.7 60.8 48.0 11.2 93 95 A A < - 0 0 8 -5,-2.1 -1,-0.3 -6,-0.2 -19,-0.2 -0.261 38.0-155.5 -50.1 137.3 62.9 49.3 8.3 94 96 A D S S+ 0 0 80 -21,-2.7 2,-0.3 1,-0.3 -20,-0.2 0.620 79.8 5.5 -84.1 -19.8 61.7 48.1 4.9 95 97 A D E -d 74 0A 29 -22,-1.0 -20,-3.1 -7,-0.1 2,-0.4 -0.976 60.4-150.4-165.7 159.3 65.2 48.6 3.5 96 98 A Y E -d 75 0A 20 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.944 15.4-179.6-146.6 111.7 68.7 49.5 4.6 97 99 A V E -d 76 0A 10 -22,-3.1 -20,-1.8 -2,-0.4 2,-0.2 -0.936 20.2-133.3-116.5 142.1 71.1 51.2 2.4 98 100 A T E -d 77 0A 45 -2,-0.4 -20,-0.3 -22,-0.2 -18,-0.1 -0.646 29.4 -83.6-100.1 154.5 74.7 52.1 3.4 99 101 A K S S+ 0 0 36 -22,-1.8 2,-0.1 -2,-0.2 3,-0.0 -0.822 107.4 46.0-102.4 138.4 76.7 55.3 3.0 100 102 A P S S+ 0 0 130 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.447 88.2 177.0 -80.8 150.5 78.2 56.3 0.9 101 103 A F - 0 0 36 -2,-0.1 2,-0.5 -4,-0.1 -2,-0.1 -0.635 34.9-104.5-112.3 169.3 75.4 55.4 -1.5 102 104 A S > - 0 0 58 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 -0.836 23.2-141.3 -92.7 126.2 74.7 55.8 -5.2 103 105 A N H > S+ 0 0 69 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.916 102.6 50.0 -49.8 -50.3 72.2 58.6 -5.9 104 106 A R H > S+ 0 0 199 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.850 110.3 49.7 -62.6 -38.8 70.5 56.5 -8.6 105 107 A E H > S+ 0 0 79 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.895 108.4 52.7 -64.3 -45.2 70.2 53.4 -6.4 106 108 A L H X S+ 0 0 3 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.959 111.7 47.3 -53.4 -50.4 68.7 55.5 -3.6 107 109 A Q H X S+ 0 0 33 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.917 111.5 49.9 -61.1 -42.2 66.1 56.8 -6.1 108 110 A A H X S+ 0 0 57 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.888 112.1 47.7 -64.1 -36.6 65.4 53.3 -7.5 109 111 A R H X S+ 0 0 94 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.889 109.4 52.4 -75.7 -40.3 64.9 51.9 -4.0 110 112 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.964 111.5 47.6 -55.0 -50.7 62.6 54.8 -2.9 111 113 A K H X S+ 0 0 129 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.877 110.2 52.6 -59.8 -36.4 60.4 54.1 -6.0 112 114 A A H X S+ 0 0 33 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.923 108.7 49.8 -70.4 -38.0 60.4 50.4 -5.3 113 115 A L H < S+ 0 0 26 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.944 114.3 44.7 -60.3 -42.9 59.2 51.0 -1.7 114 116 A L H >< S+ 0 0 23 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.883 106.7 58.9 -72.8 -37.7 56.4 53.3 -3.1 115 117 A R H 3< S+ 0 0 188 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.916 109.9 46.6 -53.4 -43.9 55.4 50.9 -5.8 116 118 A R T 3< 0 0 213 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.200 360.0 360.0-103.0 80.2 54.8 48.3 -3.0 117 119 A S < 0 0 103 -3,-1.2 -46,-0.1 -4,-0.1 -71,-0.0 -0.678 360.0 360.0 160.8 360.0 52.8 50.4 -0.6