==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 11-JUN-13 4L5G . COMPND 2 MOLECULE: CARD; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR D.B.SRIVASTAVA,L.F.WESTBLADE,E.A.CAMPBELL,S.A.DARST . 323 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17127.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 40.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.8 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 2 0 0 1 0 0 2 0 1 0 2 0 0 1 1 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 2 1 1 1 2 0 0 1 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 0 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 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 3 A E 0 0 192 0, 0.0 2,-0.4 0, 0.0 48,-0.0 0.000 360.0 360.0 360.0-165.5 3.5 11.9 31.9 2 4 A F - 0 0 28 4,-0.0 3,-0.1 47,-0.0 6,-0.0 -0.941 360.0-146.7-108.0 133.9 5.7 12.5 28.9 3 5 A R > - 0 0 179 -2,-0.4 3,-2.2 1,-0.1 15,-0.3 -0.667 33.9 -84.6 -96.6 154.4 5.5 9.9 26.1 4 6 A P T 3 S+ 0 0 92 0, 0.0 15,-0.2 0, 0.0 -1,-0.1 -0.299 118.7 30.2 -54.7 140.4 8.5 9.0 23.9 5 7 A G T 3 S+ 0 0 50 13,-3.2 2,-0.1 1,-0.3 14,-0.1 0.163 85.5 144.4 91.7 -18.1 8.8 11.4 21.0 6 8 A D < - 0 0 26 -3,-2.2 12,-2.3 12,-0.2 2,-0.4 -0.347 48.8-132.4 -57.2 125.0 7.4 14.2 23.1 7 9 A K E +A 17 0A 58 10,-0.2 53,-2.3 -2,-0.1 2,-0.3 -0.683 39.4 164.8 -80.6 132.8 9.0 17.6 22.3 8 10 A V E -AB 16 59A 0 8,-2.3 8,-2.4 -2,-0.4 2,-0.4 -0.846 30.8-130.6-143.1 171.4 10.0 19.4 25.4 9 11 A V E -AB 15 58A 10 49,-2.5 49,-2.3 -2,-0.3 6,-0.2 -0.988 8.4-170.4-131.7 143.4 12.1 22.2 26.9 10 12 A L > - 0 0 0 4,-1.8 3,-3.5 -2,-0.4 47,-0.2 -0.754 41.8-103.4-132.5 88.3 14.5 22.3 29.8 11 13 A P T 3 S+ 0 0 16 0, 0.0 85,-0.1 0, 0.0 -2,-0.0 -0.267 96.5 3.8 -56.9 134.6 15.6 25.9 30.7 12 14 A P T 3 S+ 0 0 77 0, 0.0 85,-0.0 0, 0.0 86,-0.0 -0.766 118.1 72.2-108.3 41.3 18.2 27.0 29.9 13 15 A Y S < S- 0 0 83 -3,-3.5 28,-0.1 1,-0.3 2,-0.1 0.250 92.7-119.1-103.2 11.9 19.5 24.0 28.0 14 16 A G - 0 0 11 -4,-0.1 -4,-1.8 26,-0.1 -1,-0.3 -0.323 46.6 -30.2 91.9-169.1 17.3 24.3 24.9 15 17 A V E +A 9 0A 24 -6,-0.2 25,-0.5 -2,-0.1 2,-0.3 -0.591 61.8 158.8 -90.8 150.9 14.8 22.1 23.1 16 18 A G E -A 8 0A 0 -8,-2.4 -8,-2.3 -2,-0.2 2,-0.4 -0.868 32.2-112.1-154.4-174.2 14.8 18.3 23.2 17 19 A V E -AC 7 37A 43 20,-2.0 20,-2.8 -2,-0.3 2,-0.6 -0.989 28.7-115.0-134.9 141.1 12.9 15.1 22.7 18 20 A V E - C 0 36A 1 -12,-2.3 -13,-3.2 -2,-0.4 18,-0.2 -0.658 23.6-172.3 -77.2 114.7 11.9 12.4 25.2 19 21 A A E - 0 0 46 16,-2.7 2,-0.3 -2,-0.6 -1,-0.2 0.933 52.3 -87.2 -70.8 -47.9 13.6 9.2 24.3 20 22 A G E - C 0 35A 17 15,-0.8 15,-2.3 -16,-0.1 2,-0.5 -0.982 46.7 -60.2 166.5-165.1 11.7 7.1 26.9 21 23 A I E - C 0 34A 79 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.948 38.1-169.1-115.9 124.2 11.6 5.9 30.5 22 24 A A E - C 0 33A 50 11,-2.4 11,-2.7 -2,-0.5 2,-0.5 -0.931 9.9-149.6-111.8 133.2 14.4 3.8 32.1 23 25 A Q E - C 0 32A 128 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.870 14.7-178.0-103.8 129.4 14.0 2.2 35.5 24 26 A R E - C 0 31A 36 7,-2.3 7,-2.2 -2,-0.5 2,-0.5 -0.969 16.8-141.6-124.6 144.1 16.9 1.6 37.7 25 27 A S E + C 0 30A 81 -2,-0.4 2,-0.5 5,-0.3 5,-0.3 -0.895 18.4 178.5-109.4 125.6 16.9 -0.1 41.1 26 28 A V E > S- C 0 29A 29 3,-2.4 3,-1.3 -2,-0.5 196,-0.1 -0.981 75.4 -15.0-126.3 120.1 19.0 1.2 44.0 27 29 A S T 3 S- 0 0 113 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.904 129.4 -52.6 54.2 41.3 18.8 -0.6 47.3 28 30 A G T 3 S+ 0 0 75 1,-0.2 2,-0.5 -3,-0.0 -1,-0.2 0.430 116.9 101.1 81.3 2.0 15.7 -2.4 46.3 29 31 A V E < -C 26 0A 60 -3,-1.3 -3,-2.4 191,-0.2 2,-0.8 -0.979 63.6-142.6-117.3 129.3 13.6 0.6 45.1 30 32 A S E -C 25 0A 70 -2,-0.5 -5,-0.3 -5,-0.3 2,-0.3 -0.809 14.6-161.7 -97.3 113.0 13.3 1.2 41.4 31 33 A R E -C 24 0A 50 -7,-2.2 -7,-2.3 -2,-0.8 2,-0.5 -0.634 13.3-132.9 -88.3 147.9 13.3 4.8 40.4 32 34 A A E -C 23 0A 13 -2,-0.3 17,-2.7 -9,-0.2 2,-0.4 -0.895 21.7-169.1-107.4 128.3 12.0 5.9 37.0 33 35 A Y E -CD 22 48A 3 -11,-2.7 -11,-2.4 -2,-0.5 2,-0.4 -0.909 16.3-138.6-115.3 140.7 14.0 8.3 34.9 34 36 A Y E -CD 21 47A 4 13,-3.3 13,-2.5 -2,-0.4 2,-0.5 -0.781 16.6-145.7 -84.4 138.8 13.1 10.2 31.7 35 37 A Q E -CD 20 46A 55 -15,-2.3 -16,-2.7 -2,-0.4 -15,-0.8 -0.946 17.0-170.9-103.4 126.4 15.8 10.4 29.1 36 38 A V E -CD 18 45A 0 9,-2.4 9,-1.7 -2,-0.5 2,-0.5 -0.967 8.3-152.5-119.9 128.4 15.8 13.6 27.1 37 39 A D E -CD 17 44A 46 -20,-2.8 -20,-2.0 -2,-0.5 7,-0.2 -0.849 3.9-163.5-103.2 131.7 18.0 14.2 24.1 38 40 A F E >>> - D 0 43A 7 5,-2.9 5,-2.1 -2,-0.5 3,-0.9 -0.891 6.9-178.4-114.5 97.8 19.1 17.6 23.1 39 41 A P T 345S+ 0 0 91 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.805 78.5 65.7 -67.8 -29.8 20.3 17.5 19.4 40 42 A G T 345S+ 0 0 85 -25,-0.5 -24,-0.1 1,-0.2 -26,-0.1 0.783 121.4 19.5 -62.9 -28.7 21.3 21.1 19.4 41 43 A S T <45S- 0 0 46 -3,-0.9 -1,-0.2 2,-0.1 3,-0.1 0.255 102.2-122.9-122.4 7.1 24.0 20.4 22.0 42 44 A R T <5S+ 0 0 170 -4,-0.6 2,-0.2 -3,-0.2 -2,-0.1 0.861 70.6 134.2 49.2 40.2 24.3 16.6 21.4 43 45 A S E < -D 38 0A 19 -5,-2.1 -5,-2.9 166,-0.0 2,-0.3 -0.611 45.5-147.2-114.3 171.5 23.5 16.3 25.1 44 46 A K E -De 37 209A 71 164,-1.8 166,-0.5 -7,-0.2 2,-0.4 -0.948 3.2-162.1-134.9 157.0 21.3 14.2 27.4 45 47 A A E -De 36 210A 1 -9,-1.7 -9,-2.4 -2,-0.3 2,-0.6 -0.983 9.1-152.2-139.2 130.1 19.4 14.8 30.6 46 48 A Y E -De 35 211A 37 164,-2.9 166,-1.1 -2,-0.4 -11,-0.2 -0.915 21.0-174.8-103.0 118.7 18.1 12.1 32.9 47 49 A V E -D 34 0A 0 -13,-2.5 -13,-3.3 -2,-0.6 166,-0.1 -0.956 26.5-120.0-124.3 116.9 15.1 13.4 34.8 48 50 A P E > -D 33 0A 3 0, 0.0 3,-2.6 0, 0.0 -15,-0.3 -0.231 24.8-124.7 -52.0 137.0 13.2 11.5 37.6 49 51 A V T 3 S+ 0 0 43 -17,-2.7 -16,-0.1 1,-0.3 -47,-0.0 0.628 112.9 53.2 -63.9 -12.7 9.6 11.0 36.6 50 52 A E T 3 S+ 0 0 83 -18,-0.3 -1,-0.3 1,-0.1 4,-0.1 0.417 105.5 59.2 -96.1 0.6 8.6 12.7 39.9 51 53 A A X> + 0 0 0 -3,-2.6 4,-1.7 1,-0.1 3,-1.1 0.525 62.0 103.2-112.4 -9.4 10.7 15.7 39.1 52 54 A P H >>>S+ 0 0 13 0, 0.0 4,-1.6 0, 0.0 5,-1.6 0.893 89.6 44.6 -49.3 -52.9 9.7 17.4 35.8 53 55 A H H 345S+ 0 0 125 1,-0.2 -2,-0.1 2,-0.2 137,-0.0 0.790 112.5 53.7 -59.4 -30.4 7.9 20.3 37.4 54 56 A S H <45S+ 0 0 11 -3,-1.1 136,-0.8 1,-0.2 -1,-0.2 0.775 116.1 35.3 -80.3 -26.1 10.7 20.8 40.0 55 57 A V H <<5S- 0 0 6 -4,-1.7 -2,-0.2 -3,-0.7 -1,-0.2 0.524 115.7-105.6-106.6 -9.2 13.5 21.1 37.4 56 58 A G T <5 + 0 0 9 -4,-1.6 2,-0.4 -5,-0.3 -3,-0.2 0.524 60.7 156.0 101.2 7.8 11.6 22.9 34.7 57 59 A L < + 0 0 4 -5,-1.6 -1,-0.3 -6,-0.2 2,-0.3 -0.550 21.4 162.1 -68.5 122.2 11.1 20.2 32.2 58 60 A R E -B 9 0A 51 -49,-2.3 -49,-2.5 -2,-0.4 2,-0.1 -0.899 43.9 -84.9-138.5 164.2 8.0 21.2 30.1 59 61 A K E -B 8 0A 101 -2,-0.3 -51,-0.3 -51,-0.2 2,-0.1 -0.466 48.1-122.1 -65.4 141.2 6.1 20.5 26.9 60 62 A A - 0 0 11 -53,-2.3 -53,-0.1 1,-0.2 -1,-0.1 -0.410 45.8 -68.7 -79.0 162.6 7.5 22.5 24.0 61 63 A L - 0 0 7 -2,-0.1 -1,-0.2 1,-0.1 -54,-0.0 -0.287 49.5-131.2 -51.0 126.6 5.2 24.9 22.0 62 64 A A >> - 0 0 28 1,-0.1 3,-2.8 -3,-0.1 4,-0.7 -0.615 26.8-109.4 -77.5 146.1 2.6 23.0 20.0 63 65 A P G >4 S+ 0 0 63 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.772 117.8 56.2 -49.9 -36.5 2.4 24.1 16.3 64 66 A E G 34 S+ 0 0 140 1,-0.2 4,-0.5 2,-0.2 -3,-0.0 0.630 99.3 61.9 -74.0 -12.9 -1.0 25.8 16.8 65 67 A E G <> S+ 0 0 56 -3,-2.8 4,-2.4 1,-0.2 3,-0.3 0.733 83.9 81.5 -80.4 -23.4 0.5 27.9 19.6 66 68 A V H S+ 0 0 71 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.902 112.6 47.9 -61.7 -40.5 0.5 32.1 15.8 68 70 A V H > S+ 0 0 70 -4,-0.5 4,-1.6 -3,-0.3 -2,-0.2 0.860 109.6 53.2 -71.6 -32.3 -0.7 33.2 19.3 69 71 A I H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.879 111.1 47.1 -64.1 -38.0 2.9 33.5 20.5 70 72 A L H X S+ 0 0 22 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.870 110.6 49.9 -74.4 -39.2 3.7 35.8 17.5 71 73 A D H X S+ 0 0 87 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.815 112.3 50.8 -65.6 -31.0 0.6 37.9 18.0 72 74 A L H X S+ 0 0 45 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.926 107.8 50.3 -70.6 -47.6 1.6 38.2 21.6 73 75 A L H < S+ 0 0 4 -4,-2.4 3,-0.2 1,-0.2 -2,-0.2 0.859 112.2 51.5 -55.4 -34.9 5.2 39.2 20.7 74 76 A K H < S+ 0 0 80 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.935 123.6 24.2 -70.0 -48.9 3.6 41.8 18.5 75 77 A N H < S+ 0 0 106 -4,-2.0 2,-0.4 -5,-0.1 -1,-0.2 0.180 88.3 141.9-103.5 15.1 1.2 43.4 21.0 76 78 A G < + 0 0 2 -4,-1.0 2,-0.3 -3,-0.2 36,-0.2 -0.438 20.4 166.1 -71.6 120.5 3.2 42.5 24.1 77 79 A R + 0 0 128 -2,-0.4 29,-0.1 31,-0.1 30,-0.1 -0.979 4.5 152.6-133.1 145.5 3.2 45.1 26.8 78 80 A X - 0 0 31 -2,-0.3 2,-0.1 28,-0.1 -2,-0.0 -0.929 44.5 -99.4-166.0 145.3 4.2 45.1 30.5 79 81 A P - 0 0 126 0, 0.0 30,-0.0 0, 0.0 -2,-0.0 -0.444 40.5-178.2 -66.8 137.8 5.5 47.5 33.2 80 82 A L - 0 0 22 -2,-0.1 7,-0.1 29,-0.1 6,-0.0 -0.969 34.8 -92.0-133.7 149.7 9.2 47.3 33.8 81 83 A P - 0 0 47 0, 0.0 6,-0.1 0, 0.0 9,-0.0 -0.310 21.7-144.0 -61.6 144.3 11.3 49.2 36.3 82 84 A K S S+ 0 0 199 4,-0.1 2,-0.4 5,-0.1 3,-0.0 0.781 80.6 91.1 -77.0 -29.5 12.9 52.5 35.0 83 85 A Q S > S- 0 0 99 1,-0.1 4,-2.2 2,-0.0 5,-0.2 -0.548 79.9-137.6 -71.0 123.1 16.0 51.7 37.1 84 86 A W H > S+ 0 0 158 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.855 96.9 46.8 -53.1 -44.9 18.4 49.7 35.0 85 87 A A H > S+ 0 0 20 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.914 113.1 46.3 -69.3 -45.8 19.5 47.2 37.6 86 88 A A H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.844 114.4 51.0 -64.0 -33.5 16.0 46.4 38.9 87 89 A R H X S+ 0 0 23 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.918 108.3 49.9 -69.3 -44.5 14.9 46.0 35.3 88 90 A H H X S+ 0 0 56 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.865 108.9 53.7 -63.3 -36.3 17.7 43.7 34.3 89 91 A R H X S+ 0 0 145 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.958 110.3 47.7 -57.2 -50.4 16.9 41.6 37.3 90 92 A K H X S+ 0 0 86 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.893 112.7 46.3 -61.0 -45.1 13.3 41.4 36.1 91 93 A T H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.897 111.9 52.2 -68.2 -39.6 14.2 40.5 32.5 92 94 A S H X S+ 0 0 48 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.891 107.9 51.8 -60.3 -42.1 16.7 37.9 33.7 93 95 A E H X S+ 0 0 114 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.916 111.3 47.0 -62.3 -42.4 14.0 36.3 35.9 94 96 A I H X S+ 0 0 15 -4,-1.9 4,-1.6 2,-0.2 5,-0.5 0.926 114.5 46.1 -65.9 -44.6 11.6 36.0 33.0 95 97 A L H < S+ 0 0 23 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.917 112.7 50.2 -63.5 -45.2 14.2 34.6 30.7 96 98 A A H < S+ 0 0 59 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.874 106.1 55.3 -61.8 -39.0 15.4 32.1 33.3 97 99 A D H < S- 0 0 64 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.873 95.6-157.9 -63.4 -35.8 11.9 31.0 33.9 98 100 A G < + 0 0 7 -4,-1.6 -3,-0.1 1,-0.2 -1,-0.1 0.577 29.4 156.9 74.6 12.8 11.8 30.3 30.2 99 101 A N > - 0 0 51 -5,-0.5 4,-2.4 1,-0.1 -1,-0.2 -0.570 38.3-144.2 -69.8 128.6 8.0 30.4 29.6 100 102 A P H > S+ 0 0 6 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.835 97.7 49.7 -66.1 -33.5 7.4 31.3 25.9 101 103 A Y H > S+ 0 0 72 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.910 113.5 43.9 -71.1 -43.7 4.3 33.4 26.6 102 104 A R H > S+ 0 0 145 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.901 115.5 50.4 -66.5 -38.7 6.0 35.4 29.3 103 105 A I H X S+ 0 0 3 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.901 109.6 49.2 -68.1 -40.8 9.0 35.8 27.1 104 106 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.890 111.3 50.2 -62.3 -41.3 7.0 36.9 24.1 105 107 A Q H X S+ 0 0 69 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.900 113.2 45.6 -67.5 -40.3 5.2 39.5 26.2 106 108 A X H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.897 112.1 50.0 -70.0 -42.4 8.4 40.9 27.6 107 109 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.865 105.6 58.9 -64.2 -36.3 10.2 41.0 24.2 108 110 A G H X S+ 0 0 3 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.926 108.5 45.2 -54.8 -45.5 7.1 42.8 22.8 109 111 A Q H X S+ 0 0 18 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.929 114.6 46.2 -66.0 -47.9 7.7 45.5 25.4 110 112 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.860 112.9 50.7 -64.3 -36.9 11.4 45.8 24.8 111 113 A R H X S+ 0 0 25 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.892 107.3 52.7 -69.6 -41.2 11.0 45.8 21.1 112 114 A A H X S+ 0 0 27 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.914 111.5 47.5 -59.1 -43.2 8.4 48.6 21.2 113 115 A W H X>S+ 0 0 45 -4,-1.9 4,-2.9 2,-0.2 5,-0.7 0.876 109.1 54.7 -64.8 -39.1 10.9 50.6 23.3 114 116 A E H X5S+ 0 0 45 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.942 111.1 42.8 -60.8 -49.9 13.7 49.9 20.8 115 117 A V H <5S+ 0 0 100 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.842 118.4 47.1 -67.3 -32.9 11.8 51.1 17.8 116 118 A E H <5S- 0 0 133 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.917 141.9 -17.3 -75.8 -45.2 10.5 54.2 19.7 117 119 A R H <5S- 0 0 161 -4,-2.9 -3,-0.2 1,-0.2 -2,-0.2 0.235 96.8-104.2-150.5 11.8 13.7 55.4 21.4 118 120 A G << - 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