==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 09-SEP-07 2R7M . COMPND 2 MOLECULE: 5-FORMAMINOIMIDAZOLE-4-CARBOXAMIDE-1-(BETA)-D- . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR Y.ZHANG,R.H.WHITE,S.E.EALICK . 355 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17339.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 256 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 34 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 2 1 1 1 1 2 0 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 2 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 . 1 1 0 2 0 1 2 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 1 2 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 1 A M 0 0 162 0, 0.0 105,-0.2 0, 0.0 104,-0.0 0.000 360.0 360.0 360.0 -41.0 35.8 22.9 19.3 2 2 A I - 0 0 11 103,-1.3 2,-0.1 1,-0.1 105,-0.1 -0.145 360.0-137.8 -44.8 123.1 34.7 21.2 16.0 3 3 A S > - 0 0 49 1,-0.1 4,-0.6 103,-0.1 -1,-0.1 -0.411 11.6-130.6 -85.9 160.7 33.7 23.9 13.5 4 4 A K H >> S+ 0 0 84 2,-0.2 4,-2.8 1,-0.2 3,-0.8 0.915 113.3 48.6 -72.6 -45.3 30.8 23.9 11.2 5 5 A D H 3> S+ 0 0 105 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.847 106.7 58.2 -61.0 -34.9 33.0 24.9 8.2 6 6 A E H 34 S+ 0 0 88 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.788 112.4 40.2 -63.7 -29.1 35.3 22.1 9.3 7 7 A I H 4 S+ 0 0 39 -3,-0.4 3,-0.6 -4,-0.2 -2,-0.2 0.866 112.3 47.4 -76.4 -42.0 34.5 17.1 5.1 11 11 A F H >< S+ 0 0 6 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.695 102.2 64.5 -71.3 -23.5 31.1 16.6 3.6 12 12 A D T 3< S+ 0 0 106 -4,-0.9 -1,-0.2 1,-0.3 4,-0.2 0.767 97.2 55.1 -73.3 -25.9 32.2 18.5 0.4 13 13 A K T < S+ 0 0 187 -3,-0.6 -1,-0.3 -4,-0.4 2,-0.2 0.430 91.1 108.8 -82.7 -0.4 34.7 15.8 -0.3 14 14 A Y S < S- 0 0 11 -3,-0.9 2,-1.1 1,-0.1 5,-0.1 -0.558 83.0-115.3 -76.5 137.9 31.8 13.4 -0.1 15 15 A N > - 0 0 61 -2,-0.2 3,-2.4 1,-0.2 -1,-0.1 -0.662 27.1-157.2 -66.7 99.2 30.4 11.7 -3.2 16 16 A K T 3 S+ 0 0 91 -2,-1.1 3,-0.3 1,-0.3 -1,-0.2 0.509 87.0 62.3 -64.4 -5.0 27.0 13.4 -3.2 17 17 A D T 3 S+ 0 0 151 1,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.560 107.2 42.7 -92.2 -12.9 25.5 10.5 -5.3 18 18 A E S < S+ 0 0 117 -3,-2.4 2,-0.3 2,-0.0 -1,-0.2 -0.132 72.0 160.1-129.6 36.8 26.3 7.9 -2.6 19 19 A I - 0 0 14 -3,-0.3 23,-0.5 -5,-0.1 2,-0.2 -0.453 19.3-168.5 -65.8 122.3 25.3 9.5 0.7 20 20 A T E -a 87 0A 13 66,-1.5 68,-2.6 65,-0.3 2,-0.5 -0.704 18.9-127.7-106.1 163.6 24.7 6.8 3.3 21 21 A I E -ab 88 43A 1 21,-1.8 23,-2.7 -2,-0.2 2,-0.3 -0.961 30.1-173.1-111.7 125.7 23.2 7.0 6.8 22 22 A A E +ab 89 44A 0 66,-3.0 68,-2.7 -2,-0.5 2,-0.3 -0.844 12.3 152.6-116.5 156.2 25.3 5.6 9.6 23 23 A T E - b 0 45A 0 21,-1.8 23,-2.7 -2,-0.3 2,-0.3 -0.971 46.4 -85.2-166.2 168.5 24.7 4.9 13.3 24 24 A L E - b 0 46A 0 66,-0.4 2,-2.2 -2,-0.3 4,-0.3 -0.642 46.6-111.4 -81.1 137.9 25.7 2.7 16.2 25 25 A G S S+ 0 0 1 21,-3.8 2,-0.3 -2,-0.3 23,-0.1 -0.456 86.9 58.3 -73.0 80.5 23.8 -0.6 16.5 26 26 A S S > S+ 0 0 14 -2,-2.2 2,-2.1 21,-0.1 3,-1.1 -0.960 80.4 34.9 179.9 176.2 21.9 0.2 19.7 27 27 A H T 3 S- 0 0 55 -2,-0.3 288,-0.1 1,-0.3 -2,-0.1 -0.352 131.2 -12.7 68.6 -77.5 19.4 2.5 21.4 28 28 A T T >> S+ 0 0 1 -2,-2.1 4,-1.4 -4,-0.3 3,-0.5 0.035 97.8 118.1-142.6 22.9 17.1 3.4 18.5 29 29 A S H <> + 0 0 1 -3,-1.1 4,-2.7 1,-0.2 5,-0.3 0.732 60.4 71.7 -77.5 -23.0 19.1 2.2 15.5 30 30 A L H 3> S+ 0 0 39 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.890 110.9 30.5 -57.8 -42.8 16.6 -0.4 14.2 31 31 A H H <> S+ 0 0 1 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.717 115.7 59.8 -91.5 -23.8 14.2 2.3 13.0 32 32 A I H X S+ 0 0 3 -4,-1.4 4,-1.3 2,-0.2 -2,-0.2 0.925 116.3 35.2 -59.2 -46.3 16.9 4.8 12.2 33 33 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.876 120.1 47.8 -79.8 -40.7 18.3 2.2 9.8 34 34 A K H X S+ 0 0 103 -4,-1.7 4,-2.3 -5,-0.3 -3,-0.2 0.939 111.8 51.3 -60.2 -47.9 14.9 0.9 8.7 35 35 A G H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.857 109.2 51.5 -58.5 -38.0 13.7 4.4 8.1 36 36 A A H ><>S+ 0 0 0 -4,-1.3 5,-2.0 2,-0.2 3,-0.9 0.943 108.5 49.1 -63.1 -51.2 16.8 5.1 6.0 37 37 A K H ><5S+ 0 0 78 -4,-2.2 3,-1.8 1,-0.3 -2,-0.2 0.917 108.4 55.1 -53.5 -45.7 16.3 2.1 3.8 38 38 A L H 3<5S+ 0 0 94 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.740 107.0 51.1 -60.8 -26.5 12.7 3.1 3.3 39 39 A E T <<5S- 0 0 17 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.399 127.9 -97.2 -93.9 0.9 13.8 6.6 2.1 40 40 A G T < 5S+ 0 0 67 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.1 0.293 78.2 135.5 105.6 -7.5 16.3 5.0 -0.4 41 41 A F < - 0 0 20 -5,-2.0 2,-0.4 -6,-0.2 -1,-0.3 -0.350 54.1-129.5 -74.7 149.6 19.5 5.2 1.6 42 42 A S - 0 0 57 -23,-0.5 -21,-1.8 -2,-0.1 2,-0.3 -0.798 37.2-138.5 -86.0 143.2 22.2 2.5 1.9 43 43 A T E -b 21 0A 1 -2,-0.4 20,-2.2 -23,-0.2 19,-1.1 -0.843 15.9-156.0-119.3 144.2 22.9 2.1 5.7 44 44 A V E -bc 22 63A 2 -23,-2.7 -21,-1.8 -2,-0.3 2,-0.6 -0.960 10.0-165.6-117.7 126.0 25.9 1.6 7.9 45 45 A C E -bc 23 64A 0 18,-2.7 20,-2.1 -2,-0.5 2,-0.7 -0.932 12.6-149.1-113.6 116.3 25.7 -0.0 11.3 46 46 A I E +bc 24 65A 1 -23,-2.7 -21,-3.8 -2,-0.6 2,-0.2 -0.737 42.8 147.3 -76.1 117.5 28.5 0.2 13.8 47 47 A T E - c 0 66A 0 18,-1.5 20,-2.4 -2,-0.7 2,-0.3 -0.737 33.6-143.1-138.4-175.2 28.3 -3.1 15.7 48 48 A M > - 0 0 34 18,-0.2 3,-1.9 -2,-0.2 4,-0.2 -0.975 38.8 -74.3-151.4 163.8 30.3 -5.8 17.5 49 49 A K T 3 S+ 0 0 177 18,-0.4 18,-0.0 -2,-0.3 0, 0.0 -0.321 118.7 22.0 -60.2 141.9 30.4 -9.5 18.0 50 50 A G T 3 S+ 0 0 79 1,-0.1 -1,-0.3 -3,-0.0 0, 0.0 0.241 123.3 59.2 84.2 -12.6 27.7 -10.8 20.4 51 51 A R S < S+ 0 0 92 -3,-1.9 4,-0.2 2,-0.1 -2,-0.2 0.173 83.8 77.5-129.0 14.2 25.7 -7.6 19.7 52 52 A D >> + 0 0 14 -4,-0.2 4,-1.3 1,-0.1 3,-0.5 0.601 65.0 88.7-106.6 -15.2 25.1 -7.8 16.0 53 53 A V H 3> S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.839 83.0 56.0 -54.8 -44.8 22.4 -10.4 15.6 54 54 A P H 3> S+ 0 0 52 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.889 111.2 45.5 -59.2 -37.9 19.4 -8.1 15.9 55 55 A Y H <4>S+ 0 0 22 -3,-0.5 5,-1.3 -4,-0.2 6,-0.8 0.729 114.1 48.9 -77.5 -24.0 20.7 -6.0 13.0 56 56 A K H <5S+ 0 0 92 -4,-1.3 3,-0.3 -3,-0.2 -1,-0.2 0.854 114.6 43.2 -80.8 -38.2 21.5 -9.1 10.9 57 57 A R H <5S+ 0 0 193 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.1 0.749 112.4 51.6 -84.2 -22.4 18.1 -10.8 11.4 58 58 A F T <5S- 0 0 139 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.550 100.7-139.2 -88.5 -6.4 16.1 -7.6 10.9 59 59 A K T 5 + 0 0 164 -3,-0.3 -3,-0.2 -4,-0.2 -4,-0.1 0.829 59.8 132.6 58.1 42.6 18.0 -7.1 7.6 60 60 A V < + 0 0 6 -5,-1.3 2,-0.4 -6,-0.1 -23,-0.2 0.546 48.8 65.3-108.4 -9.9 18.3 -3.4 8.3 61 61 A A - 0 0 14 -6,-0.8 -17,-0.1 1,-0.1 3,-0.1 -0.952 49.0-172.0-122.1 132.9 22.0 -2.7 7.6 62 62 A D S S+ 0 0 74 -19,-1.1 2,-0.4 -2,-0.4 -18,-0.2 0.835 80.4 29.8 -88.0 -37.5 23.8 -3.0 4.3 63 63 A K E -c 44 0A 95 -20,-2.2 -18,-2.7 2,-0.0 2,-0.4 -0.987 69.7-154.1-127.3 133.1 27.3 -2.5 5.6 64 64 A F E -c 45 0A 48 -2,-0.4 2,-0.6 -20,-0.2 -18,-0.2 -0.886 5.2-164.0-102.9 134.9 28.7 -3.4 9.1 65 65 A I E -c 46 0A 2 -20,-2.1 -18,-1.5 -2,-0.4 2,-0.4 -0.924 20.2-155.5-109.5 99.3 31.7 -1.7 10.7 66 66 A Y E -c 47 0A 94 -2,-0.6 2,-0.3 -20,-0.2 -18,-0.2 -0.632 11.1-171.5 -75.7 125.8 32.7 -4.1 13.5 67 67 A V - 0 0 13 -20,-2.4 -18,-0.4 -2,-0.4 3,-0.2 -0.742 32.2-124.0-106.8 164.0 34.6 -2.6 16.5 68 68 A D S S- 0 0 136 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.919 98.9 -5.5 -70.9 -45.1 36.3 -4.5 19.3 69 69 A N S > S- 0 0 99 -21,-0.1 3,-2.8 -3,-0.1 -1,-0.4 -0.968 78.4-109.4-142.9 152.5 34.2 -2.6 21.8 70 70 A F G > S+ 0 0 1 -2,-0.3 3,-1.2 1,-0.3 4,-0.1 0.664 113.8 74.5 -59.2 -13.6 31.7 0.2 21.2 71 71 A S G > S+ 0 0 56 1,-0.2 3,-1.0 2,-0.1 -1,-0.3 0.776 81.9 69.2 -68.7 -23.7 34.3 2.4 22.9 72 72 A D G X S+ 0 0 32 -3,-2.8 3,-2.0 1,-0.2 6,-0.4 0.595 70.7 92.3 -69.3 -10.9 36.5 2.2 19.7 73 73 A I G < S+ 0 0 0 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.551 80.9 58.3 -68.0 -5.3 34.0 4.3 17.8 74 74 A K G < S+ 0 0 67 -3,-1.0 -1,-0.3 24,-0.2 -2,-0.2 0.718 82.0 114.2 -85.9 -26.1 36.0 7.4 18.7 75 75 A N S X> S- 0 0 59 -3,-2.0 4,-1.7 -4,-0.2 3,-1.1 -0.136 74.9-129.0 -52.6 135.7 39.1 5.9 17.1 76 76 A E H 3> S+ 0 0 111 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.705 106.5 66.1 -61.8 -19.5 40.3 7.8 14.1 77 77 A E H 3> S+ 0 0 114 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.907 103.7 43.1 -66.1 -42.6 40.2 4.5 12.1 78 78 A I H <> S+ 0 0 5 -3,-1.1 4,-1.9 -6,-0.4 -2,-0.2 0.855 108.6 58.3 -74.6 -35.9 36.4 4.2 12.4 79 79 A Q H X S+ 0 0 5 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.849 106.7 51.3 -56.3 -35.6 36.0 7.9 11.6 80 80 A E H X S+ 0 0 70 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.929 106.4 50.1 -71.6 -49.0 37.9 7.1 8.3 81 81 A K H X S+ 0 0 75 -4,-1.7 4,-0.7 1,-0.2 -1,-0.2 0.872 112.2 51.0 -53.0 -39.6 35.7 4.1 7.2 82 82 A L H <>S+ 0 0 0 -4,-1.9 5,-2.2 1,-0.2 3,-0.3 0.863 110.4 47.0 -69.2 -39.1 32.7 6.4 7.8 83 83 A R H ><5S+ 0 0 32 -4,-1.7 3,-1.0 1,-0.2 -2,-0.2 0.846 109.9 53.5 -69.8 -34.5 34.1 9.2 5.7 84 84 A E H 3<5S+ 0 0 138 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.646 107.6 52.1 -75.9 -14.4 35.0 6.8 2.9 85 85 A L T 3<5S- 0 0 47 -4,-0.7 -65,-0.3 -3,-0.3 -1,-0.3 0.399 110.6-122.8 -98.8 -0.7 31.4 5.5 2.9 86 86 A N T < 5 + 0 0 17 -3,-1.0 -66,-1.5 1,-0.2 2,-0.3 0.805 52.0 172.3 61.7 33.0 30.0 9.0 2.6 87 87 A S E < -a 20 0A 0 -5,-2.2 2,-0.5 -68,-0.2 -66,-0.2 -0.538 33.3-154.6 -80.4 131.7 28.0 8.5 5.8 88 88 A I E -a 21 0A 0 -68,-2.6 -66,-3.0 -2,-0.3 2,-0.4 -0.928 28.2-135.5 -91.7 126.9 26.0 11.1 7.7 89 89 A V E -ad 22 112A 1 22,-2.8 24,-2.7 -2,-0.5 -66,-0.2 -0.712 7.6-148.8 -87.4 132.9 26.0 9.8 11.3 90 90 A V - 0 0 2 -68,-2.7 -66,-0.4 -2,-0.4 2,-0.1 -0.908 21.8-141.4-100.8 113.5 22.7 9.9 13.2 91 91 A P + 0 0 7 0, 0.0 219,-0.6 0, 0.0 2,-0.3 -0.404 27.5 164.2 -78.1 151.4 23.4 10.4 16.9 92 92 A H B >> -e 310 0B 0 217,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.966 51.3 -80.6-155.5 170.1 21.6 8.8 19.8 93 93 A G H 3> S+ 0 0 16 217,-0.6 4,-1.6 -2,-0.3 5,-0.1 0.828 124.6 42.6 -39.5 -54.1 21.9 8.1 23.5 94 94 A S H 3> S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.834 111.0 55.0 -67.5 -36.7 24.2 5.0 23.2 95 95 A F H <> S+ 0 0 0 -3,-0.6 4,-2.0 1,-0.2 5,-0.3 0.915 108.3 48.3 -65.0 -44.4 26.4 6.6 20.6 96 96 A I H X S+ 0 0 15 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.899 113.7 47.8 -63.9 -40.5 27.2 9.6 22.7 97 97 A A H < S+ 0 0 79 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.944 115.8 41.2 -66.3 -50.6 27.9 7.5 25.8 98 98 A Y H < S+ 0 0 85 -4,-2.5 -24,-0.2 1,-0.2 -1,-0.2 0.796 122.2 41.8 -70.4 -29.0 30.3 5.0 24.1 99 99 A C H < S- 0 0 2 -4,-2.0 4,-0.2 -5,-0.3 -1,-0.2 0.763 113.6-122.1 -86.4 -27.5 32.0 7.7 22.0 100 100 A G X - 0 0 26 -4,-1.9 4,-2.2 -5,-0.3 -3,-0.2 0.529 11.8-110.5 83.6 127.9 32.1 10.1 24.9 101 101 A L H > S+ 0 0 29 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.668 117.1 52.6 -67.4 -20.4 30.6 13.5 24.7 102 102 A D H > S+ 0 0 95 2,-0.2 4,-1.3 1,-0.1 5,-0.3 0.901 109.9 48.1 -77.9 -44.6 33.9 15.4 24.6 103 103 A N H >>S+ 0 0 49 -4,-0.2 4,-2.0 1,-0.2 5,-1.0 0.865 111.4 52.8 -57.4 -38.5 35.1 13.2 21.8 104 104 A V H <5S+ 0 0 0 -4,-2.2 4,-0.4 3,-0.2 -1,-0.2 0.924 108.9 48.9 -61.9 -44.3 31.8 13.9 20.1 105 105 A E H <5S- 0 0 4 -4,-1.4 -103,-1.3 1,-0.2 -1,-0.2 0.677 136.6 -3.2 -76.9 -21.0 32.2 17.7 20.4 106 106 A N H <5S+ 0 0 72 -4,-1.3 -3,-0.2 -105,-0.2 -2,-0.2 0.384 129.6 50.2-153.6 5.0 35.8 18.1 19.1 107 107 A S T <5S+ 0 0 47 -4,-2.0 2,-0.8 -5,-0.3 -3,-0.2 0.411 85.9 84.9-126.4 -3.7 37.3 14.7 18.2 108 108 A F < - 0 0 1 -5,-1.0 2,-1.5 -4,-0.4 -1,-0.1 -0.764 53.5-176.2-108.3 89.8 34.7 13.1 16.0 109 109 A L + 0 0 48 -2,-0.8 -1,-0.1 -3,-0.1 -5,-0.1 -0.322 44.2 107.4 -89.2 53.9 35.2 14.4 12.5 110 110 A V S S- 0 0 0 -2,-1.5 246,-0.1 246,-0.1 -22,-0.1 -0.988 79.3 -99.6-125.4 136.7 32.3 12.7 10.7 111 111 A P - 0 0 0 0, 0.0 -22,-2.8 0, 0.0 2,-0.4 -0.260 44.3-161.7 -53.4 144.0 29.2 14.7 9.6 112 112 A M B -d 89 0A 1 244,-1.3 244,-1.5 -24,-0.2 2,-0.3 -0.995 20.1-119.4-140.6 130.3 26.3 14.3 12.0 113 113 A F B S+F 355 0C 4 -24,-2.7 242,-0.2 -2,-0.4 2,-0.1 -0.552 80.3 20.7 -68.9 130.4 22.6 14.9 11.8 114 114 A G S S- 0 0 9 240,-2.6 2,-0.9 -2,-0.3 -2,-0.2 -0.403 106.8 -44.5 105.7 176.1 21.5 17.6 14.2 115 115 A N > - 0 0 11 171,-0.3 3,-0.7 193,-0.2 4,-0.3 -0.775 48.3-163.0 -86.7 103.4 23.0 20.5 16.2 116 116 A R G > S+ 0 0 1 -2,-0.9 3,-1.3 1,-0.2 4,-0.2 0.848 84.1 56.4 -55.0 -43.6 26.2 19.0 17.7 117 117 A R G > S+ 0 0 85 1,-0.2 3,-1.6 2,-0.1 4,-0.4 0.854 98.1 62.1 -59.4 -37.7 26.7 21.8 20.3 118 118 A I G < S+ 0 0 2 -3,-0.7 4,-0.5 1,-0.3 -1,-0.2 0.520 80.3 80.9 -76.2 -4.8 23.3 21.2 21.9 119 119 A L G <> S+ 0 0 6 -3,-1.3 4,-0.6 -4,-0.3 3,-0.4 0.729 88.6 58.5 -70.8 -20.3 24.1 17.6 22.9 120 120 A R H <> S+ 0 0 64 -3,-1.6 4,-1.4 -4,-0.2 3,-0.4 0.828 95.8 62.6 -73.2 -33.6 25.9 19.2 25.9 121 121 A W H 4 S+ 0 0 37 -4,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.640 104.3 46.3 -69.9 -15.5 22.7 20.9 27.0 122 122 A E H 4 S+ 0 0 20 -4,-0.5 -1,-0.2 -3,-0.4 184,-0.2 0.657 108.5 57.5 -94.7 -20.1 20.9 17.6 27.6 123 123 A S H < S+ 0 0 62 -4,-0.6 2,-0.5 -3,-0.4 -2,-0.2 0.806 99.1 63.2 -80.0 -32.2 23.9 16.1 29.4 124 124 A E X - 0 0 76 -4,-1.4 4,-3.1 1,-0.1 5,-0.2 -0.870 69.1-150.5-105.1 123.0 24.1 18.8 32.2 125 125 A R H > S+ 0 0 77 -2,-0.5 4,-2.2 1,-0.2 5,-0.1 0.752 99.0 53.8 -60.2 -28.1 21.2 19.2 34.6 126 126 A S H > S+ 0 0 90 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.915 112.8 41.1 -73.5 -45.9 22.0 22.9 34.9 127 127 A L H > S+ 0 0 33 2,-0.2 4,-3.2 -7,-0.2 -2,-0.2 0.943 117.2 49.6 -63.5 -49.6 22.0 23.6 31.2 128 128 A E H X S+ 0 0 9 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.934 115.3 42.8 -54.0 -51.7 18.9 21.4 30.8 129 129 A G H X S+ 0 0 25 -4,-2.2 4,-2.4 -5,-0.2 5,-0.3 0.867 112.6 54.1 -64.4 -39.3 17.1 23.2 33.6 130 130 A K H X S+ 0 0 79 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.972 111.8 44.8 -54.9 -56.4 18.3 26.6 32.4 131 131 A L H X S+ 0 0 1 -4,-3.2 4,-2.6 1,-0.2 -2,-0.2 0.918 115.6 44.9 -55.1 -51.7 16.8 25.9 28.9 132 132 A L H <>S+ 0 0 7 -4,-2.5 5,-2.9 2,-0.2 4,-0.4 0.879 116.8 46.4 -65.4 -38.0 13.5 24.5 30.2 133 133 A R H ><5S+ 0 0 157 -4,-2.4 3,-0.7 -5,-0.2 -2,-0.2 0.924 116.4 43.9 -68.0 -46.5 13.1 27.3 32.7 134 134 A E H 3<5S+ 0 0 61 -4,-3.2 -2,-0.2 -5,-0.3 -1,-0.2 0.795 107.5 58.9 -71.8 -28.8 14.0 30.0 30.2 135 135 A A T 3<5S- 0 0 9 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.644 119.9-112.3 -71.1 -15.0 11.8 28.4 27.5 136 136 A G T < 5 + 0 0 44 -3,-0.7 2,-0.3 -4,-0.4 -3,-0.2 0.762 64.2 151.0 90.8 29.5 9.0 28.9 29.9 137 137 A L < - 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