==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 19-APR-07 2YW2 . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINE--GLYCINE LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR S.BABA,M.KANAGAWA,S.KURAMITSU,S.YOKOYAMA,G.KAWAI,G.SAMPEI,RI . 846 2 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36034.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 609 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 168 19.9 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 70 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 206 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.4 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 3 3 2 0 2 6 6 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 0 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 PARALLEL BRIDGES PER LADDER . 10 4 0 10 4 0 2 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 2 2 4 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 58 0, 0.0 25,-2.4 0, 0.0 26,-1.5 0.000 360.0 360.0 360.0 160.1 3.2 26.2 -0.4 2 2 A K E -a 27 0A 39 60,-0.3 62,-1.6 24,-0.2 63,-1.5 -0.837 360.0-170.0 -97.6 127.4 5.9 23.7 -1.3 3 3 A V E -ab 28 65A 0 24,-2.5 26,-2.9 -2,-0.5 2,-0.4 -0.956 5.2-160.6-120.6 136.4 4.9 20.0 -1.1 4 4 A L E -ab 29 66A 0 61,-2.5 63,-2.7 -2,-0.4 2,-0.5 -0.959 1.2-161.9-118.5 131.6 7.2 17.0 -1.4 5 5 A V E -ab 30 67A 0 24,-2.5 26,-2.3 -2,-0.4 2,-0.6 -0.954 11.6-149.5-111.5 127.9 6.1 13.5 -2.1 6 6 A V E +ab 31 68A 0 61,-2.5 63,-2.4 -2,-0.5 2,-0.2 -0.870 54.0 56.6-101.9 122.2 8.6 10.7 -1.3 7 7 A G E -a 32 0A 0 24,-2.8 26,-1.2 -2,-0.6 -2,-0.1 -0.671 61.8-127.1 142.0 163.7 8.5 7.6 -3.4 8 8 A N S S+ 0 0 66 -2,-0.2 24,-0.1 24,-0.2 29,-0.1 0.336 70.9 79.9-126.3 8.0 8.8 6.3 -7.0 9 9 A G S > S- 0 0 16 355,-0.1 4,-1.5 25,-0.1 353,-0.1 -0.168 91.0 -78.7-108.1-162.4 5.7 4.2 -7.7 10 10 A G H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.835 122.8 57.2 -65.4 -36.6 2.1 4.2 -8.6 11 11 A R H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 108.8 47.6 -61.1 -42.1 0.9 5.0 -5.1 12 12 A E H > S+ 0 0 2 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.823 108.5 53.3 -70.6 -31.9 3.1 8.1 -5.3 13 13 A H H X S+ 0 0 13 -4,-1.5 4,-2.9 349,-0.4 -1,-0.2 0.930 110.4 48.7 -67.7 -40.7 1.7 9.1 -8.7 14 14 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.908 113.0 47.7 -62.2 -42.2 -1.8 8.8 -7.2 15 15 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.956 115.2 43.6 -62.6 -52.0 -0.7 11.0 -4.2 16 16 A A H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.888 111.5 55.4 -60.7 -41.4 1.0 13.6 -6.4 17 17 A W H < S+ 0 0 56 -4,-2.9 4,-0.3 -5,-0.2 -1,-0.2 0.888 111.9 43.0 -58.7 -43.0 -2.0 13.6 -8.8 18 18 A K H >< S+ 0 0 17 -4,-2.0 3,-1.5 -5,-0.2 4,-0.3 0.926 113.6 50.7 -70.9 -45.7 -4.4 14.3 -6.0 19 19 A V H >< S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.3 6,-0.4 0.872 102.9 61.0 -59.7 -38.3 -2.2 16.9 -4.4 20 20 A A T 3< S+ 0 0 44 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.631 94.0 65.0 -66.0 -13.1 -1.8 18.7 -7.7 21 21 A Q T < S+ 0 0 104 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.607 83.9 97.9 -84.1 -11.5 -5.6 19.2 -7.8 22 22 A S X - 0 0 7 -3,-1.8 3,-0.5 -4,-0.3 -3,-0.0 -0.595 69.0-145.8 -83.5 135.9 -5.3 21.5 -4.7 23 23 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.557 94.4 70.8 -73.2 -6.8 -5.2 25.3 -5.1 24 24 A L T 3 S+ 0 0 72 -5,-0.1 2,-0.3 2,-0.0 -4,-0.1 0.877 78.6 82.1 -78.5 -39.9 -2.9 25.4 -2.1 25 25 A V < + 0 0 27 -3,-0.5 -23,-0.2 -6,-0.4 3,-0.1 -0.506 41.3 167.8 -74.9 131.4 0.2 23.9 -3.7 26 26 A K S S+ 0 0 122 -25,-2.4 2,-0.4 1,-0.3 -24,-0.2 0.623 74.9 27.5-111.0 -25.9 2.4 26.2 -5.7 27 27 A E E -a 2 0A 50 -26,-1.5 -24,-2.5 2,-0.0 2,-0.5 -0.964 69.0-166.1-141.8 120.3 5.5 24.0 -6.1 28 28 A L E -a 3 0A 12 -2,-0.4 14,-3.1 -26,-0.2 2,-0.3 -0.923 7.7-175.0-113.0 133.1 5.3 20.2 -6.1 29 29 A Y E -ac 4 42A 14 -26,-2.9 -24,-2.5 -2,-0.5 2,-0.4 -0.905 8.1-166.9-124.3 151.5 8.3 17.9 -5.7 30 30 A V E -ac 5 43A 0 12,-2.5 14,-2.7 -2,-0.3 2,-0.5 -0.979 20.2-130.4-138.4 135.6 8.8 14.2 -5.9 31 31 A A E S-ac 6 44A 0 -26,-2.3 -24,-2.8 -2,-0.4 2,-0.2 -0.934 87.1 -30.9-123.8 102.2 11.9 12.3 -4.7 32 32 A K E S+a 7 0A 67 12,-0.6 -1,-0.2 -2,-0.5 -24,-0.2 -0.924 90.7 158.1 -97.6 -40.7 12.6 10.5 -7.0 33 33 A G - 0 0 8 -26,-1.2 2,-0.3 -2,-0.2 -25,-0.0 -0.177 37.1 -97.4 95.0-147.3 9.3 9.6 -8.7 34 34 A N > - 0 0 2 -25,-0.1 4,-2.2 330,-0.1 332,-0.2 -0.915 39.9 -75.1-156.2 179.8 8.9 8.4 -12.3 35 35 A A T 4 S+ 0 0 7 330,-1.6 4,-0.3 -2,-0.3 331,-0.1 0.860 126.4 49.7 -52.3 -42.5 8.1 9.5 -15.8 36 36 A G T >4 S+ 0 0 0 1,-0.2 3,-1.1 2,-0.2 4,-0.2 0.914 111.9 46.1 -66.0 -43.7 4.4 9.9 -15.1 37 37 A I G >> S+ 0 0 0 1,-0.2 3,-2.0 2,-0.2 4,-1.4 0.821 100.1 69.1 -69.9 -29.5 4.9 11.9 -11.9 38 38 A W G 3< S+ 0 0 73 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.577 85.7 70.0 -67.2 -6.7 7.4 14.2 -13.6 39 39 A E G <4 S+ 0 0 117 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.703 118.1 19.3 -80.8 -18.2 4.6 15.6 -15.8 40 40 A I T <4 S+ 0 0 71 -3,-2.0 2,-0.3 -4,-0.2 -2,-0.2 0.410 123.9 51.7-129.4 -1.6 3.2 17.3 -12.7 41 41 A A S < S- 0 0 11 -4,-1.4 2,-0.3 -14,-0.1 -12,-0.2 -0.987 79.0-108.7-141.6 150.1 6.1 17.4 -10.2 42 42 A K E -c 29 0A 108 -14,-3.1 -12,-2.5 -2,-0.3 2,-0.4 -0.602 40.0-119.3 -77.7 131.2 9.7 18.5 -10.0 43 43 A R E -c 30 0A 122 -2,-0.3 2,-0.6 -14,-0.2 -12,-0.2 -0.554 22.3-163.0 -76.1 126.5 12.2 15.6 -9.9 44 44 A V E -c 31 0A 10 -14,-2.7 2,-2.6 -2,-0.4 -12,-0.6 -0.942 15.2-142.9-111.2 111.6 14.4 15.5 -6.8 45 45 A D + 0 0 91 -2,-0.6 2,-0.4 -14,-0.1 -14,-0.1 -0.322 63.0 110.4 -75.2 62.2 17.4 13.2 -7.4 46 46 A I S S- 0 0 15 -2,-2.6 -2,-0.1 8,-0.0 5,-0.0 -0.987 70.6-117.9-137.8 123.7 17.5 11.7 -3.9 47 47 A S > - 0 0 46 -2,-0.4 3,-2.0 1,-0.1 7,-0.2 -0.300 23.7-122.1 -60.1 141.0 16.6 8.0 -3.2 48 48 A P T 3 S+ 0 0 10 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.776 112.3 54.1 -55.6 -26.5 13.6 7.7 -0.8 49 49 A T T 3 S+ 0 0 60 1,-0.2 2,-1.8 2,-0.1 3,-0.2 0.497 80.6 88.4 -88.9 -3.7 15.8 5.7 1.6 50 50 A D <> + 0 0 56 -3,-2.0 4,-2.1 1,-0.2 5,-0.2 -0.517 59.0 167.1 -89.5 65.9 18.5 8.3 1.8 51 51 A V H > + 0 0 18 -2,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.802 65.8 49.9 -54.6 -39.7 16.5 9.8 4.7 52 52 A E H > S+ 0 0 109 -3,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.923 112.8 47.8 -68.2 -41.8 19.1 12.2 6.1 53 53 A K H > S+ 0 0 100 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.858 111.0 51.1 -66.6 -36.3 19.7 13.6 2.6 54 54 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.904 110.1 49.5 -66.4 -42.9 16.0 14.0 1.9 55 55 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.911 110.8 50.1 -62.6 -42.0 15.5 15.9 5.3 56 56 A E H X S+ 0 0 81 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.896 111.4 49.3 -64.2 -39.1 18.4 18.2 4.4 57 57 A F H X S+ 0 0 40 -4,-2.0 4,-3.4 2,-0.2 5,-0.3 0.959 110.2 49.2 -62.9 -53.3 16.9 18.9 1.0 58 58 A A H X>S+ 0 0 0 -4,-2.7 5,-2.7 1,-0.2 4,-1.0 0.885 113.4 48.4 -53.7 -41.8 13.5 19.7 2.4 59 59 A K H <5S+ 0 0 106 -4,-2.2 3,-0.3 3,-0.2 -1,-0.2 0.960 116.2 40.7 -65.0 -52.8 15.1 22.0 5.0 60 60 A N H <5S+ 0 0 141 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.863 118.7 46.8 -65.0 -37.1 17.3 23.9 2.5 61 61 A E H <5S- 0 0 61 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.637 110.3-124.1 -79.9 -15.2 14.5 24.0 -0.2 62 62 A G T <5 - 0 0 36 -4,-1.0 -60,-0.3 -3,-0.3 2,-0.2 0.873 35.3-171.6 74.8 37.8 12.0 25.1 2.4 63 63 A V < - 0 0 8 -5,-2.7 25,-0.3 -6,-0.2 -1,-0.2 -0.469 11.0-161.9 -65.9 128.3 9.5 22.3 1.9 64 64 A D S S+ 0 0 75 -62,-1.6 2,-0.3 1,-0.3 24,-0.3 0.784 71.0 12.9 -83.0 -31.0 6.3 23.1 3.8 65 65 A F E -b 3 0A 0 -63,-1.5 -61,-2.5 22,-0.1 2,-0.4 -0.980 62.4-163.4-151.7 135.2 4.8 19.6 3.9 66 66 A T E -bd 4 89A 2 22,-1.3 24,-3.3 -2,-0.3 2,-0.5 -0.969 1.9-163.9-123.6 136.1 6.1 16.2 3.0 67 67 A I E -bd 5 90A 0 -63,-2.7 -61,-2.5 -2,-0.4 2,-0.5 -0.980 13.6-146.0-120.6 122.3 4.0 13.0 2.4 68 68 A V E -b 6 0A 3 22,-1.6 -61,-0.1 -2,-0.5 -63,-0.1 -0.770 16.3-179.4 -95.0 127.5 5.8 9.6 2.5 69 69 A G + 0 0 1 -63,-2.4 219,-0.3 -2,-0.5 -62,-0.2 0.969 56.6 53.0 -86.4 -63.2 4.7 6.9 0.2 70 70 A P S > S- 0 0 22 0, 0.0 4,-0.7 0, 0.0 219,-0.1 -0.284 71.3-126.6 -80.1 161.4 6.8 3.7 0.8 71 71 A E H > S+ 0 0 50 1,-0.2 4,-2.8 2,-0.2 3,-0.3 0.851 95.4 69.3 -73.1 -39.4 7.6 1.7 3.9 72 72 A A H > S+ 0 0 27 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.908 100.1 47.0 -49.3 -54.1 11.4 1.6 3.8 73 73 A P H 4>S+ 0 0 1 0, 0.0 5,-2.5 0, 0.0 4,-0.3 0.869 114.4 49.1 -58.0 -36.9 11.9 5.3 4.5 74 74 A L H ><5S+ 0 0 1 -4,-0.7 3,-1.6 -3,-0.3 23,-0.2 0.941 110.2 47.7 -69.0 -48.0 9.4 5.2 7.4 75 75 A V H 3<5S+ 0 0 34 -4,-2.8 -1,-0.2 1,-0.3 -3,-0.2 0.821 110.7 55.8 -62.4 -27.8 10.9 2.1 9.0 76 76 A E T 3<5S- 0 0 86 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.523 122.2-106.0 -82.6 -7.0 14.3 3.9 8.7 77 77 A G T <>5 + 0 0 2 -3,-1.6 4,-1.9 -4,-0.3 -3,-0.2 0.813 63.4 152.7 89.5 32.5 13.1 6.9 10.6 78 78 A I H > S+ 0 0 3 13,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.921 106.5 49.1 -62.8 -44.8 10.0 11.2 10.0 80 80 A D H > S+ 0 0 59 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.873 109.4 53.2 -61.5 -39.1 12.4 11.6 12.9 81 81 A E H X S+ 0 0 49 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.860 112.5 44.7 -63.6 -37.0 15.0 13.0 10.5 82 82 A F H ><>S+ 0 0 0 -4,-1.9 5,-2.7 2,-0.2 3,-0.7 0.872 111.6 51.0 -75.2 -40.1 12.4 15.6 9.4 83 83 A E H ><5S+ 0 0 87 -4,-2.8 3,-1.8 1,-0.2 -2,-0.2 0.847 101.6 63.9 -64.9 -33.6 11.3 16.4 12.9 84 84 A K H 3<5S+ 0 0 141 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.787 107.9 41.5 -60.3 -28.3 14.9 16.9 13.9 85 85 A R T <<5S- 0 0 49 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.158 122.3-104.9-105.9 16.3 15.0 19.8 11.5 86 86 A G T < 5S+ 0 0 69 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.820 70.6 148.0 65.5 35.3 11.6 21.2 12.4 87 87 A L < - 0 0 22 -5,-2.7 2,-0.5 -8,-0.2 -1,-0.2 -0.750 48.7-123.8-105.0 148.9 9.8 20.0 9.3 88 88 A K + 0 0 104 -25,-0.3 -22,-1.3 -2,-0.3 2,-0.4 -0.779 38.6 165.8 -90.5 124.5 6.2 18.8 8.9 89 89 A I E -d 66 0A 3 -2,-0.5 2,-0.7 -24,-0.2 -22,-0.2 -0.999 32.8-133.3-141.9 137.6 5.9 15.3 7.4 90 90 A F E +d 67 0A 1 -24,-3.3 -22,-1.6 -2,-0.4 176,-0.1 -0.821 67.5 71.0 -95.7 113.9 3.0 12.9 7.3 91 91 A G S S- 0 0 5 -2,-0.7 175,-0.1 174,-0.5 -2,-0.1 -0.780 83.9 -70.1 157.7 160.9 3.9 9.4 8.4 92 92 A P - 0 0 1 0, 0.0 -13,-0.4 0, 0.0 -12,-0.2 -0.421 46.1-115.0 -76.9 148.8 4.8 7.5 11.6 93 93 A N > - 0 0 25 170,-0.4 4,-2.0 -14,-0.2 -16,-0.1 -0.234 43.3 -89.4 -71.9 173.0 8.1 8.0 13.4 94 94 A K T 4 S+ 0 0 114 1,-0.2 4,-0.3 2,-0.2 7,-0.1 0.800 125.6 51.1 -55.7 -36.6 10.6 5.1 13.6 95 95 A E T >4 S+ 0 0 75 1,-0.2 3,-1.3 2,-0.2 -1,-0.2 0.949 113.4 43.7 -68.2 -47.5 9.1 3.7 16.8 96 96 A A T >4 S+ 0 0 1 167,-0.3 3,-1.5 1,-0.3 -2,-0.2 0.778 103.1 66.7 -68.3 -27.1 5.5 3.6 15.5 97 97 A A T >X S+ 0 0 1 -4,-2.0 4,-3.0 1,-0.3 3,-1.9 0.629 78.3 84.7 -70.0 -11.7 6.7 2.3 12.1 98 98 A K H <> + 0 0 81 -3,-1.3 4,-2.3 -4,-0.3 8,-0.4 0.732 69.3 78.0 -62.3 -21.6 7.7 -0.9 13.9 99 99 A L H <4 S+ 0 0 2 -3,-1.5 185,-0.6 1,-0.2 -1,-0.3 0.811 115.9 18.6 -58.1 -26.7 4.0 -2.1 13.6 100 100 A E H <4 S+ 0 0 13 -3,-1.9 -2,-0.2 -4,-0.2 -1,-0.2 0.740 121.3 63.7-106.8 -39.9 5.1 -2.8 10.0 101 101 A G H < S+ 0 0 13 -4,-3.0 2,-0.4 1,-0.2 46,-0.3 0.725 109.8 34.6 -58.2 -30.1 8.9 -2.9 10.4 102 102 A S X - 0 0 24 -4,-2.3 4,-2.9 -5,-0.2 44,-0.2 -0.924 58.0-166.3-134.3 110.6 8.9 -5.9 12.8 103 103 A K H > S+ 0 0 39 42,-2.4 4,-3.3 -2,-0.4 5,-0.3 0.891 96.7 54.5 -57.4 -40.8 6.4 -8.8 12.5 104 104 A A H > S+ 0 0 13 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.913 109.4 46.9 -60.0 -43.7 7.5 -10.0 15.9 105 105 A F H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.957 114.9 46.9 -62.3 -49.8 6.7 -6.5 17.3 106 106 A A H X S+ 0 0 4 -4,-2.9 4,-2.6 -8,-0.4 -2,-0.2 0.906 114.1 45.5 -60.0 -45.5 3.3 -6.4 15.5 107 107 A K H X S+ 0 0 2 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.918 114.0 48.2 -66.7 -43.4 2.3 -9.9 16.5 108 108 A T H X S+ 0 0 76 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.904 112.9 50.3 -62.3 -40.9 3.3 -9.4 20.2 109 109 A F H X S+ 0 0 9 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.934 110.4 48.3 -61.5 -49.2 1.4 -6.1 20.2 110 110 A M H <>S+ 0 0 1 -4,-2.6 5,-2.6 1,-0.2 4,-0.4 0.870 111.5 50.2 -62.2 -37.8 -1.7 -7.6 18.7 111 111 A K H ><5S+ 0 0 153 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.948 110.6 50.1 -65.5 -46.1 -1.7 -10.5 21.3 112 112 A K H 3<5S+ 0 0 130 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.849 118.3 37.6 -60.5 -36.9 -1.3 -8.1 24.1 113 113 A Y T 3<5S- 0 0 41 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.257 112.3-110.7-103.5 13.8 -4.1 -5.8 23.0 114 114 A G T < 5 + 0 0 41 -3,-1.1 -3,-0.2 -4,-0.4 -4,-0.1 0.792 55.9 162.9 66.0 32.6 -6.5 -8.5 21.8 115 115 A I < - 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