==== 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 TRANSFERASE 07-JUN-07 2Q7X . COMPND 2 MOLECULE: UPF0052 PROTEIN SP_1565; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 621 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28077.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 404 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 40 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 172 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.4 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 0 5 4 2 5 1 3 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 6 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 PARALLEL BRIDGES PER LADDER . 6 0 3 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 0 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 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 X 0 0 157 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.6 29.2 1.4 39.7 2 2 A R - 0 0 101 1,-0.1 3,-0.1 3,-0.0 315,-0.1 -0.269 360.0 -89.5 -69.9 161.2 27.6 3.9 37.2 3 3 A X - 0 0 89 1,-0.1 24,-0.2 24,-0.0 -1,-0.1 -0.449 47.7-103.7 -67.5 140.3 27.0 7.6 38.0 4 4 A P - 0 0 26 0, 0.0 24,-2.4 0, 0.0 2,-0.5 -0.368 32.3-132.9 -62.2 147.5 23.7 8.4 39.5 5 5 A X E -a 28 0A 85 22,-0.2 174,-2.6 172,-0.1 175,-1.6 -0.934 23.0-175.0-107.4 126.1 21.1 10.0 37.1 6 6 A I E -ab 29 180A 0 22,-2.7 24,-2.1 -2,-0.5 2,-0.5 -0.980 8.1-163.3-125.8 125.2 19.2 13.2 38.2 7 7 A T E -ab 30 181A 2 173,-2.1 175,-2.5 -2,-0.4 2,-0.5 -0.955 7.7-155.0-111.2 125.7 16.5 14.9 36.2 8 8 A V E -ab 31 182A 1 22,-2.8 24,-2.6 -2,-0.5 2,-0.5 -0.846 9.3-162.9-100.7 129.6 15.5 18.4 37.2 9 9 A I E +ab 32 183A 0 173,-2.9 175,-2.4 -2,-0.5 2,-0.4 -0.975 66.5 16.1-118.4 120.9 11.9 19.5 36.3 10 10 A G - 0 0 0 22,-2.2 24,-0.3 -2,-0.5 173,-0.1 -0.695 69.5-155.0 128.6 -63.6 10.9 23.1 36.1 11 11 A G + 0 0 2 -2,-0.4 47,-0.3 173,-0.1 46,-0.2 0.797 39.4 143.7 48.3 48.0 14.1 24.9 36.0 12 12 A G > - 0 0 1 173,-0.9 3,-1.7 1,-0.2 2,-0.2 0.252 58.3 -28.3 -89.6-152.6 12.9 28.2 37.5 13 13 A T T 3 S+ 0 0 88 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.488 131.7 24.6 -69.2 131.7 14.6 30.7 39.8 14 14 A G T 3> S+ 0 0 13 -2,-0.2 4,-1.3 -3,-0.1 -1,-0.2 0.107 93.8 100.7 96.6 -17.0 17.1 29.0 42.0 15 15 A S H <> S+ 0 0 0 -3,-1.7 4,-3.3 170,-0.3 5,-0.2 0.831 70.2 64.3 -70.9 -33.0 17.7 26.1 39.7 16 16 A P H > S+ 0 0 41 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.892 104.0 45.8 -58.6 -39.6 21.0 27.4 38.2 17 17 A V H > S+ 0 0 40 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.903 114.3 49.3 -70.5 -35.6 22.8 27.2 41.6 18 18 A I H X S+ 0 0 0 -4,-1.3 4,-2.9 2,-0.2 5,-0.2 0.967 112.0 48.1 -61.0 -51.9 21.4 23.7 42.1 19 19 A L H X S+ 0 0 0 -4,-3.3 4,-2.1 2,-0.2 -2,-0.2 0.886 111.0 51.6 -56.0 -42.2 22.5 22.7 38.6 20 20 A X H X S+ 0 0 61 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.936 112.5 45.4 -57.8 -49.7 26.0 24.2 39.3 21 21 A S H X S+ 0 0 4 -4,-2.6 4,-0.5 1,-0.2 3,-0.4 0.903 111.0 52.9 -64.0 -39.4 26.4 22.2 42.5 22 22 A L H >< S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 5,-0.4 0.880 104.3 56.9 -63.2 -35.3 25.1 19.1 40.8 23 23 A R H 3< S+ 0 0 83 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.819 100.3 57.5 -66.1 -31.3 27.7 19.5 38.1 24 24 A E H 3< S+ 0 0 125 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.621 100.6 74.2 -71.3 -14.6 30.5 19.5 40.7 25 25 A X S << S- 0 0 83 -3,-1.1 2,-1.4 -4,-0.5 -3,-0.0 -0.449 101.9-100.7 -92.8 172.7 29.2 16.1 41.8 26 26 A D S S+ 0 0 125 -2,-0.1 2,-0.3 2,-0.0 -3,-0.1 -0.513 79.3 118.0 -95.2 71.6 29.8 12.9 39.9 27 27 A V - 0 0 14 -2,-1.4 2,-0.3 -5,-0.4 -22,-0.2 -0.983 63.0-121.7-141.6 141.3 26.2 12.7 38.3 28 28 A E E -a 5 0A 73 -24,-2.4 -22,-2.7 -2,-0.3 2,-0.4 -0.699 34.8-155.6 -79.1 140.2 24.4 12.7 34.9 29 29 A I E +a 6 0A 16 -2,-0.3 88,-1.3 -24,-0.2 2,-0.4 -0.942 18.1 178.2-125.2 136.0 21.9 15.5 34.6 30 30 A A E -ac 7 117A 10 -24,-2.1 -22,-2.8 -2,-0.4 2,-0.4 -0.960 12.7-156.8-128.6 146.2 18.8 15.9 32.5 31 31 A A E -ac 8 118A 2 86,-2.6 88,-2.7 -2,-0.4 2,-0.4 -0.987 2.6-160.6-125.3 139.2 16.5 18.9 32.5 32 32 A I E +ac 9 119A 0 -24,-2.6 -22,-2.2 -2,-0.4 2,-0.3 -0.978 18.1 173.9-117.4 129.4 12.8 19.1 31.5 33 33 A V E - c 0 120A 0 86,-2.1 88,-1.7 -2,-0.4 2,-0.4 -0.969 29.9-124.7-133.7 149.2 11.3 22.5 30.7 34 34 A T - 0 0 24 -2,-0.3 2,-0.4 -24,-0.3 21,-0.1 -0.765 19.3-172.8 -91.5 137.4 8.0 23.8 29.4 35 35 A V + 0 0 22 -2,-0.4 91,-0.5 87,-0.1 2,-0.2 -0.903 28.3 161.8-132.5 92.8 8.2 26.0 26.2 36 36 A A B +g 126 0B 28 -2,-0.4 91,-0.2 1,-0.2 65,-0.1 -0.619 40.2 32.2-117.7 172.1 4.6 27.2 25.8 37 37 A D S S+ 0 0 31 89,-4.0 2,-0.5 1,-0.2 -1,-0.2 0.903 86.6 175.0 50.1 59.1 2.4 29.9 24.0 38 38 A D > - 0 0 15 88,-0.3 3,-1.3 -3,-0.2 -1,-0.2 -0.858 30.6 -53.6-123.6 122.2 5.0 29.9 21.3 39 39 A G G > S- 0 0 21 -2,-0.5 3,-0.9 1,-0.3 5,-0.4 -0.274 115.2 -3.8 69.5-130.3 5.4 31.5 17.8 40 40 A G G > S+ 0 0 82 59,-0.5 3,-0.6 1,-0.2 -1,-0.3 0.717 131.8 60.5 -72.2 -22.1 2.7 31.2 15.2 41 41 A S G < S+ 0 0 32 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.509 81.3 85.1 -83.5 -6.5 0.7 28.9 17.5 42 42 A S G < S- 0 0 23 -3,-0.9 -1,-0.2 -5,-0.2 -2,-0.1 0.604 92.0-129.4 -73.9 -13.7 0.3 31.6 20.3 43 43 A G S < S+ 0 0 79 -3,-0.6 2,-0.3 1,-0.3 -2,-0.1 0.712 70.2 115.6 71.9 21.0 -2.8 33.3 18.7 44 44 A E S S- 0 0 74 -5,-0.4 -1,-0.3 5,-0.0 -2,-0.1 -0.898 74.8-101.7-119.3 148.7 -1.2 36.7 19.0 45 45 A L > - 0 0 130 -2,-0.3 4,-1.3 1,-0.1 3,-0.2 -0.329 37.8-114.2 -62.6 148.8 -0.1 39.2 16.3 46 46 A R T 4 S+ 0 0 62 1,-0.2 -1,-0.1 2,-0.2 -7,-0.1 0.829 114.9 49.9 -63.6 -33.9 3.7 39.1 15.6 47 47 A X T 4 S+ 0 0 62 1,-0.2 -1,-0.2 339,-0.1 -2,-0.0 0.872 104.2 61.8 -68.3 -35.6 4.4 42.7 16.9 48 48 A N T 4 S+ 0 0 109 -3,-0.2 2,-0.7 1,-0.1 -2,-0.2 0.840 98.2 57.7 -63.9 -43.2 2.4 42.0 20.1 49 49 A X < 0 0 90 -4,-1.3 -1,-0.1 -10,-0.1 -7,-0.0 -0.877 360.0 360.0 -96.4 113.6 4.6 39.2 21.5 50 50 A Q 0 0 100 -2,-0.7 42,-0.0 336,-0.0 -4,-0.0 -0.166 360.0 360.0 168.6 360.0 8.3 40.0 22.0 51 ! 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 52 55 A P > 0 0 128 0, 0.0 4,-0.9 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 167.5 11.3 33.7 29.3 53 56 A G H > + 0 0 26 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.609 360.0 80.1 -94.0 -20.8 13.9 32.5 31.8 54 57 A D H > S+ 0 0 19 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.940 106.0 37.1 -48.3 -53.6 13.3 28.8 32.5 55 58 A L H > S+ 0 0 13 -3,-0.3 4,-3.1 1,-0.2 5,-0.2 0.924 116.9 51.7 -67.0 -47.2 15.1 27.9 29.3 56 59 A R H X S+ 0 0 62 -4,-0.9 4,-2.0 1,-0.2 5,-0.2 0.871 110.5 49.3 -58.0 -39.9 17.7 30.7 29.6 57 60 A N H X S+ 0 0 27 -4,-2.9 4,-2.2 -46,-0.2 -1,-0.2 0.922 115.0 42.9 -65.7 -49.2 18.6 29.6 33.1 58 61 A V H X S+ 0 0 2 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.912 112.9 53.3 -65.8 -45.2 19.0 25.9 32.2 59 62 A L H < S+ 0 0 2 -4,-3.1 4,-0.3 1,-0.2 -2,-0.2 0.917 114.4 40.5 -55.0 -49.6 20.9 26.7 29.0 60 63 A V H >< S+ 0 0 11 -4,-2.0 3,-1.0 -5,-0.2 -1,-0.2 0.906 115.6 51.0 -68.1 -44.3 23.5 28.8 30.8 61 64 A A H 3< S+ 0 0 9 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.805 116.4 41.7 -62.5 -31.4 23.7 26.4 33.8 62 65 A X T 3< S+ 0 0 1 -4,-2.1 53,-2.7 -5,-0.1 -1,-0.2 0.330 93.1 114.6 -97.8 2.3 24.3 23.5 31.5 63 66 A S S < S- 0 0 0 -3,-1.0 50,-0.2 -4,-0.3 51,-0.2 -0.171 80.5-110.7 -73.1 166.1 26.7 25.3 29.1 64 67 A D S S+ 0 0 61 48,-1.3 49,-0.1 1,-0.3 -1,-0.1 0.709 114.8 28.3 -73.4 -17.5 30.3 24.4 28.7 65 68 A X > + 0 0 40 47,-0.3 4,-2.8 -5,-0.1 5,-0.3 -0.521 68.9 171.4-139.5 70.9 31.4 27.6 30.4 66 69 A P H > S+ 0 0 40 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.826 79.4 50.6 -53.4 -36.1 28.7 28.7 32.9 67 70 A X H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.972 113.7 45.8 -68.5 -53.1 30.7 31.5 34.5 68 71 A F H > S+ 0 0 21 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.929 115.8 45.7 -45.7 -57.2 31.6 32.9 31.1 69 72 A Y H X S+ 0 0 2 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.754 109.8 53.4 -70.4 -27.0 28.0 32.6 29.9 70 73 A E H < S+ 0 0 67 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.936 111.4 47.2 -65.6 -46.9 26.4 34.1 33.1 71 74 A X H X S+ 0 0 62 -4,-2.3 4,-1.2 -5,-0.2 3,-0.3 0.974 121.3 37.0 -56.1 -56.2 28.7 37.1 32.7 72 75 A V H >< S+ 0 0 14 -4,-2.6 2,-2.7 1,-0.2 3,-1.0 0.977 112.6 56.1 -59.5 -62.8 27.8 37.4 29.0 73 76 A F T 3< S+ 0 0 4 -4,-2.8 -1,-0.2 1,-0.2 14,-0.2 -0.371 116.3 37.6 -71.5 66.8 24.1 36.5 29.2 74 77 A Q T 34 S+ 0 0 51 -2,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.154 80.1 113.9 174.8 -32.7 23.4 39.3 31.8 75 78 A Y << - 0 0 53 -4,-1.2 11,-2.1 -3,-1.0 2,-0.4 -0.297 53.3-150.9 -53.7 146.4 25.5 42.3 30.8 76 79 A R B -J 85 0C 146 9,-0.3 8,-0.1 -3,-0.1 7,-0.1 -0.971 8.5-123.3-127.8 141.7 23.3 45.2 29.8 77 80 A F + 0 0 20 7,-2.2 324,-0.0 -2,-0.4 -1,-0.0 -0.116 24.1 175.5 -68.4 172.0 23.9 48.0 27.4 78 81 A S 0 0 94 5,-0.1 -1,-0.1 0, 0.0 5,-0.1 0.319 360.0 360.0-145.8 -33.0 23.6 51.7 28.5 79 82 A E 0 0 139 2,-0.0 4,-0.1 4,-0.0 -2,-0.0 0.505 360.0 360.0 25.0 360.0 24.8 53.3 25.3 80 ! 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 81 87 A F 0 0 68 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -61.2 19.1 50.9 21.7 82 88 A A + 0 0 44 2,-0.1 -6,-0.0 -4,-0.0 0, 0.0 -0.944 360.0 0.5-138.8 -31.3 19.7 51.4 24.6 83 89 A G S S+ 0 0 41 -2,-0.1 -5,-0.1 -5,-0.1 -4,-0.0 -0.173 74.6 130.6-125.6 39.4 19.6 49.6 28.0 84 90 A H - 0 0 90 -8,-0.1 -7,-2.2 1,-0.1 2,-0.3 -0.613 60.7-100.5 -97.7 150.9 18.6 46.0 27.3 85 91 A P B >> -J 76 0C 8 0, 0.0 4,-1.0 0, 0.0 3,-0.7 -0.571 29.2-133.7 -68.8 126.7 20.3 42.7 28.4 86 92 A L T 34 S+ 0 0 6 -11,-2.1 -12,-0.2 -2,-0.3 312,-0.0 -0.475 94.5 38.8 -69.9 146.5 22.6 40.9 25.9 87 93 A G T 3> S+ 0 0 1 -14,-0.2 4,-1.0 -2,-0.1 -1,-0.2 0.003 105.6 67.5 93.0 -35.3 21.8 37.2 25.8 88 94 A N H <> S+ 0 0 69 -3,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.815 100.4 52.7 -72.1 -36.2 18.1 37.9 26.2 89 95 A L H X S+ 0 0 17 -4,-1.0 4,-2.2 1,-0.2 5,-0.1 0.812 105.0 54.5 -67.2 -32.5 18.7 39.3 22.7 90 96 A I H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.888 110.6 43.8 -67.6 -41.7 20.3 36.0 21.5 91 97 A I H X S+ 0 0 19 -4,-1.0 4,-1.8 2,-0.2 -2,-0.2 0.887 114.6 51.4 -71.2 -36.4 17.3 33.9 22.5 92 98 A A H X S+ 0 0 26 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.925 112.3 47.2 -61.3 -45.1 15.0 36.5 21.0 93 99 A G H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.916 112.4 45.0 -65.4 -50.1 16.9 36.4 17.8 94 100 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 6,-0.2 0.875 113.8 52.1 -67.0 -34.9 17.1 32.7 17.3 95 101 A S H X S+ 0 0 14 -4,-1.8 4,-1.4 -5,-0.2 5,-0.3 0.903 111.6 45.1 -66.8 -42.5 13.4 32.2 18.2 96 102 A E H < S+ 0 0 46 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.925 113.0 53.4 -64.0 -45.1 12.3 34.9 15.7 97 103 A X H < S+ 0 0 35 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.890 116.5 35.8 -51.9 -50.7 14.6 33.3 13.1 98 104 A Q H < S- 0 0 59 -4,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.549 111.6-116.8 -87.4 -15.7 13.2 29.7 13.5 99 105 A G S < S+ 0 0 44 -4,-1.4 -59,-0.5 -5,-0.2 2,-0.3 0.185 87.5 29.5 103.1 -17.5 9.6 30.9 14.1 100 106 A S S > S- 0 0 15 -5,-0.3 4,-0.7 -6,-0.2 -2,-0.1 -0.935 78.1-117.2-161.6 152.7 9.2 29.6 17.7 101 107 A T H >> S+ 0 0 33 -2,-0.3 4,-0.7 1,-0.2 3,-0.6 0.857 116.6 60.2 -59.1 -37.1 11.5 29.0 20.6 102 108 A Y H >4 S+ 0 0 65 1,-0.2 3,-1.1 2,-0.2 4,-0.3 0.929 105.8 46.5 -54.7 -48.9 10.5 25.3 20.4 103 109 A N H 34 S+ 0 0 90 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.652 111.7 53.7 -67.8 -15.9 12.0 25.3 16.8 104 110 A A H S+ 0 0 162 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.941 113.6 48.8 -72.5 -42.3 18.4 22.6 19.0 107 113 A L H > S+ 0 0 28 -4,-0.3 4,-2.6 1,-0.2 -2,-0.2 0.916 111.0 53.6 -53.8 -42.2 20.2 25.8 17.7 108 114 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.864 107.3 47.8 -66.9 -37.7 20.2 27.0 21.4 109 115 A S H X>S+ 0 0 32 -4,-1.7 5,-2.0 2,-0.2 4,-0.6 0.852 113.1 50.0 -69.8 -34.2 21.9 23.9 22.8 110 116 A X H <5S+ 0 0 108 -4,-1.9 3,-0.5 3,-0.2 -2,-0.2 0.920 111.1 49.3 -61.0 -49.8 24.5 24.2 20.0 111 117 A F H <5S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 117.7 38.3 -57.8 -46.3 25.0 27.8 20.8 112 118 A F H <5S- 0 0 3 -4,-2.2 -48,-1.3 -5,-0.1 -47,-0.3 0.505 101.5-132.6 -88.6 0.0 25.5 27.2 24.6 113 119 A H T <5 - 0 0 41 -4,-0.6 -3,-0.2 -3,-0.5 -4,-0.1 0.921 35.9-157.9 50.3 48.0 27.4 24.0 24.0 114 120 A T < - 0 0 33 -5,-2.0 2,-0.3 -51,-0.2 -51,-0.2 -0.148 11.2-144.7 -66.9 148.6 25.2 22.4 26.6 115 121 A T + 0 0 67 -53,-2.7 -1,-0.1 -3,-0.1 -3,-0.0 -0.712 66.7 11.5 -99.8 160.4 26.2 19.2 28.5 116 122 A G S S- 0 0 43 -2,-0.3 2,-0.4 -86,-0.1 -86,-0.2 -0.162 105.1 -52.7 62.7-163.4 23.6 16.5 29.5 117 123 A X E -c 30 0A 51 -88,-1.3 -86,-2.6 2,-0.0 2,-0.5 -0.902 39.1-170.4-117.3 134.8 20.1 16.6 28.0 118 124 A I E -c 31 0A 18 -2,-0.4 -86,-0.2 -88,-0.2 -9,-0.1 -0.994 19.9-178.5-116.5 121.1 17.6 19.5 28.0 119 125 A Y E -c 32 0A 42 -88,-2.7 -86,-2.1 -2,-0.5 2,-0.1 -0.944 26.7-126.2-122.2 143.1 14.1 18.4 26.8 120 126 A P E -c 33 0A 8 0, 0.0 48,-0.3 0, 0.0 -86,-0.2 -0.491 29.1-119.4 -73.8 153.0 10.9 20.1 26.2 121 127 A S S S+ 0 0 1 -88,-1.7 47,-2.0 -2,-0.1 2,-0.3 0.830 93.4 16.5 -61.2 -30.9 7.9 18.6 28.1 122 128 A S B -K 167 0D 4 45,-0.3 45,-0.2 46,-0.1 4,-0.1 -0.923 63.7-134.1-140.8 159.2 6.1 18.0 24.7 123 129 A D S S+ 0 0 59 43,-0.5 44,-0.1 -2,-0.3 -1,-0.0 0.381 87.9 66.9 -95.8 5.7 6.9 17.8 21.1 124 130 A H S S- 0 0 101 42,-0.3 2,-0.1 1,-0.0 -2,-0.1 -0.826 98.4 -83.3-123.9 161.0 3.9 19.9 20.1 125 131 A P - 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