==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/DNA/RNA 30-JUL-06 2HVS . COMPND 2 MOLECULE: 5'-D(*AP*TP*TP*CP*CP*GP*AP*TP*AP*GP*TP*GP*GP*GP*G . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.NANDAKUMAR,C.D.LIMA . 638 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32732.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 446 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 16.9 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 . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 58 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 179 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.6 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 2 1 4 2 1 3 3 3 0 0 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 3 2 3 4 0 0 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 . 1 0 0 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 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 0 A S 0 0 117 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -73.3 58.7 100.9 69.3 2 1 A M + 0 0 21 43,-0.1 94,-0.1 91,-0.1 92,-0.0 0.616 360.0 127.9 -66.2 -11.8 57.0 98.3 67.1 3 2 A F - 0 0 35 42,-0.1 2,-0.4 1,-0.0 93,-0.0 -0.182 37.5-176.2 -54.1 132.1 54.4 101.0 66.4 4 3 A K - 0 0 78 119,-0.0 2,-0.3 54,-0.0 54,-0.1 -0.998 30.4-117.4-133.1 125.8 53.6 101.8 62.8 5 4 A K - 0 0 120 -2,-0.4 52,-0.1 52,-0.1 3,-0.1 -0.472 41.5-105.7 -64.9 122.2 51.3 104.6 61.9 6 5 A Y - 0 0 15 50,-0.4 -1,-0.1 -2,-0.3 35,-0.0 -0.170 43.4 -96.0 -50.1 138.9 48.3 103.2 60.1 7 6 A S - 0 0 13 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.010 38.6-121.2 -51.1 163.8 48.3 103.8 56.4 8 7 A S - 0 0 61 -3,-0.1 214,-0.4 216,-0.0 2,-0.2 -0.815 23.7-134.0-109.3 154.6 46.3 106.8 55.1 9 8 A L - 0 0 35 -2,-0.3 2,-0.4 214,-0.1 216,-0.2 -0.689 9.3-122.8-110.0 162.8 43.5 106.4 52.6 10 9 A E E -a 225 0A 39 214,-2.8 216,-2.5 -2,-0.2 2,-0.0 -0.865 29.9-109.6-107.4 137.5 42.6 108.3 49.4 11 10 A N E > -a 226 0A 27 -2,-0.4 3,-1.6 214,-0.2 7,-0.2 -0.298 19.9-129.0 -62.1 141.7 39.2 110.0 48.8 12 11 A H T 3 S+ 0 0 64 214,-1.9 6,-0.1 1,-0.3 -1,-0.1 0.877 109.5 55.9 -59.6 -37.0 36.9 108.4 46.3 13 12 A Y T 3 S+ 0 0 163 1,-0.1 2,-1.9 2,-0.0 -1,-0.3 0.505 77.0 103.1 -75.3 -5.2 36.5 111.8 44.6 14 13 A N <> - 0 0 40 -3,-1.6 4,-1.9 1,-0.2 3,-0.3 -0.607 51.5-177.9 -79.7 84.7 40.3 112.1 44.1 15 14 A S H > S+ 0 0 56 -2,-1.9 4,-1.3 1,-0.2 5,-0.2 0.822 72.4 69.8 -54.3 -35.6 40.2 111.1 40.4 16 15 A K H >> S+ 0 0 143 1,-0.2 4,-2.2 2,-0.2 3,-1.4 0.959 106.6 36.5 -44.3 -66.4 44.0 111.4 40.3 17 16 A F H 3> S+ 0 0 6 -3,-0.3 4,-2.2 1,-0.3 5,-0.3 0.941 111.1 60.3 -53.4 -54.4 44.4 108.3 42.4 18 17 A I H 3X S+ 0 0 26 -4,-1.9 4,-0.5 -7,-0.2 -1,-0.3 0.656 111.5 42.9 -53.4 -15.4 41.4 106.5 40.9 19 18 A E H S+ 0 0 0 -4,-2.2 5,-2.2 1,-0.2 6,-0.9 0.903 108.5 52.4 -64.5 -44.1 45.2 102.6 39.8 22 21 A Y H <5S+ 0 0 96 -4,-0.5 3,-0.2 -5,-0.3 -1,-0.2 0.825 113.4 45.5 -62.5 -32.3 43.3 102.0 36.6 23 22 A S H <5S+ 0 0 94 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.943 114.1 45.3 -75.6 -51.5 46.5 102.5 34.6 24 23 A L T <5S- 0 0 111 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.356 111.4-126.3 -74.3 9.2 48.6 100.3 36.8 25 24 A G T > 5 + 0 0 46 -3,-0.2 3,-1.3 -5,-0.1 -3,-0.2 0.716 68.2 138.0 52.3 24.4 45.7 97.9 36.6 26 25 A L T 3 < + 0 0 45 -5,-2.2 -4,-0.2 1,-0.3 -1,-0.1 0.719 55.3 77.2 -69.8 -20.4 45.7 97.8 40.4 27 26 A T T 3 S+ 0 0 12 -6,-0.9 132,-0.6 -9,-0.1 -1,-0.3 0.459 81.4 93.3 -69.7 1.0 41.9 97.9 40.3 28 27 A G < + 0 0 41 -3,-1.3 -2,-0.0 -7,-0.2 -6,-0.0 -0.067 62.5 42.6 -83.1-171.3 42.0 94.3 39.3 29 28 A G S S- 0 0 68 182,-0.1 130,-0.5 183,-0.1 2,-0.4 -0.030 104.2 -35.4 66.3-174.7 41.7 91.3 41.6 30 29 A E E -B 158 0A 87 128,-0.1 182,-3.1 129,-0.1 183,-0.4 -0.690 59.7-162.8 -87.9 128.2 39.2 90.9 44.5 31 30 A W E -BC 157 211A 1 126,-3.3 126,-2.5 -2,-0.4 2,-0.4 -0.713 5.4-145.8-108.0 159.1 38.4 94.0 46.5 32 31 A V E -BC 156 210A 0 178,-3.4 178,-2.0 -2,-0.3 2,-0.4 -0.988 5.9-161.3-130.4 134.1 36.8 94.4 50.0 33 32 A A E + C 0 209A 0 122,-2.4 121,-2.9 -2,-0.4 122,-0.5 -0.909 12.8 176.4-113.4 139.3 34.5 97.0 51.3 34 33 A R E -BC 153 208A 4 174,-1.7 174,-2.6 -2,-0.4 119,-0.2 -0.999 38.2 -92.6-143.3 145.3 33.8 97.7 55.0 35 34 A E E - C 0 207A 5 117,-2.3 2,-0.9 -2,-0.3 172,-0.3 -0.270 36.3-128.8 -56.9 133.3 31.8 100.3 56.9 36 35 A K - 0 0 39 170,-3.1 169,-0.8 191,-0.2 2,-0.4 -0.758 26.7-148.4 -85.0 109.4 33.9 103.3 57.9 37 36 A I - 0 0 8 -2,-0.9 2,-1.5 168,-0.1 64,-0.1 -0.655 7.6-135.6 -85.8 135.0 33.2 103.6 61.6 38 37 A H + 0 0 59 -2,-0.4 2,-0.1 62,-0.1 -1,-0.1 -0.625 69.1 96.7 -88.8 81.3 33.2 107.1 63.1 39 38 A G S S- 0 0 8 -2,-1.5 2,-0.3 63,-0.1 63,-0.2 0.019 82.0 -69.8-128.7-121.7 35.3 106.5 66.2 40 39 A T E -E 101 0B 29 61,-1.7 61,-2.7 -2,-0.1 59,-0.1 -0.987 49.0 -97.4-147.1 136.5 39.0 107.2 66.7 41 40 A N E +E 100 0B 17 -2,-0.3 15,-0.7 59,-0.2 2,-0.3 -0.288 52.3 169.4 -54.8 135.6 41.9 105.3 65.3 42 41 A F E -EF 99 55B 0 57,-1.9 57,-2.5 13,-0.2 2,-0.3 -0.992 12.6-172.7-149.8 147.1 43.2 102.7 67.8 43 42 A S E -EF 98 54B 0 11,-1.9 11,-2.1 -2,-0.3 2,-0.5 -0.987 19.6-139.6-145.0 155.2 45.6 99.9 67.6 44 43 A L E -EF 97 53B 0 53,-2.4 53,-2.2 -2,-0.3 2,-1.4 -0.960 12.2-155.7-114.5 113.7 46.8 97.0 69.8 45 44 A I E -EF 96 52B 2 7,-3.8 7,-1.4 -2,-0.5 2,-0.6 -0.644 18.4-169.4 -93.6 82.6 50.6 96.3 69.6 46 45 A I E +EF 95 51B 0 49,-2.5 49,-2.7 -2,-1.4 2,-0.3 -0.616 9.7 173.6 -77.9 115.6 50.7 92.7 70.6 47 46 A E E -E 94 0B 20 3,-3.0 47,-0.2 -2,-0.6 46,-0.1 -0.744 45.5-103.6-117.2 166.3 54.1 91.3 71.2 48 47 A R S S+ 0 0 70 45,-1.0 40,-0.1 -2,-0.3 46,-0.1 0.898 119.9 21.2 -55.7 -42.8 55.4 88.0 72.6 49 48 A D S S+ 0 0 133 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.548 130.2 19.2-106.1 -8.6 56.1 89.4 76.0 50 49 A K - 0 0 96 -5,-0.1 -3,-3.0 2,-0.0 2,-0.4 -0.968 57.6-138.6-153.4 168.0 53.9 92.6 76.2 51 50 A V E -F 46 0B 50 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.996 19.2-168.4-132.9 136.9 51.0 94.4 74.7 52 51 A T E -F 45 0B 28 -7,-1.4 -7,-3.8 -2,-0.4 2,-0.2 -0.987 12.0-142.4-133.8 133.1 50.8 98.1 74.0 53 52 A C E -F 44 0B 6 -2,-0.4 7,-2.6 7,-0.3 2,-0.3 -0.566 21.4-169.1 -89.0 151.5 47.9 100.4 73.1 54 53 A A E -FG 43 59B 0 -11,-2.1 -11,-1.9 5,-0.3 2,-0.2 -0.998 16.6-144.7-145.9 147.7 48.3 103.2 70.6 55 54 A K E > -FG 42 58B 43 3,-2.5 3,-2.1 -2,-0.3 -13,-0.2 -0.516 56.3 -73.9 -96.9 170.4 46.5 106.2 69.3 56 55 A R T 3 S+ 0 0 83 -15,-0.7 -50,-0.4 1,-0.3 -14,-0.1 0.743 131.3 32.5 -33.2 -45.8 46.6 107.4 65.7 57 56 A T T 3 S- 0 0 99 1,-0.2 -1,-0.3 -52,-0.1 -52,-0.1 0.450 125.6 -43.1 -99.8 -2.6 50.2 108.8 66.0 58 57 A G E < S-G 55 0B 8 -3,-2.1 -3,-2.5 -54,-0.1 -1,-0.2 -0.914 81.6 -26.0 159.4 172.6 51.8 106.5 68.5 59 58 A P E -G 54 0B 47 0, 0.0 2,-0.7 0, 0.0 -5,-0.3 0.013 58.5-117.3 -44.1 151.2 51.8 104.5 71.7 60 59 A I - 0 0 9 -7,-2.6 -7,-0.3 4,-0.1 6,-0.1 -0.886 35.2-124.0 -97.4 113.3 49.6 105.7 74.5 61 60 A L > - 0 0 112 -2,-0.7 3,-1.0 1,-0.1 -7,-0.0 -0.305 16.7-115.7 -61.2 136.1 51.9 106.6 77.4 62 61 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.798 118.7 44.2 -37.6 -43.7 51.2 104.9 80.8 63 62 A A T 3 S+ 0 0 103 2,-0.1 -2,-0.0 0, 0.0 -3,-0.0 0.854 99.0 94.4 -73.7 -35.9 50.3 108.2 82.3 64 63 A E < - 0 0 60 -3,-1.0 2,-0.4 1,-0.1 -4,-0.1 0.016 64.0-147.1 -54.9 159.7 48.2 109.3 79.4 65 64 A D - 0 0 120 4,-0.0 2,-0.4 3,-0.0 -4,-0.1 -0.998 13.2-175.6-134.3 129.3 44.5 108.7 79.2 66 65 A F > - 0 0 26 -2,-0.4 3,-1.4 -6,-0.1 4,-0.1 -0.778 64.7 -56.1-133.9 89.8 42.7 108.0 75.9 67 66 A F T 3 S- 0 0 90 -2,-0.4 39,-0.1 1,-0.3 -2,-0.0 0.711 98.1 -66.8 53.1 26.2 38.9 107.7 75.9 68 67 A G T > S+ 0 0 26 1,-0.1 3,-1.7 2,-0.1 -1,-0.3 0.890 80.2 161.8 65.0 38.3 38.9 105.0 78.6 69 68 A Y T X> + 0 0 27 -3,-1.4 3,-4.1 1,-0.3 4,-1.3 0.811 55.2 86.9 -59.8 -32.6 40.6 102.6 76.2 70 69 A E H 3> S+ 0 0 75 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.745 78.7 68.1 -40.9 -24.6 41.6 100.4 79.1 71 70 A I H <> S+ 0 0 65 -3,-1.7 4,-2.7 2,-0.2 -1,-0.3 0.804 97.7 49.4 -68.6 -29.0 38.1 98.9 78.6 72 71 A I H <> S+ 0 0 3 -3,-4.1 4,-1.6 2,-0.2 -1,-0.2 0.920 109.1 52.4 -74.2 -43.0 39.2 97.4 75.3 73 72 A L H < S+ 0 0 50 -4,-1.3 4,-0.3 2,-0.2 -2,-0.2 0.931 116.5 39.2 -57.2 -46.9 42.3 96.0 77.0 74 73 A K H >< S+ 0 0 161 -4,-2.4 3,-1.7 1,-0.2 4,-0.3 0.984 116.0 49.9 -67.1 -58.4 40.2 94.4 79.7 75 74 A N H 3< S+ 0 0 102 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.612 122.4 33.0 -57.8 -16.5 37.4 93.3 77.4 76 75 A Y T 3X S+ 0 0 23 -4,-1.6 4,-2.6 -3,-0.2 3,-0.4 0.236 80.3 114.7-124.7 12.5 39.8 91.7 74.9 77 76 A A H <> S+ 0 0 44 -3,-1.7 4,-2.5 -4,-0.3 5,-0.2 0.829 77.8 53.8 -52.6 -34.6 42.5 90.5 77.3 78 77 A D H > S+ 0 0 127 -4,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.918 108.0 48.2 -69.8 -39.6 41.6 86.9 76.5 79 78 A S H > S+ 0 0 10 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.948 111.2 51.2 -63.2 -48.0 42.1 87.5 72.8 80 79 A I H X S+ 0 0 6 -4,-2.6 4,-2.4 1,-0.2 5,-0.3 0.962 110.5 48.5 -53.4 -53.9 45.4 89.2 73.3 81 80 A K H X S+ 0 0 112 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.932 109.2 54.5 -52.0 -47.5 46.6 86.3 75.4 82 81 A A H X S+ 0 0 32 -4,-2.6 4,-0.6 2,-0.2 -1,-0.2 0.887 108.4 47.6 -55.4 -43.9 45.5 83.9 72.7 83 82 A V H >X S+ 0 0 0 -4,-2.5 3,-2.5 -3,-0.3 4,-1.5 0.984 111.8 49.3 -61.7 -56.6 47.5 85.7 70.1 84 83 A Q H 3X S+ 0 0 38 -4,-2.4 4,-1.0 1,-0.3 -1,-0.2 0.860 101.4 66.0 -51.2 -37.7 50.6 85.8 72.2 85 84 A D H 3< S+ 0 0 102 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.745 109.2 36.6 -60.0 -20.9 50.2 82.2 72.9 86 85 A I H X< S+ 0 0 68 -3,-2.5 3,-0.9 -4,-0.6 -1,-0.2 0.689 99.0 76.9-104.5 -18.7 50.8 81.3 69.3 87 86 A M H >X>S+ 0 0 0 -4,-1.5 3,-1.9 1,-0.2 5,-0.8 0.845 78.2 74.3 -57.5 -40.5 53.5 83.9 68.5 88 87 A E T 3<5S+ 0 0 139 -4,-1.0 3,-0.2 1,-0.3 -1,-0.2 0.808 108.3 30.0 -43.7 -43.3 56.3 82.0 70.2 89 88 A T T <45S+ 0 0 134 -3,-0.9 -1,-0.3 -4,-0.2 -2,-0.1 -0.317 107.9 76.6-114.6 48.4 56.5 79.4 67.5 90 89 A S T <45S- 0 0 40 -3,-1.9 -2,-0.2 2,-0.2 -1,-0.1 0.487 94.3-116.9-135.2 -6.7 55.5 81.6 64.5 91 90 A A T <5S+ 0 0 46 -4,-0.5 36,-2.1 -3,-0.2 2,-0.6 0.712 74.0 129.4 73.9 17.9 58.3 83.8 63.5 92 91 A V E < - H 0 126B 11 -5,-0.8 34,-0.3 34,-0.3 -1,-0.2 -0.935 38.0-176.3-111.5 117.8 56.2 86.8 64.4 93 92 A V E S- 0 0 3 32,-2.2 -45,-1.0 -2,-0.6 2,-0.3 0.866 71.7 -5.6 -77.8 -37.1 57.7 89.5 66.7 94 93 A S E -EH 47 125B 2 31,-1.6 31,-2.3 -47,-0.2 2,-0.5 -0.998 49.0-147.8-159.0 156.4 54.5 91.5 66.8 95 94 A Y E -EH 46 124B 30 -49,-2.7 -49,-2.5 -2,-0.3 2,-0.9 -0.989 13.0-163.5-124.3 116.6 50.9 91.9 65.6 96 95 A Q E -EH 45 123B 4 27,-2.7 27,-2.4 -2,-0.5 2,-0.5 -0.865 12.4-163.2-104.1 101.7 49.6 95.5 65.4 97 96 A V E -EH 44 122B 0 -53,-2.2 -53,-2.4 -2,-0.9 2,-0.4 -0.741 3.9-159.8 -86.7 123.2 45.9 95.1 65.1 98 97 A F E +EH 43 121B 0 23,-3.3 22,-2.5 -2,-0.5 23,-1.7 -0.832 24.9 140.1-105.0 143.1 44.1 98.3 63.9 99 98 A G E -EH 42 119B 0 -57,-2.5 -57,-1.9 -2,-0.4 2,-0.6 -0.913 52.9 -85.3-161.0-177.1 40.5 99.0 64.4 100 99 A E E -EH 41 118B 21 18,-1.6 18,-2.0 -2,-0.3 2,-0.7 -0.919 30.4-143.6-107.0 124.1 38.2 101.9 65.2 101 100 A F E +EH 40 117B 0 -61,-2.7 -61,-1.7 -2,-0.6 2,-0.3 -0.774 36.6 175.6 -83.1 119.8 37.7 102.6 68.9 102 101 A A E + H 0 116B 0 14,-2.5 14,-2.3 -2,-0.7 -63,-0.1 -0.945 14.4 81.2-132.8 154.8 34.0 103.5 69.0 103 102 A G S >> S- 0 0 11 -2,-0.3 3,-0.9 12,-0.2 4,-0.7 -0.893 71.8 -5.8 147.5-176.9 31.4 104.4 71.5 104 103 A P T 34 S+ 0 0 81 0, 0.0 2,-0.5 0, 0.0 4,-0.1 -0.151 123.3 2.8 -47.6 128.9 29.9 107.1 73.8 105 104 A G T 34 S+ 0 0 69 2,-0.4 3,-0.1 1,-0.1 -38,-0.0 -0.106 101.7 95.7 87.4 -38.5 31.8 110.3 73.8 106 105 A I T <4 S- 0 0 3 -3,-0.9 2,-0.3 -2,-0.5 -1,-0.1 0.824 103.8 -6.1 -56.8 -30.2 34.5 109.4 71.2 107 106 A Q S < S- 0 0 79 -4,-0.7 -2,-0.4 3,-0.2 3,-0.4 -0.980 72.3-123.0-162.4 153.6 32.4 111.1 68.5 108 107 A K S S+ 0 0 175 -2,-0.3 3,-0.1 1,-0.2 -70,-0.0 -0.542 81.7 35.5-102.3 167.2 29.0 112.7 68.1 109 108 A N S S+ 0 0 141 -2,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.549 100.6 90.6 71.7 9.2 26.0 112.1 65.8 110 109 A V - 0 0 32 -3,-0.4 2,-0.5 -7,-0.1 -3,-0.2 -0.998 56.2-161.6-138.5 138.3 26.6 108.4 65.9 111 110 A D + 0 0 118 -2,-0.4 2,-0.2 -3,-0.1 91,-0.1 -0.748 21.7 156.7-126.2 89.9 25.4 105.6 68.2 112 111 A Y - 0 0 8 -2,-0.5 3,-0.1 1,-0.3 62,-0.0 -0.513 51.6 -94.4 -93.7 170.8 27.3 102.4 68.2 113 112 A G S S- 0 0 40 -2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.633 73.3 -32.8 -60.5-131.6 26.8 100.3 71.4 114 113 A D S S- 0 0 137 1,-0.2 -1,-0.1 -11,-0.2 -12,-0.1 -0.336 95.1 -56.1 -82.4 171.2 29.2 100.5 74.3 115 114 A K S S+ 0 0 54 -2,-0.1 2,-0.3 -3,-0.1 -12,-0.2 -0.180 76.4 158.7 -48.2 131.6 32.9 101.2 73.8 116 115 A D E -H 102 0B 20 -14,-2.3 -14,-2.5 -3,-0.1 2,-0.5 -0.979 40.5-120.5-153.8 168.5 34.3 98.6 71.4 117 116 A F E -H 101 0B 0 -2,-0.3 2,-0.8 -16,-0.2 32,-0.5 -0.950 19.4-167.0-118.6 114.2 37.1 97.8 69.0 118 117 A Y E -Hi 100 149B 1 -18,-2.0 -18,-1.6 -2,-0.5 32,-0.3 -0.822 17.3-142.8-104.9 100.3 36.3 97.1 65.4 119 118 A V E +Hi 99 150B 0 30,-2.1 32,-2.8 -2,-0.8 -20,-0.3 -0.330 32.8 158.8 -65.7 134.5 39.3 95.7 63.5 120 119 A F E + 0 0 29 -22,-2.5 2,-0.3 1,-0.4 -21,-0.2 0.489 64.8 12.5-129.1 -12.7 39.9 96.7 59.9 121 120 A D E -H 98 0B 2 -23,-1.7 -23,-3.3 18,-0.1 -1,-0.4 -0.987 55.6-158.2-162.1 154.3 43.6 96.0 59.3 122 121 A I E -H 97 0B 0 12,-0.3 12,-2.5 -2,-0.3 2,-0.5 -0.995 6.8-151.9-141.9 137.6 46.6 94.2 60.9 123 122 A I E -HJ 96 133B 5 -27,-2.4 -27,-2.7 -2,-0.4 2,-0.5 -0.921 11.8-157.0-110.8 128.7 50.4 94.6 60.5 124 123 A V E -HJ 95 132B 21 8,-3.6 8,-2.4 -2,-0.5 2,-0.5 -0.889 5.2-167.2-109.3 129.2 52.7 91.6 61.0 125 124 A T E -HJ 94 131B 5 -31,-2.3 -32,-2.2 -2,-0.5 -31,-1.6 -0.959 14.5-155.0-113.2 123.7 56.3 92.0 61.9 126 125 A T E > -H 92 0B 21 4,-2.1 3,-2.9 -2,-0.5 -34,-0.3 -0.585 32.2-102.5 -97.5 161.3 58.4 88.8 61.6 127 126 A E T 3 S+ 0 0 60 -36,-2.1 377,-0.5 1,-0.3 376,-0.3 0.805 123.5 57.0 -47.7 -34.9 61.6 87.9 63.4 128 127 A S T 3 S- 0 0 61 -37,-0.3 -1,-0.3 375,-0.1 372,-0.2 0.613 124.6-103.8 -74.9 -13.6 63.5 88.7 60.2 129 128 A G < + 0 0 25 -3,-2.9 2,-0.2 1,-0.3 -2,-0.2 0.514 66.9 154.0 101.8 7.8 62.0 92.3 60.3 130 129 A D - 0 0 76 -4,-0.1 -4,-2.1 1,-0.0 2,-0.5 -0.511 25.9-162.3 -70.5 132.7 59.4 91.8 57.5 131 130 A V E +J 125 0B 66 -2,-0.2 2,-0.3 -6,-0.2 -6,-0.2 -0.963 20.0 160.8-120.3 117.6 56.6 94.2 58.0 132 131 A T E -J 124 0B 86 -8,-2.4 -8,-3.6 -2,-0.5 2,-0.7 -0.989 40.8-123.1-142.6 148.9 53.4 93.4 56.1 133 132 A Y E -J 123 0B 18 -2,-0.3 -10,-0.2 -10,-0.2 3,-0.1 -0.798 40.0-120.0 -87.8 117.8 49.7 94.2 56.2 134 133 A V - 0 0 18 -12,-2.5 -12,-0.3 -2,-0.7 2,-0.1 -0.191 30.9-108.4 -51.9 145.2 47.7 91.0 56.5 135 134 A D > - 0 0 19 1,-0.1 4,-1.6 78,-0.1 3,-0.5 -0.507 31.1-108.1 -78.0 152.9 45.3 90.3 53.5 136 135 A D H > S+ 0 0 6 76,-2.5 4,-2.0 75,-0.3 5,-0.2 0.797 118.5 53.6 -51.2 -36.7 41.6 90.8 54.3 137 136 A Y H > S+ 0 0 75 75,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.949 111.2 47.3 -64.2 -43.3 40.9 87.0 54.1 138 137 A M H > S+ 0 0 110 -3,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.761 107.5 58.5 -67.4 -24.4 43.6 86.5 56.6 139 138 A M H X S+ 0 0 1 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.925 105.3 47.3 -72.8 -42.2 42.2 89.3 58.7 140 139 A E H X S+ 0 0 30 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.952 111.9 50.7 -61.3 -49.0 38.8 87.6 59.1 141 140 A S H X S+ 0 0 73 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.894 110.3 51.2 -55.7 -41.5 40.4 84.4 60.0 142 141 A F H X S+ 0 0 15 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.981 111.0 45.7 -60.0 -59.8 42.5 86.2 62.6 143 142 A C H X>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 4,-0.8 0.905 113.6 49.5 -52.3 -46.8 39.6 87.9 64.2 144 143 A N H <5S+ 0 0 23 -4,-2.9 3,-0.4 3,-0.2 -1,-0.2 0.903 113.3 46.6 -61.1 -42.2 37.5 84.7 64.3 145 144 A T H <5S+ 0 0 82 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.916 123.8 31.8 -68.0 -42.3 40.3 82.7 65.8 146 145 A F H <5S- 0 0 19 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.247 110.9-114.9-100.7 12.5 41.2 85.3 68.5 147 146 A K T <5 + 0 0 114 -4,-0.8 2,-0.4 -3,-0.4 -3,-0.2 0.935 57.3 155.1 57.9 53.0 37.6 86.6 68.9 148 147 A F < - 0 0 0 -5,-2.0 -1,-0.2 -6,-0.1 2,-0.1 -0.882 42.1-123.5-109.3 142.3 38.1 90.2 67.7 149 148 A K E -i 118 0B 23 -32,-0.5 -30,-2.1 -2,-0.4 2,-0.3 -0.445 31.4-149.5 -77.0 160.6 35.2 92.2 66.4 150 149 A M E -i 119 0B 2 -32,-0.3 -30,-0.2 -2,-0.1 -31,-0.1 -0.910 27.1 -90.1-131.8 161.6 35.7 93.6 62.8 151 150 A A - 0 0 3 -32,-2.8 -115,-0.1 -2,-0.3 -116,-0.0 -0.566 67.6 -95.5 -69.2 113.3 34.6 96.6 60.8 152 151 A P - 0 0 1 0, 0.0 -117,-2.3 0, 0.0 2,-0.4 0.056 39.5-120.1 -34.6 131.7 31.4 95.2 59.3 153 152 A L E -B 34 0A 7 38,-0.5 40,-2.2 -119,-0.2 -119,-0.3 -0.638 24.1-173.1 -82.3 129.5 31.9 93.8 55.8 154 153 A L E - 0 0 7 -121,-2.9 -120,-0.2 -2,-0.4 -1,-0.1 0.164 62.4 -62.7-106.5 15.1 29.9 95.4 53.0 155 154 A G E - 0 0 8 -122,-0.5 -122,-2.4 36,-0.2 2,-0.4 -0.192 40.2-118.1 119.5 150.4 30.9 92.8 50.4 156 155 A R E +B 32 0A 71 -124,-0.2 2,-0.3 -3,-0.1 -124,-0.2 -0.984 59.1 79.0-123.9 133.4 33.8 91.3 48.5 157 156 A G E S-B 31 0A 25 -126,-2.5 -126,-3.3 -2,-0.4 55,-0.1 -0.982 71.5 -0.5 168.4-156.9 34.2 91.5 44.8 158 157 A K E >> -B 30 0A 144 -2,-0.3 3,-2.3 -128,-0.2 4,-1.9 -0.349 55.6-127.2 -66.4 137.3 35.2 93.5 41.7 159 158 A F H 3> S+ 0 0 2 -132,-0.6 4,-1.8 -130,-0.5 -1,-0.1 0.825 110.3 56.9 -51.1 -38.4 36.3 97.1 42.2 160 159 A E H 34 S+ 0 0 76 -133,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.607 111.3 46.1 -72.3 -9.9 33.8 98.4 39.7 161 160 A E H X4 S+ 0 0 106 -3,-2.3 3,-2.5 2,-0.1 -2,-0.2 0.894 111.7 44.3 -93.4 -60.3 31.1 96.7 41.8 162 161 A L H >< S+ 0 0 13 -4,-1.9 3,-2.1 1,-0.3 -2,-0.2 0.826 104.2 65.6 -55.9 -33.9 32.0 97.8 45.4 163 162 A I T 3< S+ 0 0 60 -4,-1.8 -1,-0.3 -5,-0.3 -3,-0.1 0.605 91.3 67.0 -67.3 -6.6 32.6 101.3 44.2 164 163 A K T < S+ 0 0 143 -3,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.307 74.6 116.8 -93.7 6.8 28.9 101.4 43.4 165 164 A L S < S- 0 0 38 -3,-2.1 2,-0.5 1,-0.1 31,-0.1 -0.604 76.2-108.8 -78.5 135.3 28.0 101.1 47.1 166 165 A P > - 0 0 43 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.482 18.1-154.4 -66.7 114.1 26.1 104.2 48.5 167 166 A N T 3 S+ 0 0 38 -2,-0.5 62,-0.4 1,-0.3 29,-0.0 0.416 94.8 63.0 -71.2 8.2 28.4 106.1 50.8 168 167 A D T 3 S+ 0 0 58 60,-0.1 -1,-0.3 27,-0.1 3,-0.1 0.168 77.6 145.0-112.5 14.9 25.2 107.4 52.6 169 168 A L < - 0 0 0 -3,-2.0 35,-2.9 34,-0.1 28,-0.3 -0.175 59.1-102.1 -56.2 141.8 24.3 103.8 53.6 170 169 A D B -K 203 0C 8 26,-2.1 26,-0.3 33,-0.3 33,-0.3 -0.397 47.5 -98.1 -63.3 143.0 22.6 103.4 57.0 171 170 A S - 0 0 1 31,-3.1 -1,-0.1 1,-0.1 4,-0.1 -0.266 33.9-169.6 -60.8 150.1 25.1 102.1 59.6 172 171 A V > + 0 0 13 2,-0.1 4,-2.5 -3,-0.1 3,-0.2 0.229 57.5 105.0-128.1 12.6 25.0 98.4 60.1 173 172 A V H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.829 79.0 56.4 -63.5 -30.7 27.1 98.2 63.2 174 173 A Q H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.899 109.1 44.9 -69.0 -38.2 24.0 97.6 65.3 175 174 A D H > S+ 0 0 77 2,-0.2 4,-2.7 -3,-0.2 5,-0.2 0.914 113.1 52.8 -68.5 -42.0 23.0 94.6 63.2 176 175 A Y H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.966 112.0 42.8 -56.2 -58.5 26.6 93.3 63.3 177 176 A N H X S+ 0 0 16 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.861 112.2 56.1 -58.6 -35.7 26.8 93.5 67.1 178 177 A F H < S+ 0 0 132 -4,-2.0 4,-0.4 -5,-0.2 -1,-0.2 0.936 109.6 44.6 -62.7 -44.9 23.3 92.0 67.3 179 178 A T H ><>S+ 0 0 34 -4,-2.7 5,-2.4 1,-0.2 3,-1.3 0.899 110.6 56.2 -64.3 -39.7 24.4 89.0 65.3 180 179 A V H 3<5S+ 0 0 22 -4,-2.6 5,-0.2 1,-0.3 -2,-0.2 0.917 107.3 48.9 -57.5 -43.3 27.6 88.8 67.3 181 180 A D T 3<5S+ 0 0 119 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.484 126.9 22.3 -78.0 -2.7 25.5 88.6 70.5 182 181 A H T < 5S+ 0 0 126 -3,-1.3 -3,-0.2 -4,-0.4 -2,-0.1 0.583 131.9 25.4-124.4 -76.7 23.3 85.8 69.2 183 182 A A T 5S- 0 0 65 -4,-0.5 4,-0.2 1,-0.2 -3,-0.2 0.802 114.1-113.3 -64.6 -28.1 24.5 83.7 66.3 184 183 A G >< - 0 0 23 -5,-2.4 4,-2.0 -6,-0.2 -1,-0.2 -0.382 25.8 -69.6 117.2 166.1 28.0 84.4 67.4 185 184 A L H > S+ 0 0 28 -5,-0.2 4,-2.3 1,-0.2 5,-0.1 0.887 121.1 54.4 -63.6 -44.2 31.2 86.2 66.3 186 185 A V H > S+ 0 0 65 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.918 113.0 41.0 -60.8 -46.1 32.2 83.9 63.4 187 186 A D H >> S+ 0 0 70 1,-0.2 4,-1.0 2,-0.2 3,-1.0 0.918 113.9 55.4 -67.6 -39.7 28.8 84.1 61.6 188 187 A A H 3< S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.845 107.6 50.2 -59.1 -35.4 28.7 87.8 62.4 189 188 A N H 3< S+ 0 0 3 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.623 111.6 45.5 -81.7 -12.4 32.1 88.3 60.7 190 189 A K H << S+ 0 0 118 -3,-1.0 2,-0.3 -4,-0.7 -1,-0.2 0.460 86.8 108.5-105.8 -4.3 31.2 86.4 57.5 191 190 A C < - 0 0 40 -4,-1.0 2,-0.9 -3,-0.2 -38,-0.5 -0.548 64.1-143.4 -73.8 132.6 27.9 88.1 57.0 192 191 A V - 0 0 81 -2,-0.3 -38,-0.2 -38,-0.1 -1,-0.1 -0.856 23.3-145.1 -98.7 105.1 27.9 90.6 54.2 193 192 A W - 0 0 28 -40,-2.2 2,-0.1 -2,-0.9 -21,-0.1 -0.291 16.6-103.2 -72.9 151.7 25.7 93.4 55.3 194 193 A N - 0 0 122 -22,-0.1 2,-0.5 1,-0.0 -1,-0.1 -0.440 24.8-152.6 -72.0 146.1 23.4 95.5 53.1 195 194 A A + 0 0 12 -2,-0.1 2,-0.3 -41,-0.1 -26,-0.1 -0.902 42.3 126.3-123.8 97.1 24.6 98.9 52.1 196 195 A E - 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0 0 103 -2,-0.4 2,-0.3 6,-0.2 6,-0.2 -0.384 18.6-116.9-119.6-163.4 51.0 99.8 47.3 217 216 A L > - 0 0 19 4,-0.5 3,-2.7 -2,-0.1 4,-0.0 -0.928 34.8-102.5-136.5 159.8 52.7 102.4 45.0 218 217 A R T 3 S+ 0 0 259 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.937 122.6 56.7 -46.9 -53.7 56.3 103.3 44.5 219 218 A N T 3 S- 0 0 92 1,-0.1 -1,-0.3 -3,-0.1 0, 0.0 0.509 122.2-108.4 -58.6 -5.3 55.7 106.5 46.6 220 219 A G < + 0 0 42 -3,-2.7 2,-0.4 1,-0.3 -2,-0.2 0.728 69.4 145.6 84.1 21.1 54.6 104.2 49.4 221 220 A N - 0 0 54 -214,-0.1 -4,-0.5 -4,-0.0 -1,-0.3 -0.753 47.9-122.9 -92.2 140.3 50.9 105.1 49.3 222 221 A R - 0 0 6 -214,-0.4 2,-1.7 -2,-0.4 -6,-0.2 -0.570 17.8-120.8 -82.5 143.9 48.5 102.3 50.1 223 222 A V + 0 0 0 -8,-2.5 2,-0.3 -2,-0.2 -8,-0.3 -0.660 67.7 128.0 -83.6 89.1 45.9 101.4 47.5 224 223 A A - 0 0 0 -2,-1.7 -214,-2.8 -14,-0.2 2,-0.3 -0.967 42.2-155.1-148.7 128.5 42.9 102.1 49.8 225 224 A I E -aD 10 209A 0 -16,-3.9 -16,-2.5 -2,-0.3 2,-0.4 -0.809 1.8-155.0-109.2 145.2 39.9 104.3 49.1 226 225 A K E -aD 11 208A 37 -216,-2.5 -214,-1.9 -2,-0.3 2,-0.5 -0.959 3.2-167.5-116.9 134.8 37.6 106.1 51.5 227 226 A C E + D 0 207A 1 -20,-3.2 -20,-1.6 -2,-0.4 2,-0.3 -0.795 18.0 169.8-123.0 85.9 34.0 106.9 50.5 228 227 A K E - 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0 0 0 -3,-1.4 35,-2.3 34,-0.1 28,-0.3 -0.111 55.0 -96.8 -55.2 152.4 69.6 105.6 51.9 491 169 B D B -W 524 0G 11 26,-2.1 33,-0.2 33,-0.2 26,-0.2 -0.539 46.5-100.2 -72.1 134.5 67.7 105.1 55.1 492 170 B S - 0 0 1 31,-2.3 4,-0.2 -2,-0.3 -1,-0.1 -0.308 35.0-171.3 -56.3 133.4 69.8 103.9 57.9 493 171 B V > + 0 0 3 1,-0.1 4,-3.1 2,-0.1 -1,-0.2 0.345 60.8 98.1-109.4 3.9 69.4 100.1 58.2 494 172 B V H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.927 81.9 53.3 -58.2 -45.2 71.3 99.7 61.5 495 173 B Q H > S+ 0 0 66 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.884 113.1 43.3 -58.5 -38.7 68.0 99.7 63.5 496 174 B D H > S+ 0 0 71 2,-0.2 4,-2.9 -4,-0.2 5,-0.2 0.941 111.9 54.2 -71.1 -46.4 66.6 97.0 61.4 497 175 B Y H X S+ 0 0 2 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.943 110.1 46.4 -49.6 -56.1 69.9 95.1 61.5 498 176 B N H X S+ 0 0 22 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.906 109.8 55.3 -55.7 -43.8 70.0 95.1 65.2 499 177 B F H >X S+ 0 0 43 -4,-1.8 4,-1.7 -5,-0.3 3,-0.6 0.967 107.5 48.0 -54.1 -55.2 66.3 94.1 65.3 500 178 B T H 3X>S+ 0 0 6 -4,-2.9 4,-2.9 1,-0.3 5,-1.3 0.891 108.7 55.9 -53.5 -40.2 67.1 91.0 63.2 501 179 B V H 3<5S+ 0 0 26 -4,-2.3 5,-0.3 1,-0.2 -1,-0.3 0.871 108.7 47.4 -60.9 -37.1 70.0 90.2 65.5 502 180 B D H <<5S+ 0 0 119 -4,-2.0 -1,-0.2 -3,-0.6 -2,-0.2 0.750 130.1 19.0 -77.0 -25.2 67.8 90.2 68.5 503 181 B H H <5S+ 0 0 68 -4,-1.7 -2,-0.2 -376,-0.3 -3,-0.2 0.776 133.6 32.2-115.2 -40.9 65.1 88.0 67.0 504 182 B A T <5S- 0 0 21 -4,-2.9 4,-0.3 -377,-0.5 -3,-0.2 0.561 111.6-109.1 -95.3 -9.2 66.5 86.1 64.0 505 183 B G >< - 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0 0 31 -215,-0.0 4,-1.7 -219,-0.0 3,-1.0 -0.818 360.0 -91.6-134.4 174.3 83.5 111.2 32.6 556 249 B E T 34 S+ 0 0 145 1,-0.3 0, 0.0 -2,-0.2 0, 0.0 0.131 132.9 31.2 -74.8 24.4 84.7 110.0 29.2 557 250 B A T 34 S+ 0 0 49 3,-0.0 -1,-0.3 0, 0.0 58,-0.1 0.239 111.2 65.8-155.9 -6.7 81.2 108.7 28.7 558 251 B D T X4 S+ 0 0 11 -3,-1.0 3,-1.1 2,-0.1 4,-0.3 0.913 108.4 35.7 -87.4 -54.2 79.3 111.3 30.7 559 252 B N T >X S+ 0 0 79 -4,-1.7 4,-2.1 1,-0.3 3,-0.6 0.616 98.1 81.0 -75.7 -14.2 80.1 114.4 28.5 560 253 B K H 3> S+ 0 0 104 -5,-0.4 4,-0.8 1,-0.3 -1,-0.3 0.682 90.3 57.1 -65.0 -13.7 79.9 112.3 25.4 561 254 B L H <> S+ 0 0 4 -3,-1.1 4,-1.8 2,-0.2 -1,-0.3 0.798 102.7 52.3 -83.3 -33.0 76.2 112.8 25.8 562 255 B V H <> S+ 0 0 24 -3,-0.6 4,-3.8 -4,-0.3 5,-0.2 0.887 99.3 64.1 -68.9 -40.4 76.7 116.6 25.8 563 256 B G H X S+ 0 0 44 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.905 108.0 41.0 -49.8 -46.2 78.6 116.3 22.5 564 257 B I H >< S+ 0 0 77 -4,-0.8 3,-1.0 2,-0.2 -1,-0.2 0.904 115.1 50.6 -70.4 -42.4 75.5 115.1 20.8 565 258 B L H >X S+ 0 0 2 -4,-1.8 3,-2.3 1,-0.2 4,-0.6 0.928 101.0 63.2 -61.0 -44.2 73.2 117.6 22.6 566 259 B A H 3< S+ 0 0 29 -4,-3.8 3,-0.4 1,-0.3 -1,-0.2 0.716 86.1 76.2 -52.4 -24.5 75.5 120.5 21.7 567 260 B C T << S+ 0 0 98 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.503 97.3 45.4 -68.8 -3.6 74.7 119.7 18.0 568 261 B Y T <4 S+ 0 0 34 -3,-2.3 2,-1.1 -4,-0.1 -1,-0.2 0.642 81.9 103.9-111.0 -22.4 71.3 121.3 18.5 569 262 B V < + 0 0 15 -4,-0.6 2,-0.3 -3,-0.4 3,-0.0 -0.470 50.3 136.9 -66.7 99.5 72.2 124.5 20.4 570 263 B T > - 0 0 67 -2,-1.1 4,-2.0 1,-0.1 3,-0.3 -0.999 65.1-118.1-148.4 146.2 72.0 127.1 17.7 571 264 B L H > S+ 0 0 70 -2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.783 112.8 60.7 -50.8 -32.9 70.7 130.7 17.4 572 265 B N H > S+ 0 0 107 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.986 106.0 44.9 -60.6 -56.2 68.2 129.5 14.7 573 266 B R H > S+ 0 0 23 -3,-0.3 4,-2.1 1,-0.3 -1,-0.2 0.878 110.8 55.2 -54.4 -39.5 66.5 127.1 17.1 574 267 B V H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 -1,-0.3 0.950 109.5 47.8 -57.9 -46.6 66.6 129.9 19.7 575 268 B N H X S+ 0 0 50 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.918 105.0 57.1 -61.2 -46.7 64.7 132.0 17.1 576 269 B N H X S+ 0 0 83 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.905 111.7 44.3 -52.1 -42.9 62.2 129.3 16.3 577 270 B V H >X S+ 0 0 1 -4,-2.1 3,-1.0 1,-0.2 4,-0.5 0.984 111.5 52.1 -64.8 -54.4 61.3 129.3 19.9 578 271 B I H >< S+ 0 0 24 -4,-2.9 3,-1.0 1,-0.3 -2,-0.2 0.799 104.2 60.5 -50.9 -30.3 61.3 133.1 20.1 579 272 B S H 3< S+ 0 0 89 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.917 97.2 56.2 -65.5 -43.2 59.0 133.0 17.1 580 273 B K H << S+ 0 0 165 -4,-1.4 2,-0.7 -3,-1.0 -1,-0.2 0.539 98.0 75.5 -66.7 -5.2 56.3 131.1 19.1 581 274 B I S << S- 0 0 20 -3,-1.0 -1,-0.1 -4,-0.5 11,-0.0 -0.874 74.9-153.0-113.4 99.8 56.4 134.0 21.6 582 275 B G S S+ 0 0 88 -2,-0.7 2,-0.3 2,-0.0 -1,-0.2 0.812 74.2 14.4 -34.4 -55.9 54.6 137.0 20.3 583 276 B E - 0 0 168 2,-0.0 2,-0.3 0, 0.0 -1,-0.0 -0.858 61.1-163.0-128.4 162.6 56.6 139.6 22.2 584 277 B I - 0 0 29 -2,-0.3 5,-0.0 56,-0.1 -6,-0.0 -0.985 5.2-159.2-147.5 132.7 59.9 139.8 24.3 585 278 B G > - 0 0 21 -2,-0.3 3,-1.4 1,-0.0 4,-0.1 -0.610 42.9 -95.5-105.2 168.8 61.1 142.3 26.8 586 279 B P T 3 S+ 0 0 97 0, 0.0 3,-0.1 0, 0.0 54,-0.1 0.417 124.5 55.2 -64.0 6.9 64.7 143.0 28.0 587 280 B K T 3 S+ 0 0 185 1,-0.1 4,-0.2 2,-0.1 3,-0.1 -0.102 78.7 86.9-131.5 34.8 63.9 140.6 30.8 588 281 B D <> + 0 0 37 -3,-1.4 4,-2.6 2,-0.1 5,-0.2 0.312 49.0 115.4-115.1 7.0 62.7 137.4 29.1 589 282 B F H > S+ 0 0 49 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.895 81.4 43.5 -40.2 -59.0 66.2 135.9 28.7 590 283 B G H > S+ 0 0 46 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.909 109.8 56.3 -57.2 -44.7 65.3 133.0 31.0 591 284 B K H > S+ 0 0 118 2,-0.2 4,-1.1 3,-0.2 -1,-0.2 0.921 113.5 41.7 -54.2 -45.3 61.9 132.5 29.4 592 285 B V H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 3,-0.4 0.993 119.0 40.2 -66.4 -64.7 63.6 132.1 26.0 593 286 B M H X S+ 0 0 17 -4,-2.4 4,-3.3 1,-0.3 3,-0.3 0.904 114.8 52.0 -53.9 -48.0 66.6 129.9 27.0 594 287 B G H X S+ 0 0 34 -4,-2.8 4,-1.2 -5,-0.3 -1,-0.3 0.865 111.9 48.6 -57.9 -33.4 64.6 127.8 29.4 595 288 B L H X S+ 0 0 51 -4,-1.1 4,-1.5 -5,-0.4 -1,-0.3 0.786 111.8 49.3 -76.1 -27.6 62.1 127.3 26.6 596 289 B T H X S+ 0 0 1 -4,-1.8 4,-3.0 -3,-0.3 5,-0.3 0.919 105.0 57.5 -75.3 -45.2 65.0 126.4 24.2 597 290 B V H X S+ 0 0 18 -4,-3.3 4,-0.7 1,-0.2 -2,-0.2 0.837 111.1 42.7 -54.0 -38.0 66.5 123.9 26.6 598 291 B Q H X S+ 0 0 103 -4,-1.2 4,-2.7 -5,-0.2 -1,-0.2 0.881 110.7 54.9 -78.3 -38.1 63.3 121.9 26.7 599 292 B D H X S+ 0 0 23 -4,-1.5 4,-2.1 1,-0.3 5,-0.3 0.935 106.6 51.5 -58.2 -45.6 62.7 122.2 23.0 600 293 B I H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -1,-0.3 0.815 111.8 49.0 -60.1 -28.9 66.2 120.7 22.5 601 294 B L H X S+ 0 0 42 -4,-0.7 4,-1.8 -5,-0.3 5,-0.3 0.842 105.9 55.3 -78.4 -35.3 65.0 118.0 24.8 602 295 B E H X S+ 0 0 83 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.856 119.1 34.0 -64.7 -34.7 61.7 117.5 22.9 603 296 B E H < S+ 0 0 69 -4,-2.1 6,-0.2 -5,-0.2 -2,-0.2 0.878 114.3 54.4 -88.9 -42.9 63.8 116.9 19.8 604 297 B T H ><>S+ 0 0 0 -4,-2.5 5,-1.8 -5,-0.3 3,-0.6 0.870 115.9 41.4 -60.0 -36.3 66.8 115.1 21.2 605 298 B S H ><5S+ 0 0 48 -4,-1.8 3,-2.0 1,-0.2 2,-0.3 0.860 104.1 66.5 -77.4 -37.0 64.5 112.6 22.8 606 299 B R T 3<5S+ 0 0 174 -4,-0.8 -1,-0.2 -5,-0.3 -2,-0.2 0.094 105.8 45.3 -73.2 26.1 62.3 112.4 19.8 607 300 B E T < 5S- 0 0 111 -3,-0.6 -1,-0.3 -2,-0.3 -2,-0.2 0.261 128.5 -86.8-147.4 2.0 65.3 110.8 18.0 608 301 B G T < 5S+ 0 0 62 -3,-2.0 2,-1.8 1,-0.1 -3,-0.2 0.226 93.3 117.9 107.3 -14.5 66.5 108.3 20.5 609 302 B I < + 0 0 32 -5,-1.8 2,-0.1 -6,-0.2 -3,-0.1 -0.456 41.6 172.3 -86.2 66.5 68.8 110.5 22.5 610 303 B T - 0 0 64 -2,-1.8 3,-0.1 -5,-0.2 -5,-0.0 -0.465 30.4-144.8 -73.7 147.6 67.0 110.2 25.8 611 304 B L S S+ 0 0 14 1,-0.2 2,-2.3 -2,-0.1 4,-0.2 0.553 77.4 96.4 -92.1 -8.2 68.7 111.7 28.8 612 305 B T + 0 0 119 2,-0.1 -1,-0.2 4,-0.1 2,-0.1 -0.194 64.8 123.3 -76.3 49.3 67.6 109.1 31.4 613 306 B Q S S- 0 0 69 -2,-2.3 -2,-0.1 2,-0.3 0, 0.0 -0.280 86.7 -78.1 -99.1-173.1 70.9 107.3 30.9 614 307 B A S S+ 0 0 107 -2,-0.1 2,-0.5 2,-0.1 -2,-0.1 0.421 105.8 96.6 -67.6 2.3 73.7 106.3 33.2 615 308 B D S S- 0 0 12 -4,-0.2 -2,-0.3 -57,-0.1 -57,-0.0 -0.845 95.0-101.0 -98.8 127.7 74.8 110.0 33.1 616 309 B N > - 0 0 60 -2,-0.5 2,-3.1 1,-0.2 4,-1.3 -0.259 27.6-139.3 -50.0 107.5 73.5 112.1 36.0 617 310 B P T 4 S+ 0 0 60 0, 0.0 -1,-0.2 0, 0.0 -6,-0.0 -0.015 93.3 57.5 -62.9 37.5 70.5 114.0 34.5 618 311 B S T > S+ 0 0 75 -2,-3.1 4,-2.8 3,-0.1 5,-0.3 0.540 98.9 43.6-129.7 -69.1 71.7 117.1 36.3 619 312 B L H > S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.813 118.6 52.4 -53.7 -30.0 75.3 118.1 35.5 620 313 B I H X S+ 0 0 2 -4,-1.3 4,-3.1 2,-0.2 5,-0.3 0.975 108.8 44.8 -71.2 -57.2 74.3 117.4 31.9 621 314 B K H > S+ 0 0 99 1,-0.2 4,-2.7 -5,-0.2 -2,-0.2 0.889 115.5 49.2 -55.6 -41.1 71.1 119.6 31.8 622 315 B K H X S+ 0 0 107 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.929 113.6 46.1 -64.6 -43.0 73.0 122.4 33.6 623 316 B E H X S+ 0 0 93 -4,-1.8 4,-1.0 -5,-0.3 -2,-0.2 0.847 113.5 48.9 -66.3 -34.9 75.8 122.0 31.1 624 317 B L H X S+ 0 0 0 -4,-3.1 4,-1.8 2,-0.2 -2,-0.2 0.879 112.2 49.7 -70.4 -37.9 73.3 121.9 28.2 625 318 B V H X S+ 0 0 30 -4,-2.7 4,-2.3 -5,-0.3 -2,-0.2 0.914 104.9 56.4 -65.2 -43.0 71.7 125.0 29.7 626 319 B K H X S+ 0 0 86 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.812 106.4 54.2 -58.9 -28.3 75.1 126.7 29.9 627 320 B M H X S+ 0 0 56 -4,-1.0 4,-0.9 2,-0.2 -1,-0.2 0.933 106.0 47.4 -72.2 -47.9 75.3 126.0 26.2 628 321 B V H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.866 115.2 48.9 -61.9 -35.6 72.0 127.7 25.3 629 322 B Q H X S+ 0 0 38 -4,-2.3 4,-2.5 2,-0.2 3,-0.4 0.967 105.3 54.8 -67.0 -53.7 73.1 130.7 27.4 630 323 B D H < S+ 0 0 61 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.706 115.7 43.2 -53.6 -17.8 76.5 130.9 25.9 631 324 B V H < S+ 0 0 40 -4,-0.9 4,-0.3 -3,-0.2 -1,-0.3 0.755 111.6 50.3 -98.7 -31.6 74.6 131.2 22.6 632 325 B L H >< S+ 0 0 0 -4,-1.9 3,-1.4 -3,-0.4 4,-0.5 0.895 102.1 60.2 -76.0 -41.2 71.9 133.5 23.6 633 326 B R G >X S+ 0 0 126 -4,-2.5 3,-2.0 1,-0.3 4,-0.7 0.944 90.4 67.9 -51.6 -56.9 74.0 136.2 25.2 634 327 B P G 34 S+ 0 0 98 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.720 125.3 11.4 -36.5 -29.6 76.1 137.0 22.0 635 328 B A G <> S+ 0 0 15 -3,-1.4 4,-0.6 -4,-0.3 -2,-0.2 0.147 90.2 108.9-142.0 23.7 72.9 138.4 20.5 636 329 B W H <> S+ 0 0 31 -3,-2.0 4,-0.6 -4,-0.5 5,-0.2 0.814 86.2 54.1 -69.4 -27.9 70.3 138.8 23.3 637 330 B I H >X S+ 0 0 128 -4,-0.7 4,-2.0 1,-0.2 3,-1.9 0.988 107.1 47.8 -64.4 -60.5 70.8 142.5 23.0 638 331 B E H 34 S+ 0 0 154 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.578 109.1 58.3 -57.7 -12.8 70.1 142.5 19.2 639 332 B L H 3< S+ 0 0 54 -4,-0.6 -1,-0.3 -3,-0.1 -2,-0.2 0.585 112.1 34.1 -97.1 -12.4 67.0 140.4 19.9 640 333 B V H << 0 0 37 -3,-1.9 -2,-0.2 -4,-0.6 -3,-0.1 0.739 360.0 360.0-109.9 -35.3 65.2 142.8 22.3 641 334 B S < 0 0 154 -4,-2.0 -3,-0.2 -5,-0.2 -4,-0.1 0.834 360.0 360.0-106.6 360.0 66.1 146.2 21.0