==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-SEP-10 3ORF . COMPND 2 MOLECULE: DIHYDROPTERIDINE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR C.CHEN,N.N.ZHUANG,K.H.SEO,Y.S.PARK,K.H.LEE . 920 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37644.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 670 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 153 16.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 3.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 45 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 112 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.7 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 0 0 4 0 0 0 0 5 6 4 3 0 2 1 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 1 0 12 12 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 0 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 4 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 2 A S 0 0 131 0, 0.0 2,-0.4 0, 0.0 25,-0.1 0.000 360.0 360.0 360.0 133.7 22.0 -13.6 32.4 2 3 A K - 0 0 110 23,-0.3 25,-2.7 65,-0.1 2,-0.5 -0.773 360.0-145.4 -99.8 142.8 20.5 -14.2 29.0 3 4 A N E -a 27 0A 21 -2,-0.4 65,-2.4 23,-0.2 66,-1.4 -0.889 11.6-171.7-106.2 133.9 21.5 -12.2 25.9 4 5 A I E -ab 28 69A 0 23,-2.7 25,-2.2 -2,-0.5 2,-0.4 -0.977 7.2-160.9-117.8 136.3 19.4 -11.1 23.0 5 6 A L E -ab 29 70A 0 64,-2.7 66,-2.6 -2,-0.5 2,-0.5 -0.933 4.5-167.0-116.4 134.7 20.8 -9.6 19.9 6 7 A V E > -ab 30 71A 0 23,-2.6 25,-2.2 -2,-0.4 3,-1.0 -0.959 11.2-158.5-131.5 115.2 18.8 -7.5 17.5 7 8 A L E 3 S+ab 31 72A 5 64,-2.1 66,-3.8 -2,-0.5 67,-0.4 -0.760 96.2 31.1 -88.9 132.6 19.8 -6.4 13.9 8 9 A G T > S+ 0 0 3 23,-2.5 3,-2.0 -2,-0.4 6,-0.4 0.686 82.4 158.1 85.0 15.8 17.6 -3.4 13.1 9 10 A G T < + 0 0 0 22,-1.6 9,-0.2 -3,-1.0 23,-0.2 0.587 65.6 50.2 -55.7 -8.3 17.8 -2.8 16.8 10 11 A S T 3 S+ 0 0 17 21,-0.2 -1,-0.3 4,-0.1 22,-0.1 0.542 89.3 97.3-107.4 -5.7 16.9 1.0 16.4 11 12 A G S <> S- 0 0 24 -3,-2.0 4,-2.7 1,-0.1 5,-0.2 -0.071 94.0 -92.4 -70.0 179.4 13.8 0.5 14.1 12 13 A A H > S+ 0 0 41 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.968 126.5 33.1 -60.2 -53.4 10.3 0.6 15.5 13 14 A L H > S+ 0 0 13 60,-0.2 4,-2.7 2,-0.2 5,-0.2 0.952 118.5 53.7 -66.6 -47.1 10.0 -3.2 16.0 14 15 A G H > S+ 0 0 0 -6,-0.4 4,-1.6 59,-0.3 -2,-0.2 0.891 110.1 47.3 -56.8 -44.0 13.7 -3.6 16.8 15 16 A A H X S+ 0 0 33 -4,-2.7 4,-2.3 -7,-0.2 -1,-0.2 0.813 110.3 52.2 -70.6 -31.4 13.5 -1.0 19.6 16 17 A E H X S+ 0 0 42 -4,-1.6 4,-2.6 -5,-0.2 5,-0.3 0.897 108.2 51.6 -70.1 -37.6 10.3 -2.5 21.0 17 18 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.877 112.1 47.3 -61.3 -36.5 12.0 -5.9 21.2 18 19 A V H X S+ 0 0 0 -4,-1.6 4,-3.0 -5,-0.2 5,-0.2 0.981 112.7 48.3 -70.7 -46.8 14.9 -4.3 23.0 19 20 A K H X S+ 0 0 128 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.907 114.0 46.0 -58.1 -49.3 12.6 -2.5 25.5 20 21 A F H X S+ 0 0 31 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.907 114.0 46.9 -66.3 -43.1 10.5 -5.5 26.2 21 22 A F H ><>S+ 0 0 0 -4,-2.1 5,-1.9 -5,-0.3 3,-1.3 0.953 109.3 54.7 -63.3 -42.3 13.5 -7.9 26.7 22 23 A K H ><5S+ 0 0 78 -4,-3.0 3,-1.9 1,-0.3 -2,-0.2 0.906 103.7 56.8 -56.2 -41.7 15.2 -5.3 28.9 23 24 A S H 3<5S+ 0 0 78 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.729 104.3 51.7 -62.5 -22.3 12.1 -5.2 31.1 24 25 A K T <<5S- 0 0 96 -3,-1.3 -1,-0.3 -4,-0.9 -2,-0.2 0.176 124.8-105.7 -99.0 15.5 12.3 -9.0 31.7 25 26 A S T < 5S+ 0 0 104 -3,-1.9 -23,-0.3 1,-0.2 2,-0.3 0.735 70.9 144.3 67.5 27.6 16.0 -8.5 32.8 26 27 A W < - 0 0 19 -5,-1.9 2,-0.4 -25,-0.1 -1,-0.2 -0.646 56.7-112.9 -83.5 154.3 17.7 -9.9 29.6 27 28 A N E -a 3 0A 42 -25,-2.7 -23,-2.7 -2,-0.3 2,-0.4 -0.737 38.8-150.8 -82.3 132.0 20.9 -8.2 28.5 28 29 A T E -a 4 0A 0 -2,-0.4 13,-1.7 -25,-0.2 12,-0.5 -0.888 16.3-173.0-113.6 141.1 20.2 -6.5 25.1 29 30 A I E -ac 5 41A 1 -25,-2.2 -23,-2.6 -2,-0.4 2,-0.4 -0.995 6.9-163.3-132.8 138.1 22.4 -5.8 22.2 30 31 A S E -ac 6 42A 0 11,-2.4 13,-3.5 -2,-0.4 2,-0.4 -0.975 10.3-173.3-127.8 128.7 21.6 -3.7 19.0 31 32 A I E +ac 7 43A 0 -25,-2.2 -23,-2.5 -2,-0.4 -22,-1.6 -0.994 34.3 125.0-113.6 131.9 23.2 -3.5 15.6 32 33 A D E S- c 0 44A 18 11,-1.7 13,-1.7 -2,-0.4 4,-0.1 -0.911 73.5 -87.5-165.6 180.0 21.8 -0.8 13.3 33 34 A F S S+ 0 0 113 -2,-0.3 2,-0.3 11,-0.2 11,-0.1 0.768 115.5 30.8 -75.7 -23.0 22.9 2.3 11.2 34 35 A R S S- 0 0 138 9,-0.1 9,-0.1 10,-0.1 -24,-0.1 -0.859 99.8 -90.9-130.0 161.3 22.4 4.5 14.3 35 36 A E - 0 0 108 -2,-0.3 3,-0.1 7,-0.1 -4,-0.1 -0.286 17.7-147.1 -70.8 157.6 22.8 3.7 18.0 36 37 A N > - 0 0 13 -6,-0.2 3,-1.8 1,-0.1 -6,-0.1 -0.880 14.8-174.0-121.1 95.3 20.0 2.5 20.3 37 38 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.757 79.3 66.6 -70.2 -20.5 21.1 4.1 23.6 38 39 A N T 3 S+ 0 0 65 -3,-0.1 2,-0.1 3,-0.0 -10,-0.1 0.764 87.4 87.0 -67.6 -22.7 18.3 2.2 25.4 39 40 A A S < S- 0 0 10 -3,-1.8 3,-0.2 1,-0.1 -10,-0.1 -0.461 84.7-126.1 -79.0 155.5 20.1 -1.0 24.7 40 41 A D S S+ 0 0 72 -12,-0.5 2,-0.4 1,-0.3 -11,-0.2 0.840 101.4 18.9 -70.7 -35.6 22.8 -2.4 27.0 41 42 A H E S-c 29 0A 65 -13,-1.7 -11,-2.4 -5,-0.1 2,-0.4 -0.993 75.2-173.8-134.9 134.5 25.2 -2.6 24.1 42 43 A S E -c 30 0A 31 -2,-0.4 2,-0.3 -13,-0.2 -11,-0.2 -0.988 0.5-171.7-132.4 132.0 24.7 -0.8 20.8 43 44 A F E -c 31 0A 27 -13,-3.5 -11,-1.7 -2,-0.4 2,-0.4 -0.925 10.3-148.7-124.3 149.1 26.8 -1.1 17.6 44 45 A T E -c 32 0A 53 -2,-0.3 2,-0.4 -13,-0.2 -11,-0.2 -0.865 7.2-164.3-115.8 141.3 26.7 0.9 14.5 45 46 A I - 0 0 7 -13,-1.7 3,-0.1 -2,-0.4 8,-0.0 -0.965 16.8-151.7-125.4 143.7 27.5 -0.4 11.0 46 47 A K S S- 0 0 178 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.762 82.6 -12.0 -86.1 -26.2 28.2 1.9 8.0 47 48 A D - 0 0 78 2,-0.1 -1,-0.2 -3,-0.1 49,-0.0 -0.902 65.1-107.2-155.4-176.6 26.8 -0.8 5.7 48 49 A S S S+ 0 0 18 -2,-0.3 56,-0.1 -3,-0.1 5,-0.0 0.320 75.5 126.1-102.3 7.6 25.7 -4.4 5.5 49 50 A G S > S- 0 0 23 4,-0.1 4,-2.4 1,-0.1 5,-0.3 0.042 77.9 -92.0 -60.8 164.7 28.8 -5.4 3.5 50 51 A E H > S+ 0 0 70 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.890 121.6 44.9 -43.6 -52.1 31.4 -8.1 4.2 51 52 A E H > S+ 0 0 118 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.923 112.0 49.4 -71.3 -43.6 33.8 -6.0 6.2 52 53 A E H > S+ 0 0 48 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.877 113.7 47.1 -56.2 -43.3 31.3 -4.2 8.3 53 54 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.952 110.2 51.3 -68.8 -50.9 29.6 -7.4 9.3 54 55 A K H X S+ 0 0 70 -4,-2.9 4,-3.2 -5,-0.3 -2,-0.2 0.908 111.9 50.8 -47.8 -39.4 32.9 -9.2 10.1 55 56 A S H X S+ 0 0 44 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.923 108.4 46.6 -72.0 -44.8 33.9 -6.2 12.3 56 57 A V H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.901 117.0 45.2 -66.8 -38.6 30.8 -6.0 14.4 57 58 A I H X S+ 0 0 8 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.958 113.6 50.6 -64.2 -47.6 30.9 -9.8 15.0 58 59 A E H X S+ 0 0 113 -4,-3.2 4,-2.3 -5,-0.3 -2,-0.2 0.900 113.0 47.5 -57.5 -36.9 34.6 -9.5 15.6 59 60 A K H < S+ 0 0 102 -4,-3.2 4,-0.2 2,-0.2 -1,-0.2 0.901 114.1 43.8 -66.6 -47.3 33.8 -6.7 18.2 60 61 A I H <>S+ 0 0 0 -4,-2.7 5,-1.6 2,-0.2 3,-0.5 0.829 114.3 52.0 -69.8 -34.4 31.0 -8.6 20.0 61 62 A N H ><5S+ 0 0 74 -4,-2.6 3,-3.2 -5,-0.2 -2,-0.2 0.972 104.4 53.7 -64.0 -59.7 33.1 -11.8 20.0 62 63 A S T 3<5S+ 0 0 104 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.503 104.0 59.8 -56.1 -5.6 36.2 -10.1 21.6 63 64 A K T 3 5S- 0 0 117 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.2 0.262 113.1-123.7-100.0 3.4 33.8 -8.9 24.3 64 65 A S T < 5 + 0 0 107 -3,-3.2 2,-0.4 1,-0.2 -3,-0.2 0.635 60.4 139.8 66.3 21.0 33.0 -12.5 25.1 65 66 A I < - 0 0 31 -5,-1.6 2,-0.3 -4,-0.1 -1,-0.2 -0.752 27.7-175.7-101.8 142.6 29.2 -12.5 24.6 66 67 A K - 0 0 77 -2,-0.4 2,-0.4 -62,-0.0 47,-0.2 -0.878 23.5-125.9-121.3 160.9 27.1 -15.2 23.0 67 68 A V E - d 0 113A 1 45,-3.3 47,-2.6 -2,-0.3 -63,-0.2 -0.886 18.4-165.0-123.7 143.1 23.4 -14.9 22.4 68 69 A D E S+ 0 0 31 -65,-2.4 50,-2.3 -2,-0.4 2,-0.4 0.678 86.6 26.8 -88.7 -27.4 20.4 -16.9 23.3 69 70 A T E -bd 4 118A 0 -66,-1.4 -64,-2.7 48,-0.2 2,-0.4 -0.986 64.4-170.8-137.1 129.9 18.0 -15.2 21.0 70 71 A F E -bd 5 119A 0 48,-3.2 50,-2.9 -2,-0.4 2,-0.4 -0.972 7.9-177.0-117.4 135.2 18.8 -13.4 17.7 71 72 A V E -bd 6 120A 0 -66,-2.6 -64,-2.1 -2,-0.4 2,-0.8 -0.992 16.5-152.9-132.2 126.5 16.1 -11.3 15.9 72 73 A C E +bd 7 121A 6 48,-2.7 50,-1.1 -2,-0.4 -64,-0.2 -0.880 26.8 158.6 -97.9 115.3 16.5 -9.5 12.7 73 74 A A + 0 0 20 -66,-3.8 -59,-0.3 -2,-0.8 -65,-0.2 0.188 38.6 116.5-113.9 13.4 14.1 -6.6 12.6 74 75 A A + 0 0 24 -67,-0.4 2,-0.3 -61,-0.1 48,-0.2 -0.452 38.0 91.0 -73.5 153.4 16.0 -4.7 9.9 75 76 A G - 0 0 36 -2,-0.1 2,-0.3 26,-0.0 23,-0.1 -0.937 47.4-138.9 151.8-167.5 14.4 -4.1 6.5 76 77 A G - 0 0 24 -2,-0.3 2,-0.4 18,-0.1 22,-0.0 -0.957 13.4-121.7-172.3 162.7 12.3 -1.6 4.6 77 78 A W + 0 0 92 -2,-0.3 2,-0.3 20,-0.0 -2,-0.0 -0.967 28.1 163.7-119.7 139.1 9.4 -1.3 2.2 78 79 A S - 0 0 42 -2,-0.4 59,-0.4 56,-0.1 58,-0.1 -0.968 22.7-139.0-146.6 148.3 9.3 0.2 -1.3 79 80 A G + 0 0 15 -2,-0.3 55,-0.2 57,-0.1 11,-0.1 -0.233 36.3 108.4 -96.5 175.6 6.7 -0.2 -4.1 80 81 A G B -h 134 0B 6 53,-2.3 55,-1.3 -2,-0.1 56,-0.6 0.117 43.5-125.5 129.3 138.0 6.6 -0.7 -7.8 81 82 A N > - 0 0 36 53,-0.2 3,-0.6 52,-0.2 307,-0.2 -0.180 50.2 -86.2 -88.3-173.6 6.0 -3.0 -10.6 82 83 A A T 3 S+ 0 0 0 305,-2.2 306,-0.2 50,-0.2 259,-0.2 0.739 122.6 43.5 -78.3 -16.9 8.4 -3.7 -13.4 83 84 A S T 3 S+ 0 0 36 304,-0.1 -1,-0.2 4,-0.1 305,-0.1 0.557 88.9 110.1-104.6 -5.0 7.5 -0.9 -15.7 84 85 A S S X S- 0 0 26 -3,-0.6 3,-1.6 1,-0.1 4,-0.3 -0.263 76.2-115.8 -76.1 157.5 7.2 1.9 -13.2 85 86 A D T 3 S+ 0 0 148 1,-0.3 3,-0.3 2,-0.1 4,-0.3 0.802 112.7 48.7 -62.1 -36.3 9.6 4.8 -12.8 86 87 A E T 3> S+ 0 0 86 1,-0.2 4,-1.9 2,-0.1 -1,-0.3 0.355 82.9 103.9 -87.3 9.8 10.8 3.9 -9.4 87 88 A F H <> S+ 0 0 0 -3,-1.6 4,-2.1 1,-0.2 3,-0.3 0.908 77.5 44.7 -67.0 -55.0 11.5 0.3 -10.2 88 89 A L H > S+ 0 0 16 -4,-0.3 4,-1.8 -3,-0.3 -1,-0.2 0.851 115.7 49.5 -55.9 -39.3 15.3 0.2 -10.5 89 90 A K H > S+ 0 0 124 -4,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.824 107.7 53.9 -62.5 -38.8 15.7 2.3 -7.3 90 91 A S H X S+ 0 0 5 -4,-1.9 4,-2.5 -3,-0.3 5,-0.3 0.906 104.8 57.4 -70.5 -35.4 13.2 -0.0 -5.4 91 92 A V H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.979 111.2 39.1 -55.9 -57.9 15.5 -2.9 -6.5 92 93 A K H X S+ 0 0 117 -4,-1.8 4,-2.5 1,-0.2 5,-0.3 0.928 115.5 53.3 -66.2 -40.1 18.6 -1.6 -4.9 93 94 A G H X S+ 0 0 17 -4,-2.8 4,-1.9 1,-0.2 5,-0.3 0.882 112.7 42.8 -53.8 -45.7 16.7 -0.3 -1.8 94 95 A M H X>S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-1.3 0.879 113.0 52.6 -78.4 -36.1 15.0 -3.7 -1.0 95 96 A I H X>S+ 0 0 0 -4,-2.4 5,-2.6 -5,-0.3 4,-0.6 0.975 115.1 41.5 -59.7 -49.6 18.2 -5.6 -1.7 96 97 A D H <5S+ 0 0 60 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.851 123.0 37.2 -68.5 -39.6 20.2 -3.4 0.7 97 98 A M H <5S+ 0 0 77 -4,-1.9 -1,-0.2 -5,-0.3 -3,-0.2 0.887 132.6 17.6 -82.0 -45.7 17.6 -3.2 3.4 98 99 A N H X5S+ 0 0 4 -4,-2.4 4,-1.7 -5,-0.3 -3,-0.2 0.891 127.8 38.2 -96.2 -39.6 16.0 -6.7 3.4 99 100 A L H X S+ 0 0 6 -6,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.858 109.0 50.2 -81.0 -35.1 20.5 -7.9 6.3 102 103 A A H X S+ 0 0 3 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.869 114.1 47.2 -62.1 -41.7 18.9 -11.4 6.2 103 104 A F H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.944 110.3 51.6 -65.9 -45.7 22.2 -12.7 4.8 104 105 A A H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.903 106.3 55.7 -56.4 -43.3 24.1 -10.8 7.6 105 106 A S H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.884 101.5 57.2 -54.1 -45.2 21.9 -12.4 10.2 106 107 A A H X S+ 0 0 0 -4,-1.6 4,-3.1 1,-0.2 5,-0.2 0.972 112.0 41.3 -54.1 -52.6 22.8 -15.9 8.9 107 108 A H H X S+ 0 0 16 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.921 114.0 51.4 -56.5 -47.1 26.5 -15.1 9.5 108 109 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.906 113.5 46.3 -61.1 -44.2 25.9 -13.3 12.9 109 110 A G H X S+ 0 0 1 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.937 109.3 52.0 -63.6 -53.0 23.9 -16.3 14.1 110 111 A A H < S+ 0 0 17 -4,-3.1 -2,-0.2 -5,-0.3 -1,-0.2 0.921 120.1 37.2 -48.4 -40.4 26.4 -18.9 12.9 111 112 A K H < S+ 0 0 75 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.875 130.5 22.6 -84.0 -34.6 29.1 -17.0 14.8 112 113 A L H < S+ 0 0 0 -4,-2.8 -45,-3.3 -5,-0.2 -3,-0.2 0.511 87.9 109.8-115.1 -9.1 27.4 -15.8 18.0 113 114 A L E < -d 67 0A 11 -4,-2.3 2,-0.2 -5,-0.3 -45,-0.2 -0.487 61.7-130.8 -77.4 138.6 24.3 -18.0 18.7 114 115 A N E > - 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0 0 51 -47,-2.6 3,-1.8 -2,-0.5 -2,-0.1 -0.302 41.9 -58.4 -89.5-179.5 6.4 -45.9 49.3 808 116 D Q E 3 S+ 0 0 150 1,-0.3 46,-0.2 -2,-0.1 -1,-0.2 -0.186 123.1 12.4 -59.8 148.0 4.9 -42.4 49.9 809 117 D G E 3 S+ 0 0 35 44,-2.3 -1,-0.3 1,-0.2 45,-0.1 0.684 94.2 157.3 60.5 17.3 7.1 -39.5 49.2 810 118 D G E < - 0 0 1 -3,-1.8 46,-2.2 43,-0.3 2,-0.5 -0.229 43.6-118.7 -70.9 161.7 9.6 -41.8 47.4 811 119 D L E -ef 762 856J 0 -50,-2.7 -48,-2.6 44,-0.2 2,-0.5 -0.905 26.6-168.8-104.9 130.6 12.0 -40.6 44.7 812 120 D F E -ef 763 857J 0 44,-3.2 46,-2.5 -2,-0.5 2,-0.4 -0.966 8.5-179.5-126.1 118.4 11.6 -42.2 41.2 813 121 D V E -ef 764 858J 0 -50,-2.8 -48,-3.4 -2,-0.5 2,-0.3 -0.961 13.2-173.8-128.5 124.9 14.3 -41.6 38.6 814 122 D L E -ef 765 859J 1 44,-2.1 46,-2.0 -2,-0.4 2,-0.7 -0.854 28.5-125.7-107.6 144.8 14.8 -42.7 34.9 815 123 D T E + f 0 860J 16 -50,-1.0 46,-0.2 -2,-0.3 44,-0.1 -0.840 38.7 171.0 -91.2 118.5 18.0 -42.1 33.0 816 124 D G - 0 0 2 44,-3.3 2,-0.3 -2,-0.7 19,-0.1 0.239 31.0-104.2 -99.5-138.9 17.1 -40.2 29.8 817 125 D A > - 0 0 1 44,-0.2 3,-0.7 17,-0.2 4,-0.2 -0.859 3.3-148.7-156.9 123.3 19.5 -38.7 27.3 818 126 D S G > S+ 0 0 10 44,-2.2 3,-2.2 -2,-0.3 4,-0.4 0.893 101.2 64.6 -54.9 -37.6 20.3 -35.0 26.7 819 127 D A G > S+ 0 0 48 43,-0.6 3,-1.9 1,-0.3 -1,-0.2 0.891 92.2 60.9 -55.9 -35.7 20.8 -35.9 23.1 820 128 D A G < S+ 0 0 7 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.455 83.7 80.0 -73.2 -1.3 17.1 -36.8 22.7 821 129 D L G < S+ 0 0 65 -3,-2.2 -1,-0.3 -4,-0.2 2,-0.2 0.728 106.4 24.3 -71.1 -21.2 16.2 -33.2 23.6 822 130 D N S < S- 0 0 81 -3,-1.9 -210,-0.1 -4,-0.4 -662,-0.0 -0.558 114.9 -45.8-125.2-164.5 17.1 -32.4 19.9 823 131 D R - 0 0 66 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 -0.293 41.0-172.1 -66.3 143.4 17.2 -34.1 16.5 824 132 D T > + 0 0 5 -216,-0.2 3,-1.8 -4,-0.1 7,-0.3 -0.412 26.5 149.9-132.6 48.1 19.0 -37.6 16.7 825 133 D S T 3 S+ 0 0 8 1,-0.3 3,-0.4 2,-0.1 -50,-0.2 0.768 73.1 50.3 -65.9 -20.7 19.1 -38.2 12.9 826 134 D G T 3 S+ 0 0 43 1,-0.2 -53,-4.0 -52,-0.1 -1,-0.3 0.493 123.9 30.4 -89.6 -2.0 22.3 -40.3 13.2 827 135 D M B <> S+i 773 0K 55 -3,-1.8 4,-2.9 -55,-0.3 -1,-0.2 -0.405 72.7 159.5-150.0 59.4 20.8 -42.4 16.0 828 136 D I H > S+ 0 0 0 -55,-1.5 4,-2.8 -3,-0.4 5,-0.2 0.901 74.3 47.3 -61.5 -46.4 17.0 -42.5 15.3 829 137 D A H > S+ 0 0 1 -56,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.911 115.5 45.8 -65.4 -42.1 16.1 -45.6 17.3 830 138 D Y H > S+ 0 0 39 -59,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.912 114.5 49.2 -61.4 -46.4 18.1 -44.4 20.4 831 139 D G H X S+ 0 0 0 -4,-2.9 4,-2.9 -7,-0.3 -2,-0.2 0.941 112.7 45.9 -59.5 -45.3 16.6 -40.9 20.1 832 140 D A H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.879 113.1 48.4 -69.8 -41.3 13.0 -42.1 19.8 833 141 D T H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.828 114.5 47.0 -65.4 -37.2 13.3 -44.6 22.7 834 142 D K H X S+ 0 0 11 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.873 109.3 53.6 -71.8 -37.3 14.9 -41.9 24.9 835 143 D A H X S+ 0 0 16 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.949 109.8 49.0 -57.8 -41.9 12.2 -39.4 23.9 836 144 D A H X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.918 108.6 54.1 -65.4 -40.2 9.6 -42.0 25.0 837 145 D T H X S+ 0 0 4 -4,-1.9 4,-2.1 1,-0.2 3,-0.4 0.931 107.1 49.1 -57.8 -44.8 11.6 -42.3 28.2 838 146 D H H X S+ 0 0 10 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.882 109.1 55.0 -63.5 -31.7 11.4 -38.6 28.9 839 147 D H H X S+ 0 0 15 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.852 105.1 51.4 -71.4 -30.2 7.6 -38.8 28.2 840 148 D I H X S+ 0 0 0 -4,-1.6 4,-2.4 -3,-0.4 -1,-0.2 0.931 106.0 56.2 -73.4 -42.8 7.1 -41.5 30.8 841 149 D I H < S+ 0 0 0 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.923 109.7 44.7 -49.2 -52.8 9.0 -39.4 33.4 842 150 D K H >< S+ 0 0 55 -4,-1.9 3,-1.3 1,-0.2 4,-0.4 0.885 111.6 52.3 -63.0 -41.9 6.6 -36.5 32.9 843 151 D D H >< S+ 0 0 0 -4,-1.8 3,-0.8 1,-0.3 -1,-0.2 0.785 105.9 56.2 -65.2 -33.9 3.4 -38.7 32.9 844 152 D L T 3< S+ 0 0 2 -4,-2.4 -1,-0.3 1,-0.2 7,-0.2 0.567 91.5 71.5 -76.5 -9.6 4.5 -40.2 36.2 845 153 D A T < S+ 0 0 21 -3,-1.3 -1,-0.2 -4,-0.4 -2,-0.2 0.703 81.7 93.9 -76.5 -22.5 4.7 -36.7 37.8 846 154 D S S X S- 0 0 34 -3,-0.8 3,-2.3 -4,-0.4 5,-0.4 -0.436 88.0-115.9 -76.0 150.9 0.9 -36.5 37.9 847 155 D E T 3 S+ 0 0 206 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.734 117.1 40.9 -49.9 -30.8 -1.3 -37.5 40.9 848 156 D N T 3 S+ 0 0 89 1,-0.1 -1,-0.3 -5,-0.1 -304,-0.1 0.198 79.3 99.9-109.8 12.8 -2.8 -40.2 38.6 849 157 D G S < S- 0 0 0 -3,-2.3 -305,-3.0 -5,-0.1 -304,-0.3 0.771 102.5-103.7 -65.0 -21.8 0.2 -41.6 36.7 850 158 D G S S+ 0 0 12 -4,-0.4 -2,-0.1 1,-0.4 -3,-0.1 0.365 82.3 121.5 116.4 -2.8 0.1 -44.5 39.3 851 159 D L S S- 0 0 15 -5,-0.4 -1,-0.4 -7,-0.2 -48,-0.1 -0.481 71.2 -88.5 -83.6 162.5 3.0 -43.6 41.7 852 160 D P > - 0 0 30 0, 0.0 3,-1.8 0, 0.0 -43,-0.2 -0.343 55.9 -74.4 -72.5 160.3 2.2 -43.2 45.4 853 161 D A T 3 S+ 0 0 71 1,-0.2 -44,-2.3 -45,-0.1 -43,-0.3 -0.094 115.7 14.2 -46.1 141.8 1.1 -39.8 47.0 854 162 D G T 3 S+ 0 0 66 -46,-0.2 -1,-0.2 1,-0.2 -46,-0.0 0.343 91.1 136.1 72.2 -8.8 4.0 -37.3 47.4 855 163 D S < - 0 0 12 -3,-1.8 2,-0.5 -46,-0.1 -44,-0.2 -0.294 46.1-137.9 -71.6 160.9 6.5 -39.1 45.2 856 164 D T E -f 811 0J 18 -46,-2.2 -44,-3.2 49,-0.1 2,-0.5 -0.982 7.1-155.7-122.1 131.6 8.7 -37.2 42.7 857 165 D S E +f 812 0J 0 -2,-0.5 49,-2.9 -46,-0.2 50,-0.3 -0.924 24.2 169.7-105.8 129.3 9.4 -38.5 39.2 858 166 D L E -f 813 0J 0 -46,-2.5 -44,-2.1 -2,-0.5 2,-0.4 -0.970 25.7-146.1-141.7 147.5 12.6 -37.2 37.6 859 167 D G E -fg 814 908J 0 48,-2.1 50,-2.8 -2,-0.3 2,-0.5 -0.903 6.2-157.1-109.0 141.4 14.9 -37.8 34.6 860 168 D I E -fg 815 909J 0 -46,-2.0 -44,-3.3 -2,-0.4 50,-0.2 -0.992 11.5-164.9-112.1 132.5 18.6 -37.4 34.6 861 169 D L E - g 0 910J 0 48,-2.4 50,-1.9 -2,-0.5 -44,-0.2 -0.861 6.4-161.9-120.1 92.2 19.8 -36.8 31.1 862 170 D P E - g 0 911J 21 0, 0.0 -44,-2.2 0, 0.0 -43,-0.6 -0.342 16.2-163.1 -70.2 161.0 23.5 -37.3 30.8 863 171 D V S S- 0 0 57 48,-0.7 2,-0.3 1,-0.3 49,-0.1 0.775 80.5 -11.0-104.5 -63.4 25.6 -35.9 27.9 864 172 D T - 0 0 44 47,-0.2 19,-2.7 17,-0.1 2,-0.3 -0.981 65.4-156.8-141.0 132.9 28.6 -38.1 28.5 865 173 D L E -j 883 0L 28 -2,-0.3 2,-1.4 17,-0.2 5,-0.1 -0.777 27.3-118.1 -98.4 146.3 29.5 -40.4 31.5 866 174 D D E +j 884 0L 42 17,-3.8 19,-0.5 -2,-0.3 16,-0.0 -0.718 55.7 152.2 -84.5 88.4 33.0 -41.4 32.3 867 175 D T > - 0 0 17 -2,-1.4 4,-2.0 17,-0.1 3,-0.4 -0.893 58.3-114.2-112.9 151.1 32.6 -45.2 31.9 868 176 D P H > S+ 0 0 98 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.861 117.6 56.4 -49.0 -40.7 35.4 -47.8 31.0 869 177 D T H > S+ 0 0 95 2,-0.2 4,-0.8 1,-0.2 -3,-0.0 0.919 104.0 49.6 -59.8 -49.5 33.5 -48.4 27.7 870 178 D N H >> S+ 0 0 66 -3,-0.4 4,-1.0 1,-0.2 3,-0.9 0.932 111.0 54.3 -55.6 -43.3 33.6 -44.7 26.7 871 179 D R H >< S+ 0 0 97 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.956 97.3 62.5 -44.1 -62.3 37.3 -44.8 27.4 872 180 D K H 3< S+ 0 0 162 -4,-2.4 -1,-0.2 1,-0.3 3,-0.2 0.688 113.1 34.4 -44.8 -26.6 38.0 -47.9 25.2 873 181 D Y H << S+ 0 0 180 -3,-0.9 2,-0.4 -4,-0.8 -1,-0.3 0.547 107.1 59.3-115.7 -12.0 36.9 -45.9 22.0 874 182 D M X< + 0 0 111 -3,-1.4 3,-0.7 -4,-1.0 -1,-0.2 -0.603 56.8 167.7-121.3 71.0 37.9 -42.3 22.3 875 183 D S T 3 S+ 0 0 88 -2,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.935 78.2 29.9 -36.1 -58.6 41.6 -42.6 22.7 876 184 D D T 3 S+ 0 0 153 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.345 89.6 119.4-106.6 3.7 42.2 -38.9 22.2 877 185 D A S < S- 0 0 23 -3,-0.7 2,-1.4 -6,-0.1 3,-0.1 -0.226 76.7 -95.6 -68.1 159.8 39.1 -37.1 23.5 878 186 D N > - 0 0 100 1,-0.2 3,-2.1 3,-0.1 37,-0.1 -0.611 38.7-171.4 -82.9 90.1 39.0 -34.6 26.3 879 187 D F G > S+ 0 0 66 -2,-1.4 3,-1.2 1,-0.3 -1,-0.2 0.739 77.2 70.9 -54.9 -34.7 38.1 -36.9 29.2 880 188 D D G 3 S+ 0 0 71 1,-0.3 36,-2.2 -3,-0.1 -1,-0.3 0.671 86.5 65.4 -58.0 -23.0 37.6 -33.9 31.6 881 189 D D G < S+ 0 0 66 -3,-2.1 32,-0.5 33,-0.2 2,-0.3 0.010 91.0 88.9 -84.9 25.6 34.3 -32.9 29.6 882 190 D W S < S- 0 0 20 -3,-1.2 -17,-0.2 30,-0.1 34,-0.1 -0.913 82.5-113.2-125.6 146.8 32.8 -36.2 30.9 883 191 D T E -j 865 0L 0 -19,-2.7 -17,-3.8 -2,-0.3 2,-0.2 -0.708 23.4-125.2 -91.6 132.1 30.9 -36.8 34.1 884 192 D P E >> -j 866 0L 48 0, 0.0 4,-1.1 0, 0.0 3,-0.8 -0.515 17.4-132.3 -67.4 137.7 32.3 -39.0 36.9 885 193 D L H >> S+ 0 0 27 -19,-0.5 4,-2.6 1,-0.2 3,-0.5 0.880 104.9 62.7 -57.2 -41.4 29.8 -41.7 37.8 886 194 D S H 3> S+ 0 0 54 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.810 98.1 55.8 -57.0 -35.8 30.3 -40.9 41.5 887 195 D E H <> S+ 0 0 60 -3,-0.8 4,-2.0 2,-0.2 -1,-0.3 0.866 107.4 48.5 -66.7 -36.2 28.9 -37.4 41.0 888 196 D V H X S+ 0 0 80 -4,-2.2 4,-1.4 1,-0.2 3,-0.8 0.951 111.8 45.8 -56.6 -55.1 21.2 -35.8 47.9 895 203 D W H 3< S+ 0 0 7 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.817 111.4 53.5 -52.3 -41.1 17.8 -36.0 46.3 896 204 D S H 3< S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.744 117.6 34.5 -69.3 -25.4 17.0 -39.1 48.3 897 205 D T H << S+ 0 0 76 -4,-1.4 2,-0.3 -3,-0.8 -2,-0.2 0.427 121.3 41.4-117.8 -3.8 17.8 -37.5 51.6 898 206 D N >< - 0 0 79 -4,-1.4 3,-2.2 -5,-0.2 4,-0.4 -0.753 64.3-171.8-143.8 94.9 16.7 -33.9 51.2 899 207 D S G > S+ 0 0 77 1,-0.3 3,-0.9 -2,-0.3 -1,-0.1 0.740 82.4 59.3 -70.5 -17.0 13.5 -33.8 49.4 900 208 D D G 3 S+ 0 0 145 1,-0.2 -1,-0.3 0, 0.0 -5,-0.1 0.518 92.2 68.9 -90.1 6.1 13.4 -30.0 49.0 901 209 D S G < S+ 0 0 34 -3,-2.2 -1,-0.2 -7,-0.2 -2,-0.2 0.565 83.1 103.4 -83.9 -10.7 16.7 -30.3 47.0 902 210 D R S < S- 0 0 36 -3,-0.9 3,-0.1 -4,-0.4 2,-0.0 -0.460 75.7-126.7 -67.7 134.7 14.5 -32.0 44.4 903 211 D P - 0 0 17 0, 0.0 4,-0.2 0, 0.0 3,-0.2 -0.325 53.6 -57.2 -75.1 168.1 13.6 -30.0 41.3 904 212 D T S > S- 0 0 117 1,-0.1 3,-2.1 2,-0.1 -48,-0.0 -0.083 72.3 -83.9 -47.0 137.5 9.9 -29.7 40.4 905 213 D N T 3 S+ 0 0 67 1,-0.3 -47,-0.1 -3,-0.1 -1,-0.1 -0.086 115.6 19.9 -44.8 126.7 8.0 -33.0 39.9 906 214 D G T 3 S+ 0 0 11 -49,-2.9 -1,-0.3 1,-0.3 -48,-0.2 0.542 87.0 151.4 88.0 4.6 8.4 -34.3 36.3 907 215 D S < - 0 0 17 -3,-2.1 -48,-2.1 -50,-0.3 2,-0.6 -0.458 41.4-142.0 -69.4 139.2 11.6 -32.2 35.6 908 216 D L E -g 859 0J 0 15,-1.7 15,-2.7 -50,-0.2 2,-0.9 -0.921 20.3-152.2 -93.4 121.2 14.2 -33.6 33.1 909 217 D V E -gH 860 922J 0 -50,-2.8 -48,-2.4 -2,-0.6 13,-0.2 -0.779 6.1-159.7-108.0 102.1 17.5 -32.7 34.5 910 218 D K E -gH 861 921J 54 11,-2.2 11,-3.4 -2,-0.9 2,-0.4 -0.426 10.1-172.2 -68.7 144.8 20.3 -32.3 32.0 911 219 D F E +gH 862 920J 1 -50,-1.9 -48,-0.7 9,-0.3 2,-0.4 -0.990 7.1 171.9-141.6 142.6 23.8 -32.6 33.3 912 220 D E E - H 0 919J 47 7,-2.2 7,-2.4 -2,-0.4 2,-0.4 -1.000 20.7-139.6-147.8 139.3 27.0 -31.9 31.5 913 221 D T E + H 0 918J 3 -32,-0.5 2,-0.3 -2,-0.4 5,-0.2 -0.800 18.4 172.5-106.2 145.8 30.7 -31.6 32.3 914 222 D K E > S- H 0 917J 113 3,-1.4 3,-1.6 -2,-0.4 -33,-0.2 -0.912 78.3 -13.8-147.2 115.0 33.1 -29.1 31.0 915 223 D S T 3 S- 0 0 89 -2,-0.3 -34,-0.2 1,-0.3 3,-0.1 0.901 128.1 -54.0 54.3 45.7 36.7 -29.0 32.6 916 224 D K T 3 S+ 0 0 152 -36,-2.2 2,-0.6 1,-0.2 -1,-0.3 0.497 113.0 120.1 71.9 0.9 35.6 -31.2 35.5 917 225 D V E < -H 914 0J 100 -3,-1.6 -3,-1.4 -37,-0.1 2,-0.6 -0.887 50.6-156.2-102.7 117.8 32.8 -28.8 36.4 918 226 D T E -H 913 0J 24 -2,-0.6 2,-0.4 -5,-0.2 -5,-0.2 -0.795 6.5-167.0 -96.4 120.3 29.3 -30.5 36.3 919 227 D T E -H 912 0J 80 -7,-2.4 -7,-2.2 -2,-0.6 2,-0.5 -0.909 5.6-156.9-108.1 133.8 26.3 -28.3 35.7 920 228 D W E -H 911 0J 51 -2,-0.4 2,-0.5 -9,-0.2 -9,-0.3 -0.951 10.6-166.0-107.8 127.9 22.9 -29.7 36.3 921 229 D T E -H 910 0J 66 -11,-3.4 -11,-2.2 -2,-0.5 2,-0.6 -0.963 13.7-141.6-122.7 118.6 20.1 -27.9 34.4 922 230 D N E H 909 0J 100 -2,-0.5 -13,-0.2 -13,-0.2 -15,-0.0 -0.632 360.0 360.0 -73.9 118.9 16.4 -28.4 35.2 923 231 D L 0 0 97 -15,-2.7 -15,-1.7 -2,-0.6 -1,-0.1 -0.505 360.0 360.0-141.3 360.0 14.3 -28.5 32.0