==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 10-DEC-04 1Y82 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR P.HORANYI,W.TEMPEL,J.HABEL,L.CHEN,D.LEE,D.NGUYEN,S.-H.CHANG, . 577 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26846.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 449 77.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 0 0.0 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 . 37 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 276 47.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.8 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 0 3 2 0 4 4 2 7 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 P 0 0 73 0, 0.0 320,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.8 19.5 60.9 28.1 2 3 A L - 0 0 48 1,-0.1 3,-0.1 439,-0.0 435,-0.1 -0.560 360.0-114.3 -77.5 136.9 17.1 58.6 26.2 3 4 A P - 0 0 18 0, 0.0 29,-0.2 0, 0.0 30,-0.1 -0.433 44.2 -93.4 -66.0 142.4 13.4 59.4 26.4 4 5 A P - 0 0 77 0, 0.0 29,-2.4 0, 0.0 2,-0.5 -0.187 40.6-115.6 -57.6 149.4 11.4 56.6 28.2 5 6 A D E +a 33 0A 43 103,-0.3 105,-2.2 27,-0.2 2,-0.3 -0.780 43.4 165.5 -90.2 130.3 9.9 54.0 26.0 6 7 A I E -ab 34 110A 3 27,-2.9 29,-2.6 -2,-0.5 2,-0.3 -0.878 14.9-172.9-135.0 168.1 6.1 53.8 25.9 7 8 A T E - b 0 111A 5 103,-2.6 105,-2.4 -2,-0.3 2,-0.3 -0.909 11.1-142.8-148.4 177.3 3.3 52.2 23.8 8 9 A F E - b 0 112A 0 -2,-0.3 29,-0.3 103,-0.2 2,-0.2 -0.944 16.3-124.5-137.7 153.0 -0.5 52.3 23.5 9 10 A D > - 0 0 9 103,-1.1 4,-2.2 -2,-0.3 5,-0.2 -0.501 44.6 -96.4 -85.5 172.4 -3.2 49.8 22.8 10 11 A S H > S+ 0 0 10 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.854 122.1 52.5 -64.0 -36.3 -5.5 50.6 19.9 11 12 A L H > S+ 0 0 126 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.921 114.2 43.7 -64.1 -38.7 -8.3 52.1 22.0 12 13 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.833 111.1 54.6 -75.5 -34.4 -5.9 54.4 23.7 13 14 A L H X S+ 0 0 0 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.912 104.9 53.8 -64.3 -45.8 -4.2 55.3 20.4 14 15 A I H < S+ 0 0 48 -4,-2.2 3,-0.4 1,-0.2 4,-0.4 0.910 111.2 46.1 -52.7 -46.4 -7.5 56.3 18.9 15 16 A K H >< S+ 0 0 100 -4,-1.5 3,-1.2 1,-0.2 -2,-0.2 0.885 106.4 58.4 -67.6 -37.1 -8.0 58.7 21.8 16 17 A X H 3< S+ 0 0 0 -4,-2.1 9,-0.3 1,-0.2 -1,-0.2 0.780 108.8 47.0 -60.5 -26.4 -4.5 60.0 21.6 17 18 A H T 3< S+ 0 0 50 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.407 87.3 115.1 -97.3 -2.8 -5.3 61.1 18.0 18 19 A S S X S- 0 0 43 -3,-1.2 3,-1.9 -4,-0.4 4,-0.1 -0.287 80.8-110.2 -63.7 153.3 -8.7 62.7 18.8 19 20 A Q G > S+ 0 0 115 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.893 118.1 57.3 -47.2 -47.2 -9.0 66.5 18.3 20 21 A S G 3 S+ 0 0 109 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.541 106.4 50.0 -66.0 -8.6 -9.2 67.0 22.1 21 22 A X G <> S+ 0 0 28 -3,-1.9 4,-2.8 -6,-0.2 -1,-0.3 0.149 72.8 112.7-118.1 13.9 -5.7 65.3 22.6 22 23 A K H <> S+ 0 0 77 -3,-1.4 4,-2.3 1,-0.2 -1,-0.1 0.877 81.2 42.6 -59.7 -46.1 -3.7 67.2 19.9 23 24 A K H > S+ 0 0 126 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.904 114.4 51.6 -69.9 -42.0 -1.4 69.0 22.4 24 25 A I H > S+ 0 0 18 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.916 110.9 48.7 -59.3 -46.8 -1.0 65.9 24.6 25 26 A L H X S+ 0 0 25 -4,-2.8 4,-2.7 -9,-0.3 -2,-0.2 0.941 111.5 50.1 -55.0 -51.4 0.0 63.9 21.5 26 27 A E H X S+ 0 0 102 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.894 114.3 43.3 -58.7 -44.3 2.5 66.6 20.4 27 28 A I H X S+ 0 0 20 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.905 112.1 54.7 -67.9 -40.7 4.1 66.7 23.9 28 29 A T H X S+ 0 0 1 -4,-3.0 4,-1.7 -5,-0.2 -2,-0.2 0.920 107.9 49.0 -59.0 -41.9 4.0 62.9 24.0 29 30 A L H < S+ 0 0 54 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.842 113.1 48.0 -66.1 -33.7 5.9 62.7 20.7 30 31 A A H < S+ 0 0 81 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.756 120.7 34.6 -76.3 -27.1 8.5 65.3 21.9 31 32 A K H < S+ 0 0 31 -4,-1.7 2,-0.3 -3,-0.2 -2,-0.2 0.572 114.9 42.8-111.7 -10.5 9.2 63.6 25.3 32 33 A F S < S- 0 0 33 -4,-1.7 2,-0.6 -5,-0.2 -27,-0.2 -0.931 70.0-121.7-135.2 155.9 8.9 59.9 24.8 33 34 A T E -a 5 0A 48 -29,-2.4 -27,-2.9 -2,-0.3 2,-0.7 -0.911 32.6-154.3 -90.5 117.8 9.9 57.1 22.3 34 35 A V E -a 6 0A 7 -2,-0.6 33,-2.6 31,-0.3 2,-0.8 -0.877 10.0-170.2-104.0 112.6 6.6 55.5 21.2 35 36 A N E -d 67 0B 8 -29,-2.6 2,-0.4 -2,-0.7 33,-0.2 -0.852 10.4-169.6-106.2 96.8 6.9 51.9 20.1 36 37 A L E -d 68 0B 0 31,-2.5 33,-3.6 -2,-0.8 2,-0.2 -0.743 21.2-126.1 -95.0 131.8 3.7 50.7 18.4 37 38 A S E >> -d 69 0B 2 -2,-0.4 4,-2.0 -29,-0.3 3,-0.5 -0.490 21.2-125.5 -65.5 140.0 3.0 47.2 17.6 38 39 A I H 3> S+ 0 0 0 31,-2.4 4,-2.3 1,-0.2 -1,-0.1 0.761 113.0 61.0 -53.3 -26.3 2.0 46.8 13.9 39 40 A V H 3> S+ 0 0 1 30,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.868 102.4 47.5 -74.2 -38.9 -1.1 45.1 15.3 40 41 A T H <> S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.870 112.6 52.5 -61.7 -40.7 -2.2 48.2 17.2 41 42 A V H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.926 109.5 48.0 -60.7 -44.5 -1.5 50.1 14.0 42 43 A Y H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.908 112.0 48.3 -66.4 -40.4 -3.8 47.7 12.1 43 44 A R H X S+ 0 0 60 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.905 112.6 49.3 -69.4 -36.2 -6.5 47.9 14.6 44 45 A Y H X S+ 0 0 10 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.922 110.8 48.9 -63.3 -46.2 -6.3 51.7 14.5 45 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.723 103.2 62.6 -70.3 -23.4 -6.4 51.9 10.7 46 47 A T H X S+ 0 0 2 -4,-1.5 4,-2.2 -5,-0.2 -1,-0.2 0.931 105.5 45.5 -58.8 -49.2 -9.4 49.6 10.7 47 48 A V H X S+ 0 0 57 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.959 114.2 49.6 -59.2 -49.6 -11.3 52.3 12.6 48 49 A R H <>S+ 0 0 56 -4,-2.0 5,-2.8 1,-0.2 -2,-0.2 0.874 111.0 47.6 -59.0 -41.6 -10.0 55.0 10.2 49 50 A A H ><5S+ 0 0 7 -4,-2.5 3,-1.3 3,-0.2 -1,-0.2 0.838 108.4 55.9 -70.7 -32.9 -11.0 53.0 7.1 50 51 A Y H 3<5S+ 0 0 115 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.841 106.9 49.1 -62.4 -36.6 -14.5 52.3 8.6 51 52 A L T 3<5S- 0 0 95 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.264 122.0-117.1 -80.5 7.0 -14.8 56.1 8.9 52 53 A K T < 5 + 0 0 158 -3,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.787 60.9 155.1 61.6 32.5 -13.6 56.2 5.2 53 54 A K < - 0 0 103 -5,-2.8 2,-1.3 -6,-0.1 -1,-0.2 -0.285 58.1 -93.5 -81.2 174.4 -10.4 58.1 5.9 54 55 A N > + 0 0 88 1,-0.2 4,-2.9 2,-0.1 5,-0.2 -0.692 46.2 177.0 -92.7 86.4 -7.3 58.0 3.8 55 56 A I H > S+ 0 0 0 -2,-1.3 4,-3.2 1,-0.2 5,-0.2 0.816 76.6 53.3 -69.0 -31.7 -5.4 55.2 5.6 56 57 A E H > S+ 0 0 97 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.936 113.6 45.0 -65.4 -44.5 -2.4 55.1 3.3 57 58 A L H > S+ 0 0 111 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.943 117.0 44.0 -61.4 -50.2 -2.0 58.9 3.8 58 59 A E H X S+ 0 0 45 -4,-2.9 4,-2.6 1,-0.2 3,-0.4 0.901 108.7 57.6 -67.0 -40.7 -2.5 58.6 7.6 59 60 A L H X S+ 0 0 2 -4,-3.2 4,-3.5 1,-0.2 -1,-0.2 0.875 101.5 57.0 -53.8 -40.2 -0.2 55.6 7.9 60 61 A D H X S+ 0 0 94 -4,-1.6 4,-0.8 2,-0.2 -1,-0.2 0.870 108.0 46.9 -61.5 -35.9 2.6 57.6 6.3 61 62 A V H >X S+ 0 0 88 -4,-1.1 4,-1.5 -3,-0.4 3,-1.1 0.966 113.7 48.5 -66.7 -50.6 2.2 60.2 9.1 62 63 A L H >X S+ 0 0 3 -4,-2.6 4,-2.4 1,-0.3 3,-0.6 0.925 106.3 56.6 -51.4 -51.7 2.2 57.4 11.7 63 64 A K H 3< S+ 0 0 104 -4,-3.5 -1,-0.3 1,-0.2 5,-0.2 0.789 110.6 47.7 -47.7 -31.3 5.3 55.8 10.1 64 65 A D H << S+ 0 0 140 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.782 118.4 33.3 -86.6 -31.5 7.0 59.1 10.7 65 66 A I H << S+ 0 0 60 -4,-1.5 2,-0.3 -3,-0.6 -31,-0.3 0.641 115.0 57.7-102.3 -16.0 6.1 59.9 14.3 66 67 A Y S < S- 0 0 12 -4,-2.4 2,-0.9 -5,-0.3 -31,-0.2 -0.846 76.7-125.6-116.7 146.3 6.0 56.4 15.7 67 68 A N E -d 35 0B 85 -33,-2.6 -31,-2.5 -2,-0.3 2,-0.7 -0.855 35.4-155.9 -79.9 105.3 8.4 53.5 15.9 68 69 A I E -d 36 0B 16 -2,-0.9 -31,-0.2 -5,-0.2 152,-0.1 -0.824 3.4-153.3 -93.9 116.8 6.2 50.9 14.2 69 70 A V E -d 37 0B 14 -33,-3.6 -31,-2.4 -2,-0.7 -30,-0.3 -0.798 8.4-142.1 -98.0 110.7 7.3 47.4 15.4 70 71 A P - 0 0 48 0, 0.0 2,-1.0 0, 0.0 149,-0.2 -0.162 25.9-105.6 -66.6 163.1 6.5 44.6 12.9 71 72 A L B +E 218 0C 1 147,-1.6 147,-1.6 4,-0.1 2,-0.1 -0.831 57.6 168.7 -87.8 105.9 5.4 41.2 14.2 72 73 A N > - 0 0 38 -2,-1.0 4,-2.0 145,-0.2 5,-0.2 -0.449 51.1 -86.9-109.8-175.0 8.6 39.3 13.6 73 74 A E H > S+ 0 0 45 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.915 123.4 53.8 -59.7 -43.8 9.9 35.8 14.7 74 75 A E H > S+ 0 0 88 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.842 110.6 44.2 -64.1 -40.1 11.2 37.1 18.0 75 76 A I H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.863 111.7 55.0 -73.1 -34.1 8.0 38.7 19.1 76 77 A A H X S+ 0 0 1 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.914 107.6 48.5 -63.9 -43.6 6.0 35.6 18.0 77 78 A I H X S+ 0 0 20 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.967 113.4 47.8 -57.2 -49.8 8.2 33.3 20.1 78 79 A K H X S+ 0 0 34 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.901 114.4 46.3 -59.5 -43.4 7.7 35.6 23.1 79 80 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.839 110.7 52.4 -68.8 -37.4 3.9 35.8 22.4 80 81 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.925 112.5 45.6 -61.6 -44.6 3.7 32.0 22.0 81 82 A Q H X S+ 0 0 44 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.944 114.2 48.7 -63.5 -50.6 5.5 31.5 25.4 82 83 A I H X S+ 0 0 1 -4,-2.7 4,-1.8 -5,-0.2 5,-0.2 0.974 116.1 41.7 -49.9 -62.0 3.3 34.1 27.1 83 84 A E H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.839 112.7 53.1 -62.8 -37.6 0.1 32.6 25.7 84 85 A A H X S+ 0 0 5 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.950 110.8 48.1 -60.1 -47.6 1.1 29.0 26.3 85 86 A D H < S+ 0 0 39 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.800 110.9 50.8 -64.4 -31.1 1.9 29.8 30.0 86 87 A L H ><>S+ 0 0 4 -4,-1.8 5,-2.1 -5,-0.2 3,-0.7 0.809 111.3 48.4 -73.0 -32.2 -1.5 31.6 30.4 87 88 A X H ><5S+ 0 0 29 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.880 99.1 65.4 -73.2 -40.7 -3.3 28.6 28.9 88 89 A R T 3<5S+ 0 0 80 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.372 106.6 48.8 -57.3 5.1 -1.4 26.3 31.3 89 90 A K T < 5S- 0 0 84 -3,-0.7 -1,-0.3 2,-0.2 -2,-0.2 0.037 127.2 -91.3-141.2 17.8 -3.4 28.2 33.9 90 91 A G T < 5S+ 0 0 77 -3,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.441 84.2 127.3 89.3 2.4 -7.0 28.2 32.6 91 92 A X < - 0 0 78 -5,-2.1 -1,-0.2 -6,-0.1 -2,-0.2 -0.736 40.8-168.7-104.5 139.5 -6.8 31.4 30.7 92 93 A X - 0 0 140 -2,-0.3 -5,-0.0 -5,-0.0 2,-0.0 -0.789 22.9-167.6-121.8 88.0 -7.7 32.1 27.0 93 94 A P - 0 0 22 0, 0.0 2,-0.1 0, 0.0 -6,-0.0 -0.316 26.3 -96.3 -80.7 157.4 -6.4 35.6 26.2 94 95 A D > - 0 0 82 1,-0.1 4,-2.4 -2,-0.0 5,-0.2 -0.430 25.0-127.8 -67.1 142.9 -7.3 37.8 23.2 95 96 A I H > S+ 0 0 32 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.950 110.1 52.2 -55.5 -51.9 -4.8 37.7 20.2 96 97 A E H > S+ 0 0 24 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 110.6 47.9 -55.0 -47.4 -4.6 41.5 20.2 97 98 A D H > S+ 0 0 12 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.907 112.9 47.4 -54.9 -51.2 -3.8 41.6 24.0 98 99 A V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.913 115.7 43.0 -61.9 -44.9 -1.1 39.0 23.7 99 100 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.837 117.2 47.9 -74.2 -29.2 0.7 40.4 20.7 100 101 A T H X S+ 0 0 3 -4,-2.1 4,-1.9 -5,-0.3 -2,-0.2 0.927 116.1 43.2 -70.5 -48.0 0.4 43.9 22.1 101 102 A A H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.923 113.5 51.9 -61.7 -46.4 1.7 42.8 25.5 102 103 A A H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.874 109.7 48.8 -63.8 -40.2 4.4 40.7 23.9 103 104 A T H X S+ 0 0 3 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.868 110.8 51.2 -65.6 -37.5 5.6 43.6 21.8 104 105 A A H X>S+ 0 0 3 -4,-1.9 5,-2.3 2,-0.2 4,-1.0 0.890 111.4 47.1 -68.6 -39.3 5.7 45.9 24.9 105 106 A I H <5S+ 0 0 16 -4,-2.6 3,-0.2 3,-0.2 -2,-0.2 0.938 113.9 48.7 -64.7 -41.9 7.7 43.4 26.8 106 107 A Y H <5S+ 0 0 30 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.835 118.8 37.1 -69.3 -34.1 10.1 43.0 23.9 107 108 A T H <5S- 0 0 28 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.555 108.4-125.0 -88.5 -10.7 10.6 46.7 23.3 108 109 A K T <5 + 0 0 78 -4,-1.0 2,-0.4 -3,-0.2 -103,-0.3 0.887 54.8 161.8 64.5 42.5 10.5 47.3 27.2 109 110 A S < - 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0 0 94 -5,-2.4 2,-0.9 -8,-0.1 -1,-0.2 -0.501 55.5-104.5 -73.9 153.5 22.3 8.6 29.7 495 55 D N > - 0 0 94 1,-0.2 4,-1.9 -2,-0.2 5,-0.1 -0.731 35.3-169.6 -78.9 105.5 19.1 10.4 30.6 496 56 D I H > S+ 0 0 15 -2,-0.9 4,-3.3 1,-0.2 5,-0.2 0.758 81.2 64.4 -81.2 -21.0 20.4 13.0 33.0 497 57 D E H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.948 108.7 42.9 -54.6 -48.9 17.0 14.1 34.1 498 58 D L H > S+ 0 0 109 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.897 116.6 47.9 -63.3 -40.2 16.6 10.6 35.5 499 59 D E H X S+ 0 0 37 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.881 107.6 53.9 -72.0 -37.4 20.1 10.6 36.9 500 60 D L H X S+ 0 0 6 -4,-3.3 4,-3.1 1,-0.2 -1,-0.2 0.905 103.9 57.5 -61.8 -43.1 19.7 14.1 38.5 501 61 D D H X S+ 0 0 83 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.882 106.1 49.4 -53.6 -43.1 16.6 12.8 40.3 502 62 D V H X S+ 0 0 83 -4,-1.4 4,-1.5 2,-0.2 3,-0.2 0.934 113.1 45.9 -60.9 -46.0 18.7 9.9 41.9 503 63 D L H X S+ 0 0 3 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.905 108.0 59.0 -64.1 -38.6 21.4 12.4 43.0 504 64 D K H < S+ 0 0 91 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.860 107.4 46.2 -58.1 -37.3 18.7 14.8 44.3 505 65 D D H < S+ 0 0 122 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.802 121.4 33.7 -77.7 -32.9 17.4 12.1 46.7 506 66 D I H < S+ 0 0 64 -4,-1.5 2,-0.3 -3,-0.1 -31,-0.3 0.725 115.1 50.4 -99.4 -21.4 20.8 11.0 48.1 507 67 D Y S < S- 0 0 12 -4,-2.8 2,-0.9 -5,-0.2 -31,-0.2 -0.867 73.9-124.4-118.2 149.5 22.8 14.2 48.2 508 68 D N E -r 476 0J 84 -33,-2.6 -31,-2.2 -2,-0.3 2,-0.5 -0.841 36.1-150.7 -82.5 109.9 22.4 17.7 49.4 509 69 D I E -r 477 0J 25 -2,-0.9 -31,-0.2 -33,-0.2 -142,-0.1 -0.779 6.1-150.1 -89.9 125.2 23.0 19.6 46.2 510 70 D V E -r 478 0J 12 -33,-3.8 -31,-2.2 -2,-0.5 -30,-0.3 -0.829 6.5-140.6-107.9 106.0 24.5 23.0 46.9 511 71 D P - 0 0 64 0, 0.0 2,-0.9 0, 0.0 -145,-0.1 -0.194 25.7-109.2 -58.2 150.2 23.8 25.8 44.4 512 72 D L B +N 365 0H 0 -147,-0.9 -147,-1.1 4,-0.1 2,-0.2 -0.792 56.1 170.3 -76.6 105.8 26.6 28.3 43.5 513 73 D N > - 0 0 43 -2,-0.9 4,-2.3 -149,-0.1 5,-0.1 -0.460 48.5 -84.0-114.9-173.8 25.3 31.4 45.3 514 74 D E H > S+ 0 0 33 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.882 123.9 51.1 -62.2 -43.1 26.5 35.0 46.2 515 75 D E H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 113.0 44.7 -63.2 -43.4 28.3 33.9 49.3 516 76 D I H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.870 110.2 56.4 -65.7 -37.3 30.2 31.1 47.6 517 77 D A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.890 107.5 47.8 -65.7 -40.8 31.0 33.4 44.7 518 78 D I H X S+ 0 0 25 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.950 113.2 47.5 -60.0 -54.5 32.7 36.0 47.0 519 79 D K H X S+ 0 0 38 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.875 113.5 48.5 -57.3 -39.3 34.7 33.3 48.8 520 80 D A H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.890 110.5 50.6 -68.4 -41.1 35.8 31.8 45.4 521 81 D A H X S+ 0 0 0 -4,-2.2 4,-3.3 -5,-0.2 5,-0.2 0.959 113.5 45.5 -58.5 -51.4 36.7 35.2 44.1 522 82 D Q H X S+ 0 0 79 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.919 114.9 47.5 -58.5 -47.9 38.9 35.9 47.2 523 83 D I H X S+ 0 0 3 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.960 115.9 44.9 -56.6 -52.5 40.5 32.4 47.1 524 84 D E H X S+ 0 0 7 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.908 113.1 48.4 -63.0 -46.4 41.2 32.8 43.4 525 85 D A H X S+ 0 0 5 -4,-3.3 4,-2.3 2,-0.2 -1,-0.2 0.945 114.5 46.8 -60.3 -47.4 42.6 36.4 43.6 526 86 D D H X S+ 0 0 38 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.917 111.7 50.1 -58.5 -48.9 44.8 35.4 46.5 527 87 D L H < S+ 0 0 3 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.885 112.0 49.2 -60.0 -38.4 46.1 32.3 44.8 528 88 D X H < S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.876 106.2 54.3 -66.5 -41.6 46.8 34.4 41.7 529 89 D R H < 0 0 74 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.748 360.0 360.0 -64.4 -23.8 48.7 37.1 43.6 530 90 D K < 0 0 112 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.123 360.0 360.0 -92.7 360.0 50.9 34.2 45.0 531 ! 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 0.0 532 92 D X 0 0 104 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.3 49.3 30.3 40.8 533 93 D X - 0 0 174 -5,-0.0 3,-0.1 0, 0.0 -9,-0.0 -0.771 360.0-165.5-131.1 89.5 46.4 29.6 38.4 534 94 D P - 0 0 26 0, 0.0 2,-0.2 0, 0.0 26,-0.0 -0.364 30.0-100.8 -65.7 150.2 43.9 27.2 40.0 535 95 D D > - 0 0 52 1,-0.1 4,-1.8 -2,-0.0 5,-0.1 -0.489 25.9-130.6 -62.3 142.2 41.3 25.4 38.0 536 96 D I H > S+ 0 0 24 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.894 108.9 54.8 -61.5 -47.4 37.8 27.2 38.3 537 97 D E H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.897 109.2 48.9 -52.5 -42.4 36.1 23.9 39.1 538 98 D D H > S+ 0 0 10 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.883 111.9 47.3 -67.3 -43.8 38.6 23.3 42.0 539 99 D V H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.2 0.926 114.5 46.4 -60.0 -50.4 38.1 26.8 43.4 540 100 D L H X S+ 0 0 1 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.867 113.7 49.4 -65.6 -36.0 34.3 26.6 43.2 541 101 D T H X S+ 0 0 2 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.936 115.3 42.7 -65.8 -46.8 34.5 23.1 44.7 542 102 D A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.928 112.8 53.5 -63.1 -47.0 36.7 24.3 47.6 543 103 D A H X S+ 0 0 0 -4,-3.3 4,-1.9 1,-0.2 -1,-0.2 0.856 109.8 48.1 -57.2 -40.0 34.7 27.5 48.1 544 104 D T H X S+ 0 0 3 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.882 110.9 50.5 -69.2 -39.7 31.5 25.4 48.4 545 105 D A H <>S+ 0 0 2 -4,-1.9 5,-2.9 2,-0.2 -2,-0.2 0.838 110.0 49.7 -65.6 -40.7 33.1 23.0 51.0 546 106 D I H ><5S+ 0 0 37 -4,-2.4 3,-1.3 3,-0.2 -2,-0.2 0.964 113.6 47.4 -55.7 -54.7 34.3 25.9 53.2 547 107 D Y H 3<5S+ 0 0 84 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.1 0.893 117.7 39.5 -54.9 -51.5 30.8 27.4 53.1 548 108 D T T 3<5S- 0 0 28 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.380 107.8-127.3 -80.1 4.6 29.1 24.1 53.9 549 109 D K T < 5 + 0 0 131 -3,-1.3 2,-0.4 1,-0.2 -3,-0.2 0.924 55.1 159.1 43.7 52.4 31.9 23.3 56.4 550 110 D S < - 0 0 4 -5,-2.9 19,-0.5 -6,-0.1 2,-0.5 -0.879 49.1-120.8-109.8 133.1 32.3 19.9 54.6 551 111 D L E -p 447 0I 23 -105,-2.3 -103,-2.1 -2,-0.4 2,-0.6 -0.627 35.0-133.6 -66.9 120.8 35.4 17.7 54.7 552 112 D L E -pq 448 570I 0 17,-3.5 19,-1.9 -2,-0.5 2,-0.6 -0.731 15.2-155.7 -86.8 119.3 36.3 17.4 51.0 553 113 D I E +pq 449 571I 0 -105,-3.7 -103,-1.3 -2,-0.6 2,-0.3 -0.880 26.7 160.2-100.3 121.7 37.0 13.8 50.0 554 114 D T E - q 0 572I 0 17,-1.8 19,-1.8 -2,-0.6 3,-0.3 -0.952 50.5-140.0-141.8 147.7 39.3 13.7 46.9 555 115 D D S S+ 0 0 59 -2,-0.3 2,-0.1 17,-0.2 -1,-0.0 0.335 105.7 49.3 -84.4 2.8 41.6 11.3 45.1 556 116 D D > + 0 0 77 1,-0.1 3,-0.7 2,-0.0 4,-0.3 -0.488 60.5 161.7-142.1 73.6 43.9 14.4 44.5 557 117 D S G > + 0 0 27 -3,-0.3 3,-1.1 1,-0.2 4,-0.3 0.736 65.0 70.7 -63.7 -27.8 44.5 16.2 47.8 558 118 D K G > S+ 0 0 70 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.844 91.0 55.4 -67.1 -38.5 47.6 18.1 46.6 559 119 D R G < S+ 0 0 89 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.1 0.602 107.4 53.0 -70.8 -11.1 46.0 20.5 44.2 560 120 D Y G X S+ 0 0 1 -3,-1.1 3,-1.8 -4,-0.3 4,-0.4 0.454 82.7 95.4 -96.3 -5.8 43.7 21.7 47.0 561 121 D E G X S+ 0 0 119 -3,-1.4 3,-1.0 -4,-0.3 4,-0.4 0.808 75.4 58.7 -57.0 -40.2 46.7 22.4 49.3 562 122 D P G 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.602 105.4 54.2 -61.0 -8.6 46.9 26.2 48.5 563 123 D X G X >S+ 0 0 4 -3,-1.8 5,-1.2 1,-0.2 3,-1.2 0.495 79.4 87.3-112.9 -7.5 43.3 26.4 49.8 564 124 D R G X 5S+ 0 0 45 -3,-1.0 3,-1.9 -4,-0.4 -1,-0.2 0.838 81.7 64.2 -53.5 -40.5 43.8 24.9 53.2 565 125 D R G 3 5S+ 0 0 158 -4,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.697 96.0 59.2 -62.5 -21.2 44.8 28.3 54.5 566 126 D F G < 5S- 0 0 50 -3,-1.2 -1,-0.3 -4,-0.0 -2,-0.2 0.201 131.4 -88.2 -91.3 13.7 41.2 29.5 53.7 567 127 D G T < 5S+ 0 0 55 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.436 76.2 149.3 98.8 -1.1 39.6 26.9 56.0 568 128 D L < - 0 0 7 -5,-1.2 2,-0.5 -8,-0.1 -1,-0.3 -0.496 31.4-155.3 -70.5 130.3 39.3 23.9 53.6 569 129 D D - 0 0 93 -19,-0.5 -17,-3.5 -2,-0.2 2,-0.3 -0.930 16.7-177.5-102.8 126.3 39.5 20.4 55.2 570 130 D T E -q 552 0I 44 -2,-0.5 -17,-0.2 -19,-0.2 -19,-0.1 -0.872 11.9-178.6-120.3 153.5 40.6 17.6 52.8 571 131 D X E -q 553 0I 44 -19,-1.9 -17,-1.8 -2,-0.3 2,-0.1 -0.975 34.0-108.5-145.0 138.1 41.0 13.8 53.1 572 132 D P E > -q 554 0I 40 0, 0.0 4,-2.3 0, 0.0 -17,-0.2 -0.391 21.6-130.3 -63.9 145.5 42.2 11.3 50.5 573 133 D L H > S+ 0 0 4 -19,-1.8 4,-3.3 2,-0.2 5,-0.2 0.905 109.2 56.9 -61.9 -39.8 39.5 9.0 49.2 574 134 D D H > S+ 0 0 115 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.892 111.5 41.3 -55.8 -45.3 41.9 6.0 49.9 575 135 D K H > S+ 0 0 136 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.840 113.4 54.7 -71.3 -35.2 42.1 7.0 53.5 576 136 D F H X S+ 0 0 7 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.947 107.4 49.2 -62.3 -48.7 38.4 7.8 53.6 577 137 D V H X S+ 0 0 18 -4,-3.3 4,-1.9 1,-0.2 3,-0.5 0.886 111.0 51.2 -59.1 -41.5 37.6 4.3 52.3 578 138 D K H < S+ 0 0 55 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.942 110.6 46.9 -60.0 -50.6 39.8 2.7 55.0 579 139 D E H < S+ 0 0 67 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.588 111.0 54.4 -71.6 -10.5 38.2 4.7 57.8 580 140 D V H < 0 0 19 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.878 360.0 360.0 -86.0 -43.2 34.8 3.8 56.6 581 141 D E < 0 0 164 -4,-1.9 -116,-0.0 -5,-0.1 -117,-0.0 -0.385 360.0 360.0 -80.3 360.0 35.3 -0.0 56.5