==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYTOKINE 22-MAY-08 3D87 . COMPND 2 MOLECULE: INTERLEUKIN-23 SUBUNIT P19; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.M.BEYER,R.INGRAM,L.RAMANATHAN,P.REICHERT,H.LE,V.MADISON . 914 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44761.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 583 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 198 21.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 99 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 17.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 1 0 0 0 0 0 0 0 2 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 3 1 0 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 PARALLEL BRIDGES PER LADDER . 8 8 8 7 2 4 1 2 2 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 . 5 1 3 0 0 1 1 0 0 0 0 1 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 R 0 0 297 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 174.3 47.7 3.7 -1.2 2 2 A A - 0 0 88 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.657 360.0 -88.5 -93.0 148.2 44.5 4.5 -3.0 3 3 A V - 0 0 110 -2,-0.3 -1,-0.1 1,-0.1 59,-0.0 -0.383 54.0-114.0 -60.7 125.1 42.1 6.9 -1.4 4 4 A P - 0 0 47 0, 0.0 59,-0.3 0, 0.0 58,-0.3 0.097 37.7-175.8 -46.8 172.7 39.9 4.7 0.9 5 5 A G + 0 0 42 57,-0.1 2,-0.5 56,-0.1 55,-0.0 -0.829 26.1 73.6-157.2-170.4 36.1 4.3 0.2 6 6 A G + 0 0 70 -2,-0.3 2,-0.2 0, 0.0 56,-0.0 -0.834 52.5 73.2 115.5-131.4 33.0 2.8 1.6 7 7 A S - 0 0 112 -2,-0.5 0, 0.0 1,-0.1 0, 0.0 -0.192 52.2-155.0 -47.8 106.0 30.6 3.3 4.5 8 8 A S - 0 0 93 -2,-0.2 -1,-0.1 1,-0.1 54,-0.0 -0.733 25.6-136.8 -80.3 126.8 28.3 6.3 3.7 9 9 A P - 0 0 30 0, 0.0 2,-2.0 0, 0.0 3,-0.2 -0.029 26.7 -80.2 -84.3-176.7 27.1 7.5 7.2 10 10 A A >> - 0 0 40 99,-0.3 4,-4.2 1,-0.2 3,-0.7 -0.493 49.3-178.4 -86.1 66.3 23.8 8.7 8.8 11 11 A W H 3> S+ 0 0 15 -2,-2.0 4,-5.5 1,-0.3 148,-0.2 0.799 82.0 46.2 -30.4 -51.3 24.2 12.2 7.2 12 12 A T H 3> S+ 0 0 102 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.920 115.8 44.5 -60.2 -51.8 20.9 13.2 8.9 13 13 A Q H <> S+ 0 0 89 -3,-0.7 4,-2.1 1,-0.2 -2,-0.2 0.922 120.9 42.6 -58.9 -45.7 22.0 11.6 12.2 14 14 A C H X S+ 0 0 0 -4,-4.2 4,-4.1 2,-0.2 5,-0.3 0.925 109.7 55.6 -68.1 -48.0 25.4 13.2 11.7 15 15 A Q H X S+ 0 0 25 -4,-5.5 4,-3.1 -5,-0.3 141,-0.2 0.942 116.6 36.7 -48.9 -56.7 24.1 16.5 10.5 16 16 A Q H X S+ 0 0 113 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.859 117.1 53.3 -65.0 -40.2 22.0 17.0 13.6 17 17 A L H X S+ 0 0 33 -4,-2.1 4,-1.0 -5,-0.3 -2,-0.2 0.940 114.3 40.9 -65.1 -40.7 24.7 15.5 15.7 18 18 A S H >X S+ 0 0 1 -4,-4.1 3,-1.6 2,-0.2 4,-1.4 0.975 109.3 59.6 -66.8 -56.8 27.3 17.8 14.4 19 19 A Q H 3X S+ 0 0 41 -4,-3.1 4,-1.0 1,-0.3 -1,-0.2 0.825 102.9 52.2 -38.3 -47.1 25.0 20.8 14.5 20 20 A K H >X S+ 0 0 83 -4,-2.0 4,-2.2 1,-0.2 3,-0.8 0.900 104.2 60.1 -59.8 -37.5 24.6 20.4 18.2 21 21 A L H < S+ 0 0 21 -4,-2.2 3,-0.8 1,-0.3 -2,-0.2 0.756 105.9 62.8 -53.8 -31.0 28.2 23.4 22.7 25 25 A A T 3< S+ 0 0 1 -4,-2.0 120,-0.4 1,-0.2 -1,-0.3 0.424 90.1 64.6 -82.1 2.4 31.6 24.6 21.5 26 26 A W T < + 0 0 40 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.1 0.015 65.8 126.8-109.2 27.7 31.0 28.3 21.7 27 27 A S < - 0 0 47 -3,-0.8 -1,-0.1 114,-0.1 -2,-0.1 0.941 41.9-178.5 -48.0 -72.2 30.5 28.2 25.5 28 28 A A - 0 0 41 -3,-0.1 6,-0.1 1,-0.1 3,-0.1 0.380 25.4-117.4 78.1 143.7 33.0 30.9 26.5 29 29 A H B > -A 33 0A 24 4,-0.6 4,-5.0 1,-0.2 -1,-0.1 -0.982 13.5-134.4-122.5 125.5 34.0 32.1 30.0 30 30 A P T 4 S+ 0 0 24 0, 0.0 531,-0.2 0, 0.0 -1,-0.2 0.858 108.0 37.4 -37.8 -53.8 33.4 35.7 31.1 31 31 A L T 4 S+ 0 0 0 1,-0.2 566,-0.1 2,-0.1 461,-0.1 0.827 122.0 41.9 -75.9 -34.8 36.9 35.9 32.5 32 32 A V T 4 S+ 0 0 0 1,-0.1 -1,-0.2 -3,-0.1 2,-0.1 0.947 90.5 179.9 -76.6 -47.2 38.7 33.9 29.9 33 33 A G B < -A 29 0A 11 -4,-5.0 2,-0.9 1,-0.1 -4,-0.6 -0.424 48.9 -17.9 77.0-159.1 36.8 35.5 27.1 34 34 A H S S- 0 0 45 520,-0.5 520,-0.1 -6,-0.1 -1,-0.1 -0.724 71.7-130.5 -97.1 105.9 37.5 34.5 23.5 35 35 A M - 0 0 3 -2,-0.9 2,-0.4 103,-0.1 -2,-0.1 -0.103 24.8-138.6 -50.7 127.6 40.8 32.8 23.0 36 36 A D - 0 0 78 1,-0.0 518,-0.1 2,-0.0 103,-0.0 -0.954 7.5-119.0-132.4 139.2 43.1 33.9 20.2 37 37 A L + 0 0 55 -2,-0.4 3,-0.1 102,-0.1 -2,-0.1 -0.626 36.1 154.0 161.5 -43.2 44.8 32.6 18.2 38 38 A R - 0 0 96 1,-0.1 309,-0.0 2,-0.1 2,-0.0 -0.006 47.6 -95.3 -41.0 117.7 48.6 32.9 17.8 39 39 A E 0 0 54 1,-0.1 -1,-0.1 307,-0.0 308,-0.1 -0.173 360.0 360.0 -80.8 170.9 50.3 29.9 16.1 40 40 A E 0 0 134 306,-0.1 -1,-0.1 -3,-0.1 -2,-0.1 -0.692 360.0 360.0 81.6 360.0 51.7 27.3 15.9 41 ! 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 42 48 A D 0 0 127 0, 0.0 82,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 81.5 49.5 19.9 18.0 43 49 A V - 0 0 37 80,-0.1 28,-0.1 100,-0.0 97,-0.0 -0.860 360.0 -99.6-174.6 143.3 45.9 19.3 17.1 44 50 A P - 0 0 17 0, 0.0 2,-0.3 0, 0.0 103,-0.1 -0.233 37.0-159.5 -72.1 163.2 44.3 17.8 13.9 45 51 A H - 0 0 41 102,-0.0 2,-1.1 301,-0.0 301,-0.1 -0.991 27.6-124.0-146.5 142.4 42.8 19.9 11.1 46 52 A I - 0 0 0 -2,-0.3 298,-3.2 299,-0.1 2,-0.1 -0.698 51.7-168.6 -82.8 105.8 40.4 19.6 8.2 47 53 A Q > - 0 0 95 -2,-1.1 3,-1.3 296,-0.2 5,-0.5 -0.432 34.0 -97.9 -94.2 175.3 42.9 20.7 5.5 48 54 A C G > S+ 0 0 74 1,-0.3 3,-0.8 -2,-0.1 5,-0.3 0.918 121.0 42.6 -49.6 -62.1 42.7 21.7 2.0 49 55 A G G 3 S+ 0 0 69 1,-0.2 -1,-0.3 2,-0.1 15,-0.0 0.350 90.2 94.7 -76.6 8.7 43.7 18.4 0.5 50 56 A D G < S- 0 0 7 -3,-1.3 -1,-0.2 13,-0.1 17,-0.2 0.355 89.9-125.2 -85.4 6.7 41.4 16.5 2.9 51 57 A G S < S+ 0 0 18 -3,-0.8 13,-0.2 1,-0.1 9,-0.2 0.595 74.1 119.4 65.8 16.8 38.4 16.4 0.6 52 58 A C + 0 0 4 -5,-0.5 -1,-0.1 4,-0.1 -4,-0.1 0.482 44.1 107.6 -89.7 -4.4 35.7 17.9 2.8 53 59 A D S >> S- 0 0 38 -5,-0.3 4,-3.2 1,-0.1 3,-1.0 -0.554 89.4-109.5 -71.9 137.5 35.1 20.7 0.3 54 60 A P H 3> S+ 0 0 22 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.803 117.7 53.9 -33.9 -45.2 31.8 20.1 -1.4 55 61 A Q H 3> S+ 0 0 129 2,-0.2 4,-1.4 1,-0.2 3,-0.4 0.918 114.7 38.2 -63.0 -46.5 33.6 19.3 -4.7 56 62 A G H <> S+ 0 0 16 -3,-1.0 4,-3.0 1,-0.2 -1,-0.2 0.921 107.2 66.7 -70.3 -41.0 35.7 16.6 -3.2 57 63 A L H < S+ 0 0 8 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.767 103.7 46.0 -48.4 -32.7 32.9 15.5 -1.0 58 64 A R H < S+ 0 0 199 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.900 113.0 47.8 -78.7 -44.7 31.1 14.3 -4.1 59 65 A D H < S- 0 0 140 -4,-1.4 2,-0.3 1,-0.2 -2,-0.2 0.986 139.3 -40.2 -57.3 -61.1 34.1 12.6 -5.6 60 66 A N < - 0 0 62 -4,-3.0 -1,-0.2 -9,-0.2 -55,-0.1 -0.833 49.2-175.6-152.3-172.4 34.7 10.9 -2.4 61 67 A S > + 0 0 21 -2,-0.3 4,-2.9 -57,-0.2 5,-0.2 0.242 59.4 101.2-175.9 2.6 34.6 11.9 1.2 62 68 A Q H > S+ 0 0 39 -58,-0.3 4,-3.0 2,-0.2 5,-0.2 0.934 87.5 48.0 -70.4 -45.5 35.8 8.9 3.1 63 69 A F H > S+ 0 0 83 -59,-0.3 4,-2.1 2,-0.2 5,-0.1 0.953 116.3 44.7 -59.2 -49.0 39.2 10.5 3.5 64 70 A C H >> S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 3,-1.2 0.988 114.7 45.8 -55.5 -65.6 37.6 13.7 4.7 65 71 A L H 3X S+ 0 0 9 -4,-2.9 4,-2.5 1,-0.3 -1,-0.2 0.837 110.8 57.9 -43.6 -37.1 35.1 11.9 7.0 66 72 A Q H 3X S+ 0 0 92 -4,-3.0 4,-1.8 1,-0.2 -1,-0.3 0.887 105.7 47.1 -65.0 -40.7 38.1 9.9 8.1 67 73 A R H X S+ 0 0 58 -4,-2.4 4,-2.3 -5,-0.2 3,-0.6 0.950 112.7 49.4 -55.3 -58.0 40.7 12.7 24.3 78 84 A L H 3< S+ 0 0 16 -4,-2.4 6,-0.5 1,-0.3 5,-0.4 0.891 108.3 52.7 -46.7 -54.1 41.6 16.3 25.3 79 85 A L H 3< S+ 0 0 7 -4,-2.8 5,-0.3 1,-0.2 -1,-0.3 0.844 111.0 48.1 -54.8 -37.0 38.2 17.0 26.7 80 86 A G H << S+ 0 0 36 -4,-1.8 -1,-0.2 -3,-0.6 -2,-0.2 0.890 95.4 94.9 -70.8 -40.4 38.5 13.9 28.9 81 87 A S S >< S- 0 0 30 -4,-2.3 3,-1.1 -5,-0.2 4,-0.4 0.122 99.9 -92.8 -46.9 167.4 42.0 14.7 30.1 82 88 A D T 3> S+ 0 0 72 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.543 112.3 87.8 -61.2 -10.8 42.6 16.5 33.4 83 89 A I T 34 S+ 0 0 11 -5,-0.4 -1,-0.3 1,-0.2 54,-0.2 0.967 103.5 23.3 -53.7 -56.6 42.6 19.7 31.4 84 90 A F T <4 S+ 0 0 10 -3,-1.1 6,-0.5 -6,-0.5 -1,-0.2 0.345 125.7 55.5 -91.6 3.3 38.8 20.1 31.7 85 91 A T T 4 S+ 0 0 94 -4,-0.4 -2,-0.2 4,-0.1 -3,-0.2 0.612 90.6 81.6-110.8 -13.6 38.8 17.9 34.8 86 92 A G S < S- 0 0 14 -4,-2.6 4,-0.5 1,-0.1 -3,-0.0 -0.077 93.9 -49.7 -73.8-179.3 41.2 20.0 36.9 87 93 A E S S+ 0 0 36 1,-0.2 47,-0.2 2,-0.2 -1,-0.1 -0.642 111.1 76.9 -93.5 155.9 39.9 23.1 38.6 88 94 A P S S- 0 0 2 0, 0.0 -1,-0.2 0, 0.0 409,-0.1 -0.344 100.6-143.4 -51.6 67.5 38.1 25.7 37.9 89 95 A S - 0 0 55 1,-0.1 2,-0.4 -4,-0.1 -2,-0.2 0.165 19.7-161.7 -27.1 108.6 36.4 22.4 38.4 90 96 A L - 0 0 57 -6,-0.5 -1,-0.1 -4,-0.5 405,-0.0 -0.898 17.6-109.4-109.8 133.6 33.4 22.2 35.9 91 97 A L > - 0 0 73 -2,-0.4 3,-1.9 1,-0.1 6,-0.5 -0.172 14.4-125.1 -62.8 143.3 30.5 19.8 36.2 92 98 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.533 115.2 54.6 -64.7 -4.9 29.6 16.8 33.9 93 99 A D T 3 S+ 0 0 116 4,-0.1 5,-0.2 5,-0.1 -2,-0.0 0.567 90.1 106.5-100.0 -16.5 26.2 18.3 33.3 94 100 A S S X> S- 0 0 9 -3,-1.9 4,-2.0 1,-0.1 3,-0.9 -0.070 93.9 -96.7 -59.5 162.3 27.9 21.6 32.1 95 101 A P H 3> S+ 0 0 62 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.856 130.2 52.1 -48.8 -40.2 28.1 22.6 28.4 96 102 A V H 3> S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.842 104.5 56.0 -68.1 -34.7 31.5 21.1 28.4 97 103 A G H <> S+ 0 0 17 -3,-0.9 4,-2.5 -6,-0.5 -1,-0.2 0.996 108.2 45.2 -59.9 -61.9 30.1 17.8 29.8 98 104 A Q H X S+ 0 0 81 -4,-2.0 4,-3.7 1,-0.2 -1,-0.2 0.774 111.2 62.2 -52.5 -23.9 27.6 17.4 27.0 99 105 A L H X S+ 0 0 0 -4,-1.0 4,-3.0 -5,-0.3 -2,-0.2 0.997 105.3 37.2 -64.9 -72.6 30.5 18.3 24.8 100 106 A H H X S+ 0 0 49 -4,-2.1 4,-1.9 1,-0.2 5,-0.3 0.943 119.3 57.4 -44.7 -44.9 33.0 15.5 25.4 101 107 A A H X S+ 0 0 55 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.942 111.8 36.0 -49.0 -64.6 29.7 13.5 25.6 102 108 A S H X S+ 0 0 15 -4,-3.7 4,-2.5 2,-0.2 -1,-0.2 0.740 112.1 61.3 -64.6 -29.7 28.5 14.5 22.0 103 109 A L H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 3,-0.3 0.998 108.9 40.7 -55.6 -74.1 32.0 14.5 20.5 104 110 A L H X S+ 0 0 53 -4,-1.9 4,-3.4 2,-0.2 5,-0.3 0.896 111.3 59.6 -35.4 -61.3 32.6 10.8 21.3 105 111 A G H X S+ 0 0 32 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.907 111.0 39.3 -39.2 -56.1 29.1 10.1 20.3 106 112 A L H X S+ 0 0 0 -4,-2.5 4,-0.5 -3,-0.3 -1,-0.3 0.811 111.5 58.6 -70.4 -27.4 29.7 11.4 16.8 107 113 A S H >X S+ 0 0 0 -4,-2.5 4,-2.7 -3,-0.3 3,-2.6 0.991 109.2 46.2 -57.0 -59.5 33.2 9.8 16.8 108 114 A Q H 3< S+ 0 0 72 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.827 104.9 60.4 -48.2 -43.6 31.4 6.5 17.3 109 115 A L H 3< S+ 0 0 44 -4,-1.9 -99,-0.3 -5,-0.3 -1,-0.3 0.648 114.3 36.0 -65.6 -11.5 28.9 7.4 14.6 110 116 A L H << S+ 0 0 26 -3,-2.6 -2,-0.2 -4,-0.5 -1,-0.2 0.790 138.3 12.2-105.5 -46.6 31.8 7.6 12.1 111 117 A Q S < S- 0 0 58 -4,-2.7 2,-5.0 -5,-0.1 3,-0.3 -0.852 73.0-147.7-136.6 91.1 34.1 4.9 13.3 112 118 A P S S- 0 0 98 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 -0.191 87.0 -31.6 -56.6 53.0 32.2 2.7 15.9 113 119 A E S S- 0 0 84 -2,-5.0 2,-4.2 -6,-0.1 6,-0.0 0.621 74.5-102.9 88.3 116.9 35.6 2.3 17.5 114 120 A G > - 0 0 3 -3,-0.3 3,-2.0 1,-0.2 -1,-0.1 0.063 56.2-102.6 -56.7 32.8 38.7 2.2 15.2 115 121 A H T 3 - 0 0 115 -2,-4.2 -1,-0.2 1,-0.3 3,-0.1 0.382 64.5 -91.2 57.9 -2.6 38.6 -1.6 15.7 116 122 A H T 3 S+ 0 0 95 1,-0.2 2,-0.6 4,-0.0 -1,-0.3 0.822 88.2 136.9 56.2 51.8 41.3 -0.2 17.9 117 123 A W S < S- 0 0 196 -3,-2.0 2,-0.2 3,-0.0 -1,-0.2 -0.986 85.8 -37.8-113.5 111.4 44.4 -0.5 15.7 118 124 A E S S+ 0 0 131 -2,-0.6 -4,-0.1 1,-0.2 0, 0.0 -0.491 76.1 141.9 70.7-128.2 46.2 2.8 16.3 119 125 A T + 0 0 38 -2,-0.2 -1,-0.2 -3,-0.1 -5,-0.1 0.743 48.1 120.3 67.2 20.5 43.7 5.7 16.7 120 126 A Q + 0 0 106 1,-0.1 -1,-0.0 2,-0.1 -3,-0.0 0.894 14.0 137.3 -82.0-102.1 46.1 6.9 19.4 121 127 A Q - 0 0 64 1,-0.2 -1,-0.1 2,-0.0 3,-0.1 0.802 47.1-162.6 51.7 30.8 47.9 10.3 19.3 122 128 A I - 0 0 66 1,-0.1 -1,-0.2 -45,-0.0 -2,-0.1 -0.272 33.2 -81.5 -50.8 116.2 47.0 10.4 23.0 123 129 A P - 0 0 33 0, 0.0 -1,-0.1 0, 0.0 -80,-0.1 0.601 35.9-104.6 -14.0 157.2 47.4 14.2 24.0 124 130 A S - 0 0 104 -82,-0.2 2,-0.2 1,-0.1 -2,-0.0 0.928 62.8-111.0 -54.5 -93.8 50.6 16.2 24.9 125 131 A L - 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0 0 127 3,-0.0 3,-0.4 2,-0.0 0, 0.0 0.622 360.0-143.7 -82.9 -16.3 48.8 40.7 52.8 505 46 C T - 0 0 57 1,-0.2 2,-0.8 2,-0.1 0, 0.0 0.595 24.3-103.3 59.0 143.4 47.4 41.5 49.3 506 47 C N S S- 0 0 152 1,-0.0 -1,-0.2 0, 0.0 78,-0.1 -0.214 72.2-144.1 -83.7 42.9 48.0 44.7 47.3 507 48 C D - 0 0 94 -2,-0.8 -2,-0.1 -3,-0.4 3,-0.1 0.655 20.9-138.8 -21.3 155.9 44.5 45.2 48.6 508 49 C V - 0 0 21 1,-0.1 2,-0.1 92,-0.0 -1,-0.1 -0.601 44.5 -76.9-106.7 170.6 41.5 46.8 47.1 509 50 C P - 0 0 23 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.443 49.1-158.3 -71.2 150.2 39.2 49.1 49.0 510 51 C H - 0 0 21 -2,-0.1 2,-3.1 -3,-0.1 298,-0.1 -0.998 27.6-123.0-132.8 136.2 36.8 47.3 51.3 511 52 C I - 0 0 0 -2,-0.4 295,-3.0 296,-0.1 6,-0.1 -0.481 59.5-172.3 -73.6 76.7 33.5 48.5 52.7 512 53 C Q > - 0 0 88 -2,-3.1 3,-1.6 293,-0.2 5,-0.3 -0.009 29.3 -73.6 -73.2 179.5 35.0 47.9 56.1 513 54 C C G >> S+ 0 0 80 1,-0.3 2,-1.1 293,-0.2 3,-0.7 0.865 121.0 23.2 -30.4 -95.9 33.8 47.9 59.6 514 55 C G G 34 S+ 0 0 65 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 -0.082 85.6 109.8 -76.2 38.9 33.3 51.4 60.8 515 56 C D G <4 S- 0 0 6 -3,-1.6 -1,-0.2 -2,-1.1 17,-0.2 0.472 91.9-117.4 -87.5 -0.6 32.9 52.8 57.2 516 57 C G T <4 S+ 0 0 15 -3,-0.7 13,-0.2 -4,-0.2 14,-0.1 0.856 77.0 128.0 70.0 44.8 29.3 53.2 58.5 517 58 C C < + 0 0 3 -4,-0.6 -3,-0.1 -5,-0.3 -1,-0.1 0.014 38.6 115.3-113.3 21.3 27.5 51.0 56.1 518 59 C D S > S- 0 0 38 1,-0.1 4,-0.6 -5,-0.1 5,-0.1 -0.433 84.8-109.8 -83.8 163.9 25.7 49.1 58.8 519 60 C P H >> S+ 0 0 30 0, 0.0 4,-0.8 0, 0.0 3,-0.5 0.965 121.9 40.0 -60.3 -39.5 22.0 49.4 59.0 520 61 C Q H >> S+ 0 0 151 1,-0.2 3,-1.6 2,-0.2 4,-0.8 0.975 107.6 56.3 -69.0 -60.7 22.6 51.5 62.1 521 62 C G H 34 S+ 0 0 22 1,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.567 106.6 57.0 -52.3 -5.5 25.6 53.6 61.2 522 63 C L H << S+ 0 0 2 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.776 83.2 77.0 -96.0 -33.4 23.5 54.7 58.2 523 64 C R H << S+ 0 0 87 -3,-1.6 -2,-0.2 -4,-0.8 3,-0.1 0.903 120.0 13.3 -41.7 -45.9 20.6 56.1 60.2 524 65 C D S < S+ 0 0 144 -4,-0.8 2,-0.4 1,-0.3 -2,-0.1 0.850 132.7 29.5 -96.2 -86.8 22.9 59.0 60.9 525 66 C N + 0 0 34 -4,-0.3 -1,-0.3 1,-0.2 -57,-0.1 -0.645 49.6 146.8 -84.2 133.9 26.0 59.1 58.7 526 67 C S > + 0 0 17 -2,-0.4 4,-3.3 -3,-0.1 5,-0.2 0.387 59.8 82.7-133.0 -17.2 25.9 57.7 55.1 527 68 C Q H > S+ 0 0 27 -60,-0.3 4,-2.4 2,-0.2 5,-0.2 0.908 93.6 43.8 -59.9 -48.7 28.4 60.1 53.5 528 69 C F H > S+ 0 0 75 -61,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.981 115.4 51.2 -61.5 -52.3 31.6 58.3 54.6 529 70 C C H > S+ 0 0 0 1,-0.2 4,-2.5 -13,-0.2 3,-0.2 0.925 111.7 45.5 -47.0 -55.0 30.0 55.0 53.7 530 71 C L H X S+ 0 0 5 -4,-3.3 4,-3.5 1,-0.2 5,-0.3 0.894 109.4 54.6 -60.0 -39.9 29.1 56.3 50.2 531 72 C Q H X S+ 0 0 77 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.872 111.1 47.7 -59.1 -39.6 32.5 57.9 49.7 532 73 C R H >X S+ 0 0 42 -4,-2.3 4,-1.7 -3,-0.2 3,-1.1 1.000 112.0 48.2 -60.1 -69.6 33.9 54.5 50.4 533 74 C I H >X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.3 3,-1.0 0.853 113.4 47.2 -33.0 -63.3 31.5 52.7 48.1 534 75 C H H 3X S+ 0 0 21 -4,-3.5 4,-2.4 1,-0.3 -1,-0.3 0.862 108.8 56.5 -53.2 -40.2 32.3 55.1 45.3 535 76 C Q H X S+ 0 0 91 -4,-2.0 3,-2.3 -5,-0.4 4,-1.4 0.980 107.2 57.4 -70.4 -52.4 39.7 51.2 37.0 543 84 C L H 3< S+ 0 0 13 -4,-2.9 6,-0.4 1,-0.3 -2,-0.2 0.796 98.9 57.3 -43.8 -44.6 40.8 47.6 37.2 544 85 C L H 3< S+ 0 0 9 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.799 107.0 52.9 -64.1 -22.9 38.5 46.4 34.5 545 86 C G H << S+ 0 0 30 -3,-2.3 5,-0.3 -4,-0.6 -2,-0.2 0.993 88.6 100.3 -68.9 -63.2 40.3 49.0 32.4 546 87 C S S >X S- 0 0 30 -4,-1.4 3,-2.1 1,-0.2 4,-1.7 0.376 94.2-105.4 -21.3 147.0 43.8 47.7 33.2 547 88 C D H 3> S+ 0 0 60 1,-0.3 4,-6.6 2,-0.2 -1,-0.2 0.704 111.6 88.8 -54.1 -16.8 45.5 45.5 30.6 548 89 C I H 34 S+ 0 0 5 1,-0.3 -1,-0.3 2,-0.2 49,-0.2 0.890 106.5 18.8 -48.7 -45.0 44.6 42.8 33.1 549 90 C F H <4 S+ 0 0 4 -3,-2.1 6,-3.3 -6,-0.4 -1,-0.3 0.640 129.9 53.3 -98.7 -19.7 41.3 42.5 31.4 550 91 C T H < S+ 0 0 63 -4,-1.7 -2,-0.2 -5,-0.3 -3,-0.2 0.910 98.1 78.9 -77.6 -45.5 42.6 44.1 28.2 551 92 C G S < S- 0 0 3 -4,-6.6 4,-0.2 1,-0.2 -3,-0.0 0.259 95.0 -20.8 -51.9-179.6 45.6 41.8 28.0 552 93 C E S S+ 0 0 92 1,-0.3 41,-0.3 2,-0.1 42,-0.2 -0.602 135.7 31.1 -78.0 135.5 45.5 38.2 26.6 553 94 C P S S- 0 0 4 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.167 102.2-148.0 -83.8 106.3 43.0 36.7 26.5 554 95 C S - 0 0 29 -4,-0.2 -520,-0.5 1,-0.1 2,-0.4 -0.006 5.0-132.9 -42.8 132.4 41.4 40.1 26.0 555 96 C L - 0 0 19 -6,-3.3 -290,-0.1 -4,-0.2 -1,-0.1 -0.735 24.2-124.6 -90.0 134.2 37.9 40.6 27.3 556 97 C L > - 0 0 72 -2,-0.4 6,-0.7 1,-0.1 3,-0.6 -0.547 14.5-119.5 -81.5 150.3 35.7 42.3 24.9 557 98 C P T 3 S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 8,-0.1 0.923 114.0 43.0 -51.4 -54.6 33.8 45.5 25.8 558 99 C D T 3 S+ 0 0 125 4,-0.1 5,-0.1 5,-0.1 -2,-0.0 0.655 92.9 110.6 -69.5 -16.2 30.2 44.1 25.4 559 100 C S S <> S- 0 0 21 -3,-0.6 4,-0.9 1,-0.1 5,-0.3 -0.283 95.1 -94.5 -59.9 148.6 31.3 40.9 27.2 560 101 C P H > S+ 0 0 39 0, 0.0 4,-0.9 0, 0.0 3,-0.3 0.744 126.9 53.7 -35.9 -33.4 29.8 40.4 30.7 561 102 C V H >> S+ 0 0 4 -531,-0.2 3,-4.7 1,-0.2 4,-1.3 0.985 102.2 50.7 -67.1 -75.1 32.9 42.1 32.0 562 103 C G H 34 S+ 0 0 26 -6,-0.7 -1,-0.2 1,-0.3 4,-0.1 0.545 108.8 57.2 -40.7 -7.4 33.0 45.3 30.0 563 104 C Q H 3X S+ 0 0 81 -4,-0.9 4,-2.7 -3,-0.3 -1,-0.3 0.712 102.2 51.8 -96.3 -26.3 29.3 45.7 31.2 564 105 C L H S+ 0 0 56 -5,-0.4 4,-3.7 2,-0.2 -2,-0.2 0.991 110.7 44.8 -71.3 -74.1 29.5 49.9 32.7 567 108 C S H X S+ 0 0 14 -4,-2.7 4,-4.8 2,-0.2 5,-0.3 0.838 115.9 49.8 -37.4 -51.2 27.5 49.4 35.8 568 109 C L H X S+ 0 0 0 -4,-2.8 4,-4.6 2,-0.3 5,-0.4 0.975 115.0 39.9 -53.7 -70.9 30.4 50.5 38.0 569 110 C L H X S+ 0 0 68 -4,-1.5 4,-1.8 2,-0.2 -1,-0.3 0.807 119.8 52.0 -49.7 -29.7 31.2 53.7 36.0 570 111 C G H X S+ 0 0 26 -4,-3.7 4,-0.8 2,-0.2 3,-0.3 0.995 114.6 37.5 -67.9 -67.1 27.5 54.0 35.9 571 112 C L H >< S+ 0 0 3 -4,-4.8 3,-1.6 1,-0.3 -2,-0.2 0.881 114.8 55.5 -51.0 -44.6 26.9 53.6 39.6 572 113 C S H >X S+ 0 0 7 -4,-4.6 3,-2.1 -5,-0.3 4,-2.0 0.946 104.5 55.6 -54.9 -44.8 30.1 55.6 40.4 573 114 C Q H 3< S+ 0 0 106 -4,-1.8 -1,-0.3 -5,-0.4 -2,-0.2 0.655 100.2 60.6 -61.4 -18.2 28.6 58.4 38.3 574 115 C L T << S+ 0 0 50 -3,-1.6 -101,-0.4 -4,-0.8 -1,-0.3 0.360 110.0 38.4 -94.0 6.6 25.5 58.4 40.4 575 116 C L T <4 S+ 0 0 26 -3,-2.1 -2,-0.2 1,-0.6 -3,-0.1 0.659 134.4 16.2-115.1 -53.3 27.3 59.3 43.6 576 117 C Q < - 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