==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-NOV-11 4AAA . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE-LIKE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.CANNING,M.VOLLMAR,C.D.O.COOPER,P.MAHAJAN,N.DAGA,G.BERRIDGE . 295 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15884.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 16 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 3 0 0 1 0 1 2 0 1 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 1 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 1 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 -4 A L 0 0 75 0, 0.0 2,-0.3 0, 0.0 57,-0.0 0.000 360.0 360.0 360.0 73.9 46.2 -5.3 84.6 2 -3 A Y - 0 0 206 1,-0.0 72,-0.5 73,-0.0 2,-0.5 -0.539 360.0-141.1 -61.5 129.7 43.3 -7.6 85.3 3 -2 A F - 0 0 77 -2,-0.3 72,-0.2 70,-0.1 2,-0.2 -0.848 14.4-152.9 -92.9 137.2 41.0 -7.7 82.3 4 -1 A Q B -a 75 0A 84 70,-2.5 72,-1.3 -2,-0.5 2,-0.3 -0.564 24.2 -93.9-102.7 169.1 37.3 -7.9 83.1 5 0 A S > - 0 0 59 -2,-0.2 3,-0.5 70,-0.2 72,-0.1 -0.645 12.1-152.3 -89.4 141.6 34.6 -9.4 81.0 6 1 A M G > S+ 0 0 34 70,-0.4 3,-1.7 -2,-0.3 -1,-0.1 0.566 81.8 89.3 -79.3 -13.1 32.4 -7.5 78.5 7 2 A E G 3 S+ 0 0 151 1,-0.3 -1,-0.2 3,-0.0 22,-0.0 0.733 77.5 61.1 -61.6 -25.9 29.6 -10.0 79.0 8 3 A K G < S+ 0 0 35 -3,-0.5 21,-3.6 20,-0.1 2,-0.3 0.588 90.8 87.9 -79.7 -4.7 28.0 -8.1 81.9 9 4 A Y E < -B 28 0A 23 -3,-1.7 2,-0.4 19,-0.2 19,-0.2 -0.726 56.7-164.7-100.6 140.2 27.4 -5.0 79.7 10 5 A E E -B 27 0A 75 17,-2.0 17,-2.3 -2,-0.3 2,-0.3 -0.985 25.8-115.9-123.5 133.3 24.3 -4.3 77.6 11 6 A N E +B 26 0A 125 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.483 33.7 168.7 -71.5 126.8 24.1 -1.7 74.9 12 7 A L E - 0 0 76 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.579 62.4 -57.0-102.3 -22.9 21.7 1.2 75.4 13 8 A G E -B 25 0A 36 12,-1.1 12,-2.5 2,-0.0 2,-0.5 -0.959 62.4 -68.5 166.1 178.5 22.9 3.5 72.6 14 9 A L E > -B 24 0A 61 -2,-0.3 3,-2.3 10,-0.2 10,-0.2 -0.928 55.0-107.0 -94.5 135.2 25.9 5.4 71.3 15 10 A V G > >S+ 0 0 27 8,-2.4 5,-0.7 -2,-0.5 3,-0.6 -0.369 107.5 6.8 -55.6 119.7 27.1 8.2 73.5 16 11 A G G > 5S- 0 0 22 1,-0.2 3,-2.0 -2,-0.2 -1,-0.3 0.642 115.4 -90.9 73.7 13.2 26.1 11.4 71.6 17 12 A E G < 5S- 0 0 176 -3,-2.3 -1,-0.2 1,-0.3 -2,-0.1 0.836 94.7 -36.5 54.9 40.7 24.1 9.5 68.9 18 13 A G G X 5S+ 0 0 39 -3,-0.6 3,-2.1 3,-0.3 -1,-0.3 0.017 112.5 108.5 102.8 -20.4 27.1 9.2 66.6 19 14 A S T < 5S+ 0 0 86 -3,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.713 89.6 38.8 -69.7 -13.6 28.8 12.5 67.2 20 15 A Y T 3 -B 9 0A 19 5,-2.8 4,-2.8 -2,-0.5 -19,-0.2 -0.747 17.3-150.1 -76.2 113.2 26.1 -3.2 83.9 29 24 A K T 4 S+ 0 0 118 -21,-3.6 -1,-0.2 -2,-0.7 -20,-0.1 0.707 92.2 47.6 -63.3 -22.1 23.6 -6.1 84.2 30 25 A D T 4 S+ 0 0 134 -22,-0.3 -1,-0.2 1,-0.1 -21,-0.1 0.869 127.9 17.9 -85.8 -40.0 24.8 -6.8 87.8 31 26 A T T 4 S- 0 0 67 -3,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.562 90.4-128.1-109.4 -15.8 24.9 -3.4 89.4 32 27 A G < + 0 0 37 -4,-2.8 -3,-0.1 1,-0.2 2,-0.0 0.328 59.6 142.4 77.0 -5.3 22.7 -1.3 87.1 33 28 A R - 0 0 181 -5,-0.1 -5,-2.8 -6,-0.1 2,-0.4 -0.299 48.3-124.0 -75.6 155.1 25.3 1.4 86.7 34 29 A I E +C 27 0A 45 -7,-0.2 53,-2.1 53,-0.2 2,-0.3 -0.793 30.6 177.8-104.6 136.0 25.9 3.1 83.4 35 30 A V E -CD 26 86A 5 -9,-2.8 -9,-2.3 -2,-0.4 2,-0.4 -0.875 28.2-130.3-133.8 161.5 29.3 3.2 81.6 36 31 A A E -CD 25 85A 16 49,-2.4 49,-3.0 -2,-0.3 2,-0.4 -0.984 27.1-163.9-110.3 131.0 30.9 4.6 78.4 37 32 A I E +CD 24 84A 1 -13,-2.4 -13,-2.3 -2,-0.4 2,-0.4 -0.949 10.6 175.9-122.1 130.4 32.9 1.9 76.5 38 33 A K E -CD 23 83A 46 45,-2.1 45,-2.4 -2,-0.4 2,-0.2 -0.996 35.2-111.1-135.2 137.3 35.5 2.7 73.8 39 34 A K E + D 0 82A 100 -17,-0.5 43,-0.3 -2,-0.4 3,-0.1 -0.522 36.2 173.6 -67.4 137.5 37.8 0.4 71.9 40 35 A F E + 0 0 42 41,-3.2 2,-0.4 1,-0.4 42,-0.2 0.719 61.6 26.4-115.5 -44.2 41.4 1.1 72.9 41 36 A L E - D 0 81A 13 40,-1.8 40,-1.7 1,-0.1 -1,-0.4 -0.998 54.1-160.2-130.1 132.1 43.6 -1.6 71.3 42 37 A E S S+ 0 0 108 -2,-0.4 2,-0.4 1,-0.3 37,-0.1 0.911 81.7 5.8 -75.1 -47.6 42.8 -3.5 68.1 43 38 A S - 0 0 32 3,-0.1 3,-0.5 37,-0.1 -1,-0.3 -0.979 46.6-160.1-144.2 134.0 45.2 -6.4 68.7 44 39 A D S S+ 0 0 32 35,-1.0 36,-0.1 -2,-0.4 -1,-0.1 0.319 86.7 82.5 -88.2 4.6 47.4 -7.4 71.6 45 40 A D S S+ 0 0 102 1,-0.1 2,-1.2 34,-0.1 -1,-0.2 0.853 73.1 81.6 -65.9 -40.5 49.5 -9.6 69.2 46 41 A D > - 0 0 79 -3,-0.5 4,-2.3 1,-0.2 5,-0.1 -0.575 67.0-171.0 -68.9 96.1 51.4 -6.4 68.3 47 42 A K H > S+ 0 0 85 -2,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.789 78.6 59.6 -65.3 -28.9 53.8 -6.3 71.2 48 43 A M H > S+ 0 0 129 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.976 113.1 33.5 -61.8 -60.8 55.0 -2.8 70.3 49 44 A V H > S+ 0 0 54 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.839 112.9 64.4 -69.5 -31.6 51.6 -1.0 70.6 50 45 A K H X S+ 0 0 66 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.948 102.3 48.0 -51.0 -53.2 50.6 -3.3 73.4 51 46 A K H X S+ 0 0 129 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.885 112.7 49.1 -57.8 -38.2 53.5 -1.9 75.6 52 47 A I H X S+ 0 0 64 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.927 111.0 49.9 -68.4 -45.7 52.4 1.7 74.7 53 48 A A H X S+ 0 0 6 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.902 110.2 49.7 -59.5 -40.6 48.7 0.9 75.5 54 49 A M H X S+ 0 0 70 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.863 108.4 54.2 -70.0 -34.4 49.7 -0.6 78.9 55 50 A R H X S+ 0 0 146 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.898 110.3 46.8 -58.9 -44.0 51.8 2.5 79.6 56 51 A E H X S+ 0 0 50 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.891 110.1 52.1 -69.8 -39.7 48.7 4.7 78.9 57 52 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.923 107.6 53.0 -61.8 -44.9 46.4 2.5 81.1 58 53 A K H X S+ 0 0 75 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.912 109.3 49.0 -56.2 -43.3 48.9 2.8 84.0 59 54 A L H X S+ 0 0 62 -4,-1.8 4,-2.1 1,-0.2 3,-0.4 0.938 109.9 51.6 -61.1 -44.7 48.8 6.6 83.6 60 55 A L H < S+ 0 0 29 -4,-2.5 11,-0.3 1,-0.2 -2,-0.2 0.880 107.5 53.0 -62.7 -35.7 45.0 6.6 83.6 61 56 A K H < S+ 0 0 80 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.830 115.4 40.3 -66.4 -32.6 44.8 4.5 86.7 62 57 A Q H < S+ 0 0 157 -4,-1.3 2,-1.7 -3,-0.4 -2,-0.2 0.726 95.7 80.7 -87.7 -26.8 47.1 7.0 88.6 63 58 A L < + 0 0 18 -4,-2.1 2,-0.4 -5,-0.1 -1,-0.2 -0.528 62.7 157.7 -87.3 75.9 45.6 10.2 87.3 64 59 A R + 0 0 109 -2,-1.7 2,-0.3 -3,-0.1 5,-0.1 -0.838 2.9 145.1-110.2 127.3 42.7 10.4 89.6 65 60 A H > - 0 0 63 -2,-0.4 3,-1.9 3,-0.3 53,-0.0 -0.971 57.6-111.3-157.0 154.4 40.9 13.7 90.4 66 61 A E T 3 S+ 0 0 120 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.739 118.2 49.9 -60.6 -26.5 37.4 14.9 91.1 67 62 A N T 3 S+ 0 0 5 79,-0.1 80,-2.6 50,-0.1 2,-0.4 0.173 97.1 83.9-103.5 17.6 37.4 16.8 87.7 68 63 A L B < S-f 147 0B 12 -3,-1.9 -3,-0.3 78,-0.3 80,-0.2 -0.968 87.3-104.3-114.5 140.7 38.5 13.8 85.6 69 64 A V - 0 0 28 78,-2.7 2,-0.6 -2,-0.4 -4,-0.1 -0.261 42.2-115.5 -57.1 137.5 36.4 11.1 84.1 70 65 A N - 0 0 61 16,-0.1 16,-2.3 -4,-0.1 2,-0.6 -0.722 15.1-146.1 -84.9 116.6 36.8 7.9 86.1 71 66 A L E + E 0 85A 6 -2,-0.6 14,-0.2 -11,-0.3 3,-0.1 -0.663 20.2 179.2 -73.6 120.3 38.4 4.8 84.4 72 67 A L E - 0 0 83 12,-2.7 2,-0.3 -2,-0.6 13,-0.2 0.880 52.6 -25.7 -91.5 -47.2 36.6 1.8 85.9 73 68 A E E - E 0 84A 39 11,-1.4 11,-2.5 -69,-0.0 2,-0.5 -0.983 46.8-120.6-162.9 166.6 38.1 -1.2 84.1 74 69 A V E - E 0 83A 3 -72,-0.5 -70,-2.5 -2,-0.3 2,-0.3 -0.986 30.9-163.6-118.1 129.8 39.8 -2.6 81.1 75 70 A C E -aE 4 82A 0 7,-2.7 7,-2.8 -2,-0.5 2,-0.4 -0.867 7.3-154.1-114.9 154.2 38.1 -5.4 79.3 76 71 A K E + E 0 81A 49 -72,-1.3 2,-0.4 -2,-0.3 -70,-0.4 -0.995 11.1 178.9-128.9 127.1 39.4 -7.8 76.7 77 72 A K E > S- E 0 80A 101 3,-2.4 3,-2.2 -2,-0.4 2,-0.3 -0.986 71.7 -44.1-128.7 117.2 37.2 -9.5 74.1 78 73 A K T 3 S- 0 0 172 -2,-0.4 -35,-0.0 1,-0.3 0, 0.0 -0.451 124.6 -26.5 56.6-117.9 39.2 -11.8 71.9 79 74 A K T 3 S+ 0 0 102 -2,-0.3 -35,-1.0 -37,-0.1 2,-0.3 0.474 118.4 96.5-102.0 -3.8 42.4 -9.8 71.1 80 75 A R E < - E 0 77A 81 -3,-2.2 -3,-2.4 -37,-0.2 2,-0.4 -0.655 59.4-148.0 -94.8 143.9 40.8 -6.3 71.5 81 76 A W E -DE 41 76A 1 -40,-1.7 -41,-3.2 -2,-0.3 -40,-1.8 -0.890 11.8-167.3-109.1 144.6 41.0 -4.1 74.6 82 77 A Y E -DE 39 75A 27 -7,-2.8 -7,-2.7 -2,-0.4 2,-0.4 -0.968 14.2-138.9-129.4 142.7 38.3 -1.8 75.7 83 78 A L E -DE 38 74A 9 -45,-2.4 -45,-2.1 -2,-0.4 2,-0.5 -0.858 14.2-155.6-102.2 136.6 38.3 1.0 78.3 84 79 A V E -DE 37 73A 0 -11,-2.5 -12,-2.7 -2,-0.4 -11,-1.4 -0.968 14.6-176.6-116.5 117.5 35.2 1.4 80.5 85 80 A F E -DE 36 71A 40 -49,-3.0 -49,-2.4 -2,-0.5 -14,-0.2 -0.811 36.4 -94.9-111.3 152.9 34.6 4.8 82.0 86 81 A E E -D 35 0A 48 -16,-2.3 2,-0.4 -2,-0.3 -51,-0.2 -0.462 46.8-118.1 -56.5 132.5 31.9 6.0 84.4 87 82 A F - 0 0 42 -53,-2.1 2,-0.4 -2,-0.1 -53,-0.2 -0.674 24.8-152.1 -80.4 135.1 29.1 7.5 82.4 88 83 A V - 0 0 15 -2,-0.4 52,-0.1 1,-0.1 51,-0.1 -0.849 17.2-126.5-109.6 139.5 28.5 11.2 83.1 89 84 A D S S- 0 0 85 -2,-0.4 2,-0.2 49,-0.1 51,-0.2 0.818 72.0 -14.6 -68.1 -34.5 25.0 12.5 82.6 90 85 A H E -G 139 0B 48 49,-2.0 49,-2.7 -3,-0.0 2,-0.3 -0.775 55.3-121.5-149.2-174.8 25.6 15.5 80.2 91 86 A T E >> -G 138 0B 14 47,-0.3 3,-1.4 -2,-0.2 4,-1.0 -0.892 39.5-100.4-127.2 169.8 28.0 18.0 78.7 92 87 A I H 3> S+ 0 0 1 45,-2.0 4,-1.9 42,-0.6 5,-0.1 0.778 120.0 66.7 -64.6 -21.5 28.2 21.8 78.7 93 88 A L H 3> S+ 0 0 71 41,-0.4 4,-1.1 44,-0.2 -1,-0.3 0.812 94.1 58.0 -67.9 -27.6 26.7 21.7 75.2 94 89 A D H <> S+ 0 0 75 -3,-1.4 4,-1.6 2,-0.2 3,-0.3 0.903 105.8 49.0 -63.8 -42.4 23.5 20.3 76.8 95 90 A D H X S+ 0 0 28 -4,-1.0 4,-2.1 1,-0.2 -2,-0.2 0.912 110.8 50.7 -61.3 -43.9 23.3 23.5 79.0 96 91 A L H < S+ 0 0 18 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.721 103.1 58.8 -72.1 -19.3 23.9 25.6 75.9 97 92 A E H < S+ 0 0 155 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.870 110.9 42.5 -72.4 -40.2 21.0 23.8 74.0 98 93 A L H < S+ 0 0 131 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.882 128.3 31.6 -68.0 -38.4 18.6 24.9 76.8 99 94 A F S >< S+ 0 0 112 -4,-2.1 3,-2.0 -5,-0.2 -1,-0.2 -0.715 70.2 171.1-122.0 75.4 20.2 28.4 76.9 100 95 A P T 3 S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.646 76.2 54.6 -72.6 -12.2 21.3 29.1 73.4 101 96 A N T 3 S- 0 0 146 1,-0.3 2,-0.1 92,-0.0 92,-0.1 0.265 124.4 -66.9 -98.5 11.6 22.1 32.8 74.1 102 97 A G < - 0 0 15 -3,-2.0 -1,-0.3 -6,-0.2 88,-0.2 -0.267 50.4 -86.2 123.9 158.6 24.4 32.0 77.1 103 98 A L - 0 0 14 86,-2.9 -7,-0.0 1,-0.1 5,-0.0 -0.467 51.6 -79.8 -97.0 163.9 24.6 30.6 80.5 104 99 A D > - 0 0 103 -2,-0.2 4,-2.6 1,-0.1 3,-0.3 -0.283 41.0-119.9 -60.1 140.5 24.0 32.2 83.9 105 100 A Y H > S+ 0 0 87 1,-0.3 4,-2.4 2,-0.2 -1,-0.1 0.893 114.0 45.3 -54.2 -46.6 27.1 34.2 85.3 106 101 A Q H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.834 109.1 55.6 -71.0 -33.6 27.4 32.0 88.3 107 102 A V H > S+ 0 0 45 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.915 109.5 48.5 -57.9 -46.8 27.0 28.8 86.3 108 103 A V H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.4 0.927 110.1 51.4 -60.7 -44.4 29.9 30.0 84.1 109 104 A Q H X S+ 0 0 15 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.930 112.2 46.3 -57.6 -46.8 32.0 30.7 87.2 110 105 A K H X S+ 0 0 60 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.904 115.4 44.9 -67.1 -40.0 31.3 27.2 88.6 111 106 A Y H X S+ 0 0 20 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.955 115.4 45.7 -69.9 -47.9 32.1 25.4 85.4 112 107 A L H X S+ 0 0 1 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.901 109.6 56.3 -63.3 -38.4 35.3 27.4 84.6 113 108 A F H X S+ 0 0 5 -4,-2.4 4,-2.1 -5,-0.4 -1,-0.2 0.941 112.4 42.0 -54.8 -45.9 36.5 27.0 88.2 114 109 A Q H X S+ 0 0 4 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.884 111.8 52.9 -73.6 -37.5 36.3 23.2 87.9 115 110 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.938 112.0 47.6 -58.6 -48.3 37.7 23.1 84.3 116 111 A I H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.890 110.8 51.1 -60.0 -42.5 40.7 25.1 85.6 117 112 A N H X S+ 0 0 48 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.916 112.9 45.9 -61.5 -47.3 41.1 22.8 88.7 118 113 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.939 116.6 42.5 -62.1 -49.3 41.0 19.7 86.5 119 114 A I H X S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.2 5,-0.2 0.911 112.1 56.0 -64.4 -39.4 43.5 21.0 83.9 120 115 A G H X S+ 0 0 17 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.876 106.2 50.6 -58.5 -40.4 45.7 22.5 86.7 121 116 A F H X S+ 0 0 42 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.944 111.9 47.7 -63.9 -49.1 45.9 19.0 88.3 122 117 A C H ><>S+ 0 0 0 -4,-2.1 5,-2.4 1,-0.2 3,-1.4 0.941 111.2 50.6 -54.0 -51.3 47.0 17.5 84.9 123 118 A H H ><5S+ 0 0 14 -4,-3.1 3,-1.8 1,-0.3 -1,-0.2 0.827 101.4 61.8 -59.1 -34.0 49.5 20.3 84.4 124 119 A S H 3<5S+ 0 0 87 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.731 109.0 43.8 -64.4 -22.1 51.0 19.7 87.9 125 120 A H T <<5S- 0 0 104 -3,-1.4 -1,-0.3 -4,-0.8 -2,-0.2 0.087 123.0-106.0-104.9 15.9 51.8 16.2 86.6 126 121 A N T < 5S+ 0 0 126 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.836 75.5 139.4 60.2 33.7 53.1 17.4 83.2 127 122 A I < - 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0 0 50 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.228 20.7-117.5 -63.9 155.6 31.6 43.0 81.6 252 258 A E H > S+ 0 0 176 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.798 114.6 57.5 -58.6 -36.3 35.2 44.2 81.7 253 259 A V H > S+ 0 0 30 2,-0.2 4,-2.0 1,-0.2 27,-0.3 0.916 109.0 44.1 -64.4 -45.6 36.1 41.5 84.2 254 260 A V H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.926 114.0 49.7 -63.8 -48.0 35.0 38.7 81.9 255 261 A I H X S+ 0 0 4 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.918 109.5 53.0 -56.6 -43.7 36.6 40.3 78.8 256 262 A D H X S+ 0 0 54 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.911 107.8 50.0 -62.6 -43.2 39.9 40.7 80.8 257 263 A L H X S+ 0 0 3 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.951 113.6 45.5 -59.6 -48.8 39.9 37.0 81.8 258 264 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.922 111.0 52.7 -60.9 -45.1 39.4 36.0 78.2 259 265 A K H < S+ 0 0 85 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.863 107.9 51.6 -59.0 -38.9 42.0 38.4 76.9 260 266 A K H >< S+ 0 0 94 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.933 112.6 45.5 -65.1 -42.8 44.7 37.1 79.3 261 267 A C H 3< S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.821 111.6 53.8 -69.4 -31.1 44.0 33.5 78.2 262 268 A L T 3< S+ 0 0 2 -4,-2.0 -1,-0.3 -5,-0.2 2,-0.2 -0.049 71.0 150.1 -99.2 30.7 44.1 34.4 74.6 263 269 A H < - 0 0 72 -3,-1.0 6,-0.1 1,-0.2 5,-0.1 -0.459 49.0-136.5 -59.8 131.9 47.4 36.1 74.4 264 270 A I S S+ 0 0 23 -52,-0.2 -48,-0.3 -2,-0.2 -1,-0.2 0.837 93.6 68.7 -61.4 -25.8 48.8 35.7 71.0 265 271 A D S > S- 0 0 27 1,-0.2 3,-2.0 -50,-0.1 4,-0.4 -0.830 76.2-152.0 -96.0 109.9 52.2 34.9 72.6 266 272 A P G > S+ 0 0 26 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.810 94.5 60.9 -51.4 -32.6 52.1 31.5 74.5 267 273 A D G 3 S+ 0 0 147 1,-0.2 -3,-0.0 -3,-0.1 -2,-0.0 0.646 101.3 52.9 -72.0 -13.2 54.7 32.7 76.8 268 274 A K G < S+ 0 0 139 -3,-2.0 -1,-0.2 -5,-0.1 -4,-0.1 0.401 85.1 101.0-104.3 2.6 52.6 35.6 78.0 269 275 A R S < S- 0 0 14 -3,-1.1 -8,-0.2 -4,-0.4 3,-0.1 -0.538 79.5-106.6 -77.5 148.0 49.5 33.6 78.9 270 276 A P - 0 0 23 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.342 35.7 -97.2 -65.5 161.5 49.0 32.8 82.6 271 277 A F >> - 0 0 151 1,-0.1 4,-0.8 -92,-0.0 3,-0.5 -0.488 39.1-111.9 -69.1 151.5 49.6 29.4 84.1 272 278 A C G >4 S+ 0 0 3 1,-0.2 3,-1.6 2,-0.2 4,-0.4 0.936 118.2 50.5 -52.0 -51.2 46.3 27.5 84.4 273 279 A A G >4 S+ 0 0 62 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.814 101.1 63.6 -62.4 -27.5 46.3 27.6 88.2 274 280 A E G X4 S+ 0 0 82 -3,-0.5 3,-1.5 1,-0.2 -1,-0.3 0.727 86.0 75.3 -68.6 -20.5 47.0 31.4 88.1 275 281 A L G X< S+ 0 0 5 -3,-1.6 3,-1.7 -4,-0.8 6,-0.3 0.822 84.2 63.4 -60.5 -32.0 43.6 31.9 86.4 276 282 A L G < S+ 0 0 28 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.688 93.1 64.4 -69.1 -16.2 41.8 31.2 89.8 277 283 A H G < S+ 0 0 133 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.501 80.7 112.7 -76.9 -10.1 43.5 34.4 91.1 278 284 A H S X> S- 0 0 22 -3,-1.7 4,-1.8 -4,-0.2 3,-1.4 -0.352 81.9-115.8 -70.8 151.0 41.6 36.5 88.7 279 285 A D H 3> S+ 0 0 99 1,-0.3 4,-2.6 2,-0.2 -1,-0.1 0.800 111.3 70.8 -52.1 -32.9 38.9 39.0 89.8 280 286 A F H 34 S+ 0 0 1 -27,-0.3 -1,-0.3 1,-0.2 -4,-0.1 0.892 113.2 26.9 -55.2 -38.0 36.3 36.9 87.9 281 287 A F H <4 S+ 0 0 0 -3,-1.4 6,-1.9 -6,-0.3 -1,-0.2 0.735 122.6 51.5 -93.2 -27.6 36.7 34.2 90.5 282 288 A Q H >< S+ 0 0 88 -4,-1.8 3,-2.1 4,-0.2 -3,-0.2 0.778 78.5 110.4 -88.1 -24.6 37.8 36.3 93.5 283 289 A M G >< S+ 0 0 77 -4,-2.6 3,-1.9 1,-0.3 4,-0.1 -0.192 93.7 1.4 -54.0 133.6 35.0 38.9 93.5 284 290 A D G 3 S- 0 0 146 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.627 122.8 -76.7 61.2 18.3 32.6 38.5 96.4 285 291 A G G <> S+ 0 0 17 -3,-2.1 4,-2.1 3,-0.1 5,-0.3 0.740 85.0 150.5 64.8 25.5 34.6 35.6 97.7 286 292 A F H <> + 0 0 7 -3,-1.9 4,-3.3 1,-0.2 5,-0.3 0.935 68.7 52.2 -48.8 -50.9 33.1 33.3 95.1 287 293 A A H > S+ 0 0 6 -6,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.898 111.6 41.3 -61.3 -49.3 36.3 31.2 95.0 288 294 A E H > S+ 0 0 124 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.955 117.9 48.7 -62.1 -48.3 36.7 30.5 98.7 289 295 A R H X S+ 0 0 130 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.917 114.4 44.8 -56.6 -50.0 33.0 29.9 99.2 290 296 A F H X S+ 0 0 6 -4,-3.3 4,-2.2 -5,-0.3 -1,-0.2 0.870 111.3 53.1 -67.4 -36.7 32.8 27.5 96.2 291 297 A S H X S+ 0 0 40 -4,-2.3 4,-1.7 -5,-0.3 -2,-0.2 0.961 110.5 46.7 -59.6 -51.0 35.9 25.6 97.2 292 298 A Q H X S+ 0 0 127 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.834 110.4 55.0 -60.9 -36.2 34.5 25.0 100.7 293 299 A E H < S+ 0 0 106 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.932 104.9 51.9 -60.7 -48.7 31.3 23.9 99.1 294 300 A L H < S+ 0 0 73 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.827 113.1 44.9 -62.2 -36.0 33.0 21.3 96.9 295 301 A Q H < 0 0 146 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.965 360.0 360.0 -66.1 -57.5 34.7 19.7 99.9 296 302 A L < 0 0 123 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.2 0.997 360.0 360.0 -62.6 360.0 31.7 19.7 102.2