==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-DEC-10 3PVB . COMPND 2 MOLECULE: CAMP-DEPENDENT PROTEIN KINASE CATALYTIC SUBUNIT A . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR A.J.BOETTCHER,J.WU,C.KIM,J.YANG,J.BRUYSTENS,N.CHEUNG,J.K.PEN . 505 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22704.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 1 0.2 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 . 36 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 25.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 5 2 2 0 0 0 3 0 0 2 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 7 3 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 2 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 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 6 A A 0 0 151 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 97.3 58.4 59.8 -9.1 2 7 A K >> + 0 0 60 0, 0.0 3,-2.5 0, 0.0 4,-0.5 0.167 360.0 151.8 169.8 -5.0 59.6 58.2 -5.9 3 8 A K T 34 S- 0 0 116 1,-0.3 3,-0.1 2,-0.1 0, 0.0 0.579 85.1 -16.1 -5.3 -88.8 59.2 61.2 -3.5 4 9 A G T >4 S+ 0 0 47 1,-0.1 3,-1.9 2,-0.1 4,-0.4 -0.272 94.2 130.5-126.0 41.3 58.6 59.6 -0.1 5 10 A X T <> + 0 0 157 -3,-2.5 4,-1.5 1,-0.3 3,-0.2 0.735 58.9 78.5 -65.6 -22.3 57.8 56.2 -1.6 6 11 A E H 3X S+ 0 0 56 -4,-0.5 4,-0.7 1,-0.2 -1,-0.3 0.687 88.2 67.9 -60.1 -12.6 60.4 55.0 0.9 7 12 A Q H X> S+ 0 0 66 -3,-1.9 4,-1.9 2,-0.2 3,-0.7 0.967 97.7 37.5 -72.7 -59.3 57.3 55.5 3.1 8 13 A E H 3> S+ 0 0 109 -4,-0.4 4,-3.5 1,-0.2 5,-0.3 0.827 106.1 72.6 -66.0 -29.5 54.6 52.9 2.1 9 14 A S H 3X S+ 0 0 66 -4,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.895 105.9 35.6 -51.7 -42.4 57.5 50.4 1.6 10 15 A V H S+ 0 0 35 -3,-0.7 4,-3.9 -4,-0.7 5,-0.5 0.972 113.3 55.6 -73.9 -58.7 57.8 50.3 5.4 11 16 A K H X5S+ 0 0 49 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.908 115.9 42.4 -38.1 -53.8 54.1 50.6 6.2 12 17 A E H X5S+ 0 0 110 -4,-3.5 4,-2.6 2,-0.2 5,-0.3 0.979 116.2 44.8 -59.7 -63.9 53.7 47.5 4.0 13 18 A F H X5S+ 0 0 63 -4,-2.5 4,-3.0 -5,-0.3 -2,-0.2 0.902 114.6 49.3 -48.3 -51.9 56.8 45.5 5.2 14 19 A L H X5S+ 0 0 33 -4,-3.9 4,-2.6 1,-0.2 -1,-0.3 0.934 110.7 51.0 -54.0 -46.7 56.0 46.2 8.8 15 20 A A H XX S+ 0 0 143 -4,-1.8 4,-1.3 2,-0.2 3,-0.9 0.999 112.3 46.8 -62.4 -68.1 51.0 39.0 9.9 20 25 A D H 3X S+ 0 0 69 -4,-2.1 4,-1.1 1,-0.3 3,-0.3 0.806 108.9 57.6 -42.0 -43.5 53.8 36.4 9.6 21 26 A F H >X S+ 0 0 3 -4,-2.4 4,-2.1 -5,-0.3 3,-1.1 0.946 103.7 52.9 -54.9 -50.7 54.7 36.9 13.3 22 27 A L H S+ 0 0 24 -2,-0.3 3,-2.5 1,-0.2 -1,-0.1 0.927 106.8 73.1 -57.7 -50.0 72.0 16.4 21.3 36 41 A D T 3 S+ 0 0 94 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.740 89.6 54.6 -30.8 -58.1 73.2 13.3 19.3 37 42 A Q T 3 S+ 0 0 50 -3,-0.4 21,-4.8 20,-0.1 2,-0.4 0.460 101.8 72.7 -66.4 -1.0 73.6 14.9 15.8 38 43 A F E < -A 57 0A 3 -3,-2.5 2,-0.6 19,-0.3 19,-0.2 -0.920 61.9-155.7-120.6 143.0 76.0 17.6 17.2 39 44 A D E -A 56 0A 103 17,-2.5 17,-1.2 -2,-0.4 2,-0.2 -0.921 24.3-130.7-120.0 108.3 79.5 17.5 18.4 40 45 A R + 0 0 113 -2,-0.6 15,-0.1 15,-0.2 3,-0.1 -0.354 31.9 173.9 -55.9 118.8 80.4 20.3 20.8 41 46 A I - 0 0 98 1,-0.3 2,-0.3 -2,-0.2 -1,-0.2 0.865 55.0 -23.3 -97.6 -48.6 83.7 21.8 19.5 42 47 A K - 0 0 29 284,-0.0 12,-2.8 282,-0.0 2,-0.5 -0.877 63.7-100.6-151.9-179.8 84.5 24.9 21.6 43 48 A T E -C 53 0B 10 10,-0.3 10,-0.3 -2,-0.3 282,-0.2 -0.956 24.3-172.3-113.9 130.3 82.7 27.4 23.9 44 49 A L E - 0 0 6 8,-3.7 2,-0.3 -2,-0.5 279,-0.2 0.742 60.9 -37.9 -94.4 -27.1 81.9 30.9 22.4 45 50 A G E -C 52 0B 9 7,-0.5 7,-2.2 277,-0.1 -1,-0.3 -0.874 49.0-144.4 171.5 156.5 80.8 32.8 25.5 46 51 A T E -C 51 0B 60 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.843 13.7-165.5-131.9 169.9 78.8 32.5 28.6 47 52 A G - 0 0 38 3,-1.6 312,-0.1 -2,-0.3 -2,-0.0 -0.652 48.7 -72.1-139.2-163.7 76.5 34.7 30.5 48 53 A S S S+ 0 0 43 -2,-0.2 311,-0.1 1,-0.1 3,-0.0 0.618 131.4 9.2 -73.0 -9.6 74.8 35.2 33.8 49 54 A F S S+ 0 0 35 19,-0.0 21,-0.4 20,-0.0 -1,-0.1 0.595 121.2 42.4-137.8 -37.1 72.5 32.3 32.8 50 55 A G - 0 0 9 19,-0.1 -3,-1.6 17,-0.0 2,-0.3 -0.231 52.5-142.5-109.1-163.0 73.6 30.5 29.6 51 56 A R E -CD 46 68B 31 17,-0.6 17,-2.1 -5,-0.2 2,-0.4 -0.954 7.7-152.8-158.6 141.9 76.5 29.1 27.6 52 57 A V E -CD 45 67B 27 -7,-2.2 -8,-3.7 -2,-0.3 -7,-0.5 -0.763 14.4-177.2-128.9 90.7 77.2 29.0 23.9 53 58 A M E -CD 43 66B 17 13,-1.1 13,-0.9 -2,-0.4 -10,-0.3 -0.131 34.5-118.0 -70.9 176.2 79.3 26.2 22.6 54 59 A L - 0 0 3 -12,-2.8 11,-0.2 11,-0.2 -11,-0.1 -0.384 44.2-177.7-116.4 54.6 80.3 26.0 18.9 55 60 A V - 0 0 0 -15,-0.1 9,-2.0 -14,-0.1 2,-0.4 -0.138 13.6-150.4 -56.3 141.7 78.6 22.8 18.1 56 61 A K E -AB 39 63A 85 -17,-1.2 -17,-2.5 7,-0.2 7,-0.2 -0.906 20.9-113.2-115.4 144.7 78.7 21.2 14.6 57 62 A H E > -A 38 0A 34 5,-2.7 4,-1.9 -2,-0.4 3,-0.3 -0.541 18.2-143.8 -78.0 138.9 76.1 19.0 13.0 58 63 A K T 4 S+ 0 0 124 -21,-4.8 -1,-0.1 -2,-0.2 3,-0.1 0.995 97.3 28.5 -64.7 -67.3 77.0 15.4 12.4 59 64 A E T 4 S+ 0 0 104 1,-0.2 -1,-0.2 -22,-0.2 -21,-0.1 0.211 128.3 47.2 -82.2 17.5 75.3 14.6 9.1 60 65 A S T 4 S- 0 0 49 -3,-0.3 -1,-0.2 -23,-0.2 -2,-0.2 0.639 81.6-147.1-126.9 -31.7 75.5 18.3 8.0 61 66 A G < + 0 0 37 -4,-1.9 2,-0.3 1,-0.3 -3,-0.1 0.671 58.9 122.5 68.0 16.0 79.0 19.6 8.6 62 67 A N - 0 0 93 -5,-0.1 -5,-2.7 1,-0.0 -1,-0.3 -0.735 55.6-124.7-108.1 158.9 77.6 23.0 9.4 63 68 A H B +B 56 0A 34 -2,-0.3 54,-0.6 -7,-0.2 2,-0.3 -0.637 25.3 171.9-105.3 161.1 78.1 25.0 12.5 64 69 A Y E - E 0 116B 19 -9,-2.0 2,-0.9 52,-0.2 52,-0.3 -0.974 37.4-113.4-156.2 160.3 75.8 26.7 15.0 65 70 A A E - E 0 115B 9 50,-3.1 50,-2.0 -2,-0.3 2,-0.3 -0.889 36.6-155.1-101.6 105.9 76.1 28.4 18.4 66 71 A M E -DE 53 114B 0 -13,-0.9 -13,-1.1 -2,-0.9 2,-0.5 -0.659 0.4-150.9 -84.4 135.3 74.3 26.1 20.8 67 72 A K E -DE 52 113B 16 46,-1.0 46,-1.7 -2,-0.3 2,-0.3 -0.924 12.5-164.7-108.3 127.4 72.9 27.7 23.9 68 73 A I E -DE 51 112B 19 -17,-2.1 -17,-0.6 -2,-0.5 2,-0.3 -0.839 7.2-175.9-111.4 148.4 72.7 25.5 27.0 69 74 A L E - E 0 111B 6 42,-0.9 42,-0.8 -2,-0.3 2,-0.7 -0.924 29.2-126.2-149.3 120.3 70.7 26.1 30.2 70 75 A D E > - E 0 110B 58 -21,-0.4 4,-2.4 -2,-0.3 40,-0.3 -0.518 20.5-143.5 -66.0 110.1 70.6 24.0 33.4 71 76 A K H > S+ 0 0 2 38,-2.8 4,-1.3 -2,-0.7 -1,-0.2 0.861 103.1 46.1 -42.4 -38.8 66.9 23.5 33.8 72 77 A Q H > S+ 0 0 90 37,-0.5 4,-2.8 2,-0.2 -1,-0.3 0.898 104.7 55.7 -74.0 -44.8 67.6 23.8 37.5 73 78 A K H > S+ 0 0 88 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.888 106.9 56.0 -55.8 -37.0 69.9 26.9 37.4 74 79 A V H <>S+ 0 0 3 -4,-2.4 5,-2.9 2,-0.2 6,-0.3 0.934 108.8 41.3 -62.3 -53.5 67.0 28.6 35.6 75 80 A V H ><5S+ 0 0 37 -4,-1.3 3,-3.1 -5,-0.2 -1,-0.2 0.967 113.6 58.3 -58.7 -47.1 64.3 28.1 38.2 76 81 A K H 3<5S+ 0 0 69 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.908 107.9 43.8 -46.3 -51.1 67.0 28.9 40.7 77 82 A L T 3<5S- 0 0 65 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.244 116.5-115.6 -82.6 17.2 67.5 32.3 39.1 78 83 A K T < 5S+ 0 0 90 -3,-3.1 4,-0.2 1,-0.1 -3,-0.2 0.884 77.7 130.6 50.8 43.9 63.8 32.8 38.9 79 84 A Q >< + 0 0 6 -5,-2.9 4,-2.6 -6,-0.1 5,-0.3 0.169 20.7 113.5-112.1 15.2 64.1 32.8 35.1 80 85 A I H > S+ 0 0 43 -6,-0.3 4,-2.6 2,-0.2 5,-0.3 0.958 84.2 40.1 -49.0 -61.2 61.4 30.3 34.1 81 86 A E H > S+ 0 0 63 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.955 115.1 48.6 -54.8 -62.5 59.2 32.9 32.4 82 87 A H H > S+ 0 0 0 -4,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.886 114.0 49.4 -47.0 -46.1 62.0 34.9 30.7 83 88 A T H X S+ 0 0 7 -4,-2.6 4,-1.6 2,-0.3 5,-0.3 0.971 110.5 46.7 -59.1 -56.9 63.5 31.7 29.3 84 89 A L H X S+ 0 0 28 -4,-2.6 4,-1.2 -5,-0.3 -1,-0.2 0.868 115.6 51.2 -52.7 -34.5 60.2 30.3 28.0 85 90 A N H X S+ 0 0 26 -4,-2.9 4,-2.5 -5,-0.3 5,-0.4 0.925 105.3 56.5 -68.3 -45.6 59.9 33.9 26.6 86 91 A E H X S+ 0 0 6 -4,-3.3 4,-2.8 -5,-0.2 5,-0.2 0.965 109.3 39.6 -51.6 -69.9 63.4 33.7 25.0 87 92 A K H X S+ 0 0 13 -4,-1.6 4,-2.7 1,-0.2 5,-0.3 0.927 118.2 49.3 -46.1 -61.1 63.0 30.7 22.8 88 93 A R H X S+ 0 0 62 -4,-1.2 4,-2.9 -5,-0.3 -1,-0.2 0.896 112.9 43.3 -44.4 -61.0 59.5 31.5 21.7 89 94 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.923 114.0 55.9 -53.8 -44.9 60.1 35.2 20.8 90 95 A L H < S+ 0 0 4 -4,-2.8 11,-0.3 -5,-0.4 -2,-0.2 0.911 111.0 40.6 -55.8 -48.1 63.3 34.0 19.1 91 96 A Q H < S+ 0 0 36 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.890 115.8 53.1 -69.7 -37.0 61.5 31.4 16.9 92 97 A A H < S+ 0 0 2 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.963 98.8 70.6 -60.6 -58.9 58.6 33.9 16.2 93 98 A V < + 0 0 9 -4,-2.8 2,-0.3 -5,-0.2 59,-0.0 -0.307 53.1 177.3 -69.8 145.3 60.7 36.8 15.0 94 99 A N + 0 0 116 -2,-0.1 3,-0.1 6,-0.1 5,-0.1 -0.939 18.5 135.6-149.2 120.1 62.5 37.1 11.7 95 100 A F > - 0 0 14 -2,-0.3 3,-0.7 3,-0.3 53,-0.0 -0.939 61.6-100.7-155.6 161.8 64.4 40.2 10.6 96 101 A P T 3 S+ 0 0 31 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 0.951 116.1 47.5 -58.8 -50.3 67.8 40.6 9.0 97 102 A F T 3 S+ 0 0 0 47,-0.1 80,-0.5 79,-0.1 2,-0.3 -0.333 92.6 91.9 -91.1 57.0 69.7 41.7 12.1 98 103 A L S < S- 0 0 8 -2,-1.3 -3,-0.3 -3,-0.7 80,-0.1 -0.924 85.6-107.3-148.0 117.8 68.4 39.0 14.4 99 104 A V - 0 0 3 78,-2.1 2,-1.0 -2,-0.3 18,-0.1 -0.150 35.1-125.4 -47.1 133.2 70.3 35.8 14.9 100 105 A K - 0 0 46 16,-0.2 16,-1.9 -4,-0.1 2,-0.3 -0.744 20.0-144.1 -88.9 102.9 68.3 33.1 13.2 101 106 A L E -F 115 0B 26 -2,-1.0 14,-0.3 -11,-0.3 13,-0.1 -0.503 18.5-174.0 -67.4 123.7 67.5 30.3 15.8 102 107 A E E - 0 0 66 12,-1.5 2,-0.3 -2,-0.3 13,-0.2 0.954 51.3 -4.4 -86.6 -56.8 67.6 26.9 14.1 103 108 A F E -F 114 0B 46 11,-1.8 11,-0.8 2,-0.0 2,-0.3 -0.824 55.2-161.6-134.1 172.9 66.6 23.9 16.3 104 109 A S E +F 113 0B 0 -2,-0.3 -72,-2.0 9,-0.2 -71,-0.5 -0.907 15.3 157.7-162.3 130.7 65.7 23.5 19.9 105 110 A F E -F 112 0B 7 7,-1.6 7,-3.6 -2,-0.3 2,-0.3 -0.813 17.2-152.3-142.1-179.8 65.5 20.5 22.3 106 111 A K E -F 111 0B 63 5,-0.3 2,-0.2 -2,-0.2 5,-0.2 -0.983 7.4-174.6-159.5 152.6 65.5 19.7 26.0 107 112 A D - 0 0 45 3,-2.2 -36,-0.1 -2,-0.3 230,-0.1 -0.814 51.3 -70.6-139.8 178.6 66.5 16.9 28.4 108 113 A N S S+ 0 0 47 -2,-0.2 229,-2.2 1,-0.2 226,-0.1 0.838 131.0 21.0 -39.7 -47.5 66.3 15.9 32.1 109 114 A S S S+ 0 0 4 224,-0.3 -38,-2.8 227,-0.1 -37,-0.5 0.730 122.4 32.7-101.3 -23.5 68.9 18.5 33.0 110 115 A N E -E 70 0B 9 -40,-0.3 -3,-2.2 -39,-0.1 2,-0.4 -0.697 52.2-136.0-133.0-177.3 69.0 21.1 30.2 111 116 A L E -EF 69 106B 4 -42,-0.8 -42,-0.9 -5,-0.2 2,-0.4 -0.993 25.8-154.2-134.4 135.7 67.4 23.2 27.4 112 117 A Y E +EF 68 105B 0 -7,-3.6 -7,-1.6 -2,-0.4 2,-0.4 -0.961 17.9 178.0-125.3 134.6 69.0 23.6 24.0 113 118 A M E -EF 67 104B 1 -46,-1.7 -46,-1.0 -2,-0.4 2,-0.6 -0.819 13.3-163.6-128.8 88.1 68.7 26.4 21.4 114 119 A V E -EF 66 103B 0 -11,-0.8 -11,-1.8 -2,-0.4 -12,-1.5 -0.649 17.4-179.7 -77.3 118.5 70.9 25.8 18.5 115 120 A M E -EF 65 101B 6 -50,-2.0 -50,-3.1 -2,-0.6 2,-0.4 -0.816 41.7 -81.1-115.2 157.7 71.2 29.1 16.7 116 121 A E E -E 64 0B 94 -16,-1.9 -52,-0.2 -2,-0.3 -16,-0.2 -0.454 55.3-113.2 -62.1 115.3 73.1 29.9 13.5 117 122 A Y - 0 0 28 -54,-0.6 2,-0.6 -2,-0.4 -1,-0.1 -0.230 26.2-154.0 -53.6 131.1 76.7 30.4 14.6 118 123 A V > - 0 0 11 52,-0.1 3,-0.7 -3,-0.1 51,-0.3 -0.756 8.9-163.6-115.2 83.7 77.8 34.0 14.0 119 124 A A T 3 + 0 0 7 -2,-0.6 200,-0.1 1,-0.2 194,-0.1 -0.319 64.4 71.6 -64.2 148.4 81.6 34.2 13.6 120 125 A G T 3 S- 0 0 1 192,-0.1 -1,-0.2 48,-0.1 6,-0.1 0.112 93.9-117.8 129.1 -17.9 83.1 37.7 14.0 121 126 A G < - 0 0 0 -3,-0.7 48,-1.4 4,-0.1 201,-0.1 0.145 45.4 -43.8 74.0 166.3 82.7 37.9 17.7 122 127 A E B > -G 168 0C 8 46,-0.2 4,-1.3 1,-0.1 3,-0.5 -0.335 51.1-115.7 -69.6 147.8 80.7 40.4 19.9 123 128 A M T 4 S+ 0 0 2 44,-3.4 3,-0.5 41,-0.8 5,-0.2 0.916 115.2 64.5 -46.5 -47.4 80.8 44.1 19.1 124 129 A F T >> S+ 0 0 6 40,-0.5 3,-2.7 43,-0.3 4,-2.3 0.890 96.1 53.0 -40.8 -58.7 82.4 44.5 22.4 125 130 A S H 3> S+ 0 0 5 -3,-0.5 4,-2.3 1,-0.3 -1,-0.2 0.896 110.9 48.5 -48.0 -46.4 85.6 42.6 21.4 126 131 A H H 3< S+ 0 0 13 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.253 110.3 50.3 -83.5 14.2 86.0 44.8 18.4 127 132 A L H <> S+ 0 0 6 -3,-2.7 4,-0.9 -4,-0.1 -1,-0.2 0.578 109.1 52.2-112.6 -33.7 85.5 48.0 20.4 128 133 A R H < S+ 0 0 107 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.1 0.979 118.3 36.7 -64.7 -58.5 88.1 46.9 23.0 129 134 A R T < S+ 0 0 151 -4,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.992 122.2 41.6 -56.6 -68.7 90.7 46.2 20.2 130 135 A I T 4 S- 0 0 74 1,-0.2 2,-1.2 -5,-0.2 -1,-0.2 0.751 104.5-137.0 -54.4 -21.7 89.8 49.1 17.9 131 136 A G < - 0 0 39 -4,-0.9 2,-0.3 98,-0.1 -1,-0.2 -0.543 68.6 -15.3 98.7 -68.9 89.5 51.1 21.1 132 137 A R S S- 0 0 88 -2,-1.2 2,-0.2 -6,-0.1 95,-0.2 -0.953 74.9-103.8-163.1 151.9 86.3 52.9 20.1 133 138 A F - 0 0 4 93,-2.4 2,-0.1 -2,-0.3 -6,-0.0 -0.524 37.1-109.5 -84.8 151.2 84.4 53.4 16.8 134 139 A X > - 0 0 125 -2,-0.2 4,-2.6 1,-0.1 5,-0.4 -0.448 39.0 -98.3 -75.0 153.2 84.4 56.7 14.9 135 140 A E H > S+ 0 0 30 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.780 125.9 35.6 -40.2 -38.6 81.2 58.8 14.9 136 141 A P H > S+ 0 0 63 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.832 109.7 59.2 -87.6 -36.0 80.4 57.3 11.4 137 142 A H H > S+ 0 0 13 -3,-0.3 4,-0.9 1,-0.2 3,-0.2 0.893 114.5 42.5 -57.7 -37.2 81.7 53.8 11.8 138 143 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.921 99.5 68.7 -73.8 -48.0 79.2 53.7 14.7 139 144 A R H X S+ 0 0 44 -4,-1.4 4,-1.8 -5,-0.4 -1,-0.2 0.797 101.5 53.0 -41.1 -32.0 76.4 55.4 12.8 140 145 A F H X S+ 0 0 17 -4,-1.3 4,-0.9 -3,-0.2 -1,-0.2 0.957 109.6 42.1 -72.1 -54.8 76.4 52.2 10.7 141 146 A Y H X S+ 0 0 4 -4,-0.9 4,-1.2 -3,-0.3 -2,-0.2 0.792 117.5 50.0 -64.3 -28.7 76.0 49.6 13.5 142 147 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.927 100.4 58.9 -76.9 -48.6 73.5 51.8 15.3 143 148 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.788 103.9 57.5 -53.0 -25.9 71.2 52.5 12.4 144 149 A Q H X S+ 0 0 0 -4,-0.9 4,-2.7 2,-0.2 3,-0.5 0.988 106.2 45.3 -68.6 -55.9 70.8 48.8 12.2 145 150 A I H X S+ 0 0 1 -4,-1.2 4,-2.7 1,-0.3 5,-0.4 0.943 109.8 57.0 -49.5 -52.4 69.6 48.5 15.9 146 151 A V H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -1,-0.3 0.894 110.1 44.2 -46.1 -47.0 67.2 51.5 15.2 147 152 A L H X S+ 0 0 9 -4,-1.8 4,-2.0 -3,-0.5 -1,-0.2 0.926 114.1 50.4 -64.7 -44.9 65.7 49.5 12.3 148 153 A T H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 3,-0.2 0.967 109.6 47.6 -56.2 -63.4 65.5 46.3 14.4 149 154 A F H X S+ 0 0 0 -4,-2.7 4,-3.7 1,-0.3 5,-0.4 0.891 107.6 58.2 -47.4 -43.9 63.8 47.8 17.5 150 155 A E H X S+ 0 0 32 -4,-1.6 4,-1.5 -5,-0.4 -1,-0.3 0.967 111.2 42.9 -50.9 -53.4 61.3 49.5 15.1 151 156 A Y H >< S+ 0 0 7 -4,-2.0 3,-0.6 -3,-0.2 -2,-0.2 0.967 118.2 42.6 -56.6 -59.6 60.5 46.0 13.9 152 157 A L H ><>S+ 0 0 2 -4,-2.7 3,-2.4 1,-0.3 5,-1.2 0.943 114.3 50.9 -53.3 -53.5 60.4 44.3 17.4 153 158 A H H ><5S+ 0 0 27 -4,-3.7 3,-1.5 1,-0.3 -1,-0.3 0.777 100.4 66.2 -55.6 -27.7 58.5 47.2 18.9 154 159 A S T <<5S+ 0 0 37 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.454 102.5 47.2 -76.8 0.9 56.0 47.0 16.1 155 160 A L T < 5S- 0 0 0 -3,-2.4 -1,-0.3 2,-0.2 -2,-0.2 0.053 125.0 -99.7-125.9 24.7 55.0 43.6 17.4 156 161 A D T < 5S+ 0 0 38 -3,-1.5 2,-0.4 1,-0.2 -3,-0.2 0.940 81.1 140.6 54.2 48.4 54.7 44.6 21.0 157 162 A L < - 0 0 2 -5,-1.2 2,-0.4 28,-0.3 -1,-0.2 -0.982 34.1-168.7-123.3 131.6 58.1 43.2 21.6 158 163 A I B -H 184 0D 1 26,-2.0 26,-1.3 -2,-0.4 54,-0.0 -0.964 12.3-157.2-121.9 136.7 60.6 44.8 23.9 159 164 A Y - 0 0 0 -2,-0.4 2,-0.9 24,-0.2 -1,-0.1 0.832 17.0-178.6 -84.4 -35.8 64.3 43.6 24.0 160 165 A R + 0 0 13 52,-0.1 34,-0.1 1,-0.1 -1,-0.1 0.169 62.1 66.3 62.2 -18.8 65.2 44.9 27.5 161 166 A D + 0 0 3 -2,-0.9 2,-0.4 34,-0.1 -1,-0.1 -0.382 62.1 164.3-137.2 61.9 68.8 43.8 27.5 162 167 A L + 0 0 3 37,-0.1 60,-0.2 3,-0.0 34,-0.1 -0.648 13.7 122.8 -88.7 124.2 71.0 45.6 24.9 163 168 A K > - 0 0 5 -2,-0.4 3,-2.5 1,-0.1 4,-0.3 -0.976 67.1 -99.9-168.6 155.2 74.8 45.7 24.9 164 169 A P G > S+ 0 0 0 0, 0.0 3,-2.0 0, 0.0 -41,-0.8 0.842 115.6 66.9 -51.6 -34.8 77.9 44.8 22.7 165 170 A E G 3 S+ 0 0 10 1,-0.3 -43,-0.1 -43,-0.2 -3,-0.0 0.754 107.8 41.0 -58.5 -22.4 78.4 41.6 24.6 166 171 A N G < S+ 0 0 17 -3,-2.5 12,-1.5 -44,-0.0 2,-0.5 0.303 101.6 89.3-106.1 5.1 75.1 40.4 23.0 167 172 A L B < -I 177 0E 0 -3,-2.0 -44,-3.4 -4,-0.3 -43,-0.3 -0.923 58.4-166.5-109.8 127.6 75.8 41.9 19.7 168 173 A L B -G 122 0C 20 8,-2.1 2,-0.6 -2,-0.5 8,-0.5 -0.724 19.2-135.6-110.6 158.0 77.6 40.0 16.9 169 174 A I - 0 0 2 -48,-1.4 6,-0.2 -51,-0.3 7,-0.0 -0.935 26.4-145.3-112.6 107.2 79.3 41.0 13.6 170 175 A D > - 0 0 20 4,-1.4 3,-3.1 -2,-0.6 4,-0.2 -0.196 36.5 -89.5 -65.3 165.4 78.3 38.5 10.9 171 176 A Q T 3 S+ 0 0 117 1,-0.3 -1,-0.1 2,-0.1 -51,-0.0 0.766 128.6 55.9 -45.2 -35.3 80.8 37.6 8.2 172 177 A Q T 3 S- 0 0 84 138,-0.1 -1,-0.3 1,-0.0 135,-0.2 0.535 121.3-105.3 -80.3 -8.1 79.5 40.5 6.1 173 178 A G S < S+ 0 0 0 -3,-3.1 136,-0.3 1,-0.2 2,-0.2 0.725 79.1 121.3 92.7 22.0 80.2 43.0 8.8 174 179 A Y - 0 0 0 -4,-0.2 -4,-1.4 1,-0.1 -1,-0.2 -0.441 62.6 -89.8-106.0-177.5 76.6 43.6 10.0 175 180 A I - 0 0 1 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.398 27.4-167.9 -91.8 170.7 74.9 43.2 13.3 176 181 A Q - 0 0 12 -8,-0.5 -8,-2.1 -79,-0.2 2,-0.4 -0.887 14.8-144.1-156.9 121.4 73.2 40.2 14.9 177 182 A V B +I 167 0E 1 -80,-0.5 -78,-2.1 -2,-0.3 2,-0.3 -0.794 29.3 166.7 -95.3 135.6 71.1 40.5 18.1 178 183 A T + 0 0 17 -12,-1.5 -2,-0.0 -2,-0.4 -78,-0.0 -0.880 39.1 54.2-138.9 171.2 71.2 37.5 20.4 179 184 A D + 0 0 20 -2,-0.3 -1,-0.2 2,-0.0 3,-0.2 0.984 50.4 168.0 63.1 82.9 70.3 36.6 24.0 180 185 A F > + 0 0 1 1,-0.1 3,-2.4 2,-0.1 2,-1.3 0.923 34.2 116.5 -89.4 -59.9 66.6 37.4 24.3 181 186 A G T 3 S+ 0 0 6 1,-0.3 -95,-0.2 -98,-0.2 -96,-0.1 0.185 80.7 53.6 27.1 -66.3 65.4 35.9 27.5 182 187 A F T 3 S+ 0 0 3 -2,-1.3 -1,-0.3 -3,-0.2 -2,-0.1 0.718 89.4 107.1 -63.4 -18.2 64.7 39.3 28.9 183 188 A A < + 0 0 2 -3,-2.4 2,-0.3 -101,-0.1 -24,-0.2 -0.247 45.1 163.4 -59.6 152.4 62.6 39.8 25.8 184 189 A K B -H 158 0D 33 -26,-1.3 -26,-2.0 2,-0.1 2,-1.4 -0.953 48.0-104.1-166.0 155.0 58.8 39.7 26.4 185 190 A R - 0 0 42 -2,-0.3 2,-0.5 -28,-0.2 -28,-0.3 -0.744 44.2-179.1 -91.6 89.1 55.7 40.7 24.5 186 191 A V + 0 0 5 -2,-1.4 4,-0.1 1,-0.2 26,-0.1 -0.817 15.1 163.5 -89.5 128.5 54.9 43.9 26.4 187 192 A K S S+ 0 0 138 -2,-0.5 -1,-0.2 2,-0.3 3,-0.1 0.637 78.0 13.7-112.8 -34.8 51.8 45.4 25.0 188 193 A G S S- 0 0 58 1,-0.4 24,-0.3 -32,-0.1 2,-0.3 0.624 119.4 -54.0-102.7 -99.2 51.0 47.7 27.9 189 194 A R - 0 0 102 22,-0.1 -1,-0.4 23,-0.1 2,-0.3 -0.804 50.2-143.5-136.5 174.7 53.7 48.2 30.5 190 195 A T B -J 210 0F 2 20,-2.5 20,-2.9 -2,-0.3 18,-0.1 -0.998 11.6-154.3-148.5 152.6 55.8 45.8 32.5 191 196 A W + 0 0 8 175,-0.4 2,-0.2 -2,-0.3 18,-0.1 0.316 50.9 117.1-111.9 9.8 57.3 45.5 36.0 192 197 A X - 0 0 6 174,-0.1 2,-0.5 18,-0.1 173,-0.1 -0.541 54.6-137.4 -81.1 143.4 60.4 43.2 35.8 193 198 A L + 0 0 3 171,-0.5 170,-1.9 -2,-0.2 2,-0.3 -0.829 45.0 130.0 -97.2 135.2 63.8 44.4 36.6 194 199 A C E +K 362 0G 1 -2,-0.5 2,-0.3 168,-0.3 168,-0.3 -0.958 13.8 72.4-177.8 157.9 66.5 43.2 34.2 195 200 A G E S-K 361 0G 1 166,-2.9 166,-2.7 -2,-0.3 -34,-0.1 -0.927 81.9 -45.7 132.6-154.7 69.4 43.9 32.0 196 201 A T > - 0 0 3 -2,-0.3 3,-2.6 164,-0.3 4,-0.3 -0.960 56.1-122.7-122.2 108.0 73.0 44.9 32.4 197 202 A P G > S+ 0 0 21 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.558 105.4 59.4 -13.4 -60.3 73.5 47.7 35.0 198 203 A E G 3 S+ 0 0 33 1,-0.2 35,-0.3 -3,-0.1 -3,-0.0 0.546 112.9 44.9 -60.7 -2.2 75.3 50.3 32.9 199 204 A Y G < S+ 0 0 11 -3,-2.6 -1,-0.2 22,-0.1 22,-0.2 0.579 76.2 125.7-117.4 -13.1 72.2 50.2 30.6 200 205 A L < - 0 0 4 -3,-1.2 -5,-0.1 -4,-0.3 -39,-0.0 -0.166 58.3-125.6 -51.0 138.4 69.2 50.3 32.8 201 206 A A >> - 0 0 1 1,-0.1 4,-1.4 44,-0.0 3,-1.0 -0.699 26.4-105.6 -88.9 141.7 66.7 53.0 32.0 202 207 A P H >> S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 3,-0.8 0.761 118.4 47.9 -27.5 -60.5 65.7 55.5 34.7 203 208 A E H 3>>S+ 0 0 19 1,-0.3 4,-1.2 2,-0.2 5,-0.7 0.887 104.6 58.2 -54.5 -48.5 62.2 54.0 35.2 204 209 A I H <45S+ 0 0 12 -3,-1.0 -1,-0.3 1,-0.2 3,-0.1 0.829 112.5 44.0 -52.2 -32.4 63.4 50.4 35.3 205 210 A I H <<5S+ 0 0 0 -4,-1.4 -1,-0.2 -3,-0.8 -2,-0.2 0.869 108.0 56.0 -81.4 -37.2 65.5 51.6 38.3 206 211 A L H <5S- 0 0 23 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.568 100.6-136.8 -73.8 -9.1 62.7 53.6 39.9 207 212 A S T <5 + 0 0 6 -4,-1.2 -3,-0.1 -5,-0.2 -4,-0.1 0.794 68.0 114.3 56.6 42.9 60.5 50.5 40.0 208 213 A K S - 0 0 45 -22,-0.2 3,-2.2 -2,-0.2 4,-0.2 -0.864 53.2 -61.9-149.4-179.9 57.4 50.2 28.4 212 217 A K T >> S+ 0 0 33 1,-0.3 3,-3.0 -24,-0.3 4,-0.6 0.735 111.9 86.9 -41.0 -33.5 59.1 49.9 25.0 213 218 A A H >> S+ 0 0 0 1,-0.3 3,-2.3 2,-0.2 4,-0.7 0.825 75.1 70.1 -37.0 -45.0 60.6 53.3 25.6 214 219 A V H <> S+ 0 0 6 -3,-2.2 4,-2.4 1,-0.3 3,-0.3 0.690 87.3 62.6 -49.5 -28.3 63.5 51.7 27.5 215 220 A D H <> S+ 0 0 0 -3,-3.0 4,-2.0 1,-0.2 -1,-0.3 0.800 100.8 54.4 -69.6 -27.0 64.9 50.2 24.3 216 221 A W H X S+ 0 0 0 -4,-3.0 4,-2.9 -5,-0.3 3,-2.3 0.998 107.2 44.4 -67.5 -64.5 79.6 53.8 24.4 226 231 A M H 3< S+ 0 0 0 -4,-2.2 -93,-2.4 1,-0.3 -2,-0.2 0.828 114.0 53.7 -47.8 -38.8 80.8 52.8 20.9 227 232 A A T 3< S+ 0 0 0 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.174 125.8 19.3 -86.0 17.4 81.7 56.4 20.2 228 233 A A T <4 S- 0 0 13 -3,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.352 94.3-122.0-145.3 -55.4 83.8 56.9 23.2 229 234 A G S < S+ 0 0 20 -4,-2.9 -3,-0.1 -5,-0.3 -4,-0.1 0.036 89.7 76.3 121.3 -17.4 84.9 53.5 24.5 230 235 A Y S S- 0 0 96 -6,-0.3 -1,-0.2 -5,-0.3 -3,-0.1 -0.982 85.3-116.1-129.0 130.4 83.3 54.1 27.8 231 236 A P - 0 0 2 0, 0.0 3,-0.1 0, 0.0 -10,-0.1 -0.288 27.5-125.2 -58.2 147.9 79.6 54.1 28.8 232 237 A P S S+ 0 0 12 0, 0.0 2,-0.7 0, 0.0 19,-0.2 0.884 97.3 49.0 -62.9 -42.2 78.4 57.5 30.0 233 238 A F S S+ 0 0 2 -35,-0.3 2,-0.3 17,-0.1 12,-0.1 -0.853 78.1 137.2-107.1 100.3 77.1 56.4 33.3 234 239 A F + 0 0 101 -2,-0.7 2,-0.3 -3,-0.1 3,-0.1 -0.949 15.7 156.3-142.1 161.7 79.5 54.2 35.3 235 240 A A - 0 0 41 -2,-0.3 -37,-0.0 1,-0.1 -2,-0.0 -0.977 46.6-104.0-169.5 172.9 80.9 53.6 38.8 236 241 A D S S+ 0 0 142 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.906 105.5 43.3 -78.1 -45.8 82.6 51.2 41.2 237 242 A Q S >> S- 0 0 86 1,-0.1 3,-1.7 -3,-0.1 4,-1.2 -0.900 84.0-130.7-105.6 132.2 79.6 50.3 43.4 238 243 A P H >> S+ 0 0 31 0, 0.0 4,-1.6 0, 0.0 3,-0.5 0.899 101.0 59.1 -40.3 -70.5 76.2 49.7 41.6 239 244 A I H 3> S+ 0 0 14 1,-0.3 4,-0.9 2,-0.2 158,-0.1 0.701 104.6 55.9 -40.2 -23.4 73.9 51.9 43.6 240 245 A Q H X> S+ 0 0 70 -3,-1.7 3,-1.5 2,-0.2 4,-1.4 0.979 103.0 52.4 -73.7 -56.9 76.1 54.8 42.6 241 246 A I H XX S+ 0 0 12 -4,-1.2 4,-1.8 -3,-0.5 3,-0.9 0.881 105.1 56.4 -41.5 -52.3 75.7 54.1 38.9 242 247 A Y H 3X S+ 0 0 1 -4,-1.6 4,-1.9 1,-0.3 -1,-0.3 0.846 101.9 55.5 -54.6 -36.0 72.0 54.1 39.2 243 248 A E H S+ 0 0 74 -4,-1.4 5,-1.2 -3,-0.9 4,-0.6 0.929 110.9 43.7 -65.4 -48.7 73.9 58.7 37.6 245 250 A I H ><5S+ 0 0 0 -4,-1.8 3,-2.3 1,-0.2 -2,-0.2 0.994 117.2 43.3 -59.2 -64.7 71.3 57.3 35.1 246 251 A V H 3<5S+ 0 0 13 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.728 106.4 66.3 -53.3 -26.0 68.2 58.6 37.0 247 252 A S H 3<5S- 0 0 67 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.684 97.3-136.7 -72.4 -19.7 70.1 61.9 37.6 248 253 A G T <<5 + 0 0 39 -3,-2.3 2,-1.0 -4,-0.6 -3,-0.1 0.824 54.0 146.7 66.0 27.7 70.0 62.7 33.9 249 254 A K < + 0 0 61 -5,-1.2 2,-0.5 -4,-0.1 -1,-0.2 -0.802 18.7 169.7-101.8 92.1 73.6 63.8 34.3 250 255 A V - 0 0 50 -2,-1.0 2,-0.6 -3,-0.1 -17,-0.1 -0.902 17.0-163.4-105.8 128.3 75.3 63.0 31.1 251 256 A R - 0 0 214 -2,-0.5 -2,-0.0 -19,-0.2 0, 0.0 -0.958 11.7-153.4-115.0 119.3 78.8 64.3 30.4 252 257 A F - 0 0 47 -2,-0.6 -24,-0.0 1,-0.1 9,-0.0 -0.541 10.9-123.7 -90.4 152.6 80.0 64.2 26.8 253 258 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 -25,-0.0 0.147 32.8 -97.2 -74.9-158.9 83.6 63.9 25.4 254 259 A S S S+ 0 0 112 1,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.925 112.6 54.0 -89.8 -55.2 85.2 66.3 23.0 255 260 A H S S+ 0 0 67 -28,-0.0 2,-0.5 -27,-0.0 -1,-0.1 0.531 76.2 118.6 -61.7 -6.6 84.9 64.8 19.6 256 261 A F - 0 0 4 4,-0.1 -4,-0.0 1,-0.1 -28,-0.0 -0.511 65.2-131.3 -66.5 118.2 81.1 64.4 19.9 257 262 A S > - 0 0 39 -2,-0.5 4,-2.5 1,-0.1 5,-0.3 -0.146 24.5-103.3 -63.9 162.3 79.6 66.6 17.2 258 263 A S H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.866 125.9 48.6 -54.9 -32.4 76.8 69.0 17.9 259 264 A D H > S+ 0 0 63 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.975 108.2 46.2 -69.9 -62.9 74.7 66.3 16.3 260 265 A L H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.845 115.0 52.1 -52.6 -35.0 75.8 63.2 18.1 261 266 A K H X S+ 0 0 85 -4,-2.5 4,-3.6 2,-0.2 5,-0.3 0.993 111.0 45.4 -65.4 -57.8 75.5 65.2 21.3 262 267 A D H X S+ 0 0 75 -4,-2.1 4,-2.5 -5,-0.3 5,-0.2 0.947 113.9 48.3 -47.7 -64.0 71.9 66.3 20.5 263 268 A L H >X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.3 3,-1.4 0.939 116.8 42.4 -41.8 -67.9 70.8 62.8 19.5 264 269 A L H 3X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.3 -1,-0.3 0.854 109.9 57.3 -49.0 -39.9 72.3 61.3 22.6 265 270 A R H 3< S+ 0 0 43 -4,-3.6 -1,-0.3 -5,-0.2 -2,-0.2 0.884 114.9 40.4 -60.6 -32.7 71.0 64.1 24.7 266 271 A N H X< S+ 0 0 38 -4,-2.5 10,-1.3 -3,-1.4 3,-1.1 0.883 115.0 46.5 -84.3 -39.6 67.6 63.1 23.4 267 272 A L H 3< S+ 0 0 0 -4,-2.7 -47,-0.4 1,-0.3 -46,-0.2 0.674 112.6 56.2 -75.5 -14.3 67.8 59.3 23.5 268 273 A L T 3< S+ 0 0 7 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.3 0.055 75.5 137.4-103.8 25.2 69.2 59.7 27.0 269 274 A Q < - 0 0 48 -3,-1.1 6,-0.1 1,-0.1 5,-0.1 -0.587 49.3-147.8 -77.7 130.4 66.4 61.6 28.5 270 275 A V S S+ 0 0 45 -2,-0.4 2,-0.9 1,-0.1 -67,-0.2 0.753 86.8 71.0 -64.0 -24.5 65.4 60.6 32.0 271 276 A D > - 0 0 62 1,-0.1 3,-2.1 3,-0.1 -1,-0.1 -0.799 65.9-165.9 -99.3 102.8 61.7 61.6 31.2 272 277 A L G > S+ 0 0 45 -2,-0.9 3,-0.6 1,-0.3 -1,-0.1 0.522 79.6 78.6 -65.3 -4.8 60.2 59.2 28.7 273 278 A T G 3 S+ 0 0 95 1,-0.2 -1,-0.3 0, 0.0 -2,-0.0 0.652 114.6 20.8 -76.3 -12.4 57.3 61.5 28.0 274 279 A K G < S+ 0 0 108 -3,-2.1 2,-0.5 -5,-0.1 -1,-0.2 -0.047 91.5 125.3-144.1 32.7 59.8 63.3 25.8 275 280 A R X - 0 0 0 -3,-0.6 3,-1.3 3,-0.1 -8,-0.2 -0.829 67.6-107.4 -96.0 132.8 62.6 60.8 25.1 276 281 A F T 3 S+ 0 0 32 -10,-1.3 7,-0.1 -2,-0.5 -1,-0.1 -0.102 108.4 42.8 -52.0 160.2 63.2 60.3 21.4 277 282 A G T 3 S+ 0 0 6 5,-0.7 -1,-0.3 1,-0.1 6,-0.1 0.443 117.6 56.4 78.8 -2.2 62.1 57.0 20.1 278 283 A N S < S+ 0 0 53 -3,-1.3 -2,-0.2 4,-0.2 -3,-0.1 0.333 77.5 94.4-144.2 11.1 59.0 57.7 22.1 279 284 A L S S- 0 0 51 3,-0.5 -5,-0.1 -5,-0.1 4,-0.0 0.251 93.9 -79.4 -80.3-145.8 57.4 61.0 21.1 280 285 A K S S+ 0 0 200 1,-0.2 3,-0.2 2,-0.1 4,-0.1 0.897 127.6 56.0 -85.5 -48.3 54.6 61.0 18.5 281 286 A N S > S- 0 0 97 1,-0.2 3,-1.4 2,-0.1 2,-0.3 0.614 98.9-160.4 -61.1 -8.3 56.4 60.7 15.2 282 287 A G T > - 0 0 22 1,-0.2 -5,-0.7 2,-0.2 3,-0.6 -0.465 58.5 -3.8 70.4-122.4 57.6 57.7 17.0 283 288 A V T 3> S+ 0 0 19 -2,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.429 119.8 77.8 -86.2 -3.4 60.9 56.1 15.6 284 289 A N H <> S+ 0 0 72 -3,-1.4 4,-4.0 2,-0.2 -1,-0.2 0.752 81.0 67.6 -78.4 -20.9 61.0 58.6 12.8 285 290 A D H <4 S+ 0 0 29 -3,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.835 105.3 43.2 -65.4 -30.2 62.3 61.3 15.1 286 291 A I H >4 S+ 0 0 0 -3,-0.2 3,-0.8 -4,-0.2 -1,-0.2 0.895 115.6 48.0 -78.9 -41.8 65.4 59.2 15.4 287 292 A K H 3< S+ 0 0 27 -4,-1.5 -2,-0.2 1,-0.2 8,-0.2 0.899 116.4 44.2 -63.2 -40.3 65.4 58.5 11.6 288 293 A N T 3< S+ 0 0 121 -4,-4.0 -1,-0.2 4,-0.1 -2,-0.2 0.407 86.6 118.7 -85.5 0.2 64.9 62.3 11.0 289 294 A H S X> S- 0 0 8 -3,-0.8 4,-1.6 -5,-0.2 3,-1.2 -0.376 74.4-119.7 -65.1 149.9 67.5 63.4 13.5 290 295 A K G >4 S+ 0 0 52 1,-0.2 3,-0.6 2,-0.2 4,-0.4 0.973 106.9 64.1 -53.7 -60.6 70.3 65.3 11.9 291 296 A W G 34 S+ 0 0 1 1,-0.2 -1,-0.2 -32,-0.1 -31,-0.1 0.620 110.6 38.4 -41.4 -20.8 73.1 62.9 13.0 292 297 A F G X4 S+ 0 0 0 -3,-1.2 3,-2.9 -6,-0.2 -1,-0.2 0.828 80.6 106.1 -99.6 -39.9 71.6 60.2 10.8 293 298 A A T << S+ 0 0 74 -4,-1.6 -2,-0.1 -3,-0.6 -1,-0.1 0.532 74.9 61.6 -6.8 -54.4 70.5 62.1 7.7 294 299 A T T 3 S+ 0 0 112 -4,-0.4 2,-0.6 -3,-0.1 -1,-0.3 0.506 85.2 110.4 -62.9 -1.2 73.3 60.8 5.6 295 300 A T < - 0 0 21 -3,-2.9 2,-1.8 -8,-0.2 3,-0.1 -0.688 61.3-152.4 -87.8 113.7 71.9 57.3 6.2 296 301 A D > - 0 0 98 -2,-0.6 4,-1.8 1,-0.2 3,-0.4 -0.598 19.2-173.1 -79.2 85.4 70.2 55.4 3.4 297 302 A W H > S+ 0 0 29 -2,-1.8 4,-1.3 1,-0.2 3,-0.5 0.908 76.3 54.6 -48.2 -56.1 67.9 53.4 5.6 298 303 A I H >> S+ 0 0 61 1,-0.3 4,-2.7 2,-0.2 3,-0.9 0.903 109.2 49.3 -46.7 -47.4 66.5 51.1 2.9 299 304 A A H 3>>S+ 0 0 8 -3,-0.4 5,-1.9 1,-0.3 4,-0.8 0.873 102.7 61.0 -60.8 -38.2 70.0 50.0 2.0 300 305 A I H 3<5S+ 0 0 6 -4,-1.8 -1,-0.3 -3,-0.5 -2,-0.2 0.811 111.6 41.7 -58.1 -29.5 70.8 49.4 5.6 301 306 A Y H <<5S+ 0 0 79 -4,-1.3 -2,-0.2 -3,-0.9 -1,-0.2 0.918 109.3 53.3 -84.0 -50.5 68.0 46.9 5.4 302 307 A Q H <5S- 0 0 135 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.507 110.5-121.9 -65.1 -1.1 68.7 45.3 2.1 303 308 A R T <5S+ 0 0 70 -4,-0.8 -3,-0.2 -5,-0.2 -4,-0.1 0.939 77.4 121.4 58.9 51.2 72.2 44.7 3.4 304 309 A K < + 0 0 72 -5,-1.9 -4,-0.1 2,-0.1 2,-0.1 0.679 31.4 109.9-110.7 -31.5 73.9 46.7 0.6 305 310 A V S S- 0 0 45 -6,-0.6 0, 0.0 -9,-0.1 0, 0.0 -0.303 84.8-100.7 -55.9 119.1 75.8 49.4 2.5 306 311 A E - 0 0 168 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.120 46.2-113.8 -41.9 125.2 79.5 48.8 2.3 307 312 A A - 0 0 20 -135,-0.2 3,-0.2 1,-0.1 -134,-0.1 -0.182 14.5-140.7 -61.2 160.0 80.4 47.2 5.6 308 313 A P S S+ 0 0 46 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.673 88.2 7.4 -97.4 -22.1 82.7 49.2 8.0 309 314 A F S S- 0 0 63 -136,-0.3 -136,-0.0 -137,-0.1 -2,-0.0 -0.592 70.4-156.8-163.1 89.0 84.8 46.4 9.3 310 315 A I - 0 0 100 -3,-0.2 -139,-0.1 -2,-0.1 -138,-0.1 -0.624 26.9-124.9 -80.0 101.2 84.4 42.9 7.7 311 316 A P - 0 0 14 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.028 22.6-119.2 -42.9 142.7 85.6 40.3 10.3 312 317 A K + 0 0 72 -192,-0.1 2,-0.3 8,-0.1 -192,-0.1 -0.651 35.0 169.4 -91.2 143.6 88.3 37.9 9.2 313 318 A F - 0 0 78 -2,-0.3 2,-0.5 -194,-0.1 6,-0.0 -0.969 18.7-164.4-156.9 136.4 87.9 34.1 9.1 314 319 A K - 0 0 83 -2,-0.3 6,-0.1 1,-0.3 -2,-0.0 -0.945 67.5 -7.4-126.7 109.9 89.9 31.1 7.8 315 320 A G S S- 0 0 43 -2,-0.5 -1,-0.3 3,-0.0 2,-0.1 0.495 98.0 -64.9 81.2 133.7 88.1 27.8 7.5 316 321 A P S S+ 0 0 103 0, 0.0 -3,-0.0 0, 0.0 -254,-0.0 -0.279 114.3 20.9 -53.9 119.8 84.6 27.0 8.7 317 322 A G S S+ 0 0 30 1,-0.2 2,-0.3 -2,-0.1 -263,-0.0 0.933 71.9 148.0 84.5 86.9 84.6 27.2 12.5 318 323 A D - 0 0 29 -276,-0.0 2,-0.9 0, 0.0 3,-0.4 -0.892 43.3-149.3-156.0 121.8 87.3 29.2 14.3 319 324 A T + 0 0 40 -2,-0.3 -6,-0.0 1,-0.2 -276,-0.0 -0.053 54.0 137.1 -76.4 35.2 87.4 31.3 17.5 320 325 A S S S+ 0 0 94 -2,-0.9 -1,-0.2 1,-0.2 -8,-0.1 0.604 88.7 16.3 -59.5 -12.0 90.0 33.4 15.8 321 326 A N S S+ 0 0 29 -3,-0.4 -1,-0.2 2,-0.1 2,-0.2 0.561 108.9 91.9-127.1 -40.0 88.1 36.4 17.3 322 327 A F S S- 0 0 16 -4,-0.3 -277,-0.1 1,-0.1 -279,-0.1 -0.413 77.4-124.1 -63.6 129.4 86.0 34.7 20.0 323 328 A D - 0 0 50 -279,-0.2 2,-0.2 -2,-0.2 -1,-0.1 -0.171 29.5 -97.2 -70.9 165.7 87.7 34.7 23.3 324 329 A D + 0 0 118 -282,-0.0 2,-0.3 -279,-0.0 -1,-0.1 -0.507 34.2 175.7 -89.7 156.2 88.4 31.5 25.3 325 330 A Y - 0 0 52 -282,-0.2 2,-0.6 -2,-0.2 -282,-0.2 -0.950 42.9-104.3-154.7 130.8 86.5 29.8 28.2 326 331 A E - 0 0 179 -2,-0.3 2,-0.8 1,-0.1 -284,-0.0 -0.445 40.3-140.9 -63.1 111.2 87.3 26.5 29.9 327 332 A E - 0 0 62 -2,-0.6 -1,-0.1 -284,-0.1 -284,-0.0 -0.663 20.6-163.2 -81.0 108.6 84.6 24.4 28.4 328 333 A E - 0 0 175 -2,-0.8 -1,-0.0 1,-0.2 -3,-0.0 -0.014 27.7 -75.0 -78.1-173.3 83.2 22.0 31.1 329 334 A E - 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