==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-MAY-07 2UZT . COMPND 2 MOLECULE: CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR G.D.ZHU,V.B.GANDHI,J.GONG,S.THOMAS,K.W.WOODS,X.SONG,T.LI, . 356 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16290.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 220 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 2 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 . 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 . 22 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 2 1 2 0 1 1 1 1 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 1 0 1 0 1 2 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 1 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 15 A V > 0 0 95 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -36.8 2.8 24.1 19.9 2 16 A K H > + 0 0 150 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.868 360.0 53.4 -67.7 -34.9 3.7 27.8 20.1 3 17 A E H > S+ 0 0 128 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.924 109.4 48.6 -63.2 -45.5 0.9 28.2 22.7 4 18 A F H > S+ 0 0 76 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.903 111.4 48.8 -61.3 -45.5 2.4 25.3 24.7 5 19 A L H X S+ 0 0 25 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.912 107.8 53.9 -64.4 -42.8 6.0 26.7 24.6 6 20 A A H X S+ 0 0 56 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.930 113.1 43.9 -56.9 -45.9 4.9 30.2 25.7 7 21 A K H X S+ 0 0 144 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.902 112.8 52.2 -65.0 -42.2 3.2 28.7 28.7 8 22 A A H X S+ 0 0 14 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.892 107.6 51.7 -62.3 -41.3 6.2 26.4 29.4 9 23 A K H X S+ 0 0 58 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.834 107.3 53.2 -67.7 -31.9 8.6 29.3 29.3 10 24 A E H X S+ 0 0 139 -4,-1.5 4,-2.2 -5,-0.2 -2,-0.2 0.963 112.9 42.3 -66.2 -51.2 6.5 31.3 31.8 11 25 A D H X S+ 0 0 79 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.921 116.4 50.4 -60.6 -44.8 6.5 28.4 34.4 12 26 A F H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 3,-0.2 0.963 110.1 48.5 -58.2 -54.8 10.2 27.7 33.7 13 27 A L H X S+ 0 0 44 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.883 106.5 56.6 -54.6 -43.4 11.3 31.3 34.1 14 28 A K H X S+ 0 0 120 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.934 113.2 41.1 -54.5 -47.9 9.4 31.8 37.4 15 29 A K H < S+ 0 0 87 -4,-1.7 -1,-0.2 68,-0.2 -2,-0.2 0.860 111.9 55.7 -69.5 -36.9 11.3 28.8 38.9 16 30 A W H < S+ 0 0 35 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.901 111.9 42.6 -62.6 -42.5 14.6 29.8 37.3 17 31 A E H < S+ 0 0 106 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.743 128.4 30.9 -75.7 -25.5 14.5 33.3 38.9 18 32 A N S < S- 0 0 125 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.1 -0.551 84.4-171.1-134.1 70.3 13.2 31.8 42.3 19 33 A P - 0 0 44 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.297 22.7-115.9 -66.6 144.5 14.7 28.3 42.7 20 34 A A - 0 0 48 59,-0.1 2,-0.3 62,-0.1 3,-0.1 -0.421 32.2-160.4 -76.0 152.7 13.6 25.9 45.5 21 35 A Q - 0 0 91 1,-0.2 75,-0.1 -2,-0.1 315,-0.1 -0.944 51.8 -6.2-137.6 158.4 16.1 24.8 48.2 22 36 A N + 0 0 68 -2,-0.3 74,-0.2 1,-0.2 -1,-0.2 0.769 61.1 165.0 18.3 82.0 16.5 22.1 50.8 23 37 A T + 0 0 70 72,-2.4 2,-0.3 -3,-0.1 -1,-0.2 -0.039 59.9 10.2-109.2 29.1 13.2 20.4 50.4 24 38 A A - 0 0 8 71,-0.3 2,-0.3 70,-0.1 73,-0.2 -0.965 68.1-118.2 178.0 178.8 14.1 17.1 52.2 25 39 A H > - 0 0 115 -2,-0.3 3,-1.1 71,-0.1 4,-0.1 -0.975 21.3-121.8-139.6 154.0 16.7 15.3 54.4 26 40 A L G > S+ 0 0 58 -2,-0.3 3,-1.9 1,-0.2 -1,-0.1 0.872 105.7 58.7 -63.2 -42.8 18.9 12.2 54.1 27 41 A D G 3 S+ 0 0 124 1,-0.3 -1,-0.2 3,-0.1 0, 0.0 0.438 92.3 70.1 -72.1 4.5 17.7 10.3 57.1 28 42 A Q G < S+ 0 0 56 -3,-1.1 21,-1.7 21,-0.1 22,-0.5 0.445 94.4 72.7 -94.8 -3.5 14.2 10.3 55.8 29 43 A F E < S-A 48 0A 14 -3,-1.9 2,-0.7 19,-0.2 19,-0.2 -0.868 73.8-138.3-117.1 147.0 15.3 7.9 53.1 30 44 A E E -A 47 0A 85 17,-2.6 17,-2.0 -2,-0.3 2,-0.5 -0.912 21.7-138.4-104.6 113.8 16.3 4.2 53.1 31 45 A R E +A 46 0A 89 -2,-0.7 15,-0.2 15,-0.2 3,-0.1 -0.592 31.8 167.0 -71.4 119.5 19.4 3.6 51.0 32 46 A I E - 0 0 68 13,-2.7 2,-0.3 -2,-0.5 14,-0.2 0.847 50.5 -22.6-106.1 -42.8 18.8 0.3 49.1 33 47 A K E -A 45 0A 37 12,-1.2 12,-3.0 282,-0.0 2,-0.5 -0.958 56.1-103.7-170.2 149.9 21.3 -0.2 46.3 34 48 A T E -A 44 0A 0 -2,-0.3 282,-0.4 282,-0.3 10,-0.3 -0.685 30.3-177.6 -81.1 124.2 23.8 1.6 44.0 35 49 A L E - 0 0 9 8,-2.9 279,-0.4 -2,-0.5 2,-0.3 0.727 62.2 -25.2 -92.0 -28.4 22.2 1.8 40.5 36 50 A G E -A 43 0A 16 7,-1.5 7,-2.6 277,-0.1 -1,-0.3 -0.972 56.3-147.5-174.8 166.9 25.1 3.4 38.8 37 51 A T E +A 42 0A 95 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.815 17.2 154.7-140.2 179.1 28.2 5.5 39.1 38 52 A G E > -A 41 0A 32 3,-1.6 3,-1.6 -2,-0.2 315,-0.0 -0.975 54.8 -17.6 175.4-179.0 30.4 8.1 37.4 39 53 A S T 3 S- 0 0 82 -2,-0.3 -1,-0.1 1,-0.3 314,-0.0 0.521 126.4 -20.3 -0.7 -98.3 32.9 11.0 37.7 40 54 A F T 3 S+ 0 0 35 -3,-0.1 21,-1.4 28,-0.0 2,-0.3 -0.039 126.3 58.0-117.6 27.8 32.5 12.2 41.4 41 55 A G E < -AB 38 60A 18 -3,-1.6 -3,-1.6 19,-0.2 2,-0.3 -0.947 54.8-152.6-151.0 172.3 29.1 10.7 42.1 42 56 A R E -AB 37 59A 31 17,-1.5 17,-2.9 -2,-0.3 2,-0.4 -0.970 14.1-138.1-144.8 156.5 26.8 7.8 42.3 43 57 A V E -AB 36 58A 45 -7,-2.6 -8,-2.9 -2,-0.3 -7,-1.5 -0.980 23.6-173.2-121.1 128.8 23.0 7.1 42.0 44 58 A M E -AB 34 57A 0 13,-2.4 13,-3.0 -2,-0.4 2,-0.4 -0.887 30.2-113.0-123.8 154.8 21.2 4.8 44.4 45 59 A L E -AB 33 56A 0 -12,-3.0 -13,-2.7 -2,-0.3 -12,-1.2 -0.705 45.1-177.4 -80.7 129.6 17.8 3.4 44.7 46 60 A V E -AB 31 55A 1 9,-3.3 9,-3.2 -2,-0.4 2,-0.5 -0.946 21.6-143.5-131.4 152.9 16.2 4.9 47.8 47 61 A K E -AB 30 54A 62 -17,-2.0 -17,-2.6 -2,-0.3 2,-0.9 -0.971 17.2-134.0-120.7 122.3 12.9 4.5 49.6 48 62 A H E >>> -AB 29 53A 23 5,-3.6 4,-3.0 -2,-0.5 3,-0.7 -0.637 25.6-154.0 -71.2 106.4 11.2 7.5 51.3 49 63 A M T 345S+ 0 0 90 -21,-1.7 -1,-0.2 -2,-0.9 -20,-0.1 0.853 84.3 54.4 -54.9 -47.8 10.4 5.7 54.5 50 64 A E T 345S+ 0 0 111 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.805 125.7 24.4 -60.1 -29.4 7.3 7.6 55.7 51 65 A T T <45S- 0 0 77 -3,-0.7 -2,-0.2 2,-0.2 -1,-0.2 0.640 95.1-126.9-110.8 -20.1 5.6 7.0 52.4 52 66 A G T <5 + 0 0 34 -4,-3.0 2,-0.3 1,-0.3 -3,-0.2 0.456 59.0 148.0 82.8 0.8 7.2 3.8 51.0 53 67 A N E < -B 48 0A 83 -5,-0.6 -5,-3.6 -6,-0.1 -1,-0.3 -0.553 41.0-139.4 -74.7 128.2 7.8 5.7 47.8 54 68 A H E +B 47 0A 46 -2,-0.3 54,-0.5 -7,-0.3 2,-0.3 -0.618 26.8 171.6 -87.4 145.3 11.0 4.7 45.9 55 69 A Y E -BC 46 107A 27 -9,-3.2 -9,-3.3 -2,-0.3 2,-0.5 -0.920 34.9-115.2-144.6 166.4 13.3 7.3 44.3 56 70 A A E -BC 45 106A 12 50,-3.1 50,-3.4 -2,-0.3 2,-0.5 -0.944 33.0-161.5-107.4 127.7 16.7 7.5 42.6 57 71 A M E -BC 44 105A 1 -13,-3.0 -13,-2.4 -2,-0.5 2,-0.5 -0.948 8.1-154.6-118.1 119.3 19.1 9.6 44.5 58 72 A K E -BC 43 104A 25 46,-2.8 46,-2.1 -2,-0.5 2,-0.5 -0.801 12.4-162.4 -91.2 131.2 22.3 11.1 43.1 59 73 A I E -BC 42 103A 9 -17,-2.9 -17,-1.5 -2,-0.5 2,-0.4 -0.963 5.6-171.5-117.1 119.8 25.0 11.8 45.7 60 74 A L E -BC 41 102A 3 42,-2.4 42,-2.1 -2,-0.5 2,-0.6 -0.912 22.6-131.4-112.0 140.2 27.8 14.2 44.9 61 75 A D E > - C 0 101A 49 -21,-1.4 4,-2.4 -2,-0.4 40,-0.2 -0.813 15.6-146.7 -88.6 117.3 30.9 14.7 47.2 62 76 A K H > S+ 0 0 4 38,-2.4 4,-2.1 -2,-0.6 5,-0.2 0.896 97.7 48.2 -52.4 -45.9 31.3 18.4 47.6 63 77 A Q H > S+ 0 0 102 37,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.875 110.5 52.0 -64.7 -36.5 35.1 18.2 47.7 64 78 A K H > S+ 0 0 96 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.914 108.0 52.1 -65.3 -42.6 35.2 16.0 44.7 65 79 A V H <>S+ 0 0 0 -4,-2.4 5,-3.1 2,-0.2 6,-0.3 0.919 111.6 46.1 -58.2 -46.4 33.1 18.5 42.7 66 80 A V H ><5S+ 0 0 47 -4,-2.1 3,-2.2 3,-0.2 -2,-0.2 0.954 110.6 53.8 -62.0 -48.5 35.5 21.3 43.6 67 81 A K H 3<5S+ 0 0 124 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.894 111.9 43.7 -53.3 -45.1 38.5 19.1 42.8 68 82 A L T 3<5S- 0 0 47 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.312 113.5-121.2 -85.0 10.4 37.1 18.4 39.3 69 83 A K T < 5S+ 0 0 135 -3,-2.2 -3,-0.2 -5,-0.1 4,-0.2 0.874 71.6 133.3 50.9 44.5 36.1 22.1 38.9 70 84 A Q >< + 0 0 17 -5,-3.1 4,-2.4 -6,-0.1 5,-0.2 0.151 26.2 113.3-107.7 20.3 32.5 21.3 38.5 71 85 A I H > S+ 0 0 46 -6,-0.3 4,-2.1 2,-0.2 5,-0.2 0.950 81.9 38.8 -56.3 -56.4 31.1 23.9 40.9 72 86 A E H > S+ 0 0 129 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.915 116.5 51.5 -63.1 -42.7 29.4 26.1 38.3 73 87 A H H > S+ 0 0 24 -4,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.852 110.0 50.5 -62.3 -35.4 28.1 23.1 36.3 74 88 A T H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.912 108.9 50.0 -68.7 -44.1 26.7 21.5 39.4 75 89 A L H X S+ 0 0 12 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.880 109.9 53.7 -62.1 -36.9 24.8 24.7 40.3 76 90 A N H X S+ 0 0 15 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.941 107.3 49.2 -61.6 -49.7 23.5 24.7 36.8 77 91 A E H X S+ 0 0 7 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.899 113.4 47.3 -58.4 -40.6 22.2 21.2 37.0 78 92 A K H X S+ 0 0 1 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.925 114.8 43.9 -67.5 -46.6 20.4 22.0 40.3 79 93 A R H < S+ 0 0 71 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.851 117.3 45.5 -69.1 -34.9 18.9 25.3 39.1 80 94 A I H >X S+ 0 0 0 -4,-2.6 4,-1.2 -5,-0.2 3,-1.1 0.931 110.7 51.1 -75.5 -45.9 17.7 23.9 35.8 81 95 A L H 3< S+ 0 0 6 -4,-2.1 11,-0.6 -5,-0.3 -2,-0.2 0.820 107.0 52.9 -62.9 -33.9 16.3 20.6 37.0 82 96 A Q T 3< S+ 0 0 28 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.626 114.7 44.7 -77.2 -9.6 14.1 22.2 39.7 83 97 A A T <4 S+ 0 0 0 -3,-1.1 -68,-0.2 -4,-0.3 -2,-0.2 0.579 96.9 82.9-108.9 -14.8 12.7 24.5 37.0 84 98 A V < - 0 0 18 -4,-1.2 2,-0.3 -3,-0.2 8,-0.2 -0.573 46.9-177.0 -94.5 160.3 11.9 22.2 34.1 85 99 A N + 0 0 105 -2,-0.2 -73,-0.1 6,-0.1 5,-0.1 -0.798 21.3 135.7-158.3 108.2 8.9 19.9 33.4 86 100 A F > - 0 0 12 3,-0.3 3,-2.0 -2,-0.3 -2,-0.0 -0.982 56.7-117.2-152.2 141.9 8.5 17.6 30.5 87 101 A P T 3 S+ 0 0 40 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.734 113.9 47.6 -56.2 -22.4 7.3 14.0 30.3 88 102 A F T 3 S+ 0 0 0 47,-0.1 80,-3.5 79,-0.1 2,-0.4 0.374 96.6 82.6-103.2 7.1 10.7 12.7 29.0 89 103 A L B < S-e 168 0B 4 -3,-2.0 2,-0.3 78,-0.2 -3,-0.3 -0.874 87.9-110.2-107.7 140.2 12.9 14.5 31.5 90 104 A V - 0 0 6 78,-2.1 2,-0.5 -2,-0.4 -2,-0.1 -0.551 35.4-126.7 -72.4 132.4 13.4 13.0 35.0 91 105 A K - 0 0 95 -2,-0.3 16,-1.6 -4,-0.1 2,-0.7 -0.674 9.5-131.9 -85.5 125.5 11.7 15.1 37.6 92 106 A L E +D 106 0A 27 -11,-0.6 14,-0.3 -2,-0.5 3,-0.1 -0.660 27.8 178.3 -75.3 113.7 13.7 16.4 40.6 93 107 A E E - 0 0 74 12,-3.0 2,-0.3 -2,-0.7 13,-0.2 0.862 62.4 -1.3 -85.5 -42.3 11.5 15.5 43.5 94 108 A F E -D 105 0A 41 11,-1.9 11,-3.4 2,-0.0 2,-0.3 -0.977 58.2-171.7-147.1 157.0 13.7 16.8 46.4 95 109 A S E +D 104 0A 4 -2,-0.3 -72,-2.4 9,-0.2 -71,-0.3 -0.981 17.8 144.7-152.6 140.6 17.2 18.3 46.8 96 110 A F E -D 103 0A 6 7,-1.5 7,-2.6 -2,-0.3 2,-0.3 -0.962 26.2-142.0-162.9 173.5 19.2 19.1 49.9 97 111 A K E -D 102 0A 54 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.960 9.0-170.2-144.9 158.0 22.8 19.2 51.2 98 112 A D - 0 0 37 3,-1.9 230,-0.2 -2,-0.3 226,-0.0 -0.654 54.4 -65.8-132.7-166.9 24.7 18.3 54.4 99 113 A N S S+ 0 0 52 -2,-0.2 229,-2.3 225,-0.2 230,-0.1 0.849 129.7 16.8 -54.7 -35.4 28.3 18.9 55.6 100 114 A S S S+ 0 0 11 227,-0.1 -38,-2.4 224,-0.1 -37,-0.4 0.801 117.4 42.1-109.8 -34.7 29.8 16.7 53.0 101 115 A N E -C 61 0A 9 -40,-0.2 -3,-1.9 -39,-0.1 2,-0.4 -0.653 55.6-133.8-120.6 172.7 27.4 16.0 50.0 102 116 A L E -CD 60 97A 0 -42,-2.1 -42,-2.4 -5,-0.2 2,-0.4 -0.944 27.8-154.5-119.4 140.6 24.9 17.3 47.6 103 117 A Y E -CD 59 96A 0 -7,-2.6 -7,-1.5 -2,-0.4 2,-0.5 -0.974 16.9-176.6-130.2 131.9 21.7 15.3 47.0 104 118 A M E -CD 58 95A 0 -46,-2.1 -46,-2.8 -2,-0.4 2,-0.6 -0.990 10.9-164.7-122.1 117.9 19.2 15.1 44.1 105 119 A V E +CD 57 94A 0 -11,-3.4 -12,-3.0 -2,-0.5 -11,-1.9 -0.924 21.1 168.2-109.5 115.9 16.2 12.9 44.6 106 120 A M E -CD 56 92A 20 -50,-3.4 -50,-3.1 -2,-0.6 -14,-0.2 -0.826 43.0 -74.6-128.4 164.3 14.4 12.1 41.4 107 121 A E E -C 55 0A 84 -16,-1.6 2,-0.3 -2,-0.3 -52,-0.2 -0.315 54.6-121.1 -56.3 130.8 11.7 9.8 39.9 108 122 A Y - 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0 0 2 -2,-0.5 23,-0.3 24,-0.2 -1,-0.1 0.930 12.4-177.3 -77.8 -50.4 21.9 19.6 27.2 151 165 A R + 0 0 14 52,-0.1 -1,-0.1 1,-0.1 36,-0.1 0.557 60.5 72.1 62.5 13.5 25.4 18.7 26.0 152 166 A D + 0 0 4 34,-0.1 2,-0.4 202,-0.0 5,-0.1 -0.086 53.3 154.6-149.7 49.3 25.5 15.0 27.1 153 167 A L + 0 0 3 37,-0.2 34,-0.2 3,-0.1 3,-0.1 -0.634 22.4 122.0 -78.7 130.3 23.2 12.9 24.9 154 168 A K S > S- 0 0 8 -2,-0.4 3,-1.8 1,-0.1 4,-0.4 -0.892 74.0 -95.3-179.2 156.9 24.3 9.2 24.8 155 169 A P G > S+ 0 0 0 0, 0.0 -40,-1.4 0, 0.0 3,-1.3 0.818 117.9 65.4 -51.2 -37.5 22.8 5.8 25.5 156 170 A E G 3 S+ 0 0 18 1,-0.2 -40,-0.1 -42,-0.2 -3,-0.1 0.742 103.1 45.4 -59.3 -27.9 24.3 5.9 29.0 157 171 A N G < S+ 0 0 15 -3,-1.8 12,-2.3 -5,-0.1 2,-0.6 0.395 94.5 87.0-101.0 3.9 22.2 8.8 30.1 158 172 A L E < - G 0 168B 0 -3,-1.3 -44,-3.3 -4,-0.4 -43,-0.4 -0.913 57.7-170.8-109.5 116.5 18.8 7.6 28.8 159 173 A L E -FG 113 167B 27 8,-2.2 8,-2.0 -2,-0.6 2,-0.4 -0.720 19.0-128.0-104.0 156.1 16.8 5.3 31.1 160 174 A I E - G 0 166B 1 -48,-2.6 -49,-1.3 -2,-0.3 -48,-0.5 -0.879 22.2-149.0-104.3 131.7 13.7 3.4 30.2 161 175 A D > - 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0 0 22 -30,-2.4 2,-0.5 -2,-0.7 26,-0.1 -0.991 36.6-158.2-143.0 148.4 22.9 30.3 27.4 178 192 A K S S+ 0 0 151 -2,-0.3 2,-0.3 2,-0.1 -2,-0.0 -0.983 78.0 2.0-119.6 129.6 22.0 32.9 24.8 179 193 A G S S- 0 0 53 -2,-0.5 2,-0.3 2,-0.0 -2,-0.1 -0.674 114.1 -21.8 94.6-148.6 24.7 33.1 22.1 180 194 A R - 0 0 146 -2,-0.3 2,-0.3 22,-0.1 22,-0.2 -0.751 51.1-165.8-104.8 151.1 27.8 30.9 22.0 181 195 A T B -I 201 0D 6 20,-2.4 20,-1.8 -2,-0.3 18,-0.1 -0.827 7.8-156.8-125.1 167.0 29.4 29.0 24.8 182 196 A W + 0 0 138 -2,-0.3 18,-0.2 18,-0.2 16,-0.1 0.601 39.1 132.7-123.0 -16.1 32.9 27.4 24.9 183 197 A T - 0 0 40 1,-0.1 2,-1.7 18,-0.1 -2,-0.1 -0.119 58.4-128.7 -46.5 123.5 33.2 24.6 27.5 184 198 A L + 0 0 64 172,-0.1 2,-0.3 12,-0.1 -1,-0.1 -0.653 54.9 163.3 -78.0 91.6 34.9 21.4 26.0 185 199 A C + 0 0 1 -2,-1.7 2,-0.3 2,-0.1 171,-0.1 -0.776 13.9 33.9-114.6 156.4 32.0 19.3 27.2 186 200 A G B S-J 355 0E 2 169,-0.7 169,-4.2 -2,-0.3 -34,-0.1 -0.807 85.1 -46.1 116.0-154.0 30.6 15.8 26.6 187 201 A T > - 0 0 1 -2,-0.3 3,-2.2 167,-0.3 4,-0.3 -0.998 53.3-118.1-130.0 127.4 31.6 12.3 25.7 188 202 A P G > S+ 0 0 1 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.777 108.8 53.7 -31.5 -56.5 34.1 12.0 22.8 189 203 A E G 3 S+ 0 0 0 1,-0.3 35,-0.2 -3,-0.1 -35,-0.0 0.729 113.6 42.7 -60.1 -24.2 31.9 9.9 20.5 190 204 A Y G < S+ 0 0 12 -3,-2.2 2,-0.4 32,-0.1 -1,-0.3 0.238 82.3 121.5-109.4 13.9 29.1 12.5 20.6 191 205 A L < - 0 0 6 -3,-1.5 -5,-0.1 -4,-0.3 15,-0.0 -0.658 58.4-132.2 -82.7 129.9 31.0 15.7 20.3 192 206 A A >> - 0 0 0 -2,-0.4 3,-0.7 1,-0.1 4,-0.6 -0.328 26.7-108.3 -72.4 158.4 30.1 17.9 17.4 193 207 A P H >> S+ 0 0 2 0, 0.0 3,-1.2 0, 0.0 4,-0.7 0.890 115.7 60.5 -56.6 -40.4 33.0 19.4 15.4 194 208 A E H >4>S+ 0 0 8 1,-0.3 5,-0.7 2,-0.2 3,-0.7 0.812 94.8 63.1 -57.6 -34.7 32.5 22.9 16.7 195 209 A I H <45S+ 0 0 15 -3,-0.7 3,-0.3 1,-0.2 -1,-0.3 0.782 108.2 41.3 -63.4 -27.8 33.1 21.8 20.3 196 210 A I H <<5S+ 0 0 61 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.521 105.2 67.7 -96.2 -7.4 36.7 20.8 19.4 197 211 A L T <<5S- 0 0 91 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.215 92.3-134.7 -98.9 13.2 37.3 23.8 17.2 198 212 A S T 5S+ 0 0 107 -3,-0.3 -3,-0.1 1,-0.2 3,-0.1 0.691 76.3 109.3 39.9 35.7 37.3 26.5 19.9 199 213 A K S - 0 0 58 -2,-0.3 3,-2.3 -22,-0.2 4,-0.2 -0.562 55.8 -52.5-132.8-164.5 25.3 26.7 20.3 203 217 A K T >> S+ 0 0 37 1,-0.3 3,-1.6 -2,-0.2 4,-0.8 0.651 114.5 83.5 -49.8 -22.7 22.2 24.4 20.6 204 218 A A H 3> S+ 0 0 1 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.724 76.1 69.4 -59.2 -22.2 23.2 22.9 17.3 205 219 A V H <> S+ 0 0 5 -3,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.844 93.3 57.3 -66.1 -31.0 25.6 20.5 19.0 206 220 A D H <> S+ 0 0 2 -3,-1.6 4,-1.6 -4,-0.2 -1,-0.2 0.872 104.5 51.7 -66.2 -36.3 22.6 18.7 20.6 207 221 A W H X S+ 0 0 7 -4,-0.8 4,-1.5 2,-0.2 -1,-0.2 0.856 107.9 51.4 -69.5 -33.4 21.2 18.0 17.1 208 222 A W H X S+ 0 0 0 -4,-1.5 4,-1.7 1,-0.2 3,-0.3 0.948 108.5 51.8 -67.0 -44.2 24.6 16.6 16.0 209 223 A A H X S+ 0 0 6 -4,-2.2 4,-2.9 1,-0.3 -2,-0.2 0.843 104.1 57.8 -58.1 -35.1 24.6 14.3 19.1 210 224 A L H X S+ 0 0 0 -4,-1.6 4,-3.0 1,-0.2 5,-0.3 0.918 104.6 51.3 -62.2 -41.2 21.1 13.2 18.1 211 225 A G H X S+ 0 0 0 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.859 110.5 48.1 -63.5 -35.7 22.6 12.1 14.8 212 226 A V H X S+ 0 0 0 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.932 113.3 48.6 -69.0 -44.4 25.2 10.1 16.7 213 227 A L H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.922 111.1 47.5 -61.2 -50.1 22.6 8.6 18.9 214 228 A I H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.942 113.7 50.6 -58.0 -45.6 20.3 7.5 16.1 215 229 A Y H X S+ 0 0 5 -4,-1.9 4,-2.1 -5,-0.3 6,-0.3 0.956 112.5 44.5 -56.5 -54.0 23.3 6.1 14.3 216 230 A E H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.871 112.9 51.5 -61.5 -39.0 24.5 4.1 17.3 217 231 A M H < S+ 0 0 0 -4,-2.7 -93,-2.8 1,-0.2 -1,-0.2 0.947 116.2 40.0 -62.7 -47.9 21.0 2.8 18.1 218 232 A A H < S+ 0 0 2 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.725 127.8 32.2 -75.1 -22.5 20.4 1.6 14.6 219 233 A A H < S- 0 0 6 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.669 96.7-124.3-108.6 -22.4 23.9 0.2 14.0 220 234 A G S < S+ 0 0 7 -4,-2.8 -4,-0.1 -5,-0.3 -3,-0.1 0.400 87.9 58.1 92.1 -5.6 25.0 -1.0 17.4 221 235 A Y S S- 0 0 24 -6,-0.3 -2,-0.2 -5,-0.1 -1,-0.1 -0.982 91.1 -92.5-152.0 155.0 28.2 1.1 17.3 222 236 A P - 0 0 1 0, 0.0 3,-0.2 0, 0.0 -9,-0.1 -0.178 29.4-120.1 -67.1 160.8 28.9 4.9 17.0 223 237 A P S S+ 0 0 16 0, 0.0 2,-0.4 0, 0.0 19,-0.4 0.753 106.0 37.1 -72.0 -24.8 29.6 6.6 13.6 224 238 A F S S+ 0 0 3 -35,-0.2 2,-0.3 17,-0.1 8,-0.1 -0.928 77.4 149.7-133.3 110.2 33.1 7.6 14.9 225 239 A F + 0 0 34 -2,-0.4 2,-0.3 -3,-0.2 3,-0.0 -0.982 4.4 146.1-142.4 154.6 35.1 5.3 17.1 226 240 A A - 0 0 11 -2,-0.3 6,-0.1 117,-0.1 -2,-0.0 -0.951 57.8 -86.1-171.0 167.3 38.7 4.4 18.0 227 241 A D S S+ 0 0 106 -2,-0.3 -1,-0.0 1,-0.1 3,-0.0 0.827 106.2 28.6 -56.4 -39.6 40.8 3.3 20.9 228 242 A Q S >> S- 0 0 94 1,-0.1 4,-1.5 -3,-0.0 3,-1.2 -0.944 81.0-112.5-130.4 152.4 41.6 6.8 22.3 229 243 A P H 3> S+ 0 0 44 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.845 113.0 56.5 -41.4 -52.7 39.8 10.2 22.3 230 244 A I H 3> S+ 0 0 111 1,-0.3 4,-1.4 2,-0.2 -3,-0.0 0.856 106.6 50.7 -53.6 -38.1 42.4 12.0 20.1 231 245 A Q H <> S+ 0 0 64 -3,-1.2 4,-1.4 2,-0.2 -1,-0.3 0.898 111.3 49.6 -65.6 -40.9 41.8 9.3 17.4 232 246 A I H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 3,-0.2 0.930 104.9 55.3 -64.3 -48.8 38.0 10.0 17.7 233 247 A Y H X S+ 0 0 43 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.858 106.0 54.0 -55.2 -36.3 38.2 13.7 17.4 234 248 A E H X S+ 0 0 143 -4,-1.4 4,-1.3 -5,-0.2 3,-0.3 0.908 107.0 49.3 -65.9 -43.3 40.1 13.4 14.1 235 249 A K H <>S+ 0 0 91 -4,-1.4 5,-0.7 -3,-0.2 3,-0.4 0.908 106.5 57.1 -62.6 -41.4 37.4 11.1 12.6 236 250 A I H <5S+ 0 0 3 -4,-2.2 3,-0.5 1,-0.2 -1,-0.2 0.825 109.8 45.1 -59.3 -32.8 34.7 13.6 13.7 237 251 A V H <5S+ 0 0 69 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.712 95.7 72.2 -86.2 -20.2 36.4 16.4 11.7 238 252 A S T <5S- 0 0 56 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.603 94.6-143.2 -68.6 -7.4 37.1 14.3 8.6 239 253 A G T 5 + 0 0 41 -3,-0.5 2,-0.5 -4,-0.4 -3,-0.1 0.808 54.5 131.5 49.3 34.3 33.3 14.7 8.1 240 254 A K < + 0 0 145 -5,-0.7 2,-0.4 -17,-0.0 -1,-0.2 -0.972 31.9 179.9-122.7 125.7 33.1 11.2 6.8 241 255 A V - 0 0 34 -2,-0.5 2,-0.4 -3,-0.1 -17,-0.1 -0.981 15.4-150.8-126.7 135.4 30.6 8.6 7.9 242 256 A R - 0 0 198 -2,-0.4 -2,-0.0 -19,-0.4 0, 0.0 -0.869 15.1-151.5-103.3 133.9 30.1 5.0 6.8 243 257 A F - 0 0 39 -2,-0.4 9,-0.0 4,-0.0 -28,-0.0 -0.869 18.6-114.7-109.5 138.9 26.6 3.5 6.9 244 258 A P > - 0 0 15 0, 0.0 3,-1.6 0, 0.0 -1,-0.0 -0.337 29.0-119.7 -63.3 151.8 25.7 -0.1 7.4 245 259 A S T 3 S+ 0 0 125 1,-0.3 -2,-0.0 0, 0.0 0, 0.0 0.706 111.2 65.4 -68.7 -17.7 23.9 -1.6 4.3 246 260 A H T 3 S+ 0 0 77 2,-0.1 -1,-0.3 -27,-0.0 2,-0.3 0.567 76.9 107.7 -81.2 -5.0 20.8 -2.4 6.5 247 261 A F S < S- 0 0 6 -3,-1.6 -4,-0.0 1,-0.1 -28,-0.0 -0.546 75.3-122.1 -71.1 132.8 20.3 1.3 7.0 248 262 A S > - 0 0 38 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.278 19.3-111.7 -72.5 162.8 17.2 2.5 5.0 249 263 A S H > S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.928 118.8 50.7 -61.1 -45.1 17.6 5.3 2.5 250 264 A D H > S+ 0 0 64 1,-0.2 4,-2.3 2,-0.2 32,-0.4 0.854 110.1 50.9 -62.5 -35.3 15.5 7.7 4.5 251 265 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.915 109.3 48.8 -69.4 -43.1 17.7 6.9 7.6 252 266 A K H X S+ 0 0 52 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.891 112.3 50.5 -63.8 -37.3 20.9 7.6 5.8 253 267 A D H X S+ 0 0 57 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.946 109.7 48.5 -64.4 -49.7 19.5 10.8 4.4 254 268 A L H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 3,-0.2 0.925 112.3 50.8 -55.7 -46.7 18.4 12.1 7.9 255 269 A L H X S+ 0 0 0 -4,-2.4 4,-3.4 1,-0.2 -1,-0.2 0.838 105.8 53.3 -61.3 -36.9 21.8 11.2 9.3 256 270 A R H < S+ 0 0 126 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.850 112.4 46.8 -66.9 -33.4 23.7 13.1 6.5 257 271 A N H < S+ 0 0 36 -4,-1.7 10,-2.7 -3,-0.2 3,-0.3 0.655 117.8 42.3 -79.5 -20.7 21.6 16.1 7.5 258 272 A L H < S+ 0 0 0 -4,-1.1 2,-1.0 8,-0.2 -2,-0.2 0.862 112.3 50.3 -92.9 -45.3 22.2 15.6 11.2 259 273 A L S < S+ 0 0 16 -4,-3.4 2,-0.6 -5,-0.1 -1,-0.2 -0.336 81.5 141.9 -89.5 51.1 25.9 14.8 11.1 260 274 A Q - 0 0 51 -2,-1.0 6,-0.1 -3,-0.3 5,-0.1 -0.860 41.2-162.5 -98.9 117.2 26.5 17.9 9.0 261 275 A V S S+ 0 0 50 -2,-0.6 2,-1.0 -22,-0.1 -1,-0.2 0.882 75.2 84.1 -65.2 -37.2 29.7 19.7 9.8 262 276 A D S >> S- 0 0 65 1,-0.2 3,-2.4 -3,-0.1 4,-0.5 -0.561 70.4-157.8 -71.6 103.8 28.5 22.8 8.0 263 277 A L T 34 S+ 0 0 67 -2,-1.0 -1,-0.2 1,-0.3 3,-0.2 0.641 88.6 62.6 -57.8 -17.1 26.4 24.5 10.6 264 278 A T T 34 S+ 0 0 91 1,-0.2 -1,-0.3 6,-0.0 -2,-0.1 0.543 111.3 37.7 -86.5 -5.3 24.4 26.4 8.0 265 279 A K T <4 S+ 0 0 116 -3,-2.4 2,-0.3 -5,-0.1 -2,-0.2 0.336 87.7 114.3-124.9 3.8 23.1 23.1 6.5 266 280 A R >< - 0 0 0 -4,-0.5 3,-1.5 -3,-0.2 -8,-0.2 -0.635 69.2-112.9 -84.3 134.3 22.5 21.0 9.7 267 281 A F T 3 S+ 0 0 31 -10,-2.7 7,-0.1 -2,-0.3 -7,-0.1 -0.311 100.6 30.8 -63.9 143.4 19.0 20.0 10.5 268 282 A G T 3 S+ 0 0 12 5,-0.6 6,-0.3 -61,-0.0 -1,-0.2 0.083 113.3 67.9 94.3 -20.3 17.5 21.5 13.7 269 283 A N S < S+ 0 0 59 -3,-1.5 -2,-0.2 4,-0.2 -3,-0.1 0.163 83.6 94.4-115.3 16.2 19.6 24.6 13.1 270 284 A L S > S- 0 0 39 3,-0.1 3,-0.8 -5,-0.1 4,-0.1 -0.256 93.2 -82.5 -99.9-172.4 17.9 25.9 10.0 271 285 A K T 3 S+ 0 0 156 1,-0.3 -1,-0.0 2,-0.1 0, 0.0 0.890 130.6 40.8 -56.6 -45.2 15.2 28.4 9.1 272 286 A D T > S- 0 0 101 1,-0.2 3,-1.4 2,-0.1 -1,-0.3 0.481 96.8-168.5 -84.9 -3.3 12.4 25.9 9.8 273 287 A G T X + 0 0 17 -3,-0.8 3,-2.6 1,-0.2 -5,-0.6 -0.103 61.1 2.5 54.4-143.8 14.1 24.5 12.9 274 288 A V T >> S+ 0 0 18 -6,-0.3 4,-2.1 1,-0.3 3,-1.5 0.731 121.8 72.6 -48.2 -26.1 13.0 21.3 14.6 275 289 A N H <> S+ 0 0 75 -3,-1.4 4,-2.3 1,-0.3 -1,-0.3 0.788 82.3 67.0 -64.2 -26.5 10.4 20.9 11.9 276 290 A D H <4 S+ 0 0 33 -3,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.760 110.5 39.6 -63.5 -21.5 13.0 19.9 9.3 277 291 A I H X4 S+ 0 0 0 -3,-1.5 3,-1.5 -4,-0.4 -2,-0.2 0.886 112.6 51.1 -90.5 -52.1 13.4 16.9 11.4 278 292 A K H 3< S+ 0 0 22 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.802 115.9 44.2 -57.3 -31.4 9.8 16.1 12.4 279 293 A N T 3< S+ 0 0 124 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.1 0.395 84.9 118.6 -97.2 1.7 8.8 16.3 8.7 280 294 A H S X S- 0 0 6 -3,-1.5 3,-1.9 -5,-0.1 -3,-0.1 -0.369 77.6-111.8 -67.6 150.5 11.7 14.3 7.3 281 295 A K G > S+ 0 0 111 1,-0.3 3,-2.5 2,-0.2 4,-0.3 0.853 114.2 63.8 -49.1 -44.2 10.7 11.1 5.5 282 296 A W G 3 S+ 0 0 2 -32,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.739 106.1 46.6 -57.4 -22.4 12.2 8.8 8.2 283 297 A F G X S+ 0 0 3 -3,-1.9 3,-1.3 -6,-0.2 -1,-0.3 0.152 76.7 111.9-105.2 18.5 9.6 10.2 10.6 284 298 A A T < S+ 0 0 85 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.818 81.1 46.1 -61.2 -32.3 6.6 9.9 8.3 285 299 A T T 3 S+ 0 0 112 -3,-0.3 2,-0.5 -4,-0.3 -1,-0.3 0.464 90.4 107.1 -89.8 -2.0 5.1 7.2 10.5 286 300 A T < - 0 0 19 -3,-1.3 2,-1.2 -8,-0.1 3,-0.1 -0.692 57.6-155.9 -85.2 121.6 5.7 9.1 13.7 287 301 A D > - 0 0 91 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 -0.759 9.8-169.0 -94.8 88.4 2.7 10.7 15.3 288 302 A W H > S+ 0 0 30 -2,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.825 83.0 49.6 -49.3 -41.7 4.4 13.5 17.3 289 303 A I H > S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.951 109.8 50.8 -64.9 -47.7 1.3 14.3 19.3 290 304 A A H 4>S+ 0 0 7 1,-0.2 5,-2.7 2,-0.2 6,-0.6 0.867 109.8 51.5 -58.1 -37.4 0.7 10.7 20.3 291 305 A I H ><5S+ 0 0 5 -4,-2.1 3,-2.2 3,-0.2 -1,-0.2 0.957 108.5 49.2 -65.3 -49.8 4.3 10.4 21.5 292 306 A Y H 3<5S+ 0 0 90 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.907 111.9 50.4 -54.2 -43.2 4.1 13.5 23.6 293 307 A Q T 3<5S- 0 0 105 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.380 110.6-127.1 -76.9 3.3 0.9 12.1 25.1 294 308 A R T < 5S+ 0 0 57 -3,-2.2 -3,-0.2 -5,-0.2 -2,-0.1 0.798 74.8 122.0 55.9 31.3 2.7 8.8 25.7 295 309 A K < + 0 0 129 -5,-2.7 2,-0.3 -6,-0.2 -4,-0.2 0.405 37.3 104.7-104.8 3.7 -0.1 6.9 23.9 296 310 A V S S- 0 0 30 -6,-0.6 2,-0.5 -5,-0.1 0, 0.0 -0.619 83.8-103.7 -82.3 144.5 2.1 5.2 21.3 297 311 A E - 0 0 159 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.559 36.0-128.9 -71.2 117.5 2.8 1.5 21.8 298 312 A A - 0 0 20 -2,-0.5 3,-0.1 -135,-0.3 -133,-0.1 -0.447 3.3-142.1 -69.5 137.0 6.3 1.1 23.1 299 313 A P S S+ 0 0 68 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.732 89.8 37.6 -69.8 -23.8 8.4 -1.5 21.2 300 314 A F - 0 0 47 -136,-0.3 -2,-0.0 -137,-0.1 0, 0.0 -0.973 61.2-176.9-137.2 123.0 10.0 -2.6 24.5 301 315 A I - 0 0 85 -2,-0.4 2,-1.9 -3,-0.1 -139,-0.1 -0.924 11.2-161.0-119.9 103.3 8.4 -2.9 27.9 302 316 A P - 0 0 8 0, 0.0 -138,-0.1 0, 0.0 10,-0.1 -0.431 20.5-168.3 -81.8 62.6 10.9 -4.0 30.6 303 317 A K - 0 0 154 -2,-1.9 2,-0.3 1,-0.1 -140,-0.0 0.013 7.6-167.6 -46.3 160.2 8.3 -5.2 33.1 304 318 A F - 0 0 26 -142,-0.0 2,-1.2 7,-0.0 -1,-0.1 -0.971 31.1 -85.7-152.5 166.5 9.5 -5.9 36.6 305 319 A K S S- 0 0 148 -2,-0.3 4,-0.1 1,-0.0 6,-0.1 -0.627 80.1 -67.9 -79.4 95.9 8.8 -7.5 39.9 306 320 A G S > S- 0 0 40 -2,-1.2 3,-1.0 2,-0.1 -1,-0.0 0.284 85.4 -32.9 48.4-180.0 6.9 -4.8 41.9 307 321 A P T 3 S+ 0 0 110 0, 0.0 3,-0.1 0, 0.0 -254,-0.0 -0.306 123.5 31.7 -68.9 150.4 8.3 -1.5 43.2 308 322 A G T 3 S+ 0 0 19 1,-0.3 2,-0.2 -262,-0.1 -2,-0.1 0.397 80.5 146.3 84.6 -4.0 11.9 -1.2 44.3 309 323 A D < + 0 0 27 -3,-1.0 -1,-0.3 -4,-0.1 3,-0.1 -0.467 25.5 179.8 -69.9 138.3 13.1 -3.8 41.8 310 324 A T > + 0 0 27 -2,-0.2 3,-2.1 -3,-0.1 -1,-0.1 0.133 41.4 120.8-123.3 16.1 16.6 -3.2 40.4 311 325 A S T 3 S+ 0 0 54 1,-0.3 -1,-0.1 -6,-0.1 -200,-0.1 0.687 70.2 60.1 -57.0 -22.5 16.9 -6.2 38.1 312 326 A N T 3 S+ 0 0 34 -202,-0.4 -199,-0.5 -3,-0.1 -1,-0.3 0.380 99.3 68.1 -89.1 5.2 17.4 -4.1 35.0 313 327 A F S < S- 0 0 19 -3,-2.1 -277,-0.1 -201,-0.2 -3,-0.1 -0.782 83.0-112.8-118.7 163.9 20.6 -2.4 36.4 314 328 A D - 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0 0 91 1,-0.1 2,-0.6 -196,-0.0 -1,-0.2 -0.441 65.0-130.5 -61.8 127.8 30.0 2.8 29.8 352 19 B R - 0 0 10 -2,-0.2 2,-0.1 -3,-0.1 -1,-0.1 -0.746 11.7-135.1 -93.4 118.0 31.7 5.9 28.4 353 20 B N - 0 0 109 -2,-0.6 -315,-0.0 1,-0.1 2,-0.0 -0.388 23.2-119.8 -66.7 138.1 33.0 8.5 30.9 354 21 B A - 0 0 16 -167,-0.1 2,-0.5 -2,-0.1 -167,-0.3 -0.322 24.6-117.8 -73.1 160.6 32.2 12.1 30.0 355 22 B I B +J 186 0E 28 -169,-4.2 -169,-0.7 1,-0.2 -1,-0.1 -0.899 35.7 168.4-105.3 132.3 35.1 14.5 29.5 356 23 B H 0 0 77 -2,-0.5 -1,-0.2 -171,-0.1 -172,-0.1 0.837 360.0 360.0-103.0 -67.7 35.3 17.5 31.9 357 24 B D 0 0 155 -174,-0.1 -2,-0.1 -172,-0.0 -288,-0.0 0.503 360.0 360.0-138.6 360.0 38.7 19.3 31.6