==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 07-MAR-11 3R00 . COMPND 2 MOLECULE: PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINASE PI . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.LIU . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13440.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 18.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 3 0 2 1 1 0 0 0 0 0 0 0 1 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 . 1 1 2 1 1 1 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 . 2 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 33 A P 0 0 149 0, 0.0 3,-0.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-179.2 -30.7 -26.7 -16.7 2 34 A L > - 0 0 105 1,-0.1 3,-1.1 2,-0.1 2,-0.8 0.484 360.0 -54.1 77.5 165.6 -31.6 -26.2 -12.9 3 35 A E T 3 S+ 0 0 61 1,-0.3 -1,-0.1 2,-0.2 0, 0.0 -0.177 99.4 86.8 -87.3 42.0 -32.9 -27.9 -9.6 4 36 A S T 3 S+ 0 0 89 -2,-0.8 -1,-0.3 -3,-0.3 -2,-0.1 0.396 84.2 71.0 -92.3 -8.6 -36.1 -29.5 -10.5 5 37 A Q S < S+ 0 0 71 -3,-1.1 21,-2.9 21,-0.1 22,-0.5 0.768 99.2 44.5 -74.9 -26.2 -33.7 -32.4 -11.5 6 38 A Y E -A 25 0A 13 19,-0.2 2,-0.6 20,-0.1 19,-0.2 -0.941 65.3-144.3-126.4 140.6 -32.7 -33.3 -7.9 7 39 A Q E -A 24 0A 132 17,-2.8 17,-1.5 -2,-0.4 2,-0.4 -0.926 28.7-137.0 -97.0 124.8 -34.5 -33.8 -4.6 8 40 A V E +A 23 0A 86 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.643 26.3 177.0 -87.5 127.5 -32.3 -32.5 -1.7 9 41 A G E - 0 0 33 13,-3.5 3,-0.1 -2,-0.4 -1,-0.1 -0.127 43.0 -27.2-105.3-151.4 -32.1 -34.6 1.5 10 42 A P E - 0 0 93 0, 0.0 12,-2.9 0, 0.0 -1,-0.3 -0.236 64.5-102.3 -64.4 147.5 -30.1 -34.2 4.7 11 43 A L E -A 21 0A 93 10,-0.2 10,-0.3 1,-0.2 3,-0.1 -0.482 33.1-168.6 -56.1 127.3 -26.8 -32.3 5.0 12 44 A L E - 0 0 107 8,-3.3 2,-0.3 1,-0.4 9,-0.2 0.746 57.8 -41.9 -93.0 -33.3 -24.1 -35.1 5.2 13 45 A G E -A 20 0A 27 7,-1.5 7,-2.9 2,-0.0 -1,-0.4 -0.954 48.0-152.7 176.5 162.1 -21.2 -32.9 6.2 14 46 A S E +A 19 0A 81 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.977 32.9 109.8-149.7 159.4 -19.4 -29.6 5.8 15 47 A G E > S-A 18 0A 43 3,-2.4 3,-2.6 -2,-0.3 -2,-0.0 -0.964 81.7 -20.1 170.4-156.1 -15.8 -28.3 6.1 16 48 A G T 3 S+ 0 0 97 -2,-0.3 3,-0.1 1,-0.3 0, 0.0 0.679 133.6 55.5 -50.1 -22.4 -12.7 -27.0 4.1 17 49 A F T 3 S- 0 0 67 1,-0.3 2,-0.3 20,-0.0 -1,-0.3 0.629 115.5-117.3 -82.7 -14.8 -14.3 -28.9 1.1 18 50 A G E < -A 15 0A 20 -3,-2.6 -3,-2.4 19,-0.1 2,-0.4 -0.923 50.7 -37.5 111.1-139.6 -17.7 -27.0 1.4 19 51 A S E -AB 14 36A 42 17,-1.5 17,-3.0 -2,-0.3 2,-0.5 -0.985 50.5-163.5-133.4 127.8 -21.3 -28.5 2.2 20 52 A V E -AB 13 35A 25 -7,-2.9 -8,-3.3 -2,-0.4 -7,-1.5 -0.982 6.2-168.4-122.6 127.5 -22.4 -31.9 0.9 21 53 A Y E -AB 11 34A 73 13,-2.8 13,-3.2 -2,-0.5 -10,-0.2 -0.887 24.8-116.7-112.2 152.6 -26.0 -33.0 0.9 22 54 A S E + B 0 33A 17 -12,-2.9 -13,-3.5 -2,-0.3 2,-0.3 -0.513 47.3 166.7 -77.4 145.1 -27.7 -36.4 0.3 23 55 A G E -AB 8 32A 1 9,-2.8 9,-2.3 -15,-0.2 2,-0.4 -0.915 32.5-135.8-153.4 178.5 -29.9 -36.3 -2.8 24 56 A I E -AB 7 31A 59 -17,-1.5 -17,-2.8 -2,-0.3 2,-0.5 -0.990 25.7-123.0-144.2 127.7 -31.9 -38.2 -5.3 25 57 A R E >> -A 6 0A 61 5,-2.8 4,-2.2 -2,-0.4 3,-0.6 -0.644 24.0-146.4 -71.1 119.7 -32.0 -37.7 -9.1 26 58 A V T 34 S+ 0 0 75 -21,-2.9 -1,-0.2 -2,-0.5 -20,-0.1 0.911 88.9 60.9 -58.1 -42.3 -35.7 -37.1 -9.8 27 59 A S T 34 S+ 0 0 104 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.787 129.6 2.8 -61.7 -35.9 -35.8 -38.8 -13.2 28 60 A D T <4 S- 0 0 83 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.329 94.8-113.7-132.0 6.5 -34.7 -42.2 -12.1 29 61 A N < + 0 0 121 -4,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.666 54.1 166.8 63.5 18.4 -34.4 -42.0 -8.3 30 62 A L - 0 0 61 -5,-0.4 -5,-2.8 -6,-0.1 -1,-0.2 -0.472 39.9-118.3 -61.2 125.6 -30.5 -42.5 -8.4 31 63 A P E +B 24 0A 41 0, 0.0 59,-1.0 0, 0.0 2,-0.3 -0.481 45.1 169.8 -63.7 134.6 -28.9 -41.7 -5.0 32 64 A V E -BC 23 89A 0 -9,-2.3 -9,-2.8 57,-0.2 2,-0.4 -0.904 33.0-128.8-136.5 170.1 -26.5 -38.7 -5.4 33 65 A A E -BC 22 88A 13 55,-2.6 55,-3.0 -2,-0.3 2,-0.6 -0.981 18.5-151.0-119.2 136.8 -24.4 -36.4 -3.2 34 66 A I E -BC 21 87A 2 -13,-3.2 -13,-2.8 -2,-0.4 2,-0.5 -0.928 13.6-168.4-114.4 110.4 -24.7 -32.7 -3.9 35 67 A K E -BC 20 86A 9 51,-3.0 51,-2.9 -2,-0.6 2,-0.5 -0.879 5.3-158.2-107.2 129.1 -21.6 -30.8 -3.1 36 68 A H E -BC 19 85A 42 -17,-3.0 -17,-1.5 -2,-0.5 2,-0.5 -0.881 7.7-172.4-111.3 127.2 -21.6 -27.0 -2.9 37 69 A V E - C 0 84A 16 47,-3.1 47,-2.4 -2,-0.5 2,-0.3 -0.979 20.9-130.4-122.5 121.8 -18.3 -25.1 -3.3 38 70 A E E > - C 0 83A 82 -2,-0.5 3,-1.6 45,-0.2 4,-0.3 -0.537 10.2-137.7 -69.7 134.3 -18.0 -21.4 -2.7 39 71 A K G > S+ 0 0 41 43,-2.5 3,-1.6 1,-0.3 44,-0.1 0.862 102.8 59.6 -58.2 -40.8 -16.2 -19.4 -5.5 40 72 A D G 3 S+ 0 0 138 42,-0.4 -1,-0.3 1,-0.3 43,-0.1 0.649 104.6 50.8 -63.7 -14.7 -14.4 -17.3 -2.9 41 73 A R G < S+ 0 0 190 -3,-1.6 2,-0.8 -24,-0.0 -1,-0.3 0.395 86.0 97.6-106.0 1.8 -12.8 -20.4 -1.5 42 74 A I < + 0 0 21 -3,-1.6 3,-0.1 -4,-0.3 -1,-0.0 -0.818 37.9 165.6 -92.6 110.7 -11.6 -21.8 -4.8 43 75 A S + 0 0 100 -2,-0.8 2,-0.5 1,-0.1 -1,-0.2 0.561 63.6 64.6 -96.0 -13.3 -7.9 -20.8 -5.2 44 76 A D + 0 0 64 112,-0.1 12,-2.4 115,-0.0 13,-0.4 -0.954 63.0 175.2-122.2 117.8 -7.3 -23.3 -8.0 45 77 A W E +E 55 0B 66 -2,-0.5 2,-0.2 10,-0.3 8,-0.0 -0.822 1.6 170.3-121.5 153.9 -9.0 -22.9 -11.3 46 78 A G E -E 54 0B 15 8,-3.4 8,-1.9 -2,-0.3 2,-0.3 -0.720 24.8-114.6-141.4-166.8 -8.7 -24.7 -14.6 47 79 A E E -E 53 0B 136 -2,-0.2 6,-0.2 6,-0.2 -2,-0.0 -0.997 23.0-117.3-144.1 151.7 -10.4 -25.0 -17.9 48 80 A L - 0 0 20 4,-1.3 11,-0.0 -2,-0.3 10,-0.0 -0.343 38.5-100.8 -80.9 157.1 -12.3 -27.7 -19.7 49 81 A P S S+ 0 0 141 0, 0.0 -1,-0.1 0, 0.0 10,-0.0 0.821 133.7 54.7 -39.2 -26.5 -11.4 -29.5 -23.0 50 82 A N S S- 0 0 130 2,-0.1 -3,-0.0 1,-0.0 0, 0.0 0.986 113.3-118.4 -66.3 -65.3 -14.1 -26.8 -23.7 51 83 A G + 0 0 43 1,-0.4 2,-0.2 -5,-0.0 -1,-0.0 0.391 63.2 136.2 121.0 4.4 -12.6 -23.6 -22.3 52 84 A T - 0 0 50 1,-0.0 -4,-1.3 0, 0.0 2,-0.6 -0.573 62.0-114.2 -71.2 149.5 -15.1 -22.7 -19.6 53 85 A R E +E 47 0B 156 -2,-0.2 -6,-0.2 -6,-0.2 -1,-0.0 -0.822 52.4 158.1 -89.6 118.0 -13.4 -21.5 -16.4 54 86 A V E -E 46 0B 0 -8,-1.9 -8,-3.4 -2,-0.6 5,-0.1 -0.922 47.5 -77.5-135.2 160.7 -14.1 -24.1 -13.6 55 87 A P E >> -E 45 0B 5 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.306 39.8-123.5 -51.9 134.3 -12.6 -25.2 -10.3 56 88 A M H 3> S+ 0 0 25 -12,-2.4 4,-3.0 1,-0.2 5,-0.3 0.905 113.0 68.4 -41.8 -40.2 -9.6 -27.5 -10.8 57 89 A E H 3> S+ 0 0 20 -13,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.901 100.0 46.5 -53.5 -39.9 -11.6 -30.0 -8.7 58 90 A V H <> S+ 0 0 0 -3,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.927 111.7 51.2 -69.3 -41.7 -14.1 -30.3 -11.6 59 91 A V H X S+ 0 0 17 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.934 112.7 46.1 -57.3 -45.9 -11.2 -30.7 -14.1 60 92 A L H X S+ 0 0 1 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.914 110.6 52.4 -66.6 -42.2 -9.7 -33.5 -12.0 61 93 A L H X S+ 0 0 2 -4,-2.3 4,-1.1 -5,-0.3 13,-0.4 0.869 109.6 48.7 -62.3 -36.8 -13.0 -35.3 -11.5 62 94 A K H < S+ 0 0 89 -4,-2.1 3,-0.4 2,-0.2 -1,-0.2 0.903 107.6 55.9 -72.6 -34.8 -13.7 -35.4 -15.2 63 95 A K H < S+ 0 0 90 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.861 114.9 38.6 -63.8 -36.3 -10.2 -36.7 -15.9 64 96 A V H < S+ 0 0 3 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.536 86.4 123.8 -89.7 -7.3 -10.8 -39.6 -13.5 65 97 A S < + 0 0 42 -4,-1.1 2,-0.3 -3,-0.4 8,-0.1 -0.259 33.7 118.1 -55.1 130.0 -14.5 -40.3 -14.5 66 98 A S S S- 0 0 45 5,-0.2 5,-0.1 2,-0.2 -2,-0.0 -0.958 78.5 -89.2-172.2 176.7 -15.1 -43.8 -15.6 67 99 A G S S+ 0 0 67 -2,-0.3 2,-0.4 2,-0.0 -2,-0.1 0.584 87.7 115.8 -72.6 -10.7 -17.0 -47.0 -14.7 68 100 A F > - 0 0 73 1,-0.2 3,-1.0 4,-0.1 -2,-0.2 -0.416 60.4-153.6 -57.4 113.4 -14.0 -48.0 -12.5 69 101 A S T 3 S+ 0 0 36 -2,-0.4 -1,-0.2 1,-0.2 4,-0.1 0.510 75.4 82.6 -84.5 5.0 -15.7 -48.0 -9.2 70 102 A G T 3 S+ 0 0 7 81,-0.1 82,-2.4 2,-0.1 2,-0.4 0.580 90.9 53.6 -79.6 -10.8 -12.6 -47.2 -7.0 71 103 A V B < S-f 152 0C 3 -3,-1.0 -5,-0.2 80,-0.3 82,-0.2 -0.979 96.8-106.2-121.7 138.4 -12.9 -43.5 -7.7 72 104 A I - 0 0 7 80,-2.7 2,-0.5 -2,-0.4 -2,-0.1 -0.282 35.6-129.0 -57.3 142.9 -16.0 -41.4 -7.1 73 105 A R - 0 0 73 -8,-0.1 16,-2.4 -4,-0.1 2,-0.6 -0.863 3.4-139.5-100.4 133.0 -17.8 -40.3 -10.4 74 106 A L E -D 88 0A 16 -2,-0.5 14,-0.2 -13,-0.4 3,-0.1 -0.746 20.5-178.5 -78.2 117.0 -18.9 -36.8 -11.2 75 107 A L E - 0 0 51 12,-3.1 2,-0.3 -2,-0.6 13,-0.2 0.778 60.7 -29.4 -90.5 -30.5 -22.3 -37.1 -12.7 76 108 A D E -D 87 0A 62 11,-1.3 11,-3.1 2,-0.0 -1,-0.4 -0.939 53.8-150.9-174.0 170.8 -22.9 -33.4 -13.5 77 109 A W E -D 86 0A 51 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.965 4.8-159.0-156.7 154.0 -22.1 -29.9 -12.3 78 110 A F E -D 85 0A 33 7,-2.4 7,-2.7 -2,-0.3 2,-0.4 -0.985 14.0-134.4-138.1 145.1 -23.8 -26.5 -12.3 79 111 A E E -D 84 0A 103 -2,-0.3 5,-0.2 5,-0.2 3,-0.0 -0.853 22.8-174.8 -99.3 141.1 -22.5 -23.0 -12.0 80 112 A R - 0 0 111 3,-3.6 3,-0.2 -2,-0.4 -2,-0.0 -0.746 43.8 -95.4-121.3 171.3 -24.2 -20.4 -9.6 81 113 A P S S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.932 121.6 12.0 -52.3 -43.9 -23.5 -16.7 -9.1 82 114 A D S S+ 0 0 103 -43,-0.1 -43,-2.5 -44,-0.0 -42,-0.4 0.303 129.3 27.3-117.4 9.0 -21.3 -17.4 -6.0 83 115 A S E -C 38 0A 18 -45,-0.3 -3,-3.6 -3,-0.2 2,-0.4 -0.963 62.5-123.1-155.8 165.2 -20.7 -21.2 -6.1 84 116 A F E -CD 37 79A 0 -47,-2.4 -47,-3.1 -2,-0.3 2,-0.4 -0.943 22.0-150.4-109.5 150.7 -20.4 -24.4 -8.1 85 117 A V E -CD 36 78A 0 -7,-2.7 -7,-2.4 -2,-0.4 2,-0.4 -0.984 8.7-160.8-122.3 128.7 -22.6 -27.4 -7.4 86 118 A L E -CD 35 77A 2 -51,-2.9 -51,-3.0 -2,-0.4 2,-0.6 -0.907 7.7-151.2-115.7 130.4 -21.3 -30.9 -8.1 87 119 A I E -CD 34 76A 0 -11,-3.1 -12,-3.1 -2,-0.4 -11,-1.3 -0.924 25.9-179.1-102.8 119.0 -23.5 -33.9 -8.4 88 120 A L E -CD 33 74A 14 -55,-3.0 -55,-2.6 -2,-0.6 -14,-0.2 -0.843 32.9 -96.2-121.3 152.0 -21.6 -37.0 -7.4 89 121 A E E -C 32 0A 44 -16,-2.4 -57,-0.2 -2,-0.3 -1,-0.1 -0.242 36.8-158.7 -59.4 147.1 -22.4 -40.6 -7.2 90 122 A R - 0 0 45 -59,-1.0 2,-0.1 -58,-0.1 -1,-0.0 -0.936 5.7-147.5-135.4 114.2 -23.6 -41.9 -3.8 91 123 A P - 0 0 11 0, 0.0 3,-0.2 0, 0.0 52,-0.1 -0.490 25.4-123.6 -74.7 154.2 -23.5 -45.5 -2.7 92 124 A E S S+ 0 0 124 1,-0.3 2,-0.1 -2,-0.1 52,-0.1 -0.918 94.6 26.4-150.8 117.0 -26.2 -46.6 -0.3 93 125 A P S S+ 0 0 41 0, 0.0 52,-1.3 0, 0.0 53,-0.5 0.536 93.2 161.1 -79.7 156.4 -25.7 -47.8 2.3 94 126 A V E -G 144 0C 57 50,-0.2 2,-0.3 -3,-0.2 50,-0.2 -0.929 21.5-175.8-138.9 151.2 -22.3 -46.1 2.7 95 127 A Q E -G 143 0C 35 48,-1.5 48,-2.4 -2,-0.3 2,-0.1 -0.938 28.9-120.2-146.0 134.7 -19.9 -45.2 5.6 96 128 A D E > -G 142 0C 42 -2,-0.3 4,-2.3 46,-0.2 46,-0.2 -0.433 26.3-118.3 -71.0 152.3 -16.6 -43.2 5.4 97 129 A L H > S+ 0 0 0 44,-2.9 4,-2.3 41,-0.7 42,-0.2 0.833 113.2 58.7 -61.5 -35.1 -13.5 -45.1 6.4 98 130 A F H > S+ 0 0 83 40,-1.2 4,-2.6 43,-0.3 -1,-0.2 0.956 109.6 43.9 -56.1 -49.2 -12.9 -42.6 9.3 99 131 A D H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.894 112.2 53.6 -62.4 -39.5 -16.3 -43.4 10.8 100 132 A F H X S+ 0 0 2 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.909 110.7 45.4 -60.5 -45.5 -15.8 -47.1 10.3 101 133 A I H X S+ 0 0 8 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.864 108.6 56.7 -69.8 -37.9 -12.5 -47.0 12.1 102 134 A T H < S+ 0 0 97 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.970 116.5 37.7 -52.2 -48.3 -14.1 -44.8 14.9 103 135 A E H < S+ 0 0 141 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.890 126.4 33.3 -69.4 -43.9 -16.6 -47.7 15.4 104 136 A R H < S- 0 0 115 -4,-3.0 -3,-0.2 1,-0.2 -1,-0.2 0.684 90.2-150.4 -92.5 -13.9 -14.5 -50.7 14.8 105 137 A G < + 0 0 32 -4,-2.2 101,-0.3 -5,-0.2 -1,-0.2 -0.421 65.7 5.6 69.5-156.3 -11.0 -49.6 16.3 106 138 A A S S- 0 0 38 99,-0.4 2,-0.3 98,-0.1 98,-0.2 -0.314 86.9-123.2 -55.2 133.5 -7.8 -51.2 14.7 107 139 A L - 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0 0 14 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.1 -0.345 32.3-130.3 -73.9 155.1 -2.6 -42.0 12.7 209 241 A P S S+ 0 0 15 0, 0.0 2,-0.4 0, 0.0 13,-0.1 0.805 85.4 46.3 -79.9 -30.9 1.0 -42.3 13.9 210 242 A F + 0 0 7 -36,-0.3 -2,-0.1 1,-0.1 3,-0.1 -0.932 42.7 165.4-121.3 136.1 2.0 -38.6 14.0 211 243 A E + 0 0 102 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.548 67.4 53.6-114.1 -16.5 0.1 -35.6 15.4 212 244 A H S >> S- 0 0 110 1,-0.1 4,-1.9 -38,-0.1 3,-0.7 -0.907 79.0-119.8-129.1 148.4 3.0 -33.0 15.4 213 245 A D H 3> S+ 0 0 48 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.878 113.6 56.8 -48.7 -45.7 5.4 -31.6 12.9 214 246 A E H 3> S+ 0 0 141 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.856 106.6 48.5 -56.5 -41.6 8.4 -32.8 15.1 215 247 A E H <> S+ 0 0 78 -3,-0.7 4,-2.2 2,-0.2 5,-0.4 0.889 110.2 51.9 -66.3 -39.0 7.1 -36.4 14.9 216 248 A I H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.1 0.961 112.1 46.0 -63.5 -44.5 6.7 -36.3 11.1 217 249 A I H < S+ 0 0 50 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.826 111.7 50.3 -72.0 -31.6 10.2 -35.0 10.6 218 250 A R H < S- 0 0 175 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.889 87.1-161.7 -71.5 -37.9 11.7 -37.5 13.0 219 251 A G < + 0 0 17 -4,-2.2 2,-0.5 1,-0.2 -3,-0.1 0.642 31.8 150.1 67.5 17.7 9.8 -40.4 11.2 220 252 A Q - 0 0 114 -5,-0.4 2,-0.5 2,-0.0 -1,-0.2 -0.703 35.0-150.0 -83.2 127.3 10.3 -42.8 14.1 221 253 A V - 0 0 6 -2,-0.5 2,-0.5 -3,-0.1 -11,-0.0 -0.898 13.6-170.3-106.7 129.3 7.3 -45.2 14.0 222 254 A F - 0 0 156 -2,-0.5 2,-0.7 -13,-0.1 -2,-0.0 -0.952 15.7-142.6-116.1 126.8 5.8 -46.8 17.2 223 255 A F - 0 0 23 -2,-0.5 4,-0.1 1,-0.1 -2,-0.0 -0.825 16.4-177.8 -93.0 116.4 3.2 -49.5 16.9 224 256 A R + 0 0 110 -2,-0.7 2,-0.3 2,-0.1 -1,-0.1 0.451 69.3 48.2 -94.2 -6.2 0.7 -49.2 19.6 225 257 A Q S S- 0 0 98 2,-0.0 2,-0.5 0, 0.0 -20,-0.0 -0.867 103.2 -86.0-125.1 165.5 -1.3 -52.3 18.6 226 258 A R + 0 0 197 -2,-0.3 2,-0.4 -21,-0.0 -2,-0.1 -0.589 56.3 172.1 -72.8 119.7 -0.1 -55.8 17.7 227 259 A V - 0 0 6 -2,-0.5 5,-0.1 -4,-0.1 -4,-0.1 -0.998 35.6-106.0-137.3 130.0 0.8 -55.7 14.0 228 260 A S > - 0 0 21 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.054 29.2-117.4 -50.7 153.8 2.6 -58.4 12.0 229 261 A S H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.859 114.2 54.2 -64.5 -35.3 6.2 -57.8 11.1 230 262 A E H > S+ 0 0 99 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.926 110.5 46.8 -67.3 -43.9 5.5 -57.9 7.4 231 263 A C H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.931 112.6 49.0 -59.7 -48.2 2.9 -55.1 7.8 232 264 A Q H X S+ 0 0 47 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.886 109.6 53.2 -57.2 -41.2 5.1 -53.0 10.0 233 265 A H H X S+ 0 0 105 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.940 109.6 47.7 -62.2 -47.4 7.9 -53.4 7.5 234 266 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.939 114.2 47.4 -56.3 -44.5 5.6 -52.1 4.6 235 267 A I H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.941 111.2 48.8 -66.0 -44.8 4.5 -49.2 6.7 236 268 A R H < S+ 0 0 96 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.866 111.5 52.6 -67.2 -31.3 8.1 -48.2 7.8 237 269 A W H >< S+ 0 0 74 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.941 108.7 47.5 -67.3 -47.8 9.1 -48.4 4.1 238 270 A C H 3< S+ 0 0 0 -4,-2.6 -41,-0.2 1,-0.3 -1,-0.2 0.809 112.9 52.9 -57.4 -32.6 6.2 -46.1 2.9 239 271 A L T 3< S+ 0 0 4 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.090 76.6 143.9 -97.2 21.9 7.3 -43.8 5.8 240 272 A A < - 0 0 19 -3,-1.6 6,-0.1 1,-0.1 -3,-0.1 -0.346 52.6-133.7 -56.7 137.7 11.0 -43.6 4.8 241 273 A L S S+ 0 0 85 -23,-0.1 -62,-0.2 -22,-0.1 -1,-0.1 0.896 91.4 65.4 -65.7 -40.5 12.4 -40.1 5.5 242 274 A R S > S- 0 0 159 1,-0.2 3,-1.7 -64,-0.1 4,-0.3 -0.737 83.1-138.8 -86.6 127.2 14.1 -39.8 2.1 243 275 A P G > S+ 0 0 49 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.858 100.3 55.3 -53.5 -38.5 11.5 -39.7 -0.7 244 276 A S G 3 S+ 0 0 87 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.679 98.0 62.4 -77.2 -14.3 13.6 -41.9 -3.0 245 277 A D G < S+ 0 0 84 -3,-1.7 -1,-0.3 2,-0.1 -5,-0.1 0.433 84.7 100.7 -76.9 -5.5 13.8 -44.7 -0.4 246 278 A R S < S- 0 0 14 -3,-1.8 -8,-0.2 -4,-0.3 -9,-0.1 -0.546 81.6-107.5 -77.1 148.4 9.9 -45.0 -0.5 247 279 A P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.388 26.5-119.3 -71.6 159.5 8.5 -47.9 -2.5 248 280 A T > - 0 0 72 1,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.392 36.6 -99.6 -79.7 169.8 6.8 -47.4 -5.9 249 281 A F H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.893 127.4 53.5 -58.7 -38.5 3.1 -48.6 -6.2 250 282 A E H > S+ 0 0 140 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.930 108.3 48.8 -63.3 -42.0 4.4 -51.7 -7.9 251 283 A E H > S+ 0 0 84 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.929 111.3 50.6 -65.1 -41.1 6.8 -52.4 -5.0 252 284 A I H >< S+ 0 0 0 -4,-2.6 3,-1.4 1,-0.2 6,-0.3 0.970 112.7 46.1 -56.0 -52.5 3.9 -51.9 -2.5 253 285 A Q H 3< S+ 0 0 9 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.713 112.7 48.9 -69.8 -17.1 1.6 -54.3 -4.4 254 286 A N H 3< S+ 0 0 102 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.425 84.6 120.5 -96.2 -0.5 4.3 -56.9 -4.7 255 287 A H S X< S- 0 0 11 -3,-1.4 3,-1.5 -4,-0.5 4,-0.3 -0.331 75.3-120.4 -62.2 146.7 5.2 -56.7 -1.0 256 288 A P G > S+ 0 0 75 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.828 113.3 59.6 -60.1 -29.4 4.7 -60.0 0.9 257 289 A W G 3 S+ 0 0 2 -27,-0.3 -26,-0.1 1,-0.2 -4,-0.1 0.814 101.1 56.6 -69.5 -25.7 2.1 -58.4 3.2 258 290 A M G < S+ 0 0 2 -3,-1.5 3,-0.5 -6,-0.3 -1,-0.2 0.457 82.7 114.2 -83.6 4.0 -0.1 -57.6 0.1 259 291 A Q S < S+ 0 0 84 -3,-1.1 -5,-0.0 -4,-0.3 -146,-0.0 -0.304 71.0 18.2 -82.4 153.3 -0.4 -61.1 -1.2 260 292 A D S S- 0 0 154 1,-0.1 -1,-0.2 -2,-0.0 -2,-0.0 0.856 79.1-171.8 61.7 41.8 -3.7 -63.1 -1.4 261 293 A V - 0 0 40 -3,-0.5 2,-0.2 1,-0.1 -1,-0.1 -0.306 24.2-112.7 -61.7 147.2 -6.1 -60.1 -1.1 262 294 A L - 0 0 26 -152,-0.4 -1,-0.1 1,-0.1 -2,-0.0 -0.558 31.1-109.1 -72.0 148.2 -9.8 -60.8 -0.6 263 295 A L > - 0 0 109 -2,-0.2 4,-2.1 1,-0.1 5,-0.1 -0.359 33.0-110.0 -65.5 156.0 -12.2 -59.9 -3.4 264 296 A P H > S+ 0 0 42 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.926 118.7 50.5 -59.0 -45.0 -14.4 -57.0 -2.5 265 297 A Q H > S+ 0 0 74 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.899 110.4 49.5 -62.6 -39.4 -17.5 -59.1 -2.3 266 298 A E H > S+ 0 0 79 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.860 108.2 56.2 -62.3 -38.5 -15.8 -61.6 0.0 267 299 A T H X>S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.7 0.921 108.8 44.5 -59.0 -48.9 -14.7 -58.7 2.1 268 300 A A H X>S+ 0 0 0 -4,-2.3 4,-1.6 -121,-0.3 5,-0.5 0.943 114.8 49.9 -63.8 -43.2 -18.3 -57.5 2.5 269 301 A E H <>S+ 0 0 124 -4,-2.4 5,-0.5 4,-0.2 -2,-0.2 0.924 120.5 33.7 -60.9 -44.0 -19.5 -61.1 3.3 270 302 A I H <5S+ 0 0 101 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.881 136.1 15.1 -81.5 -40.3 -16.8 -61.8 5.9 271 303 A H H <5S+ 0 0 16 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.673 125.7 42.6-114.5 -22.8 -16.3 -58.3 7.5 272 304 A L T <