==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/INHIBITOR 14-NOV-11 3UMW . COMPND 2 MOLECULE: PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINASE PI . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.J.PARKER,N.HANDA,S.YOKOYAMA . 264 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12905.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 170 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 18.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 19 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 2 1 1 1 0 3 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 37 A Q 0 0 155 0, 0.0 21,-1.7 0, 0.0 22,-0.4 0.000 360.0 360.0 360.0 -23.1 34.0 -31.9 13.0 2 38 A Y E -A 21 0A 40 19,-0.2 2,-0.7 20,-0.1 19,-0.2 -0.996 360.0-139.3-130.8 136.8 32.7 -33.1 9.6 3 39 A Q E -A 20 0A 131 17,-2.8 17,-1.6 -2,-0.4 2,-0.4 -0.844 28.5-137.8 -91.1 118.7 34.4 -33.7 6.4 4 40 A V E +A 19 0A 91 -2,-0.7 15,-0.2 15,-0.2 3,-0.1 -0.620 25.7 178.2 -84.6 127.7 32.1 -32.4 3.6 5 41 A G E - 0 0 31 13,-3.0 3,-0.1 -2,-0.4 -1,-0.1 -0.122 41.9 -30.1-105.1-153.2 31.7 -34.5 0.4 6 42 A P E - 0 0 96 0, 0.0 12,-2.9 0, 0.0 -1,-0.3 -0.254 66.3 -98.3 -68.0 148.1 29.7 -34.1 -2.7 7 43 A L E -A 17 0A 92 10,-0.2 10,-0.3 1,-0.1 3,-0.1 -0.410 32.6-171.8 -56.4 132.3 26.3 -32.2 -3.0 8 44 A L E - 0 0 105 8,-3.6 2,-0.3 1,-0.4 9,-0.2 0.742 60.9 -36.3-100.3 -33.9 23.4 -34.8 -2.9 9 45 A G E -A 16 0A 32 7,-1.5 7,-3.1 2,-0.0 -1,-0.4 -0.942 54.6-166.4-176.1 164.6 20.6 -32.4 -3.7 10 46 A S E +A 15 0A 78 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.980 11.9 155.7-154.3 167.5 19.3 -28.9 -3.2 11 47 A G E > -A 14 0A 42 3,-2.6 3,-0.7 -2,-0.3 -2,-0.0 -0.860 65.0 -58.1-163.5-161.3 16.2 -26.7 -3.6 12 48 A G T 3 S+ 0 0 37 -2,-0.3 22,-0.1 1,-0.2 3,-0.1 0.826 128.4 61.2 -63.4 -34.4 14.7 -23.5 -2.1 13 49 A F T 3 S- 0 0 70 1,-0.2 21,-2.9 20,-0.1 2,-0.3 0.816 119.9 -95.7 -56.5 -34.8 14.8 -25.1 1.3 14 50 A G E < -AB 11 33A 7 -3,-0.7 -3,-2.6 19,-0.2 2,-0.3 -0.992 47.6 -59.9 144.6-149.9 18.6 -25.4 1.2 15 51 A S E -AB 10 32A 35 17,-1.4 17,-3.3 -2,-0.3 2,-0.4 -0.982 26.1-148.4-147.3 145.4 21.2 -28.1 0.3 16 52 A V E -AB 9 31A 28 -7,-3.1 -8,-3.6 -2,-0.3 -7,-1.5 -0.970 16.4-171.4-123.1 132.0 22.2 -31.6 1.4 17 53 A Y E -AB 7 30A 75 13,-2.4 13,-3.0 -2,-0.4 -10,-0.2 -0.889 26.8-117.2-120.9 146.9 25.8 -32.9 1.2 18 54 A S E + B 0 29A 17 -12,-2.9 -13,-3.0 -2,-0.3 2,-0.3 -0.495 48.7 167.9 -69.0 152.3 27.4 -36.3 1.7 19 55 A G E -AB 4 28A 1 9,-1.9 9,-2.5 -15,-0.2 2,-0.4 -0.967 33.3-133.0-161.5 172.4 29.8 -36.2 4.7 20 56 A I E -AB 3 27A 45 -17,-1.6 -17,-2.8 -2,-0.3 2,-0.6 -0.999 25.9-123.7-137.7 132.3 31.9 -38.1 7.2 21 57 A R E > -A 2 0A 65 5,-2.7 4,-2.0 -2,-0.4 5,-0.5 -0.714 24.0-145.8 -76.6 118.4 32.1 -37.7 10.9 22 58 A V T 4 S+ 0 0 80 -21,-1.7 3,-0.2 -2,-0.6 -1,-0.2 0.897 89.6 58.5 -56.5 -45.7 35.8 -37.0 11.5 23 59 A S T 4 S+ 0 0 107 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.834 128.6 6.0 -53.6 -47.3 36.0 -38.7 14.9 24 60 A D T 4 S- 0 0 79 -3,-0.4 -1,-0.2 2,-0.1 -2,-0.2 0.280 95.0-113.9-124.5 9.7 34.8 -42.2 13.8 25 61 A N < + 0 0 120 -4,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.628 55.7 165.8 63.3 16.0 34.5 -42.1 10.0 26 62 A L - 0 0 63 -5,-0.5 -5,-2.7 -6,-0.1 2,-0.2 -0.417 40.0-118.4 -63.8 129.9 30.7 -42.5 10.2 27 63 A P E +B 20 0A 38 0, 0.0 56,-1.0 0, 0.0 2,-0.3 -0.525 45.5 167.7 -67.9 132.8 28.9 -41.7 7.0 28 64 A V E -BC 19 82A 0 -9,-2.5 -9,-1.9 -2,-0.2 2,-0.4 -0.884 33.8-128.5-134.7 170.3 26.4 -38.8 7.4 29 65 A A E -BC 18 81A 13 52,-2.5 52,-3.0 -2,-0.3 2,-0.6 -0.972 18.9-149.2-117.8 143.3 24.4 -36.4 5.4 30 66 A I E -BC 17 80A 9 -13,-3.0 -13,-2.4 -2,-0.4 2,-0.6 -0.945 13.3-166.8-117.4 110.3 24.7 -32.7 6.1 31 67 A K E -BC 16 79A 9 48,-3.1 48,-3.2 -2,-0.6 2,-0.6 -0.884 5.9-159.6-110.4 119.0 21.5 -30.7 5.5 32 68 A H E -BC 15 78A 42 -17,-3.3 -17,-1.4 -2,-0.6 2,-0.6 -0.836 8.2-164.9 -97.4 122.4 21.5 -26.9 5.4 33 69 A V E -BC 14 77A 12 44,-3.0 44,-2.3 -2,-0.6 2,-0.3 -0.943 17.2-131.6-114.2 116.5 18.2 -25.3 6.0 34 70 A E E > - C 0 76A 87 -21,-2.9 3,-1.5 -2,-0.6 4,-0.4 -0.513 9.4-143.3 -67.2 124.3 17.7 -21.7 5.0 35 71 A K G > S+ 0 0 43 40,-2.6 3,-1.2 -2,-0.3 41,-0.1 0.871 98.5 53.1 -56.2 -42.3 16.0 -19.6 7.8 36 72 A D G 3 S+ 0 0 129 39,-0.4 -1,-0.3 1,-0.2 40,-0.1 0.578 107.1 53.0 -75.5 -7.2 14.0 -17.5 5.5 37 73 A R G < S+ 0 0 155 -3,-1.5 2,-0.7 -24,-0.2 -1,-0.2 0.379 81.4 102.9-107.1 3.3 12.5 -20.5 3.7 38 74 A I < + 0 0 24 -3,-1.2 3,-0.1 -4,-0.4 111,-0.0 -0.796 43.5 177.0 -83.6 114.5 11.3 -22.2 6.9 39 75 A S + 0 0 109 -2,-0.7 2,-0.5 1,-0.2 -1,-0.2 0.743 67.7 50.0 -87.9 -27.8 7.5 -21.6 7.0 40 76 A D - 0 0 38 109,-0.2 9,-2.0 112,-0.0 10,-0.3 -0.939 68.8-172.1-121.8 113.4 6.9 -23.6 10.2 41 77 A W E -E 48 0B 119 -2,-0.5 2,-0.2 7,-0.2 -2,-0.0 -0.696 2.3-171.1 -98.4 151.5 9.0 -23.1 13.3 42 78 A G E -E 47 0B 15 5,-3.3 5,-2.3 -2,-0.3 2,-0.3 -0.744 15.5-130.0-126.9 179.4 8.9 -25.1 16.5 43 79 A E 0 0 78 3,-0.2 0, 0.0 -2,-0.2 0, 0.0 -0.937 360.0 360.0-129.0 156.1 10.4 -24.9 20.1 44 80 A L 0 0 129 -2,-0.3 8,-0.0 8,-0.0 7,-0.0 -0.682 360.0 360.0 -88.6 360.0 12.3 -27.6 22.0 45 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 46 85 A R 0 0 95 0, 0.0 -3,-0.2 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0 120.3 13.3 -21.9 18.4 47 86 A V E -E 42 0B 2 -5,-2.3 -5,-3.3 30,-0.0 2,-0.1 -0.885 360.0 -73.8-141.4 167.0 14.2 -24.4 15.6 48 87 A P E >> -E 41 0B 4 0, 0.0 3,-1.8 0, 0.0 4,-1.3 -0.480 43.7-120.0 -64.0 142.1 12.8 -25.7 12.3 49 88 A M H 3> S+ 0 0 30 -9,-2.0 4,-3.0 1,-0.3 5,-0.3 0.870 113.0 68.7 -46.6 -38.2 9.8 -28.0 12.8 50 89 A E H 3> S+ 0 0 11 -10,-0.3 4,-2.5 1,-0.2 -1,-0.3 0.848 97.9 48.9 -52.3 -39.7 11.9 -30.6 11.1 51 90 A V H <> S+ 0 0 0 -3,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.920 111.4 49.5 -69.1 -41.8 14.3 -30.8 14.1 52 91 A V H X S+ 0 0 20 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.969 114.4 45.5 -57.0 -52.5 11.3 -31.1 16.5 53 92 A L H X S+ 0 0 0 -4,-3.0 4,-1.4 1,-0.2 5,-0.2 0.903 112.2 49.8 -59.4 -46.6 9.8 -33.9 14.5 54 93 A L H X S+ 0 0 4 -4,-2.5 4,-3.0 -5,-0.3 13,-0.3 0.887 109.4 51.3 -65.0 -40.2 13.1 -35.8 14.0 55 94 A K H < S+ 0 0 109 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.909 108.0 53.8 -60.5 -39.7 13.8 -35.7 17.7 56 95 A K H < S+ 0 0 91 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.802 123.3 27.2 -63.9 -31.1 10.3 -37.1 18.4 57 96 A V H < S+ 0 0 0 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.582 102.6 79.0-105.8 -17.6 11.0 -40.0 16.1 58 97 A S < + 0 0 31 -4,-3.0 2,-0.8 -5,-0.2 -3,-0.1 0.429 66.7 112.1 -75.2 1.9 14.8 -40.3 16.3 59 98 A S S S- 0 0 71 -4,-0.3 2,-0.1 -5,-0.1 -4,-0.0 -0.700 84.1 -22.6 -75.1 111.1 14.3 -42.1 19.6 60 99 A G S S- 0 0 67 -2,-0.8 2,-0.3 2,-0.0 -3,-0.0 -0.376 101.2 -33.9 94.7-166.4 15.4 -45.7 19.1 61 100 A F S S+ 0 0 212 -2,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.717 73.0 123.3 -88.0 146.2 15.7 -47.9 16.0 62 101 A S S S- 0 0 36 -2,-0.3 4,-0.1 2,-0.2 53,-0.1 -0.985 71.7 -77.5-173.7-171.3 13.3 -47.6 13.0 63 102 A G S S+ 0 0 16 -2,-0.3 82,-2.4 48,-0.1 2,-0.4 -0.159 97.2 97.8 -91.2 34.5 12.7 -47.0 9.3 64 103 A V B S-f 145 0C 6 80,-0.3 -2,-0.2 -7,-0.1 82,-0.2 -0.989 84.4-113.2-119.7 134.6 13.2 -43.3 9.9 65 104 A I - 0 0 7 80,-2.5 2,-0.3 -2,-0.4 -2,-0.1 -0.446 40.9-125.0 -62.6 133.2 16.6 -41.6 9.2 66 105 A R - 0 0 23 -2,-0.1 16,-2.2 -4,-0.1 2,-0.6 -0.666 5.6-130.0 -89.2 140.0 18.0 -40.5 12.6 67 106 A L E -D 81 0A 22 -2,-0.3 14,-0.2 -13,-0.3 3,-0.1 -0.785 25.6-179.6 -81.6 118.9 19.0 -37.0 13.4 68 107 A L E - 0 0 68 12,-3.1 2,-0.3 -2,-0.6 13,-0.2 0.800 60.7 -25.7 -92.5 -33.4 22.5 -37.2 15.0 69 108 A D E -D 80 0A 60 11,-1.3 11,-3.1 2,-0.0 -1,-0.4 -0.949 55.6-153.3-169.9 165.6 23.2 -33.6 15.7 70 109 A W E -D 79 0A 58 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.974 4.3-161.9-152.1 157.9 22.2 -30.1 14.6 71 110 A F E -D 78 0A 76 7,-2.5 7,-3.1 -2,-0.3 2,-0.4 -0.971 13.2-135.6-140.3 147.8 23.8 -26.6 14.6 72 111 A E E -D 77 0A 115 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.920 20.4-179.6-109.6 138.8 22.5 -23.1 14.2 73 112 A R - 0 0 137 3,-3.1 3,-0.3 -2,-0.4 -2,-0.0 -0.753 45.8 -94.7-120.3 168.3 24.1 -20.4 12.1 74 113 A P S S+ 0 0 114 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.889 121.8 17.1 -49.5 -44.2 23.1 -16.8 11.5 75 114 A D S S+ 0 0 124 1,-0.1 -40,-2.6 -40,-0.1 -39,-0.4 0.391 129.2 22.5-113.6 3.6 21.1 -17.6 8.3 76 115 A S E -C 34 0A 14 -42,-0.3 -3,-3.1 -3,-0.3 2,-0.3 -0.970 61.9-122.5-158.6 161.4 20.6 -21.3 8.5 77 116 A F E -CD 33 72A 0 -44,-2.3 -44,-3.0 -2,-0.3 2,-0.5 -0.907 23.5-147.3-108.2 151.9 20.4 -24.5 10.5 78 117 A V E -CD 32 71A 9 -7,-3.1 -7,-2.5 -2,-0.3 2,-0.4 -0.981 11.7-163.2-119.9 125.4 22.6 -27.4 9.8 79 118 A L E -CD 31 70A 0 -48,-3.2 -48,-3.1 -2,-0.5 2,-0.6 -0.897 8.8-151.3-110.8 136.6 21.3 -30.9 10.4 80 119 A I E -CD 30 69A 2 -11,-3.1 -12,-3.1 -2,-0.4 -11,-1.3 -0.938 25.3-177.9-108.7 119.5 23.5 -34.0 10.7 81 120 A L E -CD 29 67A 17 -52,-3.0 -52,-2.5 -2,-0.6 -14,-0.2 -0.815 32.0 -93.9-123.7 151.0 21.6 -37.1 9.5 82 121 A E E -C 28 0A 57 -16,-2.2 -54,-0.2 -2,-0.3 -1,-0.1 -0.239 37.0-161.9 -54.2 145.4 22.3 -40.9 9.3 83 122 A R - 0 0 40 -56,-1.0 2,-0.1 -55,-0.1 -1,-0.0 -0.884 5.9-150.9-138.5 109.2 23.6 -42.0 5.9 84 123 A P - 0 0 11 0, 0.0 3,-0.2 0, 0.0 52,-0.1 -0.440 23.9-124.6 -71.3 153.7 23.5 -45.7 4.8 85 124 A E S S+ 0 0 123 1,-0.3 2,-0.1 -2,-0.1 52,-0.1 -0.936 93.7 28.4-151.4 120.1 26.2 -46.7 2.4 86 125 A P S S+ 0 0 43 0, 0.0 52,-1.5 0, 0.0 53,-0.5 0.535 93.4 163.1 -76.0 148.9 25.6 -48.0 -0.2 87 126 A V E -G 137 0C 52 50,-0.2 2,-0.3 -3,-0.2 50,-0.2 -0.955 21.8-177.4-136.0 148.3 22.2 -46.3 -0.6 88 127 A Q E -G 136 0C 32 48,-1.4 48,-2.7 -2,-0.3 2,-0.1 -0.975 26.9-124.4-141.2 138.2 19.7 -45.5 -3.4 89 128 A D E > -G 135 0C 35 -2,-0.3 4,-2.0 46,-0.2 46,-0.2 -0.412 28.5-114.8 -76.3 159.5 16.4 -43.6 -3.1 90 129 A L H > S+ 0 0 0 44,-2.5 4,-2.6 41,-1.1 5,-0.2 0.843 112.7 58.9 -68.9 -32.0 13.3 -45.4 -4.3 91 130 A F H > S+ 0 0 86 40,-0.9 4,-2.7 43,-0.3 -1,-0.2 0.955 110.6 41.7 -55.3 -52.9 12.7 -43.0 -7.2 92 131 A D H > S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.862 112.9 55.3 -64.6 -37.7 16.1 -43.9 -8.7 93 132 A F H X S+ 0 0 2 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.921 111.7 42.2 -62.8 -44.8 15.6 -47.5 -7.9 94 133 A I H X S+ 0 0 7 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.892 110.9 56.8 -70.6 -39.5 12.3 -47.6 -9.8 95 134 A T H < S+ 0 0 95 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.946 114.0 40.1 -54.0 -47.3 13.7 -45.5 -12.7 96 135 A E H < S+ 0 0 143 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.863 126.1 31.3 -70.1 -40.1 16.5 -48.1 -13.1 97 136 A R H < S- 0 0 118 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.602 95.1-140.9-102.5 -7.0 14.5 -51.3 -12.7 98 137 A G < - 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0 0 88 -2,-0.3 4,-1.9 -22,-0.2 5,-0.2 -0.781 31.8-118.8-102.1 155.3 -7.0 -34.8 7.9 181 220 A G H > S+ 0 0 1 -26,-0.4 4,-2.2 -24,-0.4 5,-0.1 0.935 102.6 38.5 -61.8 -57.7 -3.7 -36.3 8.8 182 221 A R H > S+ 0 0 109 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.894 117.5 47.9 -65.5 -43.9 -4.1 -40.0 8.6 183 222 A S H > S+ 0 0 21 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.848 111.9 50.2 -70.4 -33.2 -6.4 -40.2 5.7 184 223 A A H X S+ 0 0 15 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.914 110.4 51.5 -66.4 -39.8 -4.2 -37.8 3.6 185 224 A A H X S+ 0 0 8 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.921 108.0 51.3 -61.3 -45.9 -1.2 -40.1 4.5 186 225 A V H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.881 107.2 54.2 -61.4 -39.7 -3.1 -43.2 3.3 187 226 A W H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.962 108.6 47.9 -55.6 -51.0 -3.8 -41.4 0.0 188 227 A S H X S+ 0 0 10 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.861 109.6 54.3 -60.5 -33.9 -0.1 -40.8 -0.5 189 228 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.891 105.5 52.1 -66.6 -40.9 0.5 -44.4 0.4 190 229 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 41,-0.3 -2,-0.2 0.909 110.5 48.5 -56.4 -43.3 -1.9 -45.5 -2.3 191 230 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.934 113.2 49.3 -61.9 -46.2 0.0 -43.2 -4.9 192 231 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.900 110.1 47.8 -60.3 -47.6 3.3 -44.8 -3.6 193 232 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.915 112.3 50.4 -65.2 -41.3 2.1 -48.4 -3.9 194 233 A Y H X S+ 0 0 1 -4,-2.2 4,-2.4 1,-0.2 5,-0.4 0.950 109.9 52.0 -55.8 -49.4 0.7 -47.7 -7.5 195 234 A D H X S+ 0 0 4 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.887 109.0 50.2 -54.6 -44.0 4.1 -46.2 -8.3 196 235 A M H < S+ 0 0 0 -4,-2.4 -96,-3.1 1,-0.2 -1,-0.2 0.926 118.4 35.9 -62.6 -47.8 6.0 -49.3 -7.1 197 236 A V H < S+ 0 0 5 -4,-2.3 -2,-0.2 -98,-0.2 -1,-0.2 0.675 128.5 33.6 -86.0 -15.8 3.9 -51.8 -9.1 198 237 A C H < S- 0 0 8 -4,-2.4 -99,-0.3 2,-0.2 -3,-0.2 0.589 99.7-123.9-110.8 -18.6 3.3 -49.7 -12.2 199 238 A G S < S+ 0 0 28 -4,-2.2 2,-0.3 -5,-0.4 -4,-0.2 0.492 85.3 50.0 85.2 4.6 6.6 -47.7 -12.4 200 239 A D S S- 0 0 70 -6,-0.3 -2,-0.2 -5,-0.1 -1,-0.1 -0.952 93.4 -87.6-158.1 167.3 5.0 -44.3 -12.4 201 240 A I - 0 0 14 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.1 -0.397 32.7-129.8 -77.9 156.3 2.3 -42.4 -10.4 202 241 A P S S+ 0 0 12 0, 0.0 2,-0.4 0, 0.0 13,-0.2 0.752 84.7 43.6 -83.5 -21.6 -1.3 -42.7 -11.5 203 242 A F + 0 0 3 -36,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.970 44.3 167.9-129.5 136.2 -2.3 -39.1 -11.7 204 243 A E + 0 0 104 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.724 66.9 51.0-110.6 -38.6 -0.6 -36.0 -13.2 205 244 A H S >> S- 0 0 116 1,-0.1 4,-1.8 -38,-0.0 3,-0.7 -0.698 82.1-116.1-106.2 154.6 -3.2 -33.3 -13.3 206 245 A D H 3> S+ 0 0 52 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.852 114.8 58.3 -47.1 -43.6 -5.6 -31.9 -10.7 207 246 A E H 3> S+ 0 0 132 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.843 104.9 48.3 -62.4 -37.9 -8.6 -33.2 -12.7 208 247 A E H <> S+ 0 0 71 -3,-0.7 4,-2.4 2,-0.2 5,-0.4 0.893 111.7 50.3 -68.2 -40.9 -7.3 -36.8 -12.7 209 248 A I H < S+ 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.942 112.5 46.8 -61.2 -46.8 -6.8 -36.6 -8.9 210 249 A I H < S+ 0 0 55 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.859 113.4 48.4 -64.8 -37.7 -10.3 -35.2 -8.4 211 250 A R H < S- 0 0 174 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.878 88.4-162.8 -71.0 -35.8 -11.8 -37.9 -10.7 212 251 A G < + 0 0 17 -4,-2.4 2,-0.6 1,-0.2 -3,-0.1 0.706 29.4 151.4 62.5 22.7 -9.9 -40.7 -8.8 213 252 A Q - 0 0 122 -5,-0.4 2,-0.6 2,-0.0 -1,-0.2 -0.784 35.9-146.6 -86.8 122.8 -10.3 -43.3 -11.6 214 253 A V - 0 0 6 -2,-0.6 2,-0.5 -3,-0.1 -11,-0.1 -0.799 14.4-171.1 -97.3 119.3 -7.3 -45.6 -11.4 215 254 A F - 0 0 158 -2,-0.6 2,-0.7 -13,-0.2 -2,-0.0 -0.928 16.8-140.3-106.9 127.6 -6.1 -47.1 -14.7 216 255 A F - 0 0 25 -2,-0.5 4,-0.1 1,-0.1 -2,-0.0 -0.790 17.2-176.6 -90.5 117.6 -3.5 -49.8 -14.4 217 256 A R S S+ 0 0 112 -2,-0.7 2,-0.3 2,-0.1 -1,-0.1 0.541 71.0 43.4 -89.0 -10.5 -0.8 -49.5 -17.1 218 257 A Q S S- 0 0 103 0, 0.0 2,-0.4 0, 0.0 -20,-0.0 -0.870 102.7 -83.2-125.7 163.6 1.0 -52.8 -16.0 219 258 A R + 0 0 213 -2,-0.3 2,-0.4 -21,-0.0 -2,-0.1 -0.543 55.9 171.5 -64.4 120.5 -0.2 -56.2 -15.0 220 259 A V - 0 0 4 -2,-0.4 -4,-0.1 -4,-0.1 -22,-0.0 -0.999 35.3-106.7-135.2 137.6 -1.1 -56.0 -11.4 221 260 A S > - 0 0 31 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.182 29.0-116.1 -59.4 153.1 -2.9 -58.7 -9.3 222 261 A S H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.841 114.7 54.2 -60.1 -36.7 -6.5 -58.1 -8.4 223 262 A E H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.930 110.2 45.6 -65.7 -44.1 -5.6 -58.1 -4.7 224 263 A C H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.930 111.9 52.0 -63.4 -44.5 -3.0 -55.4 -5.1 225 264 A Q H X S+ 0 0 48 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.906 109.2 51.3 -57.0 -43.2 -5.3 -53.3 -7.4 226 265 A H H X S+ 0 0 108 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.928 110.0 47.8 -62.3 -45.4 -8.0 -53.5 -4.7 227 266 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.936 113.2 49.3 -59.5 -45.6 -5.7 -52.3 -1.9 228 267 A I H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.932 111.4 47.8 -60.3 -47.8 -4.5 -49.4 -4.1 229 268 A R H < S+ 0 0 107 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.836 111.0 52.4 -65.6 -34.3 -8.1 -48.4 -5.0 230 269 A W H >< S+ 0 0 74 -4,-2.4 3,-1.8 -5,-0.2 -2,-0.2 0.953 109.3 48.3 -63.1 -50.1 -9.1 -48.6 -1.3 231 270 A C H 3< S+ 0 0 0 -4,-2.7 -41,-0.3 1,-0.3 -2,-0.2 0.826 113.0 50.9 -57.9 -31.2 -6.1 -46.3 -0.4 232 271 A L T 3< S+ 0 0 4 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.076 76.6 146.4 -98.2 24.7 -7.2 -43.9 -3.2 233 272 A A < - 0 0 19 -3,-1.8 6,-0.2 1,-0.1 -3,-0.1 -0.374 50.9-135.1 -58.0 135.2 -10.9 -43.7 -2.2 234 273 A L S S+ 0 0 81 -23,-0.1 -62,-0.2 -22,-0.1 -1,-0.1 0.903 92.0 68.8 -62.4 -41.1 -12.2 -40.2 -3.0 235 274 A R S > S- 0 0 149 1,-0.2 3,-1.7 -64,-0.1 4,-0.5 -0.712 81.6-143.1 -82.2 121.3 -14.0 -39.9 0.4 236 275 A P G > S+ 0 0 42 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.857 99.5 53.8 -51.1 -41.7 -11.3 -39.6 3.1 237 276 A S G 3 S+ 0 0 99 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.641 98.8 64.1 -73.4 -13.9 -13.3 -41.7 5.6 238 277 A D G < S+ 0 0 75 -3,-1.7 -1,-0.3 -5,-0.1 -4,-0.1 0.635 83.3 100.3 -78.1 -15.8 -13.6 -44.5 3.0 239 278 A R S < S- 0 0 14 -3,-1.4 -8,-0.2 -4,-0.5 -9,-0.1 -0.366 80.8-105.0 -72.5 150.2 -9.8 -45.0 3.1 240 279 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.319 27.2-119.7 -69.4 156.4 -8.4 -47.9 5.2 241 280 A T > - 0 0 74 1,-0.1 4,-2.5 -55,-0.0 5,-0.2 -0.477 36.8 -99.9 -79.9 168.1 -6.6 -47.4 8.5 242 281 A F H > S+ 0 0 29 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.885 127.3 53.8 -57.2 -36.3 -2.9 -48.6 8.8 243 282 A E H > S+ 0 0 136 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.897 107.1 49.0 -65.0 -42.5 -4.3 -51.7 10.5 244 283 A E H > S+ 0 0 81 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.886 111.4 50.8 -65.2 -38.2 -6.7 -52.4 7.6 245 284 A I H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.2 6,-0.3 0.961 112.2 45.4 -61.6 -53.4 -3.8 -52.0 5.1 246 285 A Q H 3< S+ 0 0 11 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.748 113.2 50.3 -67.2 -22.6 -1.5 -54.3 7.0 247 286 A N H 3< S+ 0 0 107 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.475 84.0 119.7 -88.9 -4.0 -4.3 -56.9 7.4 248 287 A H S X< S- 0 0 10 -3,-1.4 3,-1.9 -4,-0.5 4,-0.4 -0.321 75.8-120.8 -62.5 141.2 -5.1 -56.8 3.7 249 288 A P G > S+ 0 0 78 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.853 112.1 60.4 -54.2 -34.0 -4.7 -60.2 1.9 250 289 A W G 3 S+ 0 0 2 1,-0.2 -26,-0.1 -27,-0.2 -4,-0.1 0.796 100.5 57.3 -63.1 -23.4 -2.1 -58.7 -0.5 251 290 A M G < S+ 0 0 1 -3,-1.9 3,-0.5 -6,-0.3 -1,-0.2 0.496 82.3 114.8 -88.7 -2.3 0.1 -57.8 2.5 252 291 A Q S < S+ 0 0 78 -3,-1.4 -5,-0.0 -4,-0.4 -146,-0.0 -0.256 70.2 18.4 -73.2 154.9 0.4 -61.3 3.9 253 292 A D S S- 0 0 153 1,-0.1 -1,-0.2 -147,-0.0 -147,-0.1 0.871 79.6-170.2 57.5 45.9 3.7 -63.3 4.1 254 293 A V - 0 0 41 -3,-0.5 2,-0.2 -148,-0.1 -1,-0.1 -0.322 22.4-114.0 -62.7 145.5 6.1 -60.3 3.7 255 294 A L - 0 0 27 -152,-0.4 -1,-0.1 1,-0.1 -2,-0.0 -0.530 31.2-108.4 -71.9 151.0 9.8 -61.1 3.1 256 295 A L > - 0 0 109 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.357 32.7-109.3 -67.1 156.1 12.2 -60.1 5.8 257 296 A P H > S+ 0 0 42 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.923 119.2 48.8 -59.7 -40.9 14.5 -57.2 4.9 258 297 A Q H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.885 111.2 49.2 -68.1 -36.9 17.6 -59.4 4.6 259 298 A E H > S+ 0 0 88 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.869 109.3 54.3 -63.2 -38.7 15.7 -61.9 2.4 260 299 A T H X>S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.7 0.919 109.6 46.9 -61.4 -44.5 14.6 -59.0 0.3 261 300 A A H X5S+ 0 0 6 -4,-2.3 4,-1.7 -121,-0.3 -2,-0.2 0.942 113.5 47.9 -62.1 -46.1 18.2 -57.9 -0.1 262 301 A E H <5S+ 0 0 83 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.927 121.3 34.7 -62.0 -48.2 19.3 -61.5 -1.0 263 302 A I H <5S+ 0 0 101 -4,-2.8 -2,-0.2 -5,-0.1 -1,-0.2 0.905 134.6 17.7 -73.6 -44.0 16.6 -62.1 -3.6 264 303 A H H <5 0 0 12 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.620 360.0 360.0-114.4 -18.0 16.1 -58.7 -5.2 265 304 A L << 0 0 64 -4,-1.7 -3,-0.2 -5,-0.7 -4,-0.1 0.473 360.0 360.0-114.5 360.0 19.0 -56.5 -4.4