==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 20-SEP-04 1W8C . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.J.PRATT,J.A.ENDICOTT,M.E.M.NOBLE . 291 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14658.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 64.3 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 . 40 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 19 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 26.8 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+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 2 0 1 0 0 2 0 1 0 0 0 1 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 . 1 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 1 A M > 0 0 42 0, 0.0 3,-2.3 0, 0.0 63,-0.0 0.000 360.0 360.0 360.0 -21.6 53.3 -21.0 13.8 2 2 A E T 3 + 0 0 153 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.736 360.0 69.0 -62.9 -19.8 53.2 -24.8 13.9 3 3 A N T 3 S+ 0 0 71 20,-0.1 21,-2.9 21,-0.1 22,-0.5 0.383 95.1 71.3 -76.9 1.5 50.9 -24.4 16.9 4 4 A F E < -A 23 0A 21 -3,-2.3 2,-0.6 19,-0.2 19,-0.2 -0.975 62.0-157.9-128.5 139.3 48.2 -23.1 14.4 5 5 A Q E -A 22 0A 105 17,-2.3 17,-2.3 -2,-0.4 2,-0.2 -0.955 26.2-128.0-113.0 116.7 46.0 -24.6 11.8 6 6 A K E -A 21 0A 116 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.438 23.5-177.0 -64.5 128.5 44.7 -22.2 9.1 7 7 A V E - 0 0 70 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.872 63.0 -32.9 -89.0 -53.1 41.0 -22.5 8.7 8 8 A E E -A 20 0A 112 12,-1.4 12,-2.8 3,-0.0 2,-0.5 -0.980 61.1 -92.5-163.9 154.5 40.6 -20.0 5.9 9 9 A K E -A 19 0A 107 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.637 31.6-174.3 -67.9 121.1 41.9 -16.8 4.4 10 10 A I E - 0 0 75 8,-2.9 2,-0.3 -2,-0.5 9,-0.2 0.844 53.8 -84.2 -84.5 -41.9 39.8 -14.0 5.9 11 11 A G E -A 18 0A 23 7,-1.7 7,-2.9 -3,-0.1 2,-0.5 -0.989 45.8 -63.0 166.9-159.9 41.4 -11.4 3.6 12 12 A E E -A 17 0A 75 -2,-0.3 5,-0.2 5,-0.3 140,-0.1 -0.977 41.7-168.6-127.5 114.7 44.3 -9.1 3.1 13 13 A G - 0 0 26 3,-2.6 140,-0.3 -2,-0.5 141,-0.3 -0.032 46.1 -82.7 -83.7-166.4 44.9 -6.2 5.4 14 14 A T S S+ 0 0 19 138,-0.2 139,-1.2 1,-0.1 140,-0.1 0.921 127.1 28.5 -63.0 -43.1 47.3 -3.3 5.0 15 15 A Y S S- 0 0 35 1,-0.2 21,-0.9 137,-0.2 2,-0.3 0.778 126.2 -36.2 -94.4 -33.1 50.3 -5.4 6.2 16 16 A G S S- 0 0 9 19,-0.2 -3,-2.6 20,-0.1 -1,-0.2 -0.966 77.1 -46.2-173.7-179.1 49.6 -8.9 5.3 17 17 A V E -A 12 0A 14 -2,-0.3 17,-2.4 -5,-0.2 2,-0.5 -0.437 44.4-144.4 -68.7 145.2 47.1 -11.8 5.0 18 18 A V E -AB 11 33A 20 -7,-2.9 -8,-2.9 15,-0.2 -7,-1.7 -0.972 18.9-169.6-111.5 124.0 44.6 -12.4 7.8 19 19 A Y E -AB 9 32A 49 13,-3.2 13,-3.6 -2,-0.5 2,-0.5 -0.887 25.7-133.4-112.4 143.8 43.7 -16.0 8.5 20 20 A K E +AB 8 31A 41 -12,-2.8 -13,-3.2 -2,-0.4 -12,-1.4 -0.841 47.2 173.9 -81.8 133.5 41.0 -17.5 10.7 21 21 A A E -AB 6 30A 0 9,-2.6 9,-3.1 -2,-0.5 2,-0.5 -0.948 32.2-129.9-145.0 158.1 43.1 -20.1 12.6 22 22 A R E -AB 5 29A 105 -17,-2.3 -17,-2.3 -2,-0.3 2,-0.6 -0.968 20.7-131.0-115.5 130.4 42.8 -22.7 15.4 23 23 A N E > -A 4 0A 17 5,-3.1 4,-1.8 -2,-0.5 -19,-0.2 -0.683 14.4-151.4 -73.7 117.1 45.3 -23.0 18.2 24 24 A K T 4 S+ 0 0 126 -21,-2.9 -1,-0.2 -2,-0.6 -20,-0.1 0.715 92.0 41.7 -67.1 -20.2 46.2 -26.7 18.3 25 25 A L T 4 S+ 0 0 142 -22,-0.5 -1,-0.1 3,-0.1 -21,-0.1 0.942 123.5 28.5 -88.1 -63.2 46.9 -26.4 22.0 26 26 A T T 4 S- 0 0 85 2,-0.1 -2,-0.2 1,-0.1 3,-0.1 0.709 95.2-127.3 -72.2 -21.0 44.2 -24.3 23.6 27 27 A G < + 0 0 37 -4,-1.8 -3,-0.1 1,-0.3 -1,-0.1 0.341 57.8 153.4 82.8 -4.2 41.5 -25.2 21.0 28 28 A E - 0 0 84 -6,-0.1 -5,-3.1 1,-0.1 2,-0.4 -0.265 43.0-139.7 -65.8 139.8 41.0 -21.5 20.5 29 29 A V E +B 22 0A 52 -7,-0.2 47,-0.6 -3,-0.1 2,-0.3 -0.864 38.4 167.7 -96.6 132.3 39.7 -20.0 17.2 30 30 A V E -BC 21 75A 0 -9,-3.1 -9,-2.6 -2,-0.4 2,-0.6 -0.871 43.6-109.0-143.0 165.9 41.6 -16.9 16.4 31 31 A A E -BC 20 74A 9 43,-2.7 43,-3.3 -2,-0.3 2,-0.5 -0.939 36.6-162.8-100.4 118.9 42.5 -14.2 13.8 32 32 A L E -BC 19 73A 8 -13,-3.6 -13,-3.2 -2,-0.6 2,-0.5 -0.897 3.7-165.6-108.4 123.2 46.1 -14.7 12.7 33 33 A K E -BC 18 72A 26 39,-3.0 39,-2.4 -2,-0.5 2,-0.5 -0.937 11.6-149.9-114.9 129.5 47.8 -11.8 11.0 34 34 A K E - C 0 71A 61 -17,-2.4 2,-0.5 -2,-0.5 37,-0.2 -0.852 16.4-148.3 -92.0 122.9 51.1 -12.0 9.1 35 35 A I E C 0 70A 25 35,-2.6 35,-0.8 -2,-0.5 -19,-0.2 -0.835 360.0 360.0 -98.0 124.3 53.0 -8.7 9.2 36 36 A R 0 0 114 -21,-0.9 33,-0.1 -2,-0.5 -20,-0.1 -0.590 360.0 360.0 -73.8 360.0 55.1 -7.9 6.1 37 ! 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 38 44 A V 0 0 102 0, 0.0 5,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 4.7 63.1 -7.6 12.5 39 45 A P >> - 0 0 86 0, 0.0 4,-2.0 0, 0.0 3,-1.1 0.006 360.0-158.3 -66.0 121.4 62.6 -4.0 13.9 40 46 A S H 3> S+ 0 0 66 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.763 92.4 59.1 -66.9 -27.3 63.1 -3.9 17.7 41 47 A T H 3> S+ 0 0 101 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.814 106.6 48.8 -69.7 -31.2 61.1 -0.7 18.0 42 48 A A H <> S+ 0 0 5 -3,-1.1 4,-2.7 2,-0.2 5,-0.3 0.912 108.5 53.0 -73.2 -45.0 58.1 -2.5 16.4 43 49 A I H X S+ 0 0 47 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.939 111.4 46.9 -50.8 -48.5 58.5 -5.4 18.8 44 50 A R H X S+ 0 0 166 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.894 111.9 49.5 -68.7 -37.0 58.4 -3.0 21.7 45 51 A E H >X S+ 0 0 43 -4,-1.7 4,-1.0 2,-0.2 3,-0.6 0.951 112.7 46.7 -63.3 -49.9 55.4 -1.1 20.5 46 52 A I H 3X S+ 0 0 0 -4,-2.7 4,-1.2 1,-0.3 3,-0.5 0.861 106.8 57.9 -63.0 -39.6 53.3 -4.2 19.8 47 53 A S H 3< S+ 0 0 48 -4,-2.3 4,-0.3 -5,-0.3 -1,-0.3 0.814 102.5 55.4 -61.1 -30.3 54.2 -5.6 23.2 48 54 A L H XX S+ 0 0 107 -4,-1.2 3,-1.0 -3,-0.6 4,-0.5 0.840 102.6 57.9 -68.9 -29.4 52.7 -2.5 24.8 49 55 A L H >< S+ 0 0 16 -4,-1.0 3,-1.0 -3,-0.5 11,-0.3 0.812 90.6 67.7 -72.1 -32.2 49.5 -3.2 22.9 50 56 A K T 3< S+ 0 0 80 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.722 102.4 50.6 -56.5 -21.9 49.1 -6.7 24.5 51 57 A E T <4 S+ 0 0 148 -3,-1.0 2,-1.9 -4,-0.3 -1,-0.2 0.694 84.9 90.4 -87.2 -24.0 48.5 -4.7 27.8 52 58 A L << + 0 0 17 -3,-1.0 2,-0.4 -4,-0.5 8,-0.2 -0.506 61.0 169.1 -82.7 79.5 45.9 -2.4 26.4 53 59 A N + 0 0 72 -2,-1.9 5,-0.1 6,-0.1 -3,-0.0 -0.792 7.7 145.4-105.2 133.6 42.8 -4.5 27.2 54 60 A H > - 0 0 43 3,-0.4 3,-2.1 -2,-0.4 54,-0.0 -0.961 54.2-113.9-161.5 143.8 39.2 -3.3 27.0 55 61 A P T 3 S+ 0 0 94 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.682 117.4 48.2 -58.5 -21.5 35.8 -5.0 26.1 56 62 A N T 3 S+ 0 0 10 80,-0.1 81,-2.7 48,-0.1 2,-0.5 0.198 98.6 82.9-106.3 19.1 35.4 -2.8 23.0 57 63 A I B < S-e 137 0B 9 -3,-2.1 -3,-0.4 79,-0.3 2,-0.3 -0.979 89.4-115.2-119.3 124.1 39.0 -3.4 21.8 58 64 A V - 0 0 7 79,-2.5 82,-0.2 -2,-0.5 2,-0.2 -0.433 43.0-116.1 -58.6 120.9 39.8 -6.6 19.9 59 65 A K - 0 0 89 -2,-0.3 16,-2.8 -4,-0.1 2,-0.8 -0.417 13.8-141.0 -69.6 127.3 42.1 -8.4 22.2 60 66 A L E -D 74 0A 11 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.813 23.2-179.0 -80.1 109.6 45.7 -9.0 21.1 61 67 A L E - 0 0 38 12,-2.7 2,-0.3 -2,-0.8 13,-0.2 0.884 57.3 -3.2 -79.7 -41.4 46.4 -12.6 22.4 62 68 A D E -D 73 0A 73 11,-1.5 11,-2.9 2,-0.0 2,-0.5 -0.998 46.9-148.6-157.3 148.9 49.9 -13.1 21.3 63 69 A V E -D 72 0A 28 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.988 22.3-170.8-118.0 124.4 52.9 -11.6 19.4 64 70 A I E -D 71 0A 40 7,-2.7 7,-2.3 -2,-0.5 2,-0.7 -0.935 7.6-174.0-124.1 109.1 55.1 -14.2 17.7 65 71 A H E +D 70 0A 80 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.906 22.5 152.6-100.6 111.4 58.4 -13.2 16.2 66 72 A T E > -D 69 0A 52 3,-2.6 3,-2.7 -2,-0.7 -2,-0.1 -0.982 59.4 -4.4-136.1 147.2 60.0 -16.1 14.4 67 73 A E T 3 S- 0 0 166 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.812 127.7 -51.3 38.5 57.5 62.4 -16.4 11.4 68 74 A N T 3 S+ 0 0 121 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.636 120.6 112.5 63.4 14.2 62.5 -12.6 10.6 69 75 A K E < - D 0 66A 106 -3,-2.7 -3,-2.6 -31,-0.1 2,-0.4 -0.933 56.1-149.9-128.4 141.7 58.7 -12.8 10.6 70 76 A L E -CD 35 65A 15 -35,-0.8 -35,-2.6 -2,-0.4 2,-0.4 -0.928 10.9-174.4-115.1 131.5 56.0 -11.3 12.9 71 77 A Y E -CD 34 64A 11 -7,-2.3 -7,-2.7 -2,-0.4 2,-0.5 -0.995 9.1-156.8-125.7 127.1 52.6 -12.9 13.6 72 78 A L E -CD 33 63A 0 -39,-2.4 -39,-3.0 -2,-0.4 2,-0.6 -0.918 5.3-154.5-105.1 129.0 49.9 -11.2 15.6 73 79 A V E -CD 32 62A 0 -11,-2.9 -12,-2.7 -2,-0.5 -11,-1.5 -0.899 20.6-178.3-103.8 113.4 47.2 -13.4 17.2 74 80 A F E -CD 31 60A 8 -43,-3.3 -43,-2.7 -2,-0.6 -14,-0.2 -0.801 36.0 -94.7-110.4 153.5 43.9 -11.6 17.8 75 81 A E E -C 30 0A 50 -16,-2.8 2,-0.4 -2,-0.3 -45,-0.2 -0.374 50.1-124.1 -48.5 137.8 40.5 -12.5 19.3 76 82 A F - 0 0 37 -47,-0.6 2,-0.3 -2,-0.0 -47,-0.1 -0.808 26.5-172.9 -99.5 131.7 38.3 -13.5 16.5 77 83 A L - 0 0 14 -2,-0.4 53,-0.1 1,-0.1 3,-0.0 -0.904 22.2-134.8-120.6 154.6 34.9 -11.9 15.7 78 84 A H S S+ 0 0 108 51,-0.3 2,-0.3 -2,-0.3 52,-0.1 0.605 76.5 24.2 -90.4 -13.8 32.5 -13.2 13.1 79 85 A Q E -F 129 0B 31 50,-1.1 50,-2.6 211,-0.0 2,-0.3 -0.992 62.8-139.3-149.9 152.8 31.3 -10.2 11.2 80 86 A D E > -F 128 0B 20 -2,-0.3 4,-2.0 48,-0.2 48,-0.2 -0.767 27.9-115.2-112.4 163.9 32.5 -6.7 10.3 81 87 A L H > S+ 0 0 0 46,-2.7 4,-2.4 43,-1.0 5,-0.2 0.819 111.4 59.7 -67.1 -32.3 30.6 -3.4 10.2 82 88 A K H > S+ 0 0 52 42,-0.9 4,-2.2 45,-0.3 -1,-0.2 0.962 110.7 39.3 -58.8 -53.2 31.1 -3.0 6.4 83 89 A K H > S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.862 114.4 55.4 -66.7 -34.8 29.4 -6.3 5.6 84 90 A F H X S+ 0 0 10 -4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.878 109.7 46.4 -64.5 -36.9 26.7 -5.6 8.3 85 91 A M H < S+ 0 0 20 -4,-2.4 3,-0.5 2,-0.2 -2,-0.2 0.895 111.1 51.5 -71.5 -40.4 25.9 -2.2 6.6 86 92 A D H >< S+ 0 0 103 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.870 111.8 47.8 -63.9 -37.7 25.8 -3.8 3.2 87 93 A A H 3< S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.612 114.7 45.6 -74.4 -17.5 23.4 -6.4 4.6 88 94 A S T 3X S+ 0 0 22 -4,-0.7 4,-2.9 -3,-0.5 3,-0.4 0.216 80.4 110.3-106.7 10.3 21.2 -3.7 6.2 89 95 A A T <4 S+ 0 0 45 -3,-0.7 -1,-0.1 1,-0.2 -2,-0.1 0.749 70.2 57.1 -62.0 -28.5 21.3 -1.4 3.2 90 96 A L T 4 S+ 0 0 173 -3,-0.2 -1,-0.2 -4,-0.1 -2,-0.1 0.889 128.1 9.7 -78.3 -40.9 17.6 -1.9 2.3 91 97 A T T 4 S- 0 0 117 -3,-0.4 -2,-0.2 1,-0.1 -1,-0.1 0.553 105.5-122.2-113.4 -7.6 16.0 -0.8 5.6 92 98 A G < - 0 0 8 -4,-2.9 -3,-0.1 -7,-0.2 99,-0.1 0.117 37.4 -66.1 83.2 153.6 19.1 0.7 7.4 93 99 A I - 0 0 12 97,-0.5 5,-0.1 1,-0.1 -8,-0.0 -0.682 66.3-105.1 -68.4 128.3 20.5 -0.2 10.7 94 100 A P >> - 0 0 83 0, 0.0 4,-2.0 0, 0.0 3,-1.0 -0.271 26.8-117.7 -56.1 142.1 17.9 0.8 13.3 95 101 A L H 3> S+ 0 0 62 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.843 112.1 58.0 -54.4 -42.8 18.8 4.1 15.2 96 102 A P H 3> S+ 0 0 71 0, 0.0 4,-1.8 0, 0.0 188,-0.4 0.861 110.5 45.1 -55.7 -35.6 19.0 2.4 18.7 97 103 A L H <> S+ 0 0 8 -3,-1.0 4,-2.8 2,-0.2 5,-0.2 0.872 111.4 51.4 -73.6 -40.6 21.6 -0.0 17.3 98 104 A I H X S+ 0 0 6 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.954 112.9 46.9 -59.2 -47.2 23.6 2.8 15.6 99 105 A K H X S+ 0 0 11 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.887 111.3 50.3 -63.1 -42.9 23.6 4.7 18.8 100 106 A S H X S+ 0 0 3 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.919 112.9 46.6 -60.7 -45.8 24.7 1.6 20.8 101 107 A Y H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.938 113.0 48.6 -63.1 -48.0 27.5 0.9 18.4 102 108 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.2 -2,-0.2 0.922 112.5 50.0 -54.7 -44.3 28.6 4.6 18.4 103 109 A F H X S+ 0 0 53 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.914 112.3 45.8 -62.4 -45.1 28.5 4.6 22.2 104 110 A Q H X S+ 0 0 12 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.892 111.8 51.7 -69.4 -38.8 30.6 1.4 22.5 105 111 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.901 108.5 51.6 -65.1 -40.4 33.1 2.7 20.0 106 112 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.874 107.9 51.9 -62.4 -38.2 33.5 5.9 21.9 107 113 A Q H X S+ 0 0 63 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.935 110.0 50.8 -61.8 -44.0 34.1 3.9 25.1 108 114 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.944 113.9 43.1 -54.9 -51.1 36.8 2.0 23.1 109 115 A L H X S+ 0 0 0 -4,-2.8 4,-3.4 1,-0.2 5,-0.3 0.911 109.4 56.4 -63.5 -45.3 38.4 5.3 22.0 110 116 A A H X S+ 0 0 4 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.907 109.5 48.3 -55.6 -42.9 38.2 6.9 25.4 111 117 A F H X S+ 0 0 42 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.982 116.2 39.9 -59.3 -58.4 40.1 4.0 26.9 112 118 A C H ><>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 3,-0.7 0.910 115.3 52.3 -59.0 -45.2 42.9 3.9 24.3 113 119 A H H ><5S+ 0 0 27 -4,-3.4 3,-2.0 1,-0.2 -1,-0.2 0.858 101.8 59.6 -60.8 -36.8 43.1 7.7 24.2 114 120 A S H 3<5S+ 0 0 57 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.805 108.2 47.1 -62.1 -28.3 43.5 7.9 28.0 115 121 A H T <<5S- 0 0 85 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.183 121.4-112.0 -95.4 15.2 46.6 5.7 27.5 116 122 A R T < 5S+ 0 0 188 -3,-2.0 2,-0.5 1,-0.2 -3,-0.2 0.755 75.1 133.5 64.0 25.8 47.8 8.0 24.7 117 123 A V < - 0 0 36 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.934 34.1-170.5-108.5 128.5 47.3 5.3 22.0 118 124 A L - 0 0 42 -2,-0.5 23,-0.5 1,-0.2 26,-0.3 -0.764 22.8-146.4-113.3 162.9 45.5 6.2 18.8 119 125 A H - 0 0 6 -2,-0.3 24,-0.5 21,-0.2 -1,-0.2 0.923 18.4-173.8 -85.8 -58.9 44.2 4.1 16.0 120 126 A R S S+ 0 0 38 56,-0.1 44,-0.1 23,-0.1 -1,-0.1 0.217 71.6 58.2 84.9 -17.1 44.7 6.4 13.0 121 127 A D + 0 0 19 18,-0.1 2,-0.1 42,-0.1 5,-0.1 -0.166 63.8 162.4-140.7 44.5 43.0 4.2 10.5 122 128 A L + 0 0 0 40,-0.2 40,-0.1 3,-0.1 17,-0.0 -0.433 11.6 149.4 -64.5 142.8 39.4 3.5 11.6 123 129 A K > - 0 0 26 -2,-0.1 3,-2.2 38,-0.1 4,-0.3 -0.949 60.8 -96.9-167.5 154.1 37.1 2.2 8.8 124 130 A P G > S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 -43,-1.0 0.817 118.8 63.6 -50.6 -34.3 34.0 -0.0 8.7 125 131 A Q G 3 S+ 0 0 84 1,-0.2 -3,-0.1 -44,-0.2 -42,-0.0 0.643 104.3 45.6 -67.9 -18.3 36.2 -3.0 7.8 126 132 A N G < S+ 0 0 13 -3,-2.2 12,-3.1 -5,-0.1 2,-0.6 0.240 91.1 89.5-110.4 16.2 38.1 -2.8 11.1 127 133 A L E < - G 0 137B 0 -3,-1.3 -46,-2.7 -4,-0.3 2,-0.3 -0.963 66.5-162.8-108.1 117.2 35.1 -2.4 13.4 128 134 A L E -FG 80 136B 31 8,-2.8 8,-2.6 -2,-0.6 2,-0.3 -0.815 7.0-162.3-117.0 143.6 34.0 -5.9 14.3 129 135 A I E -FG 79 135B 0 -50,-2.6 -50,-1.1 -2,-0.3 -51,-0.3 -0.872 1.1-158.8-126.6 151.2 30.6 -7.1 15.7 130 136 A N > - 0 0 34 4,-1.5 3,-1.1 -2,-0.3 -53,-0.1 -0.649 38.9 -96.1-118.6-176.1 29.3 -10.2 17.5 131 137 A T T 3 S+ 0 0 78 1,-0.2 159,-0.1 -2,-0.2 -2,-0.0 0.713 114.7 65.1 -72.8 -20.6 26.0 -11.8 18.1 132 138 A E T 3 S- 0 0 128 155,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.316 118.9 -99.0 -85.4 4.4 25.6 -10.2 21.6 133 139 A G S < S+ 0 0 0 -3,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.563 79.8 133.8 87.5 8.9 25.4 -6.6 20.3 134 140 A A - 0 0 10 151,-0.1 -4,-1.5 -30,-0.0 2,-0.3 -0.517 35.6-165.5 -88.2 157.4 29.0 -5.7 21.0 135 141 A I E - G 0 129B 0 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.977 8.6-168.3-139.7 145.6 31.3 -3.9 18.5 136 142 A K E - G 0 128B 27 -8,-2.6 -8,-2.8 -2,-0.3 2,-0.5 -0.970 23.7-119.0-142.0 147.0 35.0 -3.7 18.9 137 143 A L E -eG 57 127B 1 -81,-2.7 -79,-2.5 -2,-0.3 3,-0.4 -0.771 32.9-155.0 -90.5 126.8 37.9 -1.8 17.3 138 144 A A + 0 0 3 -12,-3.1 -79,-0.1 -2,-0.5 -12,-0.0 -0.742 66.1 18.0-101.2 151.3 40.4 -4.0 15.5 139 145 A D S > S+ 0 0 37 -2,-0.3 3,-1.3 1,-0.2 4,-0.3 0.764 76.4 178.8 67.5 27.9 44.1 -3.4 14.8 140 146 A F T 3 + 0 0 11 -3,-0.4 -1,-0.2 1,-0.2 -21,-0.2 -0.406 66.4 8.9 -61.6 133.9 44.4 -0.6 17.3 141 147 A G T >> S+ 0 0 5 -23,-0.5 3,-0.6 -2,-0.1 4,-0.6 0.225 91.5 113.3 85.0 -14.3 47.9 0.9 17.5 142 148 A L H <> + 0 0 2 -3,-1.3 4,-2.4 1,-0.2 3,-0.4 0.762 69.3 63.4 -61.1 -25.1 49.3 -1.0 14.5 143 149 A A H 3> S+ 0 0 12 -24,-0.5 4,-2.0 -4,-0.3 -1,-0.2 0.866 101.1 48.0 -72.1 -36.7 49.7 2.3 12.5 144 150 A R H <4 S+ 0 0 194 -3,-0.6 -1,-0.2 -26,-0.3 -2,-0.2 0.586 116.0 48.9 -76.5 -10.3 52.3 3.8 14.9 145 151 A A H < S+ 0 0 21 -4,-0.6 -2,-0.2 -3,-0.4 -1,-0.2 0.869 132.1 8.6 -93.1 -43.2 54.1 0.4 14.7 146 152 A F H < S- 0 0 55 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.360 98.9-125.7-122.8 -0.0 54.2 -0.2 10.9 147 153 A G < - 0 0 33 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.1 0.002 26.3 -82.9 77.0 172.3 52.9 3.1 9.2 148 154 A V - 0 0 35 -4,-0.0 -1,-0.1 4,-0.0 2,-0.1 -0.932 45.5-162.7-119.8 104.7 50.1 3.7 6.7 149 155 A P - 0 0 50 0, 0.0 3,-0.1 0, 0.0 9,-0.1 -0.293 28.6-120.3 -78.5 167.6 51.1 3.0 3.1 150 156 A V S S+ 0 0 106 1,-0.2 8,-2.7 7,-0.1 2,-0.3 0.891 100.6 25.7 -71.9 -43.8 49.3 4.2 -0.1 151 157 A R B S-H 157 0C 135 6,-0.2 6,-0.2 1,-0.0 -1,-0.2 -0.905 83.2-121.4-119.0 149.8 48.8 0.6 -1.2 152 158 A T > - 0 0 9 4,-2.7 3,-3.0 -2,-0.3 -137,-0.2 -0.219 47.7 -86.2 -73.1 174.6 48.6 -2.7 0.7 153 159 A Y T 3 S+ 0 0 92 -139,-1.2 -139,-0.1 -140,-0.3 -138,-0.1 0.704 136.8 51.9 -55.9 -21.0 51.1 -5.6 0.1 154 160 A T T 3 S- 0 0 47 -141,-0.3 -1,-0.3 -140,-0.1 3,-0.1 0.313 120.9-113.2 -94.1 4.5 48.6 -6.6 -2.6 155 161 A H < + 0 0 131 -3,-3.0 -2,-0.1 1,-0.3 3,-0.1 0.390 65.8 152.9 69.5 -1.8 48.7 -3.0 -4.1 156 162 A E - 0 0 111 -5,-0.1 -4,-2.7 1,-0.1 2,-0.5 -0.268 53.6-104.7 -45.0 140.7 45.1 -2.6 -3.0 157 163 A V B -H 151 0C 96 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.656 26.0-128.1 -80.7 123.4 44.5 1.2 -2.4 158 164 A V - 0 0 7 -8,-2.7 2,-0.1 -2,-0.5 -1,-0.0 -0.580 35.2-112.1 -69.5 127.6 44.2 2.2 1.2 159 165 A T - 0 0 35 -2,-0.3 3,-0.2 1,-0.1 41,-0.1 -0.333 26.5-169.8 -68.1 141.1 41.0 4.2 1.7 160 166 A L > + 0 0 23 39,-0.5 3,-2.1 1,-0.1 -1,-0.1 0.423 60.8 103.5-102.9 -3.7 41.1 7.9 2.4 161 167 A W T 3 S+ 0 0 78 1,-0.3 36,-0.3 38,-0.2 -1,-0.1 0.755 87.1 37.0 -57.7 -30.1 37.4 8.2 3.2 162 168 A Y T 3 S+ 0 0 10 -3,-0.2 2,-0.3 -40,-0.1 -1,-0.3 0.233 86.5 126.8-105.9 8.9 37.8 8.4 6.9 163 169 A R < - 0 0 35 -3,-2.1 -42,-0.1 1,-0.1 -3,-0.1 -0.554 61.4-118.8 -80.7 130.8 41.0 10.5 7.0 164 170 A A >> - 0 0 1 -2,-0.3 4,-1.7 -44,-0.1 3,-0.7 -0.297 19.8-119.9 -64.9 146.5 41.0 13.6 9.2 165 171 A P H 3> S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.840 111.4 60.0 -62.0 -34.5 41.6 17.0 7.4 166 172 A E H 34>S+ 0 0 0 2,-0.2 5,-2.9 97,-0.2 4,-0.1 0.843 106.3 48.3 -62.5 -31.3 44.8 17.7 9.5 167 173 A I H X45S+ 0 0 22 -3,-0.7 3,-2.0 3,-0.2 -1,-0.2 0.964 112.0 47.5 -69.7 -49.4 46.4 14.6 8.1 168 174 A L H 3<5S+ 0 0 8 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.828 109.2 55.4 -59.2 -34.6 45.5 15.4 4.6 169 175 A L T 3<5S- 0 0 0 -4,-2.2 60,-2.6 -5,-0.2 61,-0.3 0.392 124.6-103.7 -82.9 3.6 46.8 19.0 5.1 170 176 A G T < 5 + 0 0 11 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.704 58.5 162.8 89.5 23.8 50.2 17.5 6.2 171 177 A X < - 0 0 53 -5,-2.9 3,-0.4 1,-0.2 -1,-0.2 -0.619 18.9-167.6 -74.4 127.4 50.3 17.7 10.0 172 178 A K S S+ 0 0 163 -2,-0.4 2,-0.2 1,-0.2 -1,-0.2 0.726 80.3 50.2 -85.9 -21.6 53.0 15.4 11.2 173 179 A Y S S+ 0 0 215 -6,-0.0 -1,-0.2 0, 0.0 -6,-0.0 -0.372 76.9 164.6-117.8 51.4 52.0 15.5 14.9 174 180 A Y - 0 0 64 -3,-0.4 2,-0.1 -2,-0.2 -2,-0.0 -0.228 22.6-138.3 -73.6 163.4 48.3 14.8 14.8 175 181 A S > - 0 0 50 -57,-0.0 3,-2.0 1,-0.0 4,-0.3 -0.339 35.7 -76.7-112.8-174.8 46.3 13.8 17.9 176 182 A T T >> S+ 0 0 49 1,-0.3 3,-1.4 2,-0.2 4,-1.0 0.688 114.1 82.4 -56.3 -19.8 43.6 11.4 19.2 177 183 A A H 3> S+ 0 0 8 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.762 76.2 70.7 -61.0 -21.9 41.2 13.8 17.5 178 184 A V H <> S+ 0 0 1 -3,-2.0 4,-1.7 1,-0.2 -1,-0.3 0.860 96.9 49.2 -64.5 -33.7 41.9 12.0 14.2 179 185 A D H <> S+ 0 0 0 -3,-1.4 4,-2.2 -4,-0.3 -1,-0.2 0.826 107.5 54.2 -73.3 -34.2 40.0 8.9 15.5 180 186 A I H X S+ 0 0 2 -4,-1.0 4,-2.4 2,-0.2 -2,-0.2 0.892 107.5 51.6 -63.9 -43.0 37.0 11.0 16.5 181 187 A W H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.948 111.0 47.0 -54.8 -51.7 36.9 12.5 13.0 182 188 A S H X S+ 0 0 4 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.881 112.0 50.0 -60.5 -44.3 36.9 9.0 11.4 183 189 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.867 107.5 54.0 -65.4 -38.1 34.2 7.7 13.8 184 190 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 76,-0.3 -2,-0.2 0.913 108.1 51.1 -56.4 -42.2 32.1 10.8 13.0 185 191 A C H X S+ 0 0 2 -4,-2.1 4,-1.9 1,-0.2 11,-0.4 0.914 111.7 46.3 -63.6 -40.1 32.4 9.8 9.3 186 192 A I H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.857 108.9 55.6 -70.7 -35.1 31.3 6.2 10.1 187 193 A F H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.938 108.6 48.0 -59.4 -51.2 28.4 7.5 12.2 188 194 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 6,-0.3 0.873 111.0 51.8 -57.5 -41.8 27.1 9.5 9.2 189 195 A E H X S+ 0 0 14 -4,-1.9 4,-2.1 2,-0.2 5,-0.3 0.877 107.2 51.5 -64.7 -39.4 27.5 6.5 6.9 190 196 A M H < S+ 0 0 4 -4,-2.2 -97,-0.5 2,-0.2 -1,-0.2 0.937 114.8 45.3 -61.3 -41.7 25.5 4.2 9.3 191 197 A V H < S+ 0 0 18 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.942 124.5 28.2 -69.4 -49.8 22.7 6.8 9.3 192 198 A T H < S- 0 0 45 -4,-2.5 -1,-0.2 2,-0.3 -3,-0.2 0.654 95.2-129.5 -90.7 -15.6 22.5 7.6 5.6 193 199 A R S < S+ 0 0 137 -4,-2.1 2,-0.3 -5,-0.2 -3,-0.1 0.740 81.2 91.1 66.4 27.4 23.7 4.3 4.2 194 200 A R S S- 0 0 204 -5,-0.3 -2,-0.3 -6,-0.3 -1,-0.2 -0.988 88.4 -99.7-146.1 139.6 26.2 6.2 2.0 195 201 A A - 0 0 21 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.323 27.8-140.9 -56.4 141.7 29.8 7.1 2.7 196 202 A L S S+ 0 0 29 -11,-0.4 -1,-0.1 1,-0.2 -34,-0.1 0.955 89.8 12.6 -72.9 -49.2 30.1 10.7 3.8 197 203 A F - 0 0 3 -36,-0.3 2,-2.2 2,-0.1 -1,-0.2 -0.639 68.3-179.7-131.6 73.6 33.4 11.7 2.0 198 204 A P + 0 0 38 0, 0.0 2,-0.1 0, 0.0 -37,-0.1 -0.391 17.6 177.0 -76.1 65.5 34.3 8.9 -0.6 199 205 A G - 0 0 4 -2,-2.2 -39,-0.5 1,-0.1 -38,-0.2 -0.348 25.4-165.2 -69.9 145.7 37.5 10.5 -2.0 200 206 A D S S+ 0 0 139 1,-0.2 2,-0.3 -40,-0.1 -1,-0.1 0.266 77.3 21.0-116.7 11.5 39.6 8.7 -4.5 201 207 A S S > S- 0 0 45 1,-0.1 4,-2.8 -41,-0.0 5,-0.2 -0.925 89.7 -99.5-160.1 166.8 42.7 10.9 -4.1 202 208 A E H > S+ 0 0 102 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.892 123.8 44.1 -61.0 -39.3 44.0 13.2 -1.4 203 209 A I H > S+ 0 0 85 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.891 112.7 50.6 -72.2 -38.7 42.8 16.3 -3.1 204 210 A D H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.914 112.2 49.3 -64.2 -39.9 39.4 14.8 -4.0 205 211 A Q H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.953 114.1 44.3 -62.2 -49.9 39.1 13.8 -0.3 206 212 A L H X S+ 0 0 7 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.921 114.2 50.0 -58.3 -46.1 40.0 17.3 0.9 207 213 A F H X S+ 0 0 41 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.851 107.7 52.8 -71.9 -29.7 37.7 18.9 -1.6 208 214 A R H X S+ 0 0 89 -4,-2.5 4,-1.4 -5,-0.2 -1,-0.2 0.917 110.3 49.0 -66.3 -40.6 34.8 16.7 -0.7 209 215 A I H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 3,-0.5 0.960 112.0 48.5 -59.5 -52.4 35.3 17.7 2.9 210 216 A F H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.857 106.5 56.5 -54.0 -41.4 35.4 21.4 1.9 211 217 A R H < S+ 0 0 88 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.828 117.9 32.7 -67.1 -33.4 32.3 21.2 -0.2 212 218 A T H < S+ 0 0 20 -4,-1.4 28,-2.7 -3,-0.5 -2,-0.2 0.867 132.3 28.2 -85.7 -46.2 30.2 19.9 2.7 213 219 A L H < S- 0 0 5 -4,-3.1 26,-0.3 -5,-0.2 -3,-0.2 0.495 114.1-103.8-100.7 -1.7 31.8 21.6 5.7 214 220 A G < - 0 0 6 -4,-2.0 24,-0.2 24,-0.5 -3,-0.1 0.232 43.7 -71.0 91.8 142.0 33.1 24.7 4.0 215 221 A T - 0 0 20 22,-2.1 24,-0.1 -4,-0.1 2,-0.1 -0.557 61.9-120.0 -60.1 128.2 36.6 25.5 3.1 216 222 A P + 0 0 2 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.429 37.9 175.4 -72.6 148.7 38.3 26.1 6.5 217 223 A D > - 0 0 75 -2,-0.1 4,-2.0 -3,-0.0 3,-0.2 -0.747 50.4 -78.5-138.4-174.1 39.9 29.5 7.1 218 224 A E T 4 S+ 0 0 81 -2,-0.2 6,-0.1 1,-0.2 0, 0.0 0.738 122.3 62.5 -65.5 -23.4 41.6 31.2 10.0 219 225 A V T 4 S+ 0 0 133 2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.961 115.7 27.1 -65.5 -50.8 38.2 32.0 11.7 220 226 A V T 4 S+ 0 0 57 1,-0.2 44,-0.5 -3,-0.2 -2,-0.2 0.759 137.4 26.3 -86.6 -21.6 37.1 28.3 12.2 221 227 A W S >< S- 0 0 11 -4,-2.0 3,-2.5 42,-0.1 4,-0.3 -0.672 76.0-151.4-145.4 78.8 40.7 26.8 12.4 222 228 A P T 3 S+ 0 0 81 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.328 87.9 23.9 -49.0 127.0 43.5 29.1 13.6 223 229 A G T > S+ 0 0 30 41,-0.0 3,-1.9 4,-0.0 4,-0.2 0.099 86.0 117.0 103.4 -18.5 46.7 27.9 12.0 224 230 A V G X S+ 0 0 0 -3,-2.5 3,-1.7 1,-0.3 6,-0.1 0.848 70.6 55.8 -52.2 -42.4 45.1 26.2 9.1 225 231 A T G 3 S+ 0 0 62 -4,-0.3 -1,-0.3 1,-0.3 -7,-0.0 0.615 105.1 53.2 -71.4 -12.1 46.7 28.5 6.4 226 232 A S G < S+ 0 0 102 -3,-1.9 -1,-0.3 5,-0.1 -2,-0.2 0.284 80.2 121.4-104.3 13.0 50.2 27.7 7.6 227 233 A M S X S- 0 0 23 -3,-1.7 3,-1.9 -4,-0.2 -57,-0.1 -0.469 77.0-109.2 -73.0 147.4 49.8 23.9 7.4 228 234 A P T 3 S+ 0 0 90 0, 0.0 -58,-0.2 0, 0.0 -1,-0.1 0.789 113.3 31.7 -50.9 -41.0 52.3 22.2 5.1 229 235 A D T 3 S+ 0 0 74 -60,-2.6 2,-0.3 2,-0.1 -59,-0.2 0.193 88.0 118.8-108.9 17.4 49.8 21.3 2.3 230 236 A Y < - 0 0 35 -3,-1.9 -5,-0.0 -61,-0.3 3,-0.0 -0.641 44.9-166.2 -80.5 137.8 47.5 24.2 2.6 231 237 A K > - 0 0 99 -2,-0.3 3,-2.1 1,-0.1 -2,-0.1 -0.997 25.9-139.8-127.5 131.3 47.4 26.3 -0.5 232 238 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.739 102.7 68.2 -55.8 -22.9 45.8 29.8 -0.8 233 239 A S T 3 + 0 0 101 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.425 67.4 124.2 -81.2 -3.8 44.5 28.7 -4.1 234 240 A F S < S- 0 0 13 -3,-2.1 -19,-0.0 1,-0.1 -4,-0.0 -0.391 73.5-107.0 -50.0 130.7 42.1 26.1 -2.6 235 241 A P - 0 0 55 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.257 30.5-122.0 -57.9 153.6 38.6 27.0 -3.9 236 242 A K + 0 0 176 -3,-0.1 2,-0.3 -22,-0.1 -25,-0.0 -0.884 34.4 179.4-108.8 104.5 36.3 28.6 -1.3 237 243 A W - 0 0 80 -2,-0.7 -22,-2.1 -27,-0.0 2,-0.2 -0.802 25.4-122.3-103.4 143.5 33.1 26.7 -0.7 238 244 A A - 0 0 88 -2,-0.3 -24,-0.5 -24,-0.2 2,-0.2 -0.523 35.2-101.4 -77.2 154.0 30.3 27.6 1.7 239 245 A R - 0 0 117 -26,-0.3 -26,-0.2 -2,-0.2 2,-0.2 -0.532 30.2-133.4 -77.0 139.6 29.3 25.1 4.4 240 246 A Q - 0 0 67 -28,-2.7 2,-0.2 -2,-0.2 -1,-0.1 -0.572 27.3-102.2 -85.3 155.1 26.1 23.0 4.0 241 247 A D >> - 0 0 119 -2,-0.2 3,-1.3 1,-0.1 4,-1.1 -0.566 22.9-130.7 -75.1 139.9 23.5 22.5 6.9 242 248 A F H 3> S+ 0 0 23 1,-0.3 4,-2.7 -2,-0.2 -1,-0.1 0.788 106.2 69.2 -61.9 -27.3 23.8 19.2 8.7 243 249 A S H 34 S+ 0 0 61 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.821 105.4 42.4 -60.3 -30.1 20.0 18.8 8.2 244 250 A K H <4 S+ 0 0 146 -3,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.775 114.4 51.7 -81.2 -31.8 20.9 18.3 4.5 245 251 A V H < S+ 0 0 25 -4,-1.1 -2,-0.2 1,-0.2 -3,-0.1 0.885 123.6 17.8 -79.2 -40.1 23.9 16.1 5.2 246 252 A V S >< S- 0 0 0 -4,-2.7 3,-2.7 3,-0.1 -1,-0.2 -0.182 84.9-165.2-130.7 49.0 22.5 13.4 7.5 247 253 A P T 3 S+ 0 0 69 0, 0.0 3,-0.1 0, 0.0 -4,-0.0 -0.485 71.3 26.1 -68.4 144.0 18.6 13.3 7.3 248 254 A P T 3 S+ 0 0 122 0, 0.0 -5,-0.1 0, 0.0 2,-0.1 -0.775 86.3 121.3-104.2 41.3 16.8 11.9 9.2 249 255 A L < - 0 0 5 -3,-2.7 -3,-0.1 -6,-0.1 -61,-0.0 -0.348 63.2-122.1 -55.7 131.0 19.2 12.1 12.1 250 256 A D > - 0 0 59 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.148 29.3 -91.8 -73.2 174.6 17.6 14.1 14.9 251 257 A E H > S+ 0 0 119 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.831 124.3 53.2 -61.2 -39.5 19.0 17.3 16.5 252 258 A D H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 27,-0.3 0.944 113.0 44.4 -58.5 -51.2 20.9 15.5 19.3 253 259 A G H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.932 114.2 48.0 -56.3 -48.8 22.6 13.3 16.7 254 260 A R H X S+ 0 0 54 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.918 111.6 52.3 -62.8 -41.4 23.4 16.2 14.3 255 261 A S H X S+ 0 0 41 -4,-2.7 4,-1.4 -5,-0.2 -1,-0.2 0.942 112.5 43.7 -57.2 -51.1 24.7 18.2 17.2 256 262 A L H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 3,-0.4 0.938 112.7 52.1 -62.2 -45.5 27.1 15.4 18.3 257 263 A L H X S+ 0 0 0 -4,-3.0 4,-1.4 1,-0.2 3,-0.3 0.902 105.9 55.4 -58.8 -41.1 28.2 14.7 14.7 258 264 A S H < S+ 0 0 29 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.863 108.2 48.0 -61.6 -32.7 29.0 18.4 14.2 259 265 A Q H >< S+ 0 0 62 -4,-1.4 10,-2.3 -3,-0.4 3,-0.6 0.785 109.2 52.9 -79.9 -26.5 31.3 18.3 17.2 260 266 A M H 3< S+ 0 0 0 -4,-1.6 -76,-0.3 -3,-0.3 -1,-0.2 0.679 112.0 48.7 -74.0 -23.7 33.0 15.1 15.9 261 267 A L T 3< S+ 0 0 1 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.209 75.9 140.2-105.8 18.4 33.6 16.9 12.7 262 268 A H < - 0 0 56 -3,-0.6 6,-0.2 1,-0.1 -3,-0.1 -0.326 51.0-137.8 -55.6 137.2 35.1 20.2 13.9 263 269 A Y S S+ 0 0 4 -50,-0.1 -97,-0.2 -43,-0.1 -1,-0.1 0.941 88.4 71.5 -60.3 -52.1 37.9 21.3 11.7 264 270 A D S >> S- 0 0 19 -44,-0.5 4,-1.8 1,-0.2 3,-1.2 -0.574 75.8-149.4 -72.0 117.8 40.2 22.4 14.5 265 271 A P T 34 S+ 0 0 20 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.821 98.0 57.8 -61.5 -29.1 41.4 19.2 16.2 266 272 A N T 34 S+ 0 0 151 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.755 110.7 41.9 -69.5 -26.1 41.6 21.2 19.5 267 273 A K T <4 S+ 0 0 133 -3,-1.2 -1,-0.2 2,-0.1 3,-0.1 0.715 90.4 106.2 -84.4 -29.4 37.8 22.1 19.2 268 274 A R S < S- 0 0 12 -4,-1.8 -8,-0.2 -6,-0.2 -9,-0.1 -0.265 84.2-100.8 -57.8 135.3 36.8 18.6 18.1 269 275 A I - 0 0 18 -10,-2.3 2,-0.1 -13,-0.2 -1,-0.1 -0.213 33.0-125.4 -59.5 145.7 35.0 16.7 20.9 270 276 A S > - 0 0 64 -3,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.455 24.0-110.9 -81.3 165.0 37.0 14.1 22.9 271 277 A A H > S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 -161,-0.1 0.929 118.5 51.2 -62.0 -42.1 35.7 10.5 23.2 272 278 A K H > S+ 0 0 130 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.897 112.1 44.2 -64.3 -43.5 35.0 11.1 27.0 273 279 A A H >4 S+ 0 0 49 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.871 109.7 57.4 -70.1 -34.7 33.0 14.3 26.4 274 280 A A H >< S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.900 97.9 61.1 -58.3 -39.2 31.2 12.6 23.5 275 281 A L H 3< S+ 0 0 44 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.748 104.6 50.5 -61.5 -23.3 30.0 9.9 26.0 276 282 A A T << S+ 0 0 81 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.456 82.2 121.7 -93.4 -5.0 28.2 12.6 28.0 277 283 A H S X S- 0 0 21 -3,-1.8 3,-2.1 -4,-0.4 4,-0.2 -0.284 75.2-117.8 -59.0 140.6 26.4 14.2 25.0 278 284 A P G > S+ 0 0 78 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.726 107.1 79.2 -52.7 -26.0 22.6 14.2 25.3 279 285 A F G 3 S+ 0 0 1 -27,-0.3 3,-0.4 1,-0.3 -26,-0.1 0.822 93.0 51.9 -47.5 -33.0 22.4 11.9 22.2 280 286 A F G X S+ 0 0 11 -3,-2.1 3,-1.9 -6,-0.2 -1,-0.3 0.409 76.5 103.0 -90.2 2.8 23.2 9.1 24.5 281 287 A Q T < S+ 0 0 174 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.878 92.4 31.8 -50.2 -46.3 20.6 9.8 27.1 282 288 A D T 3 S+ 0 0 99 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 -0.008 88.7 148.8-100.8 23.4 18.3 6.9 25.9 283 289 A V < + 0 0 41 -3,-1.9 2,-0.2 -184,-0.1 -186,-0.1 -0.364 16.3 167.6 -66.3 142.3 21.1 4.6 24.8 284 290 A T - 0 0 82 -188,-0.4 -2,-0.0 -2,-0.0 -1,-0.0 -0.806 38.9-110.7-137.4-179.5 20.5 0.8 25.1 285 291 A K - 0 0 128 -2,-0.2 -188,-0.1 -185,-0.0 2,-0.1 -0.788 37.3-179.8-121.1 86.0 22.2 -2.4 23.8 286 292 A P - 0 0 39 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.362 29.0-117.3 -75.6 162.3 19.9 -4.1 21.2 287 293 A V - 0 0 105 -2,-0.1 -155,-0.1 -154,-0.0 -156,-0.1 -0.878 25.2-134.3-101.1 136.3 21.0 -7.3 19.6 288 294 A P - 0 0 13 0, 0.0 2,-0.7 0, 0.0 -155,-0.1 -0.370 19.6-114.9 -75.5 164.0 21.6 -7.3 15.8 289 295 A H - 0 0 143 -2,-0.1 2,-0.5 2,-0.0 -158,-0.0 -0.931 40.1-174.3 -97.4 116.0 20.3 -10.0 13.6 290 296 A L - 0 0 25 -2,-0.7 2,-0.7 -159,-0.1 -206,-0.0 -0.968 19.7-162.4-115.3 125.3 23.4 -11.7 12.2 291 297 A R 0 0 222 -2,-0.5 -2,-0.0 1,-0.1 0, 0.0 -0.958 360.0 360.0 -99.3 111.1 23.2 -14.4 9.6 292 298 A L 0 0 146 -2,-0.7 -1,-0.1 -213,-0.0 0, 0.0 0.611 360.0 360.0-106.6 360.0 26.7 -16.1 9.9