==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 13-JUN-12 4FKP . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.N.KANG,J.A.STUCKEY . 279 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13981.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 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 . 37 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 27.2 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 3 1 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 . 0 1 1 0 2 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 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 47 0, 0.0 3,-1.7 0, 0.0 61,-0.0 0.000 360.0 360.0 360.0 -22.1 13.2 4.5 -38.9 2 2 A E T 3 + 0 0 165 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.593 360.0 69.5 -69.3 -7.8 12.9 4.5 -42.7 3 3 A N T 3 S+ 0 0 75 20,-0.1 21,-2.8 21,-0.1 22,-0.5 0.309 95.4 71.3 -85.9 4.9 10.5 1.5 -42.4 4 4 A F E < -A 23 0A 24 -3,-1.7 2,-0.5 19,-0.2 19,-0.2 -0.983 61.8-159.5-131.5 137.9 7.9 4.0 -40.9 5 5 A Q E -A 22 0A 97 17,-2.2 17,-2.7 -2,-0.4 2,-0.2 -0.973 26.1-128.5-112.5 121.2 5.8 6.8 -42.3 6 6 A K E +A 21 0A 118 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.487 31.7 171.8 -69.7 138.5 4.5 9.3 -39.7 7 7 A V E + 0 0 63 13,-3.0 2,-0.3 1,-0.4 14,-0.2 0.709 59.6 1.1-115.3 -44.3 0.7 9.7 -40.0 8 8 A E E -A 20 0A 102 12,-1.5 12,-3.7 3,-0.0 2,-0.7 -0.980 61.0-124.8-155.1 136.6 -0.4 11.8 -37.1 9 9 A K E -A 19 0A 133 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.764 22.8-173.6 -82.8 117.2 1.2 13.5 -34.1 10 10 A I E - 0 0 84 8,-2.1 2,-0.3 -2,-0.7 -1,-0.2 0.959 48.6 -97.2 -74.7 -49.3 -0.7 12.1 -31.1 11 11 A G E -A 18 0A 28 7,-1.6 7,-2.8 -3,-0.1 2,-1.0 -0.970 48.1 -39.3 158.8-173.9 1.1 14.5 -28.7 12 12 A E E -A 17 0A 95 -2,-0.3 5,-0.2 5,-0.2 -3,-0.0 -0.704 55.1-170.0 -87.0 96.6 3.8 15.2 -26.2 13 13 A G - 0 0 33 3,-1.5 111,-0.0 -2,-1.0 -1,-0.0 -0.009 40.6 -90.5 -71.0-177.5 4.3 12.1 -24.0 14 14 A T S S+ 0 0 51 1,-0.2 3,-0.1 3,-0.0 -1,-0.1 0.842 123.9 24.8 -65.6 -39.0 6.5 11.9 -20.8 15 15 A Y S S- 0 0 65 1,-0.3 2,-0.3 20,-0.0 -1,-0.2 0.514 132.5 -35.5-108.4 -7.2 9.7 10.8 -22.6 16 16 A G S S- 0 0 20 19,-0.2 -3,-1.5 -5,-0.0 -1,-0.3 -0.962 81.2 -48.7 168.1 179.6 9.1 12.2 -26.1 17 17 A V E -A 12 0A 50 17,-0.4 17,-1.6 -2,-0.3 2,-0.5 -0.556 47.5-144.1 -76.6 135.9 6.5 12.9 -28.9 18 18 A V E -AB 11 33A 30 -7,-2.8 -8,-2.1 -2,-0.2 -7,-1.6 -0.909 19.4-171.3-103.2 128.3 4.2 10.0 -29.7 19 19 A Y E -AB 9 32A 54 13,-2.8 13,-3.3 -2,-0.5 2,-0.4 -0.928 26.9-128.5-117.9 145.5 3.2 9.6 -33.3 20 20 A K E +AB 8 31A 37 -12,-3.7 -13,-3.0 -2,-0.4 -12,-1.5 -0.767 46.9 173.1 -81.6 135.2 0.7 7.4 -35.1 21 21 A A E -AB 6 30A 0 9,-2.7 9,-2.8 -2,-0.4 2,-0.4 -0.954 31.6-126.4-144.6 162.8 2.8 5.7 -37.9 22 22 A R E -AB 5 29A 99 -17,-2.7 -17,-2.2 -2,-0.3 2,-0.6 -0.953 18.9-133.7-114.7 133.0 2.6 3.1 -40.6 23 23 A N E > -A 4 0A 21 5,-3.5 4,-2.4 -2,-0.4 -19,-0.2 -0.761 12.4-156.8 -83.0 119.6 5.1 0.2 -41.0 24 24 A K T 4 S+ 0 0 123 -21,-2.8 -1,-0.1 -2,-0.6 -20,-0.1 0.708 88.6 54.4 -70.4 -23.8 6.1 0.0 -44.7 25 25 A L T 4 S+ 0 0 132 -22,-0.5 -1,-0.2 1,-0.1 -21,-0.1 0.811 127.8 13.4 -79.8 -35.3 7.1 -3.7 -44.5 26 26 A T T 4 S- 0 0 100 -3,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.639 93.6-119.8-113.4 -27.1 3.8 -5.1 -43.0 27 27 A G < + 0 0 47 -4,-2.4 -3,-0.1 1,-0.3 2,-0.0 0.397 60.4 156.2 91.6 2.3 1.3 -2.3 -43.4 28 28 A E - 0 0 84 -5,-0.2 -5,-3.5 -6,-0.1 2,-0.5 -0.313 39.8-138.7 -63.9 138.5 0.9 -2.3 -39.6 29 29 A V E +B 22 0A 54 -7,-0.2 45,-0.6 -3,-0.1 2,-0.3 -0.902 36.2 165.6-100.6 125.2 -0.3 0.9 -37.9 30 30 A V E -BC 21 73A 0 -9,-2.8 -9,-2.7 -2,-0.5 2,-0.5 -0.837 41.3-111.2-134.3 173.3 1.6 1.6 -34.7 31 31 A A E -BC 20 72A 12 41,-2.7 41,-3.2 -2,-0.3 2,-0.5 -0.946 34.3-160.7-107.8 128.4 2.4 4.3 -32.1 32 32 A L E -BC 19 71A 4 -13,-3.3 -13,-2.8 -2,-0.5 2,-0.5 -0.963 6.3-167.1-117.6 127.1 6.0 5.5 -32.3 33 33 A K E -BC 18 70A 1 37,-3.0 37,-2.8 -2,-0.5 2,-0.6 -0.954 9.1-155.2-114.8 124.6 7.7 7.3 -29.4 34 34 A K E C 0 69A 40 -17,-1.6 -17,-0.4 -2,-0.5 35,-0.2 -0.908 360.0 360.0 -97.8 114.4 11.1 9.0 -30.1 35 35 A I 0 0 66 33,-3.3 33,-0.7 -2,-0.6 -19,-0.2 -0.645 360.0 360.0 -80.4 360.0 12.8 9.1 -26.6 36 ! 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 37 45 A P >> 0 0 128 0, 0.0 4,-1.5 0, 0.0 3,-1.0 0.000 360.0 360.0 360.0 145.8 22.4 4.5 -21.7 38 46 A S H 3> + 0 0 82 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.802 360.0 59.7 -54.0 -36.7 23.0 0.7 -21.7 39 47 A T H 3> S+ 0 0 102 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.835 104.9 50.2 -60.5 -37.6 21.0 0.3 -18.4 40 48 A A H <> S+ 0 0 4 -3,-1.0 4,-2.7 2,-0.2 5,-0.2 0.910 107.0 53.5 -69.9 -41.9 17.9 1.8 -20.2 41 49 A I H X S+ 0 0 44 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.906 111.2 45.8 -60.3 -44.4 18.3 -0.6 -23.2 42 50 A R H X S+ 0 0 168 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.916 114.7 46.5 -66.9 -43.2 18.3 -3.7 -21.0 43 51 A E H X S+ 0 0 30 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.910 114.7 47.6 -65.4 -42.7 15.3 -2.5 -18.8 44 52 A I H >X S+ 0 0 0 -4,-2.7 4,-0.7 1,-0.2 3,-0.5 0.897 108.7 54.1 -63.5 -44.2 13.3 -1.6 -21.9 45 53 A S H >< S+ 0 0 40 -4,-2.3 3,-0.7 1,-0.2 4,-0.3 0.832 103.1 57.1 -61.6 -33.7 14.1 -4.9 -23.6 46 54 A L H >< S+ 0 0 95 -4,-1.6 3,-1.3 1,-0.2 4,-0.5 0.836 99.9 60.1 -64.9 -32.7 12.7 -6.8 -20.5 47 55 A L H X< S+ 0 0 11 -4,-1.1 3,-0.7 -3,-0.5 11,-0.3 0.742 89.2 70.1 -69.2 -21.5 9.4 -4.9 -21.0 48 56 A K T << S+ 0 0 75 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.2 0.727 99.7 49.5 -64.2 -24.2 9.1 -6.5 -24.5 49 57 A E T < S+ 0 0 150 -3,-1.3 2,-1.8 -4,-0.3 -1,-0.2 0.610 85.9 93.3 -85.9 -23.3 8.4 -9.8 -22.6 50 58 A L < + 0 0 17 -3,-0.7 2,-0.4 -4,-0.5 8,-0.1 -0.533 59.3 165.4 -79.4 75.3 5.8 -8.3 -20.3 51 59 A N + 0 0 71 -2,-1.8 5,-0.1 6,-0.1 -3,-0.0 -0.824 6.8 144.4-104.4 127.3 2.7 -9.2 -22.4 52 60 A H > - 0 0 43 -2,-0.4 3,-2.1 3,-0.4 54,-0.0 -0.973 56.2-112.9-155.9 148.5 -0.9 -9.1 -21.2 53 61 A P T 3 S+ 0 0 91 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.688 118.6 49.9 -61.7 -17.6 -4.2 -8.1 -23.0 54 62 A N T 3 S+ 0 0 10 80,-0.1 81,-2.7 48,-0.1 2,-0.4 0.160 97.7 80.5-106.4 18.2 -4.5 -5.0 -20.7 55 63 A I B < S-e 135 0B 8 -3,-2.1 -3,-0.4 79,-0.3 2,-0.3 -0.996 88.4-116.5-123.0 125.9 -1.0 -3.8 -21.4 56 64 A V - 0 0 9 79,-2.8 82,-0.2 -2,-0.4 2,-0.2 -0.471 43.2-112.8 -62.7 123.1 -0.2 -1.9 -24.6 57 65 A K - 0 0 87 -2,-0.3 16,-2.9 -4,-0.1 2,-0.8 -0.416 15.0-141.9 -67.8 130.6 2.2 -4.1 -26.4 58 66 A L E -D 72 0A 11 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.839 23.7-179.4 -89.0 108.7 5.8 -2.9 -26.8 59 67 A L E - 0 0 37 12,-2.4 2,-0.3 -2,-0.8 13,-0.2 0.891 55.9 -6.3 -78.8 -45.4 6.5 -4.2 -30.4 60 68 A D E -D 71 0A 89 11,-1.6 11,-2.8 2,-0.0 2,-0.5 -0.993 46.9-143.0-157.3 154.2 10.1 -3.1 -30.9 61 69 A V E -D 70 0A 24 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.993 22.1-166.9-119.0 118.6 13.0 -1.1 -29.5 62 70 A I E -D 69 0A 39 7,-3.2 7,-2.7 -2,-0.5 2,-0.7 -0.939 6.6-175.0-116.1 111.3 15.1 0.8 -32.1 63 71 A H E +D 68 0A 110 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.917 23.8 149.8-106.3 105.8 18.5 2.2 -31.1 64 72 A T E > +D 67 0A 60 3,-2.1 3,-1.9 -2,-0.7 -2,-0.1 -0.996 61.7 1.9-140.6 139.9 20.0 4.2 -34.0 65 73 A E T 3 S- 0 0 166 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.818 128.1 -60.8 53.0 39.1 22.3 7.3 -34.2 66 74 A N T 3 S+ 0 0 95 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.648 117.4 116.1 61.7 21.7 22.5 7.3 -30.3 67 75 A K E < - D 0 64A 104 -3,-1.9 -3,-2.1 2,-0.0 2,-0.5 -0.852 58.4-137.7-117.8 152.0 18.7 7.8 -30.3 68 76 A L E - D 0 63A 15 -33,-0.7 -33,-3.3 -2,-0.3 2,-0.4 -0.949 15.4-175.2-119.5 126.8 15.9 5.5 -29.0 69 77 A Y E -CD 34 62A 39 -7,-2.7 -7,-3.2 -2,-0.5 2,-0.5 -0.973 9.1-158.1-119.2 130.9 12.6 4.8 -30.7 70 78 A L E -CD 33 61A 0 -37,-2.8 -37,-3.0 -2,-0.4 2,-0.5 -0.936 5.1-156.4-110.3 128.8 9.9 2.7 -29.1 71 79 A V E +CD 32 60A 3 -11,-2.8 -12,-2.4 -2,-0.5 -11,-1.6 -0.938 20.8 177.3-107.5 120.5 7.3 1.0 -31.3 72 80 A F E -CD 31 58A 16 -41,-3.2 -41,-2.7 -2,-0.5 -14,-0.2 -0.862 37.8 -89.5-121.5 161.8 4.0 0.2 -29.7 73 81 A E E -C 30 0A 51 -16,-2.9 2,-0.4 -2,-0.3 -43,-0.2 -0.299 50.4-125.9 -55.8 142.9 0.6 -1.3 -30.4 74 82 A F - 0 0 40 -45,-0.6 2,-0.3 -44,-0.1 -45,-0.1 -0.871 26.9-177.9-102.1 137.8 -1.8 1.5 -31.5 75 83 A L - 0 0 13 -2,-0.4 53,-0.1 53,-0.1 52,-0.0 -0.949 27.0-129.9-126.8 149.8 -5.2 2.3 -29.9 76 84 A H S S+ 0 0 106 -2,-0.3 2,-0.3 51,-0.3 52,-0.1 0.545 77.8 21.8 -79.2 -17.6 -7.5 5.0 -31.1 77 85 A Q E -F 127 0B 13 50,-0.9 50,-2.7 204,-0.1 2,-0.2 -0.994 61.8-137.7-149.7 151.3 -8.4 7.0 -28.0 78 86 A D E > -F 126 0B 40 -2,-0.3 4,-2.1 48,-0.2 48,-0.2 -0.650 32.6-110.2-103.9 168.3 -7.2 7.7 -24.5 79 87 A L H > S+ 0 0 0 46,-2.7 4,-3.0 43,-1.2 5,-0.2 0.840 114.8 62.3 -67.8 -25.8 -9.3 7.8 -21.3 80 88 A K H > S+ 0 0 84 42,-0.7 4,-2.4 45,-0.3 -1,-0.2 0.960 108.0 41.9 -63.1 -48.5 -8.7 11.6 -21.0 81 89 A K H > S+ 0 0 118 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.932 115.3 50.6 -65.1 -42.2 -10.6 12.2 -24.3 82 90 A F H X S+ 0 0 6 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.882 111.5 47.9 -62.8 -40.4 -13.3 9.7 -23.4 83 91 A M H < S+ 0 0 22 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.910 113.0 47.8 -66.7 -40.1 -13.9 11.3 -20.0 84 92 A D H >< S+ 0 0 95 -4,-2.4 3,-1.3 1,-0.2 4,-0.2 0.926 112.8 49.2 -64.1 -43.9 -14.0 14.8 -21.7 85 93 A A H 3< S+ 0 0 78 -4,-2.9 3,-0.2 1,-0.3 -1,-0.2 0.739 114.7 45.3 -65.5 -26.4 -16.5 13.4 -24.3 86 94 A S T 3X S+ 0 0 16 -4,-1.4 4,-3.5 -5,-0.2 -1,-0.3 0.197 82.0 108.5-100.4 10.2 -18.6 11.8 -21.5 87 95 A A T <4 S+ 0 0 46 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.834 78.9 44.8 -59.3 -39.7 -18.6 14.9 -19.3 88 96 A L T 4 S+ 0 0 168 -3,-0.2 -1,-0.2 -4,-0.2 -2,-0.1 0.855 129.0 25.2 -73.9 -35.0 -22.3 15.9 -19.8 89 97 A T T 4 S- 0 0 112 -4,-0.2 -2,-0.2 -3,-0.1 -1,-0.1 0.768 102.4-128.3 -98.4 -37.4 -23.7 12.4 -19.4 90 98 A G < - 0 0 13 -4,-3.5 -3,-0.1 -7,-0.2 90,-0.1 0.223 31.4 -79.4 88.7 143.4 -21.1 10.6 -17.3 91 99 A I - 0 0 14 88,-0.6 5,-0.1 1,-0.1 -8,-0.0 -0.632 60.2-104.3 -71.6 128.7 -19.5 7.2 -18.1 92 100 A P >> - 0 0 81 0, 0.0 4,-2.2 0, 0.0 3,-0.8 -0.304 25.0-120.3 -56.9 142.9 -22.1 4.5 -17.1 93 101 A L H 3> S+ 0 0 68 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.875 111.8 56.9 -54.5 -43.2 -21.2 2.7 -13.9 94 102 A P H 3> S+ 0 0 67 0, 0.0 4,-2.1 0, 0.0 179,-0.4 0.879 110.6 45.2 -58.5 -34.4 -21.0 -0.8 -15.6 95 103 A L H <> S+ 0 0 6 -3,-0.8 4,-2.7 2,-0.2 -2,-0.2 0.907 111.8 50.5 -73.8 -42.0 -18.4 0.6 -18.0 96 104 A I H X S+ 0 0 5 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.936 113.0 48.8 -57.3 -43.5 -16.4 2.4 -15.2 97 105 A K H X S+ 0 0 10 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.911 110.8 48.8 -65.3 -43.8 -16.5 -1.0 -13.3 98 106 A S H X S+ 0 0 4 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.911 113.2 47.9 -60.8 -44.5 -15.3 -2.9 -16.4 99 107 A Y H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.938 112.5 47.9 -64.5 -43.7 -12.5 -0.5 -16.9 100 108 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.934 113.0 49.0 -62.9 -43.9 -11.4 -0.6 -13.3 101 109 A F H X S+ 0 0 54 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.939 111.8 48.0 -59.3 -47.7 -11.5 -4.4 -13.3 102 110 A Q H X S+ 0 0 11 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.897 112.4 49.0 -62.7 -41.5 -9.5 -4.7 -16.5 103 111 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.898 109.1 52.4 -67.9 -36.5 -6.8 -2.2 -15.2 104 112 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.864 108.3 52.2 -62.9 -36.0 -6.6 -4.1 -11.9 105 113 A Q H X S+ 0 0 64 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.930 111.0 47.2 -62.6 -47.7 -6.0 -7.3 -14.0 106 114 A G H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.922 114.7 46.0 -58.5 -47.4 -3.2 -5.5 -15.9 107 115 A L H X S+ 0 0 0 -4,-2.9 4,-3.3 2,-0.2 5,-0.3 0.911 108.8 54.5 -64.9 -42.6 -1.6 -4.2 -12.6 108 116 A A H X S+ 0 0 23 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.922 111.7 47.8 -56.7 -40.7 -1.9 -7.7 -10.9 109 117 A F H X S+ 0 0 49 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.966 115.9 40.6 -62.4 -57.3 0.0 -9.1 -13.9 110 118 A C H ><>S+ 0 0 0 -4,-2.5 5,-2.4 1,-0.2 3,-1.2 0.934 115.3 51.2 -59.1 -47.8 2.8 -6.5 -13.9 111 119 A H H ><5S+ 0 0 26 -4,-3.3 3,-1.7 1,-0.3 -1,-0.2 0.839 103.3 59.2 -60.3 -32.7 3.1 -6.4 -10.1 112 120 A S H 3<5S+ 0 0 73 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.732 107.5 48.0 -66.3 -23.4 3.4 -10.3 -10.0 113 121 A H T <<5S- 0 0 87 -3,-1.2 -1,-0.3 -4,-0.9 -2,-0.2 0.206 121.9-112.8 -98.2 13.1 6.5 -9.7 -12.3 114 122 A R T < 5S+ 0 0 178 -3,-1.7 2,-0.5 1,-0.2 -3,-0.2 0.779 73.1 138.3 59.1 33.4 7.7 -6.9 -9.8 115 123 A V < - 0 0 24 -5,-2.4 2,-0.3 -8,-0.1 -1,-0.2 -0.940 35.8-162.1-111.5 129.0 7.2 -4.3 -12.5 116 124 A L - 0 0 16 -2,-0.5 23,-0.7 1,-0.2 26,-0.3 -0.746 19.3-154.2-105.5 153.7 5.6 -0.9 -11.6 117 125 A H - 0 0 4 -2,-0.3 24,-0.6 21,-0.2 -1,-0.2 0.934 21.1-176.1 -84.6 -56.1 4.0 1.7 -13.9 118 126 A R + 0 0 47 47,-0.1 -1,-0.1 23,-0.1 20,-0.1 0.100 69.9 56.5 82.1 -17.4 4.8 4.7 -11.5 119 127 A D + 0 0 32 18,-0.1 2,-0.2 33,-0.1 5,-0.1 -0.176 64.7 163.5-139.4 46.7 3.0 7.2 -13.7 120 128 A L + 0 0 1 31,-0.2 31,-0.1 3,-0.1 17,-0.0 -0.459 15.7 142.0 -65.5 134.8 -0.7 6.0 -14.2 121 129 A K > - 0 0 19 -2,-0.2 3,-2.0 29,-0.0 4,-0.2 -0.950 66.4 -93.0-164.8 160.8 -2.9 8.9 -15.5 122 130 A P G > S+ 0 0 0 0, 0.0 3,-1.5 0, 0.0 -43,-1.2 0.829 119.7 65.2 -53.4 -32.7 -5.8 9.1 -18.0 123 131 A Q G 3 S+ 0 0 86 1,-0.3 -3,-0.1 -44,-0.2 -42,-0.0 0.695 104.5 44.9 -62.7 -25.5 -3.3 10.0 -20.8 124 132 A N G < S+ 0 0 8 -3,-2.0 12,-3.1 -5,-0.1 2,-0.5 0.303 92.9 89.2-107.8 18.4 -1.7 6.6 -20.5 125 133 A L E < - G 0 135B 0 -3,-1.5 -46,-2.7 -4,-0.2 2,-0.4 -0.963 63.9-166.1-109.8 116.6 -4.9 4.5 -20.4 126 134 A L E -FG 78 134B 32 8,-2.7 8,-2.6 -2,-0.5 2,-0.3 -0.872 3.8-161.1-112.6 143.9 -6.0 3.6 -23.9 127 135 A I E -FG 77 133B 0 -50,-2.7 -50,-0.9 -2,-0.4 -51,-0.3 -0.863 3.0-160.6-125.2 156.0 -9.4 2.3 -25.1 128 136 A N > - 0 0 36 4,-1.7 3,-1.2 -2,-0.3 -53,-0.1 -0.732 38.5 -99.9-125.5 178.2 -10.8 0.5 -28.1 129 137 A T T 3 S+ 0 0 78 1,-0.2 150,-0.1 -2,-0.2 -1,-0.0 0.692 113.7 66.4 -71.3 -18.6 -14.2 -0.1 -29.7 130 138 A E T 3 S- 0 0 132 146,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.409 119.7 -99.9 -81.7 -6.9 -14.4 -3.7 -28.1 131 139 A G S < S+ 0 0 0 -3,-1.2 2,-0.2 1,-0.3 -2,-0.1 0.508 77.8 137.6 97.7 5.6 -14.6 -2.4 -24.6 132 140 A A - 0 0 10 142,-0.1 -4,-1.7 -30,-0.0 2,-0.3 -0.532 34.3-164.9 -83.6 155.3 -11.0 -3.0 -23.7 133 141 A I E - G 0 127B 0 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.989 11.0-166.8-135.2 139.4 -8.8 -0.6 -21.7 134 142 A K E - G 0 126B 28 -8,-2.6 -8,-2.7 -2,-0.3 2,-0.4 -0.979 23.3-120.0-137.4 143.8 -5.0 -0.9 -21.6 135 143 A L E -eG 55 125B 0 -81,-2.7 -79,-2.8 -2,-0.3 2,-0.3 -0.702 33.5-159.5 -80.3 122.8 -2.1 0.5 -19.6 136 144 A A + 0 0 13 -12,-3.1 -79,-0.1 -2,-0.4 -12,-0.0 -0.840 65.8 20.1-109.1 148.7 0.4 2.4 -21.8 137 145 A D S > S- 0 0 28 -2,-0.3 3,-1.1 1,-0.2 4,-0.4 0.779 79.8-179.9 68.6 31.4 4.1 3.2 -21.1 138 146 A F T 3 + 0 0 10 -3,-0.3 -1,-0.2 1,-0.2 -21,-0.2 -0.464 64.1 2.5 -66.0 130.0 4.4 0.5 -18.4 139 147 A G T >> S+ 0 0 0 -23,-0.7 4,-1.4 -2,-0.2 3,-0.5 0.285 93.1 115.5 77.1 -6.9 7.8 0.2 -16.8 140 148 A L H <> + 0 0 2 -3,-1.1 4,-2.2 1,-0.2 -2,-0.1 0.769 66.7 65.0 -64.8 -28.4 9.4 3.2 -18.7 141 149 A A H 34 S+ 0 0 29 -24,-0.6 -1,-0.2 -4,-0.4 -23,-0.1 0.872 106.5 40.6 -66.1 -34.5 9.8 5.2 -15.4 142 150 A R H <4 S+ 0 0 150 -3,-0.5 -1,-0.2 -26,-0.3 -2,-0.2 0.844 113.3 58.2 -75.1 -35.6 12.4 2.7 -14.0 143 151 A A H < 0 0 7 -4,-1.4 -2,-0.2 -100,-0.1 -1,-0.2 0.852 360.0 360.0 -62.7 -39.9 13.9 2.5 -17.5 144 152 A F < 0 0 84 -4,-2.2 -3,-0.1 -101,-0.1 -129,-0.0 0.028 360.0 360.0-119.8 360.0 14.7 6.2 -17.7 145 ! 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 0.0 146 163 A V 0 0 200 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.1 4.5 20.0 -17.0 147 164 A V - 0 0 86 1,-0.1 2,-0.2 -133,-0.1 -133,-0.0 -0.451 360.0-115.6 -65.9 132.4 4.3 16.5 -15.5 148 165 A T - 0 0 33 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.528 27.5-174.6 -77.2 137.0 0.9 15.9 -13.8 149 166 A L > + 0 0 19 39,-0.5 3,-2.0 -2,-0.2 -1,-0.1 0.449 58.4 102.0-103.8 -4.9 1.0 15.3 -10.0 150 167 A W T 3 S+ 0 0 89 1,-0.3 36,-0.3 38,-0.2 -1,-0.1 0.688 87.9 36.9 -56.9 -27.6 -2.7 14.6 -9.6 151 168 A Y T 3 S+ 0 0 12 -3,-0.1 2,-0.3 -31,-0.1 -1,-0.3 0.253 85.3 127.7-111.8 10.7 -2.3 10.9 -9.4 152 169 A R < - 0 0 65 -3,-2.0 -33,-0.1 1,-0.1 -3,-0.1 -0.538 61.1-119.0 -76.5 132.3 1.0 10.7 -7.4 153 170 A A >> - 0 0 0 -2,-0.3 4,-1.8 1,-0.1 3,-0.8 -0.302 21.0-119.5 -66.6 149.6 0.9 8.6 -4.2 154 171 A P H 3> S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 6,-0.1 0.849 111.5 60.9 -64.4 -32.8 1.6 10.4 -0.9 155 172 A E H 34>S+ 0 0 2 2,-0.2 5,-2.6 1,-0.2 4,-0.1 0.853 105.3 48.3 -64.1 -32.8 4.7 8.3 -0.1 156 173 A I H X45S+ 0 0 31 -3,-0.8 3,-1.7 3,-0.2 -1,-0.2 0.943 111.7 49.8 -68.8 -44.5 6.3 9.6 -3.4 157 174 A L H 3<5S+ 0 0 3 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.780 108.6 53.9 -61.8 -29.3 5.4 13.2 -2.4 158 175 A L T 3<5S- 0 0 0 -4,-2.0 60,-2.7 -5,-0.2 61,-0.4 0.327 125.8 -98.5 -89.7 5.4 6.9 12.6 1.1 159 176 A G T < 5 + 0 0 15 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.634 61.0 161.9 93.1 17.6 10.2 11.5 -0.3 160 177 A C < - 0 0 41 -5,-2.6 3,-0.3 1,-0.2 -1,-0.3 -0.585 15.7-173.1 -68.4 122.3 10.1 7.7 -0.3 161 178 A K S S+ 0 0 159 -2,-0.4 2,-0.4 1,-0.2 -1,-0.2 0.727 78.0 50.9 -88.7 -26.1 12.9 6.6 -2.7 162 179 A Y S S+ 0 0 203 -6,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.548 79.7 170.2-114.7 60.9 12.0 2.9 -2.6 163 180 A Y - 0 0 73 -2,-0.4 2,-0.1 -3,-0.3 -2,-0.0 -0.218 19.8-134.4 -74.3 160.5 8.3 2.9 -3.3 164 181 A S > - 0 0 47 1,-0.0 3,-2.2 -2,-0.0 4,-0.3 -0.462 35.1 -82.5-108.5-179.2 6.2 -0.2 -4.0 165 182 A T T >> S+ 0 0 52 1,-0.3 3,-1.4 2,-0.2 4,-0.9 0.699 114.6 81.2 -57.2 -22.8 3.5 -1.5 -6.3 166 183 A A H 3> S+ 0 0 7 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.747 75.7 71.4 -58.2 -23.9 1.1 0.3 -4.0 167 184 A V H <> S+ 0 0 1 -3,-2.2 4,-1.9 1,-0.2 -1,-0.3 0.875 97.6 49.4 -62.3 -33.9 1.9 3.6 -5.9 168 185 A D H <> S+ 0 0 0 -3,-1.4 4,-2.5 -4,-0.3 -1,-0.2 0.842 106.9 53.7 -73.6 -32.1 -0.1 2.3 -8.9 169 186 A I H X S+ 0 0 2 -4,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.902 108.0 51.2 -65.2 -43.9 -3.1 1.3 -6.8 170 187 A W H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.961 111.5 47.2 -54.8 -52.2 -3.2 4.9 -5.4 171 188 A S H X S+ 0 0 6 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.918 112.4 49.5 -58.4 -43.1 -3.1 6.3 -9.0 172 189 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.895 108.0 53.7 -66.7 -35.7 -5.8 4.0 -10.2 173 190 A G H X S+ 0 0 0 -4,-2.5 4,-2.6 76,-0.2 -1,-0.2 0.925 108.1 50.4 -62.1 -41.2 -8.0 4.9 -7.2 174 191 A C H X S+ 0 0 1 -4,-2.3 4,-1.9 1,-0.2 11,-0.3 0.889 111.8 48.4 -62.6 -42.3 -7.7 8.6 -8.1 175 192 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.907 109.4 52.3 -64.5 -43.7 -8.7 7.7 -11.7 176 193 A F H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.950 109.8 48.6 -56.5 -48.8 -11.7 5.6 -10.5 177 194 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 6,-0.3 0.891 110.8 51.9 -59.9 -39.0 -12.9 8.6 -8.4 178 195 A E H X S+ 0 0 25 -4,-1.9 4,-2.1 1,-0.2 5,-0.3 0.879 107.3 51.3 -68.6 -37.1 -12.5 10.9 -11.4 179 196 A M H < S+ 0 0 4 -4,-2.5 -88,-0.6 1,-0.2 -1,-0.2 0.895 114.5 45.4 -62.1 -42.1 -14.5 8.6 -13.7 180 197 A V H < S+ 0 0 20 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.917 124.1 29.8 -67.5 -48.3 -17.3 8.5 -11.1 181 198 A T H < S- 0 0 44 -4,-2.6 -2,-0.2 2,-0.3 -3,-0.2 0.628 95.1-129.0 -91.9 -16.0 -17.5 12.2 -10.3 182 199 A R S < S+ 0 0 134 -4,-2.1 2,-0.3 -5,-0.2 -3,-0.1 0.700 81.1 86.8 70.2 23.3 -16.3 13.8 -13.6 183 200 A R S S- 0 0 197 -5,-0.3 -2,-0.3 -6,-0.3 -1,-0.2 -0.986 89.9 -95.4-147.7 145.9 -13.7 15.9 -11.8 184 201 A A - 0 0 17 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.311 28.7-141.1 -60.6 141.7 -10.1 15.2 -10.8 185 202 A L S S+ 0 0 28 -11,-0.3 -1,-0.1 1,-0.2 -34,-0.1 0.953 91.3 11.5 -69.8 -51.6 -9.9 14.0 -7.2 186 203 A F - 0 0 4 -36,-0.3 2,-2.0 2,-0.1 -1,-0.2 -0.692 69.5-180.0-130.3 75.6 -6.7 15.9 -6.2 187 204 A P + 0 0 36 0, 0.0 7,-0.1 0, 0.0 -37,-0.1 -0.334 17.0 174.6 -82.2 65.8 -5.8 18.4 -8.9 188 205 A G - 0 0 3 -2,-2.0 -39,-0.5 1,-0.1 -38,-0.2 -0.308 25.6-163.5 -69.6 148.5 -2.6 19.8 -7.3 189 206 A D S S+ 0 0 136 1,-0.1 2,-0.3 -40,-0.1 -1,-0.1 0.179 76.5 24.4-118.5 13.3 -0.5 22.3 -9.2 190 207 A S S > S- 0 0 48 1,-0.1 4,-2.7 -41,-0.0 5,-0.2 -0.929 89.8-100.3-163.4 162.4 2.6 21.9 -7.0 191 208 A E H > S+ 0 0 97 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.907 123.7 43.8 -61.0 -40.1 4.0 19.2 -4.8 192 209 A I H > S+ 0 0 80 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.893 112.8 51.1 -73.3 -35.5 2.8 21.0 -1.6 193 210 A D H > S+ 0 0 34 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 111.0 50.3 -65.7 -38.3 -0.6 21.8 -3.1 194 211 A Q H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.944 112.9 44.9 -61.9 -50.2 -0.9 18.1 -4.1 195 212 A L H X S+ 0 0 7 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.926 114.3 49.0 -58.9 -48.0 -0.1 16.9 -0.6 196 213 A F H X S+ 0 0 40 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.858 107.8 53.7 -66.9 -29.6 -2.4 19.4 1.0 197 214 A R H X S+ 0 0 90 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.901 110.7 48.0 -68.3 -39.6 -5.3 18.5 -1.3 198 215 A I H >X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 3,-0.6 0.953 113.2 47.7 -62.4 -47.8 -4.8 14.9 -0.2 199 216 A F H 3X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.847 106.5 56.8 -64.1 -35.0 -4.7 15.8 3.5 200 217 A R H 3< S+ 0 0 89 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.801 118.4 32.7 -68.4 -27.2 -7.8 18.1 3.3 201 218 A T H << S+ 0 0 22 -4,-1.2 28,-3.1 -3,-0.6 -2,-0.2 0.890 131.9 29.0 -92.1 -49.6 -9.9 15.2 2.0 202 219 A L H < S- 0 0 5 -4,-3.1 26,-0.3 26,-0.2 -3,-0.2 0.511 114.3-104.6 -93.5 -5.2 -8.3 12.1 3.7 203 220 A G < - 0 0 7 -4,-2.0 24,-0.2 24,-0.4 -1,-0.2 0.153 45.4 -68.0 92.8 148.2 -7.0 13.9 6.9 204 221 A T - 0 0 21 22,-2.3 24,-0.1 -4,-0.1 21,-0.0 -0.558 62.8-118.2 -67.8 126.8 -3.5 14.8 7.7 205 222 A P + 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.358 39.8 173.8 -70.3 148.7 -1.7 11.5 8.2 206 223 A D > - 0 0 72 -2,-0.0 4,-2.5 -3,-0.0 3,-0.3 -0.804 50.2 -81.5-140.1-178.3 -0.1 10.7 11.6 207 224 A E T 4 S+ 0 0 79 -2,-0.2 6,-0.0 1,-0.2 0, 0.0 0.732 122.4 61.8 -64.0 -23.2 1.6 7.8 13.3 208 225 A V T 4 S+ 0 0 123 2,-0.2 -1,-0.2 1,-0.1 0, 0.0 0.954 116.8 26.0 -66.7 -51.9 -1.8 6.2 14.1 209 226 A V T 4 S+ 0 0 68 -3,-0.3 44,-0.5 1,-0.2 -2,-0.2 0.771 137.5 27.0 -85.4 -25.1 -2.9 5.8 10.5 210 227 A W S >< S- 0 0 12 -4,-2.5 3,-2.6 42,-0.1 4,-0.3 -0.698 78.3-150.0-140.5 82.6 0.5 5.5 8.9 211 228 A P T 3 S+ 0 0 74 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.294 87.3 20.4 -55.8 131.0 3.3 4.2 11.2 212 229 A G T > S+ 0 0 37 41,-0.0 3,-1.6 4,-0.0 4,-0.3 0.224 87.0 117.7 92.3 -9.5 6.6 5.8 10.2 213 230 A V G X S+ 0 0 0 -3,-2.6 3,-1.6 1,-0.3 6,-0.1 0.861 70.1 57.9 -57.1 -39.4 5.0 8.7 8.3 214 231 A T G 3 S+ 0 0 57 -4,-0.3 -1,-0.3 1,-0.3 -7,-0.0 0.618 104.2 53.8 -70.0 -11.3 6.6 11.4 10.7 215 232 A S G < S+ 0 0 104 -3,-1.6 -1,-0.3 5,-0.1 -2,-0.2 0.377 80.8 120.3-100.6 0.8 10.1 10.0 9.8 216 233 A M S X S- 0 0 28 -3,-1.6 3,-1.6 -4,-0.3 -57,-0.1 -0.311 76.3-109.9 -68.6 149.6 9.7 10.4 6.1 217 234 A P T 3 S+ 0 0 77 0, 0.0 -58,-0.2 0, 0.0 -1,-0.1 0.832 113.6 30.8 -50.3 -43.7 12.2 12.6 4.3 218 235 A D T 3 S+ 0 0 78 -60,-2.7 2,-0.2 2,-0.1 -59,-0.2 0.253 88.8 122.2-102.4 13.4 9.8 15.5 3.3 219 236 A Y < - 0 0 32 -3,-1.6 -5,-0.0 -61,-0.4 3,-0.0 -0.562 43.1-166.3 -74.9 138.9 7.5 15.1 6.3 220 237 A K > - 0 0 107 -2,-0.2 3,-2.3 1,-0.1 -5,-0.1 -0.993 24.8-145.3-127.9 128.2 7.2 18.4 8.3 221 238 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.744 100.2 68.7 -60.5 -19.5 5.7 18.6 11.8 222 239 A S T 3 + 0 0 105 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.422 69.5 123.9 -79.0 -0.8 4.5 22.0 10.7 223 240 A F S < S- 0 0 13 -3,-2.3 -19,-0.0 1,-0.1 -4,-0.0 -0.415 73.9-104.9 -58.8 138.0 2.0 20.5 8.2 224 241 A P - 0 0 53 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.301 29.4-123.5 -63.2 149.1 -1.5 21.7 9.0 225 242 A K + 0 0 176 -3,-0.1 2,-0.3 -22,-0.1 -25,-0.0 -0.867 34.8 179.9-100.8 102.5 -3.8 19.2 10.7 226 243 A W - 0 0 76 -2,-0.8 -22,-2.3 -27,-0.1 2,-0.2 -0.823 26.2-119.6-103.1 144.6 -7.0 18.7 8.7 227 244 A A - 0 0 87 -2,-0.3 -24,-0.4 -24,-0.2 2,-0.1 -0.531 34.0-103.6 -79.6 148.2 -9.8 16.3 9.7 228 245 A R - 0 0 120 -26,-0.3 2,-0.3 -2,-0.2 -26,-0.2 -0.418 31.0-137.9 -70.4 148.8 -10.8 13.4 7.3 229 246 A Q - 0 0 56 -28,-3.1 2,-0.2 -2,-0.1 -1,-0.0 -0.746 23.8-102.2-103.0 156.7 -14.0 13.7 5.1 230 247 A D >> - 0 0 118 -2,-0.3 3,-1.7 1,-0.1 4,-1.4 -0.504 21.1-130.6 -73.9 144.2 -16.5 10.9 4.5 231 248 A F H 3> S+ 0 0 21 1,-0.3 4,-3.0 2,-0.2 7,-0.1 0.746 107.6 69.0 -63.5 -23.9 -16.3 9.1 1.1 232 249 A S H 34 S+ 0 0 60 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.780 106.3 41.2 -62.0 -28.5 -20.1 9.7 0.7 233 250 A K H <4 S+ 0 0 140 -3,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.796 117.1 49.0 -86.0 -35.7 -19.1 13.4 0.4 234 251 A V H < S+ 0 0 24 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.2 0.884 124.4 20.1 -72.1 -47.7 -16.0 12.7 -1.8 235 252 A V S >< S- 0 0 0 -4,-3.0 3,-2.4 3,-0.1 -1,-0.2 -0.238 87.7-162.5-123.5 46.4 -17.5 10.3 -4.5 236 253 A P T 3 + 0 0 70 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.429 69.4 20.3 -68.3 148.0 -21.3 10.7 -4.6 237 254 A P T 3 S+ 0 0 122 0, 0.0 -5,-0.1 0, 0.0 -4,-0.0 -0.815 89.2 124.5-100.1 30.0 -23.4 8.9 -5.8 238 255 A L < - 0 0 7 -3,-2.4 -3,-0.1 -7,-0.1 -61,-0.0 -0.200 62.0-116.8 -53.5 136.3 -21.0 5.9 -5.8 239 256 A D > - 0 0 59 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.128 28.2 -97.6 -72.4 168.2 -22.5 2.9 -3.9 240 257 A E H > S+ 0 0 119 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.813 122.3 55.2 -61.1 -30.3 -21.0 1.4 -0.7 241 258 A D H > S+ 0 0 75 2,-0.2 4,-2.5 1,-0.2 27,-0.3 0.956 113.0 43.2 -65.1 -46.6 -19.1 -1.4 -2.5 242 259 A G H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.910 115.1 48.7 -63.2 -41.9 -17.4 1.2 -4.7 243 260 A R H X S+ 0 0 64 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.913 111.1 50.2 -64.3 -41.7 -16.7 3.5 -1.7 244 261 A S H X S+ 0 0 36 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.958 113.2 46.2 -63.5 -44.1 -15.3 0.7 0.4 245 262 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 3,-0.3 0.950 112.8 49.5 -62.0 -47.6 -13.0 -0.4 -2.5 246 263 A L H X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.2 3,-0.4 0.914 107.4 54.9 -57.0 -44.8 -11.9 3.2 -3.2 247 264 A S H < S+ 0 0 31 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.866 109.1 48.0 -57.8 -37.2 -11.1 3.7 0.5 248 265 A Q H >< S+ 0 0 67 -4,-1.7 10,-2.1 -3,-0.3 3,-0.7 0.773 109.7 51.6 -75.1 -26.3 -8.8 0.7 0.4 249 266 A M H 3< S+ 0 0 0 -4,-1.7 -76,-0.2 -3,-0.4 -1,-0.2 0.676 112.5 48.6 -79.9 -18.7 -7.1 1.9 -2.7 250 267 A L T 3< S+ 0 0 1 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.146 76.0 138.1-109.2 18.9 -6.5 5.3 -1.0 251 268 A H < - 0 0 60 -3,-0.7 6,-0.2 1,-0.1 -3,-0.1 -0.367 52.6-137.8 -60.5 138.9 -5.1 4.0 2.4 252 269 A Y S S+ 0 0 13 -50,-0.1 -97,-0.2 -43,-0.1 -1,-0.1 0.951 87.1 72.9 -65.4 -49.7 -2.2 6.2 3.4 253 270 A D S >> S- 0 0 23 -44,-0.5 4,-1.7 1,-0.2 3,-1.5 -0.565 76.0-148.0 -68.6 118.0 0.1 3.4 4.6 254 271 A P T 34 S+ 0 0 29 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.794 99.3 57.4 -56.5 -26.9 1.3 1.6 1.4 255 272 A N T 34 S+ 0 0 149 1,-0.2 -2,-0.1 -91,-0.0 -3,-0.0 0.765 109.3 43.4 -74.0 -27.4 1.4 -1.7 3.4 256 273 A K T <4 S+ 0 0 98 -3,-1.5 -1,-0.2 2,-0.1 3,-0.1 0.716 90.7 107.4 -85.4 -28.7 -2.4 -1.3 4.3 257 274 A R S < S- 0 0 12 -4,-1.7 -8,-0.2 -6,-0.2 -9,-0.1 -0.276 82.3-103.4 -56.8 134.8 -3.3 -0.3 0.7 258 275 A I - 0 0 20 -10,-2.1 2,-0.2 -13,-0.2 -1,-0.1 -0.257 32.2-126.2 -61.4 144.0 -5.2 -3.1 -1.2 259 276 A S > - 0 0 63 1,-0.1 4,-2.6 -3,-0.1 5,-0.1 -0.520 21.5-114.1 -82.4 164.3 -3.2 -5.0 -3.7 260 277 A A H > S+ 0 0 2 2,-0.2 4,-1.8 1,-0.2 -152,-0.1 0.926 117.9 53.4 -63.2 -41.8 -4.5 -5.4 -7.3 261 278 A K H > S+ 0 0 165 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.914 112.0 43.2 -60.3 -45.9 -5.0 -9.1 -6.8 262 279 A A H >4 S+ 0 0 49 1,-0.2 3,-1.0 2,-0.2 4,-0.2 0.876 109.2 58.4 -69.8 -33.9 -7.1 -8.6 -3.6 263 280 A A H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 6,-0.2 0.854 96.9 62.2 -61.4 -34.5 -9.0 -5.7 -5.3 264 281 A L H 3< S+ 0 0 40 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.788 103.2 50.6 -61.3 -25.8 -10.1 -8.2 -8.0 265 282 A A T << S+ 0 0 86 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.419 83.2 123.9 -91.2 -2.0 -11.9 -10.2 -5.3 266 283 A H S X S- 0 0 18 -3,-1.7 3,-2.4 -4,-0.2 4,-0.1 -0.321 73.4-120.1 -62.8 141.3 -13.8 -7.2 -3.9 267 284 A P G > S+ 0 0 78 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.737 107.0 77.4 -54.7 -22.0 -17.6 -7.5 -3.8 268 285 A F G 3 S+ 0 0 0 -27,-0.3 3,-0.5 1,-0.3 -26,-0.1 0.828 93.9 51.4 -56.0 -28.9 -17.8 -4.4 -6.1 269 286 A F G X S+ 0 0 11 -3,-2.4 3,-1.7 -6,-0.2 -1,-0.3 0.381 75.7 103.3 -92.8 7.1 -16.9 -6.8 -8.9 270 287 A Q T < S+ 0 0 169 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.848 94.4 32.0 -53.5 -39.0 -19.6 -9.4 -8.2 271 288 A D T 3 S+ 0 0 94 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.056 86.6 150.1-109.9 24.8 -21.7 -8.0 -11.1 272 289 A V < + 0 0 44 -3,-1.7 2,-0.2 -175,-0.1 -177,-0.1 -0.287 15.9 170.4 -61.5 142.2 -18.9 -6.9 -13.5 273 290 A T - 0 0 83 -179,-0.4 -2,-0.0 2,-0.0 -1,-0.0 -0.801 36.9-114.9-137.7 178.5 -19.6 -7.1 -17.2 274 291 A K - 0 0 125 -2,-0.2 -179,-0.1 -176,-0.1 -142,-0.1 -0.757 36.8-177.2-126.6 82.3 -17.9 -5.8 -20.4 275 292 A P - 0 0 36 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.294 27.8-116.4 -73.6 164.6 -20.0 -3.2 -22.0 276 293 A V - 0 0 106 -2,-0.0 -146,-0.1 -145,-0.0 2,-0.1 -0.862 30.3-126.6-104.5 130.2 -19.0 -1.6 -25.3 277 294 A P - 0 0 16 0, 0.0 2,-1.0 0, 0.0 -146,-0.1 -0.440 18.3-112.9 -74.5 160.3 -18.3 2.2 -25.2 278 295 A H - 0 0 94 -2,-0.1 2,-0.5 2,-0.0 -149,-0.0 -0.824 48.7-179.2 -90.2 101.3 -19.9 4.8 -27.4 279 296 A L - 0 0 40 -2,-1.0 2,-0.6 -150,-0.1 -150,-0.0 -0.958 22.5-167.4-112.7 124.2 -16.8 5.9 -29.4 280 297 A R 0 0 90 -2,-0.5 -2,-0.0 0, 0.0 0, 0.0 -0.947 360.0 360.0-106.6 114.2 -16.7 8.5 -32.1 281 298 A L 0 0 136 -2,-0.6 -204,-0.1 -204,-0.0 -2,-0.0 -0.905 360.0 360.0-112.9 360.0 -13.3 8.2 -34.0