==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 10-MAR-03 1OQH . COMPND 2 MOLECULE: SEROTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.M.BAKER,Q.-.Y.HE,S.K.BRIGG,A.B.MASON,E.N BAKER . 329 1 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14073.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 218 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 20 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 2 1 0 2 1 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 0 0 0 1 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 3 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 0 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 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 3 A D 0 0 83 0, 0.0 31,-0.1 0, 0.0 263,-0.1 0.000 360.0 360.0 360.0 16.3 31.9 27.6 61.2 2 4 A K - 0 0 134 29,-0.2 32,-2.0 30,-0.2 2,-0.3 0.081 360.0 -56.4 63.8-174.7 29.4 29.9 59.5 3 5 A T E -a 34 0A 35 30,-0.2 2,-0.7 32,-0.1 32,-0.2 -0.817 28.1-147.3-111.5 143.8 29.9 32.6 56.9 4 6 A V E -a 35 0A 0 30,-1.8 32,-1.5 -2,-0.3 2,-1.0 -0.886 19.7-142.8-106.5 100.4 32.1 35.7 56.6 5 7 A R E -a 36 0A 57 -2,-0.7 51,-3.0 30,-0.2 52,-1.7 -0.507 23.1-154.7 -65.3 103.4 30.3 38.3 54.6 6 8 A W E -ab 37 57A 0 30,-3.2 32,-3.0 -2,-1.0 2,-0.8 -0.665 8.5-132.6 -85.8 135.6 33.2 39.8 52.7 7 9 A a E -a 38 0A 0 50,-2.5 2,-0.4 -2,-0.4 52,-0.3 -0.774 23.0-169.5 -91.9 109.2 32.9 43.4 51.4 8 10 A A E -a 39 0A 0 30,-2.5 32,-3.2 -2,-0.8 2,-0.8 -0.797 16.2-138.1 -97.2 137.7 34.0 43.7 47.8 9 11 A V E -a 40 0A 13 -2,-0.4 4,-0.5 30,-0.2 170,-0.5 -0.822 64.4 -28.6-102.4 102.4 34.5 47.1 46.3 10 12 A S S > S- 0 0 13 30,-2.2 4,-2.1 -2,-0.8 30,-0.1 -0.083 93.9 -55.6 83.6 175.0 33.1 47.4 42.8 11 13 A E H > S+ 0 0 89 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.779 125.6 54.1 -62.5 -37.2 32.7 44.7 40.1 12 14 A H H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.953 114.4 41.7 -65.5 -48.3 36.2 43.3 39.7 13 15 A E H > S+ 0 0 28 -4,-0.5 4,-3.0 1,-0.2 5,-0.2 0.919 111.7 57.9 -62.7 -41.7 36.6 42.5 43.4 14 16 A A H X S+ 0 0 14 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.914 107.1 48.0 -53.7 -44.6 33.0 41.3 43.4 15 17 A T H X S+ 0 0 41 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.950 112.4 46.3 -61.7 -52.1 34.0 38.8 40.7 16 18 A K H X S+ 0 0 3 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.859 112.2 53.2 -59.5 -35.5 37.1 37.5 42.5 17 19 A b H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.898 108.1 49.2 -66.8 -40.6 35.0 37.3 45.7 18 20 A Q H X S+ 0 0 87 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.879 113.8 46.5 -66.0 -37.3 32.4 35.2 43.9 19 21 A S H X S+ 0 0 32 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.906 110.2 53.8 -69.5 -40.0 35.3 33.0 42.6 20 22 A F H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.910 110.3 47.3 -59.1 -44.0 36.7 32.9 46.2 21 23 A R H X S+ 0 0 72 -4,-2.6 4,-1.9 2,-0.2 14,-0.2 0.915 112.9 47.8 -66.3 -44.5 33.4 31.7 47.5 22 24 A D H X S+ 0 0 77 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.976 114.5 44.2 -60.2 -58.5 32.9 29.0 44.9 23 25 A H H X S+ 0 0 49 -4,-2.4 4,-0.8 1,-0.2 5,-0.2 0.840 112.4 52.1 -56.8 -39.9 36.5 27.5 45.2 24 26 A M H >X S+ 0 0 0 -4,-1.9 4,-1.5 -5,-0.3 3,-0.8 0.912 109.9 50.0 -63.7 -40.7 36.4 27.6 49.0 25 27 A K H 3< S+ 0 0 136 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.780 105.6 58.2 -68.0 -27.2 33.1 25.7 48.9 26 28 A S H 3< S+ 0 0 86 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.679 122.8 19.4 -77.3 -19.4 34.6 23.1 46.5 27 29 A V H << S+ 0 0 61 -4,-0.8 -2,-0.2 -3,-0.8 -3,-0.1 0.763 102.9 78.3-114.8 -63.4 37.4 22.2 48.9 28 30 A I S < S- 0 0 10 -4,-1.5 -1,-0.1 -5,-0.2 240,-0.0 -0.272 92.5-101.7 -51.8 133.7 36.7 23.1 52.5 29 31 A P > - 0 0 87 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.155 32.3-100.6 -58.5 150.9 34.3 20.5 54.0 30 32 A S T 3 S+ 0 0 136 1,-0.3 -2,-0.1 -3,-0.1 4,-0.0 0.652 125.2 52.8 -47.2 -17.3 30.6 21.4 54.4 31 33 A D T 3 S+ 0 0 76 -30,-0.1 -1,-0.3 2,-0.1 -29,-0.2 0.764 94.8 87.2 -91.8 -27.8 31.3 22.0 58.1 32 34 A G S < S- 0 0 13 -3,-1.9 -30,-0.2 1,-0.2 2,-0.1 0.124 93.1 -63.2 -63.5-178.4 34.2 24.5 57.5 33 35 A P - 0 0 3 0, 0.0 2,-0.3 0, 0.0 -30,-0.2 -0.402 51.6-164.2 -69.7 140.6 34.1 28.3 57.0 34 36 A S E -a 3 0A 34 -32,-2.0 -30,-1.8 -2,-0.1 2,-0.4 -0.774 10.1-127.8-121.7 168.3 32.3 29.6 54.0 35 37 A V E -a 4 0A 1 -2,-0.3 2,-0.3 -14,-0.2 -30,-0.2 -0.940 14.9-170.7-124.9 143.3 32.3 33.0 52.2 36 38 A A E -a 5 0A 20 -32,-1.5 -30,-3.2 -2,-0.4 2,-0.5 -0.901 19.4-131.9-123.6 153.8 29.6 35.5 51.1 37 39 A b E -a 6 0A 44 -2,-0.3 2,-0.6 -32,-0.2 -30,-0.2 -0.930 17.8-177.5-119.6 120.2 30.0 38.6 49.0 38 40 A V E -a 7 0A 33 -32,-3.0 -30,-2.5 -2,-0.5 2,-0.5 -0.950 21.0-147.7-109.3 116.3 28.6 42.0 49.7 39 41 A K E +a 8 0A 123 -2,-0.6 2,-0.3 -32,-0.2 -30,-0.2 -0.767 21.3 175.1 -92.9 128.3 29.4 44.5 46.9 40 42 A K E -a 9 0A 57 -32,-3.2 -30,-2.2 -2,-0.5 -26,-0.1 -0.853 37.1-125.2-126.6 163.2 29.9 48.1 47.8 41 43 A A S S+ 0 0 69 -2,-0.3 2,-0.3 -32,-0.2 -32,-0.1 0.776 89.0 3.4 -78.5 -30.8 30.9 51.3 45.9 42 44 A S S > S- 0 0 14 -34,-0.1 4,-1.9 136,-0.1 3,-0.3 -0.957 74.0-104.9-150.4 166.0 33.9 52.3 48.1 43 45 A Y H > S+ 0 0 31 134,-0.4 4,-2.1 -2,-0.3 5,-0.1 0.784 119.0 64.8 -64.7 -24.8 35.8 51.1 51.2 44 46 A L H > S+ 0 0 88 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.942 102.8 44.4 -63.2 -47.1 34.0 53.8 53.0 45 47 A D H > S+ 0 0 38 -3,-0.3 4,-2.9 1,-0.2 -2,-0.2 0.916 109.7 57.7 -62.7 -40.7 30.7 52.0 52.4 46 48 A a H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.871 105.8 49.7 -55.5 -39.3 32.4 48.8 53.4 47 49 A I H X S+ 0 0 11 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.883 111.2 48.4 -69.1 -38.0 33.3 50.3 56.7 48 50 A R H X S+ 0 0 130 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.946 111.0 50.7 -66.6 -47.4 29.7 51.5 57.3 49 51 A A H X>S+ 0 0 0 -4,-2.9 5,-2.5 2,-0.2 4,-0.7 0.918 109.8 48.4 -55.4 -51.0 28.2 48.1 56.4 50 52 A I H ><5S+ 0 0 0 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.915 113.2 47.9 -57.2 -46.5 30.5 46.0 58.8 51 53 A A H 3<5S+ 0 0 37 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.750 112.9 50.0 -67.2 -23.9 29.8 48.4 61.6 52 54 A A H 3<5S- 0 0 54 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.484 116.7-115.8 -90.9 -7.5 26.1 48.1 60.8 53 55 A N T <<5S+ 0 0 94 -3,-1.0 -3,-0.2 -4,-0.7 -2,-0.1 0.859 87.9 111.4 73.5 39.1 26.3 44.3 60.7 54 56 A E S > - 0 0 6 -2,-0.3 4,-2.5 186,-0.2 3,-1.1 -0.396 45.4-106.6 -66.5 145.8 45.5 50.1 53.9 62 64 A A H 3> S+ 0 0 0 183,-0.5 4,-2.1 1,-0.3 5,-0.2 0.871 121.4 51.6 -42.5 -51.1 47.0 51.1 57.2 63 65 A G H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.855 112.5 45.2 -58.0 -36.8 45.8 54.7 56.8 64 66 A L H <> S+ 0 0 20 -3,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.798 108.2 57.6 -76.6 -29.6 42.3 53.5 56.2 65 67 A V H X S+ 0 0 0 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.867 105.4 51.8 -66.7 -35.2 42.5 51.1 59.1 66 68 A Y H >X S+ 0 0 27 -4,-2.1 3,-1.2 -5,-0.3 4,-0.9 0.955 110.5 47.4 -64.4 -47.9 43.3 54.1 61.2 67 69 A D H >< S+ 0 0 43 -4,-1.6 3,-0.5 1,-0.3 -2,-0.2 0.852 104.6 60.0 -61.8 -36.5 40.2 55.9 59.9 68 70 A A H 3< S+ 0 0 0 -4,-2.3 7,-2.8 1,-0.2 -1,-0.3 0.659 100.2 58.8 -65.9 -16.8 38.0 52.8 60.4 69 71 A Y H << S+ 0 0 67 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.818 84.1 93.2 -82.9 -32.9 38.8 53.0 64.1 70 72 A L S XX S- 0 0 61 -4,-0.9 4,-1.7 -3,-0.5 3,-1.1 -0.188 86.2 -49.1 -58.6 153.6 37.5 56.5 64.7 71 73 A A T 34 S+ 0 0 78 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.219 112.9 23.8 -64.0 156.7 33.9 56.7 66.0 72 74 A P T 34 S+ 0 0 114 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.873 128.7 39.3 -98.4 21.9 31.1 55.7 65.3 73 75 A N T <4 - 0 0 53 -3,-1.1 -2,-0.2 2,-0.1 -4,-0.1 0.859 69.7-178.6 -95.2 -44.3 32.4 52.6 63.5 74 76 A N < - 0 0 80 -4,-1.7 -5,-0.3 -7,-0.2 179,-0.2 0.880 15.8-178.7 44.9 52.6 35.4 51.7 65.8 75 77 A L - 0 0 1 -7,-2.8 234,-0.3 -5,-0.3 177,-0.2 -0.496 13.9-139.7 -81.4 152.2 36.5 48.7 63.7 76 78 A K E -D 251 0B 55 175,-3.2 175,-2.3 -2,-0.2 2,-0.4 -0.853 14.6-113.6-116.8 148.2 39.5 46.5 64.7 77 79 A P E +D 250 0B 4 0, 0.0 173,-0.3 0, 0.0 3,-0.1 -0.638 40.5 161.8 -78.2 129.3 42.3 44.9 62.8 78 80 A V E + 0 0 13 171,-2.8 225,-2.5 -2,-0.4 2,-0.4 0.706 61.4 27.1-118.2 -34.1 42.0 41.1 63.0 79 81 A V E -DE 249 302B 0 170,-1.3 170,-3.8 223,-0.2 -1,-0.3 -0.980 67.3-160.0-136.5 125.1 44.2 39.6 60.2 80 82 A A E -DE 248 301B 4 221,-2.8 221,-2.2 -2,-0.4 2,-0.3 -0.665 14.6-127.9-102.4 157.4 47.2 41.2 58.7 81 83 A E E - E 0 300B 0 166,-2.1 2,-0.3 -2,-0.2 219,-0.2 -0.667 20.3-157.3 -95.6 155.1 49.0 40.6 55.4 82 84 A F E - E 0 299B 15 217,-1.5 216,-2.9 -2,-0.3 217,-0.9 -0.969 7.8-161.9-131.5 149.5 52.7 39.9 55.2 83 85 A Y E +F 90 0C 4 7,-3.2 7,-1.9 -2,-0.3 2,-1.8 -0.492 56.0 48.7-119.2-171.3 55.0 40.4 52.2 84 86 A G E S-F 89 0C 40 212,-0.5 2,-0.3 5,-0.2 3,-0.1 -0.541 110.3 -36.7 82.5 -80.9 58.4 39.3 51.0 85 87 A S - 0 0 28 -2,-1.8 5,-0.2 3,-0.6 213,-0.1 -0.960 49.5-105.9-165.3 173.9 58.1 35.5 51.6 86 88 A K S S+ 0 0 100 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.778 120.1 53.7 -80.8 -26.8 56.7 32.9 53.9 87 89 A E S S+ 0 0 167 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.804 126.3 20.6 -75.1 -34.1 60.3 32.3 55.2 88 90 A D S S- 0 0 105 -5,-0.1 -3,-0.6 2,-0.0 -1,-0.3 -0.632 85.2-167.5-137.2 74.5 60.9 35.9 56.0 89 91 A P E -F 84 0C 55 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.426 5.0-155.6 -67.0 135.8 57.4 37.6 56.3 90 92 A Q E -F 83 0C 28 -7,-1.9 -7,-3.2 -5,-0.2 -2,-0.0 -0.968 10.8-165.3-115.8 125.4 57.4 41.3 56.4 91 93 A T S S+ 0 0 70 -2,-0.5 155,-1.6 -9,-0.2 2,-0.3 -0.114 74.7 47.0 -99.7 35.9 54.5 43.1 58.1 92 94 A F E -G 245 0D 48 153,-0.3 2,-0.3 154,-0.0 -9,-0.2 -0.920 64.5-161.5-158.2 173.8 55.4 46.4 56.5 93 95 A Y E -G 244 0D 0 151,-1.7 151,-2.7 -2,-0.3 2,-0.5 -0.957 26.0 -95.0-157.7 172.6 56.4 47.9 53.1 94 96 A Y E -G 243 0D 21 -2,-0.3 111,-1.9 149,-0.2 2,-0.4 -0.855 20.7-145.9-106.5 124.7 58.1 50.9 51.6 95 97 A A E +GH 242 204D 0 147,-2.7 146,-2.7 -2,-0.5 147,-1.1 -0.689 30.7 178.5 -81.3 130.9 56.3 54.0 50.2 96 98 A V E - H 0 203D 2 107,-3.0 107,-1.6 -2,-0.4 2,-0.6 -0.901 32.1-129.7-133.1 163.0 58.2 55.3 47.2 97 99 A A E - H 0 202D 0 127,-0.5 127,-2.1 -2,-0.3 2,-0.2 -0.948 28.5-159.6-114.1 106.9 57.8 58.1 44.7 98 100 A V E +IH 223 201D 2 103,-2.7 103,-2.1 -2,-0.6 2,-0.3 -0.629 15.9 170.3 -88.7 147.6 58.3 56.7 41.2 99 101 A V E -IH 222 200D 0 123,-2.4 123,-2.6 -2,-0.2 2,-0.3 -0.952 37.9 -93.4-148.6 165.6 59.2 59.0 38.2 100 102 A K E > -I 221 0D 72 99,-0.6 3,-1.3 -2,-0.3 121,-0.3 -0.672 52.7 -98.1 -86.0 137.4 60.2 58.7 34.6 101 103 A K T 3 S+ 0 0 79 119,-2.7 -1,-0.1 -2,-0.3 119,-0.1 -0.183 105.9 13.6 -53.5 142.4 64.0 58.7 34.0 102 104 A D T 3 S+ 0 0 140 1,-0.1 -1,-0.3 -3,-0.1 119,-0.0 0.750 80.6 135.1 62.6 26.0 65.4 62.1 33.0 103 105 A S < - 0 0 47 -3,-1.3 -2,-0.1 2,-0.1 -1,-0.1 0.816 63.9-129.5 -73.5 -27.9 62.3 64.0 34.0 104 106 A G + 0 0 62 -4,-0.2 2,-0.3 1,-0.2 -3,-0.1 0.948 62.4 90.9 84.2 52.5 64.5 66.6 35.7 105 107 A F - 0 0 6 5,-0.0 -1,-0.2 0, 0.0 2,-0.1 -0.887 49.0-149.3-173.7 142.2 63.4 67.2 39.3 106 108 A Q > - 0 0 50 -2,-0.3 3,-1.6 122,-0.1 118,-0.1 -0.385 46.5 -83.1-102.3-176.1 64.0 66.0 42.8 107 109 A M G > S+ 0 0 17 118,-0.5 3,-1.5 1,-0.3 4,-0.2 0.927 126.3 57.4 -55.5 -52.7 61.7 65.9 45.8 108 110 A N G 3 S+ 0 0 84 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.417 106.5 55.5 -64.6 8.5 62.2 69.5 46.9 109 111 A Q G < + 0 0 100 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 -0.085 68.2 108.4-130.4 33.5 61.0 70.4 43.3 110 112 A L X + 0 0 1 -3,-1.5 3,-2.7 2,-0.1 -2,-0.1 0.737 48.1 108.4 -81.7 -25.1 57.6 68.6 43.2 111 113 A R T 3 S+ 0 0 145 1,-0.3 41,-0.2 -4,-0.2 3,-0.1 -0.288 84.9 22.4 -52.9 133.7 55.7 71.9 43.3 112 114 A G T 3 S+ 0 0 39 39,-2.6 -1,-0.3 1,-0.3 40,-0.2 0.246 102.9 112.3 91.2 -14.0 54.2 72.6 39.9 113 115 A K S < S- 0 0 49 -3,-2.7 40,-3.2 38,-0.2 2,-0.5 -0.249 71.7-106.2 -85.4 175.0 54.3 68.9 38.9 114 116 A K - 0 0 61 38,-0.2 85,-2.7 39,-0.1 86,-1.4 -0.908 33.4-148.6-107.3 132.0 51.4 66.5 38.4 115 117 A S E -jk 155 200D 0 39,-1.5 41,-1.1 -2,-0.5 2,-0.6 -0.844 13.1-162.2-110.4 138.1 50.7 63.8 41.0 116 118 A c E -jk 156 201D 0 84,-2.4 86,-2.2 -2,-0.4 2,-0.3 -0.949 20.3-173.0-113.2 109.8 49.3 60.3 40.7 117 119 A H E - k 0 202D 0 39,-2.4 68,-0.2 -2,-0.6 3,-0.1 -0.752 30.2-138.3-105.2 150.3 48.0 59.0 44.1 118 120 A T S S- 0 0 11 84,-0.7 67,-2.4 1,-0.3 2,-0.3 0.961 79.6 -45.4 -66.9 -49.6 46.8 55.6 45.0 119 121 A G > - 0 0 7 65,-0.2 3,-1.7 3,-0.1 -1,-0.3 -0.934 64.2 -78.4-178.4 154.7 44.0 57.1 47.1 120 122 A L T 3 S+ 0 0 33 38,-3.1 3,-0.1 -2,-0.3 6,-0.1 -0.452 115.2 14.2 -65.7 123.4 43.1 59.8 49.6 121 123 A G T 3 S+ 0 0 7 1,-0.3 2,-0.3 -2,-0.3 -1,-0.3 0.471 94.3 132.7 92.4 1.2 44.0 58.7 53.2 122 124 A A <>> - 0 0 8 -3,-1.7 5,-2.8 -59,-0.2 4,-1.7 -0.639 59.9-125.3 -89.1 146.9 46.3 55.9 52.1 123 125 A S T 4>S+ 0 0 0 -2,-0.3 5,-3.2 3,-0.2 3,-0.2 0.967 101.8 25.5 -51.3 -73.0 49.8 55.4 53.5 124 126 A A T 45S+ 0 0 1 1,-0.2 -1,-0.2 4,-0.2 117,-0.1 0.832 128.4 43.9 -68.0 -34.6 52.1 55.3 50.5 125 127 A G T 45S- 0 0 0 -6,-0.1 -1,-0.2 -8,-0.1 -2,-0.2 0.645 136.5 -7.9 -87.6 -13.9 49.9 57.3 48.1 126 128 A W T X>S+ 0 0 9 -4,-1.7 4,-2.8 -3,-0.2 5,-0.5 0.510 121.5 53.3-143.4 -64.7 48.9 60.0 50.5 127 129 A N H >5S+ 0 0 1 0, 0.0 4,-1.1 0, 0.0 -2,-0.2 0.862 121.0 42.7 -63.6 -36.2 54.0 61.7 50.7 130 132 A I H <5S+ 0 0 0 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.770 109.9 57.9 -80.6 -25.6 51.8 64.6 51.8 131 133 A G H ><X S+ 0 0 5 -4,-1.1 4,-1.4 -5,-0.2 3,-0.5 0.208 81.7 114.6 -99.3 13.4 55.6 67.8 51.8 134 136 A Y G X4 S+ 0 0 22 -3,-1.0 3,-0.5 1,-0.2 -1,-0.2 0.922 80.9 36.5 -49.8 -56.1 53.2 69.3 54.4 135 137 A d G 34 S+ 0 0 63 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.626 107.3 65.0 -75.7 -14.6 55.1 72.6 54.9 136 138 A D G <4 S+ 0 0 69 -3,-0.5 -1,-0.2 -4,-0.1 -2,-0.2 0.808 86.9 97.4 -73.6 -27.7 56.2 72.9 51.2 137 139 A L S << S- 0 0 2 -4,-1.4 11,-0.1 -3,-0.5 4,-0.1 -0.239 85.3-104.3 -61.3 146.3 52.5 73.3 50.5 138 140 A P - 0 0 49 0, 0.0 13,-0.1 0, 0.0 -1,-0.1 -0.310 51.6 -70.8 -71.8 153.8 51.1 76.8 50.1 139 141 A E S S+ 0 0 154 2,-0.1 2,-0.1 -4,-0.1 -4,-0.0 -0.690 111.3 49.2 -94.8 148.4 49.0 78.5 52.8 140 142 A P - 0 0 106 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.529 67.7-178.7 -71.1 148.3 46.4 78.2 54.0 141 143 A R + 0 0 38 -2,-0.1 6,-0.4 -4,-0.1 7,-0.1 0.615 43.9 113.9 -91.0 -12.3 47.2 74.5 54.3 142 144 A K + 0 0 114 1,-0.2 2,-0.1 4,-0.1 -1,-0.1 -0.923 65.9 41.0-110.8 129.4 43.8 73.7 55.7 143 145 A P S >> S- 0 0 71 0, 0.0 4,-1.6 0, 0.0 3,-0.8 0.398 85.5-153.8 -71.4 140.7 41.8 72.1 54.3 144 146 A L H 3> S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.887 88.3 63.3 -49.3 -47.9 44.7 69.8 53.3 145 147 A E H 3> S+ 0 0 55 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.859 105.8 43.7 -47.1 -45.8 43.0 68.6 50.1 146 148 A K H <> S+ 0 0 91 -3,-0.8 4,-1.8 2,-0.2 -1,-0.2 0.868 110.2 54.3 -72.8 -36.5 42.9 72.1 48.6 147 149 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 -6,-0.4 -1,-0.2 0.833 109.9 49.0 -66.3 -31.0 46.5 73.0 49.6 148 150 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.871 108.3 52.5 -74.0 -37.9 47.6 69.8 47.8 149 151 A A H < S+ 0 0 2 -4,-1.6 5,-0.4 -5,-0.3 -2,-0.2 0.848 113.6 46.0 -65.0 -33.2 45.6 70.6 44.7 150 152 A N H < S+ 0 0 86 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.840 107.0 56.1 -77.5 -37.6 47.3 74.0 44.7 151 153 A F H < S+ 0 0 9 -4,-1.9 -39,-2.6 -5,-0.1 -38,-0.2 0.921 111.2 45.2 -61.5 -46.9 50.9 72.7 45.3 152 154 A F S < S- 0 0 3 -4,-1.8 -38,-0.2 -41,-0.2 3,-0.1 -0.335 85.5-124.9 -88.3 175.6 50.8 70.4 42.2 153 155 A S S S- 0 0 40 -40,-3.2 -39,-0.1 1,-0.4 -3,-0.1 -0.227 88.5 -14.2-116.2 42.1 49.5 71.5 38.8 154 156 A G S S- 0 0 0 -5,-0.4 -39,-1.5 -41,-0.2 -1,-0.4 -0.039 72.7-177.2 129.6 126.0 46.9 68.7 38.5 155 157 A S E -j 115 0D 0 12,-3.1 16,-3.0 -41,-0.2 17,-0.6 -0.773 27.0-135.9-138.3-177.6 46.4 65.5 40.4 156 158 A e E +j 116 0D 0 -41,-1.1 -39,-2.4 -2,-0.2 13,-0.2 -0.858 27.4 166.4-144.6 101.5 44.5 62.3 40.8 157 159 A A > - 0 0 0 11,-2.5 3,-1.9 -2,-0.3 -39,-0.1 -0.804 31.0-140.1-121.8 85.9 43.6 61.5 44.3 158 160 A P T 3 S+ 0 0 0 0, 0.0 -38,-3.1 0, 0.0 18,-0.2 -0.122 84.2 24.9 -46.7 137.6 40.9 58.7 44.3 159 161 A f T 3 S+ 0 0 31 16,-2.8 2,-0.2 1,-0.3 18,-0.1 0.247 90.6 126.4 88.4 -9.2 38.1 59.2 46.8 160 162 A A S < S- 0 0 6 -3,-1.9 2,-0.8 8,-0.1 -1,-0.3 -0.502 74.1-101.3 -77.5 149.3 38.6 63.0 47.1 161 163 A D >> - 0 0 70 1,-0.2 4,-2.3 -2,-0.2 3,-0.6 -0.610 30.4-163.6 -74.4 107.9 35.5 65.1 46.5 162 164 A G T 34 S+ 0 0 28 -2,-0.8 -1,-0.2 12,-0.3 7,-0.1 0.678 85.0 61.5 -65.9 -17.0 35.9 66.4 42.9 163 165 A T T 34 S+ 0 0 126 2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.829 114.1 31.4 -79.0 -33.5 33.3 69.1 43.5 164 166 A D T <4 S+ 0 0 99 -3,-0.6 -2,-0.2 1,-0.2 -1,-0.1 0.758 133.5 29.9 -93.4 -28.8 35.3 70.8 46.3 165 167 A F >< + 0 0 30 -4,-2.3 3,-2.2 1,-0.1 4,-0.2 -0.455 66.5 167.5-132.6 64.7 38.8 70.0 45.0 166 168 A P G > S+ 0 0 83 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.800 73.6 61.6 -44.0 -46.5 38.6 69.7 41.1 167 169 A Q G 3 S+ 0 0 62 1,-0.3 -12,-3.1 2,-0.2 3,-0.5 0.677 92.9 66.6 -61.7 -15.4 42.4 69.8 40.6 168 170 A L G < S+ 0 0 0 -3,-2.2 -11,-2.5 1,-0.2 -1,-0.3 0.598 108.0 39.2 -80.1 -9.1 42.6 66.6 42.6 169 171 A g S X S+ 0 0 7 -3,-2.4 3,-0.5 -4,-0.2 6,-0.3 0.223 82.4 107.2-120.0 10.4 40.7 64.8 39.8 170 172 A Q T 3 S+ 0 0 92 -3,-0.5 -14,-0.2 -4,-0.3 -2,-0.1 0.793 86.7 41.2 -60.0 -30.9 42.4 66.5 36.9 171 173 A L T 3 S+ 0 0 17 -16,-3.0 -1,-0.2 1,-0.3 -15,-0.2 0.608 134.1 21.3 -92.3 -15.2 44.3 63.4 36.0 172 174 A e S X S- 0 0 8 -17,-0.6 3,-2.2 -3,-0.5 -1,-0.3 -0.611 91.2-137.4-153.1 80.3 41.3 61.1 36.7 173 175 A P T 3 S+ 0 0 117 0, 0.0 3,-0.4 0, 0.0 -3,-0.1 -0.083 86.6 22.3 -44.1 130.7 38.1 63.1 36.4 174 176 A G T 3 S- 0 0 62 1,-0.2 -12,-0.3 -8,-0.1 -15,-0.1 0.181 97.9-119.8 95.7 -18.0 35.6 62.2 39.2 175 177 A g < - 0 0 4 -3,-2.2 -16,-2.8 -6,-0.3 -1,-0.2 0.872 37.0-153.6 47.8 45.2 38.2 60.8 41.5 176 178 A G - 0 0 27 -3,-0.4 2,-0.6 -4,-0.2 -1,-0.2 -0.206 9.8-144.3 -52.3 131.5 36.5 57.4 41.5 177 179 A f S S+ 0 0 20 -19,-0.2 -134,-0.4 -3,-0.1 2,-0.3 -0.287 73.5 43.2 -96.1 48.6 37.2 55.4 44.7 178 180 A S S > S- 0 0 7 -2,-0.6 3,-2.6 -136,-0.1 6,-0.2 -0.968 105.1 -73.3-172.7 172.8 37.4 52.0 43.1 179 181 A T T 3 S+ 0 0 34 -170,-0.5 5,-0.1 1,-0.3 -169,-0.1 0.621 114.2 80.9 -56.2 -14.1 38.7 50.0 40.2 180 182 A L T 3 S+ 0 0 144 1,-0.1 2,-0.7 2,-0.1 -1,-0.3 0.815 85.5 68.9 -60.3 -28.3 36.1 51.7 37.9 181 183 A N S X S- 0 0 18 -3,-2.6 3,-1.6 1,-0.1 -1,-0.1 -0.852 83.5-153.2 -90.4 114.6 38.7 54.5 38.1 182 184 A Q T 3 S+ 0 0 112 -2,-0.7 9,-0.2 1,-0.3 -1,-0.1 0.658 93.1 53.4 -66.9 -15.4 41.6 53.1 36.1 183 185 A Y T 3 S+ 0 0 25 8,-0.1 2,-0.3 6,-0.1 -1,-0.3 0.113 84.2 116.0-105.6 18.9 44.1 55.2 38.0 184 186 A F < + 0 0 63 -3,-1.6 4,-0.4 -6,-0.2 -65,-0.2 -0.687 67.2 5.1 -88.4 139.1 42.8 54.0 41.4 185 187 A G S > S- 0 0 17 -67,-2.4 4,-2.7 -2,-0.3 5,-0.2 -0.228 106.8 -47.0 85.5-175.0 45.2 52.0 43.6 186 188 A Y H > S+ 0 0 13 2,-0.2 4,-2.2 1,-0.2 3,-0.3 0.988 139.7 35.4 -58.1 -67.6 48.9 51.2 43.3 187 189 A S H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.728 117.6 57.8 -61.5 -21.3 49.0 49.9 39.7 188 190 A G H > S+ 0 0 6 -4,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.908 106.8 45.1 -74.5 -43.4 46.4 52.6 39.0 189 191 A A H X S+ 0 0 0 -4,-2.7 4,-0.9 -3,-0.3 -2,-0.2 0.827 114.0 52.4 -68.1 -31.9 48.6 55.4 40.2 190 192 A F H >X S+ 0 0 2 -4,-2.2 4,-2.7 -5,-0.2 3,-0.6 0.917 106.4 50.6 -70.8 -43.2 51.4 53.8 38.2 191 193 A K H 3X S+ 0 0 75 -4,-2.1 4,-2.6 1,-0.3 6,-0.2 0.815 105.3 58.8 -63.3 -28.5 49.4 53.7 35.0 192 194 A c H 3<>S+ 0 0 1 -4,-1.4 5,-1.9 2,-0.2 6,-1.8 0.833 111.0 41.9 -67.6 -31.0 48.6 57.4 35.6 193 195 A L H X<5S+ 0 0 0 -4,-0.9 3,-0.7 -3,-0.6 -2,-0.2 0.895 115.1 49.4 -80.6 -43.0 52.4 58.0 35.5 194 196 A K H 3<5S+ 0 0 107 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.869 106.3 53.5 -65.7 -42.1 53.0 55.6 32.5 195 197 A D T 3<5S- 0 0 82 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.1 0.586 118.8-115.7 -70.0 -8.1 50.3 57.0 30.3 196 198 A G T < 5S+ 0 0 47 -3,-0.7 -3,-0.2 -5,-0.2 -2,-0.1 0.742 81.6 123.5 81.1 25.9 52.1 60.3 31.0 197 199 A A S -H 95 0D 3 -109,-0.3 3,-1.1 -2,-0.2 4,-0.5 -0.617 45.4-100.4-104.6 167.2 54.9 51.1 47.1 205 207 A H T 3 S+ 0 0 21 -111,-1.9 4,-0.3 1,-0.2 31,-0.1 0.702 118.9 47.9 -59.4 -22.3 58.3 49.5 46.4 206 208 A S T 3> S+ 0 0 18 -112,-0.2 4,-1.2 1,-0.1 -1,-0.2 0.581 85.2 90.7 -97.1 -11.2 56.8 46.5 44.5 207 209 A T H X> S+ 0 0 0 -3,-1.1 3,-0.8 1,-0.2 4,-0.5 0.906 86.9 46.3 -51.7 -53.9 54.3 48.3 42.3 208 210 A I H >> S+ 0 0 5 -4,-0.5 4,-2.6 1,-0.3 3,-1.1 0.876 109.9 55.6 -60.3 -36.5 56.6 48.9 39.2 209 211 A F H 34 S+ 0 0 71 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.2 0.763 104.1 54.3 -67.1 -24.9 57.7 45.2 39.4 210 212 A E H << S+ 0 0 38 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.556 118.0 37.3 -83.0 -10.4 54.0 44.1 39.2 211 213 A N H << S+ 0 0 48 -3,-1.1 2,-0.5 -4,-0.5 -2,-0.2 0.696 116.0 42.8-113.9 -28.1 53.7 46.2 36.0 212 214 A L < - 0 0 14 -4,-2.6 -1,-0.2 -5,-0.1 6,-0.1 -0.874 54.6-177.6-126.8 100.2 56.9 45.9 34.0 213 215 A A + 0 0 91 -2,-0.5 2,-0.5 -3,-0.1 -1,-0.1 0.659 66.9 74.2 -69.7 -16.9 58.4 42.4 33.9 214 216 A N S >> S- 0 0 105 1,-0.1 4,-1.7 2,-0.0 3,-1.0 -0.877 71.0-147.5-105.9 125.4 61.4 43.5 31.9 215 217 A K H 3> S+ 0 0 106 -2,-0.5 4,-1.9 1,-0.3 5,-0.1 0.794 97.6 66.9 -56.2 -30.4 64.3 45.4 33.5 216 218 A A H 34 S+ 0 0 66 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.911 105.2 42.0 -58.7 -42.4 64.9 47.2 30.3 217 219 A D H X4 S+ 0 0 79 -3,-1.0 3,-1.2 1,-0.2 -1,-0.2 0.867 112.3 54.8 -71.6 -37.4 61.5 48.9 30.6 218 220 A R H >< S+ 0 0 31 -4,-1.7 3,-1.5 1,-0.3 15,-0.3 0.746 94.0 68.3 -68.5 -25.6 62.0 49.5 34.3 219 221 A D T 3< S+ 0 0 52 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.595 86.5 68.9 -71.7 -8.2 65.3 51.3 33.8 220 222 A Q T < S+ 0 0 106 -3,-1.2 -119,-2.7 -4,-0.2 2,-0.3 0.256 99.0 66.9 -90.2 12.0 63.3 54.2 32.2 221 223 A Y E < -I 100 0D 22 -3,-1.5 12,-0.5 -121,-0.3 2,-0.3 -0.928 62.2-177.4-131.2 155.2 62.0 54.8 35.7 222 224 A E E -IL 99 232D 35 -123,-2.6 -123,-2.4 -2,-0.3 2,-0.3 -0.932 23.4-116.2-145.9 169.5 63.6 56.0 38.9 223 225 A L E -IL 98 231D 5 8,-3.2 8,-1.9 -2,-0.3 2,-0.6 -0.850 21.3-132.0-110.6 143.8 62.8 56.7 42.6 224 226 A L E - L 0 230D 0 -127,-2.1 -127,-0.5 -2,-0.3 6,-0.2 -0.855 28.3-154.3 -93.8 124.7 62.9 60.1 44.2 225 227 A h > - 0 0 3 4,-2.9 3,-1.0 -2,-0.6 -118,-0.5 -0.485 24.7-112.1 -96.2 169.8 64.9 59.9 47.5 226 228 A L T 3 S+ 0 0 94 14,-0.3 -1,-0.1 1,-0.2 13,-0.1 0.725 112.3 64.3 -72.3 -23.4 64.6 62.1 50.6 227 229 A D T 3 S- 0 0 96 2,-0.1 -1,-0.2 -120,-0.0 3,-0.1 0.229 121.6-104.1 -85.1 16.2 68.1 63.6 50.2 228 230 A N S < S+ 0 0 59 -3,-1.0 2,-0.2 1,-0.3 -2,-0.1 0.871 88.3 107.1 63.9 40.8 66.8 65.1 47.0 229 231 A T - 0 0 51 -4,-0.1 -4,-2.9 -123,-0.0 2,-0.3 -0.734 63.9-117.1-131.3 179.9 68.6 62.7 44.7 230 232 A R E -L 224 0D 41 -2,-0.2 -6,-0.2 -6,-0.2 -124,-0.0 -0.931 24.3-178.0-126.4 150.9 67.4 59.8 42.5 231 233 A K E -L 223 0D 57 -8,-1.9 -8,-3.2 -2,-0.3 8,-0.0 -0.961 37.0 -85.7-142.9 157.5 68.0 56.0 42.6 232 234 A P E > -L 222 0D 52 0, 0.0 3,-2.3 0, 0.0 -10,-0.2 -0.237 41.5-110.8 -61.4 155.0 67.0 53.0 40.5 233 235 A V G > S+ 0 0 3 -12,-0.5 3,-0.7 -15,-0.3 -24,-0.1 0.749 118.9 63.8 -57.5 -24.2 63.7 51.3 41.3 234 236 A D G 3 S+ 0 0 65 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.613 94.2 62.9 -75.5 -13.7 65.8 48.3 42.6 235 237 A E G X + 0 0 87 -3,-2.3 3,-1.0 1,-0.2 -1,-0.2 -0.107 61.0 124.3-105.4 36.9 67.2 50.6 45.3 236 238 A Y G X + 0 0 50 -3,-0.7 3,-2.2 1,-0.2 -1,-0.2 0.842 62.0 69.3 -64.1 -37.0 64.0 51.4 47.3 237 239 A K G 3 S+ 0 0 101 -3,-0.3 -1,-0.2 1,-0.3 3,-0.2 0.775 114.4 30.8 -53.5 -25.7 65.4 50.1 50.6 238 240 A D G < S+ 0 0 116 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.159 125.4 46.9-117.1 13.0 67.7 53.1 50.5 239 241 A h S < S+ 0 0 2 -3,-2.2 2,-0.3 -14,-0.1 -142,-0.3 -0.363 79.2 117.3-154.1 63.9 65.4 55.5 48.6 240 242 A H - 0 0 46 -3,-0.2 -14,-0.3 -144,-0.1 -144,-0.2 -0.889 62.3-130.5-128.3 160.9 61.9 55.4 50.0 241 243 A L S S- 0 0 8 -146,-2.7 2,-0.3 1,-0.3 -145,-0.2 0.858 82.1 -37.6 -78.6 -36.0 59.8 58.1 51.7 242 244 A A E -G 95 0D 26 -147,-1.1 -147,-2.7 -3,-0.1 2,-0.4 -0.979 52.8-103.4-176.9 168.4 59.0 55.8 54.6 243 245 A Q E -G 94 0D 103 -2,-0.3 -149,-0.2 -149,-0.2 -3,-0.0 -0.879 42.7-174.1-105.4 135.7 58.2 52.3 55.9 244 246 A V E -G 93 0D 3 -151,-2.7 -151,-1.7 -2,-0.4 -2,-0.0 -0.917 28.1 -87.1-135.8 161.5 54.6 51.6 56.8 245 247 A P E -G 92 0D 16 0, 0.0 -183,-0.5 0, 0.0 -153,-0.3 -0.249 52.0-101.6 -61.9 147.5 52.3 49.0 58.4 246 248 A S - 0 0 0 -155,-1.6 -186,-0.1 -165,-0.2 -155,-0.1 -0.312 42.2 -89.8 -72.8 153.2 50.8 46.2 56.2 247 249 A H - 0 0 25 -186,-0.1 -166,-2.1 -167,-0.1 2,-0.4 -0.317 53.2-161.0 -56.7 144.4 47.3 46.3 54.9 248 250 A T E -CD 60 80B 0 -188,-2.9 -188,-3.1 -168,-0.2 2,-0.3 -0.980 22.3-118.5-140.2 147.5 45.0 44.5 57.3 249 251 A V E -CD 59 79B 0 -170,-3.8 -171,-2.8 -2,-0.4 -170,-1.3 -0.624 36.7-159.5 -76.0 133.1 41.6 42.9 57.4 250 252 A V E +CD 58 77B 1 -192,-3.0 -192,-0.9 -2,-0.3 2,-0.3 -0.796 13.3 174.7-115.5 162.1 39.3 44.7 59.9 251 253 A A E - D 0 76B 0 -175,-2.3 -175,-3.2 -2,-0.3 -194,-0.1 -0.953 37.1 -74.1-155.3 170.0 36.1 43.7 61.7 252 254 A R - 0 0 24 -196,-0.4 4,-0.1 -2,-0.3 6,-0.1 -0.236 31.4-136.2 -65.0 160.1 33.5 44.7 64.3 253 255 A S S S+ 0 0 63 -179,-0.2 2,-0.5 1,-0.2 3,-0.4 0.794 92.1 49.6 -88.1 -32.5 34.5 44.6 68.0 254 256 A M S S- 0 0 168 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.936 133.0 -5.6-110.5 127.4 31.2 43.0 69.1 255 257 A G S S+ 0 0 60 -2,-0.5 -1,-0.2 1,-0.1 -3,-0.2 0.949 88.6 151.7 55.6 47.0 30.0 39.9 67.3 256 258 A G - 0 0 1 -3,-0.4 -4,-0.3 -4,-0.1 -1,-0.1 0.543 47.8-139.6 -88.1 -8.2 32.9 40.5 65.0 257 259 A K > + 0 0 60 1,-0.1 4,-2.4 -6,-0.1 5,-0.1 0.835 47.3 151.5 53.0 36.0 33.5 36.9 63.9 258 260 A E H > + 0 0 77 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.913 67.8 54.1 -64.3 -41.1 37.3 37.5 64.1 259 261 A D H > S+ 0 0 93 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 113.7 43.2 -58.4 -40.6 38.0 33.8 65.0 260 262 A L H > S+ 0 0 22 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.877 110.0 55.4 -73.5 -37.1 36.0 32.8 61.9 261 263 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.966 113.3 42.4 -59.7 -50.8 37.6 35.5 59.7 262 264 A W H X S+ 0 0 56 -4,-2.8 4,-3.1 1,-0.2 5,-0.3 0.907 112.3 52.6 -60.6 -45.4 41.0 34.2 60.6 263 265 A E H X S+ 0 0 45 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.893 111.9 48.3 -58.7 -38.3 40.0 30.5 60.3 264 266 A L H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.906 115.6 42.7 -66.7 -45.0 38.7 31.3 56.8 265 267 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.815 112.9 52.2 -73.1 -32.9 41.8 33.2 55.8 266 268 A N H X S+ 0 0 51 -4,-3.1 4,-0.5 2,-0.2 -2,-0.2 0.905 115.0 41.0 -71.7 -40.6 44.2 30.7 57.3 267 269 A Q H >X S+ 0 0 49 -4,-1.9 4,-2.0 -5,-0.3 3,-0.5 0.866 115.0 54.6 -72.8 -33.0 42.6 27.8 55.5 268 270 A A H 3X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.814 103.7 53.1 -69.8 -32.2 42.3 30.0 52.4 269 271 A Q H 3< S+ 0 0 32 -4,-1.9 4,-0.4 3,-0.2 -1,-0.2 0.653 110.0 49.7 -78.5 -12.9 46.0 30.8 52.3 270 272 A E H << S+ 0 0 118 -3,-0.5 -2,-0.2 -4,-0.5 -1,-0.2 0.870 119.7 34.4 -88.6 -41.6 46.8 27.1 52.4 271 273 A H H < S+ 0 0 71 -4,-2.0 -2,-0.2 1,-0.1 9,-0.2 0.934 139.4 15.0 -75.7 -48.8 44.5 26.1 49.6 272 274 A F S < S+ 0 0 5 -4,-2.4 10,-2.4 -5,-0.2 11,-0.4 0.105 96.1 116.5-119.3 23.6 44.8 29.2 47.4 273 275 A G S >> S- 0 0 3 -4,-0.4 3,-1.9 1,-0.2 4,-0.6 0.141 80.2 -28.0 -74.8-163.2 47.9 31.0 48.7 274 276 A K T 34 S- 0 0 44 24,-0.5 -1,-0.2 1,-0.3 24,-0.0 -0.292 130.6 -19.2 -56.3 114.9 51.1 31.7 46.8 275 277 A D T 34 S+ 0 0 160 -2,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.608 106.5 116.3 64.2 13.9 51.6 29.0 44.2 276 278 A K T <4 + 0 0 115 -3,-1.9 2,-0.4 1,-0.1 -2,-0.1 0.811 68.1 37.1 -84.7 -29.0 49.2 26.7 46.0 277 279 A S < - 0 0 19 -4,-0.6 -2,-0.1 3,-0.2 -1,-0.1 -0.964 42.4-166.3-135.6 148.0 46.4 26.3 43.4 278 280 A K S S+ 0 0 184 -2,-0.4 3,-0.1 1,-0.1 -1,-0.1 0.444 99.2 48.2 -97.0 -7.9 45.8 26.1 39.7 279 281 A E S S+ 0 0 133 1,-0.3 2,-0.3 -256,-0.0 -1,-0.1 0.794 121.7 11.7 -99.8 -38.9 42.1 26.7 40.1 280 282 A F - 0 0 13 -9,-0.2 2,-0.4 -257,-0.1 -1,-0.3 -0.997 55.1-164.0-146.2 148.5 42.2 29.8 42.3 281 283 A Q - 0 0 59 -2,-0.3 3,-0.3 3,-0.2 -8,-0.2 -0.995 9.9-163.5-133.0 137.3 44.5 32.4 43.7 282 284 A L S S+ 0 0 1 -10,-2.4 11,-0.3 -2,-0.4 -9,-0.1 0.850 91.1 42.6 -83.0 -38.9 44.1 34.8 46.6 283 285 A F S S+ 0 0 5 -11,-0.4 2,-0.3 12,-0.1 -1,-0.2 -0.008 117.1 33.9-105.6 31.4 47.0 37.2 45.8 284 286 A S - 0 0 49 -3,-0.3 -3,-0.2 7,-0.1 5,-0.1 -0.928 65.7-168.4-165.6 166.5 46.7 37.6 42.1 285 287 A S > - 0 0 25 -2,-0.3 3,-0.8 1,-0.1 -3,-0.0 -0.958 33.8-136.1-168.3 146.6 43.7 37.7 39.7 286 288 A P T 3 S+ 0 0 111 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.613 108.2 57.2 -79.8 -8.9 42.7 37.6 36.0 287 289 A H T 3 S- 0 0 77 1,-0.3 2,-0.2 -275,-0.1 -272,-0.1 0.391 122.7 -59.0 -99.7 1.1 40.2 40.4 36.7 288 290 A G < - 0 0 27 -3,-0.8 3,-0.4 -276,-0.1 -1,-0.3 -0.799 60.5 -63.8 144.0 173.6 42.8 42.9 38.1 289 291 A K S S+ 0 0 84 -2,-0.2 5,-0.1 1,-0.2 -5,-0.1 -0.721 102.3 7.1 -99.2 145.9 45.4 43.7 40.7 290 292 A D S S+ 0 0 30 -2,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.822 75.3 164.6 58.4 37.3 45.0 44.0 44.4 291 293 A L S S- 0 0 2 -3,-0.4 2,-2.2 1,-0.1 -1,-0.2 -0.779 75.4 -20.6 -86.8 124.9 41.4 42.9 44.5 292 294 A L S S+ 0 0 9 -2,-0.5 2,-0.3 -233,-0.1 -233,-0.3 -0.206 146.4 26.6 73.7 -46.9 40.3 42.0 48.1 293 295 A F S S- 0 0 3 -2,-2.2 2,-0.1 -11,-0.3 -3,-0.1 -0.964 97.9 -97.1-139.5 152.3 44.0 41.6 49.0 294 296 A K > - 0 0 5 -2,-0.3 3,-1.3 -4,-0.2 -5,-0.0 -0.478 27.0-129.3 -72.9 146.1 47.1 43.1 47.5 295 297 A D T 3 S+ 0 0 23 1,-0.3 -1,-0.1 -2,-0.1 -12,-0.1 0.834 105.2 62.8 -61.1 -38.1 49.0 41.0 44.9 296 298 A S T 3 S+ 0 0 18 2,-0.0 -212,-0.5 -213,-0.0 -1,-0.3 0.470 81.2 109.7 -70.7 -0.5 52.3 41.5 46.7 297 299 A A < - 0 0 0 -3,-1.3 -214,-0.2 -214,-0.1 3,-0.1 -0.479 46.7-172.7 -76.5 147.8 51.0 39.7 49.8 298 300 A H - 0 0 48 -216,-2.9 -24,-0.5 1,-0.3 2,-0.3 0.462 60.7 -43.0-117.5 -7.8 52.3 36.3 50.5 299 301 A G E -E 82 0B 0 -217,-0.9 -217,-1.5 -26,-0.1 2,-0.3 -0.987 60.6 -82.1 170.8-166.2 50.0 35.3 53.4 300 302 A F E -E 81 0B 3 -2,-0.3 2,-0.4 -219,-0.2 -219,-0.2 -0.915 19.7-162.7-131.0 156.5 48.2 36.3 56.6 301 303 A L E -E 80 0B 79 -221,-2.2 -221,-2.8 -2,-0.3 2,-0.3 -0.999 29.9-113.5-138.0 136.1 49.0 36.6 60.3 302 304 A K E -E 79 0B 96 -2,-0.4 -223,-0.2 -223,-0.2 -224,-0.1 -0.545 29.2-125.0 -74.5 128.8 46.5 36.8 63.1 303 305 A V - 0 0 5 -225,-2.5 3,-0.1 -2,-0.3 -1,-0.1 -0.475 39.5 -94.9 -69.5 138.3 46.5 40.1 64.9 304 306 A P > - 0 0 71 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.116 61.2 -68.1 -52.5 154.0 46.9 39.6 68.7 305 307 A P T 3 S- 0 0 113 0, 0.0 -227,-0.0 0, 0.0 -3,-0.0 -0.082 109.7 -10.8 -49.1 136.6 43.8 39.4 70.9 306 308 A R T 3 S+ 0 0 211 1,-0.2 2,-0.1 -3,-0.1 -228,-0.1 0.504 86.1 162.7 51.2 12.0 41.6 42.5 71.2 307 309 A M < - 0 0 57 -3,-1.6 -1,-0.2 -230,-0.1 2,-0.1 -0.361 25.4-147.9 -64.1 132.6 44.3 44.8 69.6 308 310 A D > - 0 0 47 -232,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.398 29.0 -95.4 -92.5 174.9 42.9 48.1 68.5 309 311 A A H > S+ 0 0 0 -234,-0.3 4,-3.0 2,-0.2 5,-0.3 0.887 119.5 51.9 -58.4 -46.7 44.1 50.2 65.5 310 312 A K H > S+ 0 0 72 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.951 114.5 43.3 -55.6 -53.1 46.5 52.5 67.4 311 313 A M H 4 S+ 0 0 104 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.894 118.2 43.9 -59.9 -47.3 48.3 49.6 69.0 312 314 A Y H < S+ 0 0 46 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.981 114.5 47.8 -63.3 -58.8 48.4 47.5 65.9 313 315 A L H < S- 0 0 10 -4,-3.0 4,-0.3 -5,-0.2 -2,-0.2 0.852 110.7-133.0 -51.4 -39.8 49.5 50.4 63.6 314 316 A G X - 0 0 24 -4,-2.4 4,-2.0 -5,-0.3 3,-0.3 0.204 16.6 -85.1 94.4 145.1 52.2 51.4 66.1 315 317 A Y H > S+ 0 0 168 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.849 118.8 58.5 -51.1 -47.8 53.2 54.8 67.6 316 318 A E H > S+ 0 0 177 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.938 114.9 35.4 -51.3 -53.9 55.5 55.9 64.8 317 319 A Y H > S+ 0 0 11 -4,-0.3 4,-1.8 -3,-0.3 -1,-0.2 0.782 115.5 55.5 -73.2 -29.5 52.9 55.7 62.0 318 320 A V H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.922 110.3 46.9 -67.7 -41.4 50.0 56.9 64.3 319 321 A T H X S+ 0 0 30 -4,-3.0 4,-3.5 2,-0.2 5,-0.3 0.928 106.7 57.5 -62.8 -46.6 52.1 60.0 65.1 320 322 A A H X S+ 0 0 41 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.882 112.2 41.9 -51.7 -43.0 52.8 60.5 61.4 321 323 A I H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.921 113.8 50.3 -72.0 -45.8 49.0 60.6 60.8 322 324 A R H X S+ 0 0 92 -4,-2.7 4,-0.7 1,-0.2 5,-0.2 0.897 112.6 49.2 -58.7 -40.9 48.3 62.8 63.9 323 325 A N H < S+ 0 0 99 -4,-3.5 3,-0.3 2,-0.2 -1,-0.2 0.892 111.2 47.6 -65.9 -42.1 51.1 65.2 62.8 324 326 A L H < S+ 0 0 9 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.913 113.4 48.3 -65.5 -42.4 49.8 65.4 59.2 325 327 A R H < S+ 0 0 105 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.596 135.8 8.6 -74.5 -12.3 46.2 66.0 60.4 326 328 A E S < S+ 0 0 126 -4,-0.7 -3,-0.2 -3,-0.3 -2,-0.1 0.285 88.7 119.7-125.9-101.4 47.5 68.7 62.9 327 329 A G - 0 0 22 -5,-0.2 2,-0.2 2,-0.0 -3,-0.0 0.629 42.2-141.0 43.0 155.4 51.1 69.9 62.7 328 330 A T 0 0 123 1,-0.1 -193,-0.1 0, 0.0 -2,-0.1 -0.757 360.0 360.0-135.3-178.9 52.5 73.3 62.1 329 331 A d 0 0 96 -2,-0.2 -1,-0.1 -195,-0.1 -2,-0.0 0.439 360.0 360.0-140.4 360.0 55.3 75.1 60.2