==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-NOV-09 3KJT . COMPND 2 MOLECULE: MALTOSE-BINDING PERIPLASMIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; . AUTHOR A.D.GOULD,B.H.SHILTON . 370 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16296.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 11.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 15 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.4 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 0 1 1 0 4 3 0 2 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 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 0 0 PARALLEL BRIDGES PER LADDER . 3 2 0 2 3 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 . 3 0 1 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 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 K 0 0 231 0, 0.0 54,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 120.2 -26.1 11.7 -6.8 2 2 A I - 0 0 10 52,-0.6 2,-0.1 267,-0.3 53,-0.0 -0.380 360.0-102.3 -58.2 125.2 -22.3 11.4 -6.5 3 3 A E > - 0 0 115 -2,-0.1 3,-0.6 1,-0.1 2,-0.2 -0.271 34.1-135.2 -56.9 126.6 -21.0 13.3 -9.6 4 4 A E T 3 S+ 0 0 153 1,-0.2 3,-0.1 -3,-0.1 -1,-0.1 -0.590 80.4 36.8 -84.4 142.2 -19.9 11.0 -12.4 5 5 A G T 3 S+ 0 0 36 1,-0.3 29,-0.5 -2,-0.2 2,-0.3 0.603 106.6 60.3 96.8 11.3 -16.6 11.6 -14.2 6 6 A K S < S- 0 0 56 -3,-0.6 2,-0.4 27,-0.2 -1,-0.3 -0.947 72.6-119.2-156.2 172.5 -14.4 12.8 -11.4 7 7 A L E -a 35 0A 0 27,-2.4 29,-3.0 -2,-0.3 2,-0.5 -0.986 15.1-168.5-128.4 127.2 -13.1 11.6 -8.0 8 8 A V E -a 36 0A 22 -2,-0.4 51,-1.9 27,-0.2 50,-1.9 -0.962 14.1-166.5-111.6 127.7 -13.7 13.2 -4.6 9 9 A I E -ab 37 59A 0 27,-3.1 29,-3.1 -2,-0.5 2,-0.4 -0.957 8.1-160.9-120.6 134.4 -11.5 11.8 -1.8 10 10 A W E +ab 38 60A 24 49,-2.4 51,-2.6 -2,-0.4 2,-0.3 -0.954 20.6 158.9-114.8 131.7 -11.9 12.3 1.9 11 11 A I - 0 0 8 27,-2.0 2,-0.1 -2,-0.4 51,-0.1 -0.983 44.7 -93.0-147.5 152.5 -9.0 11.8 4.3 12 12 A N > - 0 0 40 -2,-0.3 3,-2.0 49,-0.2 5,-0.2 -0.418 33.4-122.7 -68.6 142.2 -8.2 12.9 7.9 13 13 A G T 3 S+ 0 0 33 1,-0.3 4,-0.2 27,-0.2 -1,-0.1 0.615 104.8 75.3 -60.4 -12.9 -6.1 16.1 8.1 14 14 A L T 3 S+ 0 0 132 2,-0.1 -1,-0.3 3,-0.0 2,-0.1 0.714 90.0 69.8 -71.8 -20.9 -3.5 14.2 10.1 15 15 A F S < S- 0 0 53 -3,-2.0 2,-2.4 1,-0.1 3,-0.3 -0.423 105.0 -84.0 -95.5 170.5 -2.3 12.6 6.9 16 16 A G > + 0 0 2 281,-0.4 4,-1.9 1,-0.2 5,-0.2 -0.387 59.7 154.0 -74.3 68.6 -0.4 13.9 3.8 17 17 A Y H > S+ 0 0 70 -2,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.807 71.7 56.2 -67.1 -29.9 -3.5 15.2 1.9 18 18 A N H > S+ 0 0 99 -3,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.877 109.4 47.7 -68.7 -34.1 -1.4 17.8 0.1 19 19 A G H > S+ 0 0 0 274,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.867 109.9 51.4 -72.9 -36.1 0.8 15.0 -1.2 20 20 A L H X S+ 0 0 3 -4,-1.9 4,-1.9 1,-0.2 3,-0.3 0.856 103.2 59.6 -67.4 -33.9 -2.2 12.9 -2.2 21 21 A A H X S+ 0 0 41 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.835 100.8 56.6 -62.1 -31.7 -3.5 15.9 -4.1 22 22 A E H X S+ 0 0 112 -4,-0.9 4,-1.6 2,-0.2 -1,-0.2 0.858 104.5 50.0 -67.9 -36.9 -0.3 15.7 -6.1 23 23 A V H X S+ 0 0 10 -4,-1.1 4,-2.1 -3,-0.3 -1,-0.2 0.872 108.7 55.0 -68.1 -34.7 -1.0 12.1 -7.1 24 24 A G H X S+ 0 0 1 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.877 104.2 52.7 -64.3 -38.1 -4.5 13.4 -8.1 25 25 A K H X S+ 0 0 124 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.873 108.2 50.9 -65.4 -37.0 -2.9 16.0 -10.4 26 26 A K H X S+ 0 0 104 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.913 108.3 52.6 -65.9 -41.6 -0.9 13.2 -12.1 27 27 A F H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 6,-0.5 0.918 109.7 48.5 -59.9 -45.0 -4.1 11.3 -12.6 28 28 A E H X S+ 0 0 84 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.870 108.2 54.1 -65.4 -36.4 -5.7 14.2 -14.2 29 29 A K H < S+ 0 0 146 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.851 116.9 38.3 -66.4 -31.9 -2.7 14.8 -16.5 30 30 A D H < S+ 0 0 87 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.844 134.0 18.8 -86.3 -36.2 -2.9 11.2 -17.7 31 31 A T H < S- 0 0 60 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.632 90.8-122.8-111.2 -20.7 -6.7 10.7 -17.9 32 32 A G S < S+ 0 0 58 -4,-2.0 2,-0.5 -5,-0.5 -4,-0.2 0.532 70.1 131.3 85.7 5.3 -8.3 14.1 -18.0 33 33 A I - 0 0 36 -6,-0.5 -1,-0.3 -9,-0.1 2,-0.2 -0.832 55.9-129.8 -97.9 124.4 -10.3 13.2 -14.9 34 34 A K - 0 0 122 -2,-0.5 -27,-2.4 -29,-0.5 2,-0.5 -0.490 17.8-161.2 -75.6 138.0 -10.3 15.7 -12.0 35 35 A V E -a 7 0A 19 -2,-0.2 2,-0.5 -29,-0.2 -27,-0.2 -0.984 3.6-166.5-121.9 124.9 -9.4 14.5 -8.5 36 36 A T E -a 8 0A 37 -29,-3.0 -27,-3.1 -2,-0.5 2,-0.5 -0.958 4.1-158.5-116.4 126.2 -10.4 16.6 -5.5 37 37 A V E +a 9 0A 30 -2,-0.5 2,-0.3 -29,-0.2 -27,-0.2 -0.899 15.1 176.6-106.5 126.9 -9.0 15.9 -2.0 38 38 A E E -a 10 0A 85 -29,-3.1 -27,-2.0 -2,-0.5 -2,-0.0 -0.926 23.1-160.7-128.2 152.3 -10.8 17.1 1.1 39 39 A H - 0 0 85 -2,-0.3 -26,-0.2 -29,-0.2 -29,-0.1 -0.580 21.9-169.9-131.0 70.2 -10.2 16.7 4.8 40 40 A P > - 0 0 26 0, 0.0 3,-0.7 0, 0.0 -27,-0.2 -0.209 29.2-103.4 -60.4 149.7 -13.6 17.5 6.5 41 41 A D T 3 S+ 0 0 125 1,-0.2 5,-0.1 2,-0.1 4,-0.0 -0.468 104.2 15.3 -74.0 147.0 -13.7 17.9 10.3 42 42 A K T >> S+ 0 0 129 -2,-0.1 4,-2.0 3,-0.1 3,-1.3 0.901 79.1 167.5 54.9 44.6 -15.1 14.9 12.2 43 43 A L H <> + 0 0 1 -3,-0.7 4,-2.6 1,-0.3 -2,-0.1 0.866 65.6 61.9 -55.4 -44.8 -14.7 12.8 9.1 44 44 A E H 34 S+ 0 0 28 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.716 113.0 37.6 -58.4 -21.9 -15.3 9.5 10.9 45 45 A E H <> S+ 0 0 93 -3,-1.3 4,-0.9 2,-0.1 -1,-0.2 0.755 114.7 53.5 -99.0 -31.9 -18.8 10.7 11.9 46 46 A K H X S+ 0 0 87 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.897 100.9 58.0 -71.8 -42.7 -19.7 12.5 8.6 47 47 A F H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.934 104.4 49.8 -56.3 -50.8 -19.0 9.7 6.2 48 48 A P H > S+ 0 0 39 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.860 113.2 49.2 -57.2 -35.0 -21.4 7.2 7.7 49 49 A Q H < S+ 0 0 136 -4,-0.9 4,-0.4 -3,-0.2 -2,-0.2 0.928 117.1 37.3 -70.8 -48.0 -24.1 9.9 7.6 50 50 A V H ><>S+ 0 0 34 -4,-2.4 5,-2.2 1,-0.2 3,-1.2 0.899 116.0 52.3 -73.2 -40.2 -23.7 11.0 4.0 51 51 A A H ><5S+ 0 0 9 -4,-3.0 3,-1.8 -5,-0.3 -1,-0.2 0.826 98.4 66.4 -65.6 -30.2 -23.0 7.6 2.6 52 52 A A T 3<5S+ 0 0 77 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.758 104.0 46.1 -61.7 -24.4 -26.1 6.2 4.3 53 53 A T T < 5S- 0 0 110 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.330 125.5-101.4 -99.6 5.0 -28.1 8.5 1.9 54 54 A G T < 5S+ 0 0 29 -3,-1.8 -52,-0.6 1,-0.3 -3,-0.2 0.686 90.7 104.3 83.6 18.7 -26.1 7.4 -1.2 55 55 A D < + 0 0 77 -5,-2.2 -1,-0.3 -54,-0.1 214,-0.2 -0.477 37.2 76.2-117.0-172.0 -24.0 10.6 -1.1 56 56 A G S S- 0 0 11 -2,-0.2 -48,-0.1 -3,-0.1 2,-0.1 -0.588 79.6 -23.0 107.5-168.1 -20.4 11.5 -0.1 57 57 A P - 0 0 0 0, 0.0 210,-0.2 0, 0.0 -48,-0.2 -0.348 46.7-129.1 -79.0 162.3 -16.9 11.0 -1.5 58 58 A D S S+ 0 0 1 -50,-1.9 209,-2.5 1,-0.2 2,-0.4 0.858 97.5 31.1 -76.8 -36.3 -15.9 8.3 -4.0 59 59 A I E -bC 9 266A 0 -51,-1.9 -49,-2.4 207,-0.2 2,-0.4 -0.982 68.4-166.4-127.5 135.4 -13.0 7.3 -1.8 60 60 A I E -bC 10 265A 0 205,-2.4 205,-3.0 -2,-0.4 2,-0.4 -0.983 6.3-156.9-123.6 127.7 -12.7 7.4 2.0 61 61 A F E + C 0 264A 5 -51,-2.6 2,-0.3 -2,-0.4 203,-0.2 -0.854 36.2 114.0-102.7 140.9 -9.4 7.0 3.9 62 62 A Y E - C 0 263A 43 201,-2.2 201,-3.3 -2,-0.4 2,-0.1 -0.970 65.4 -46.6 175.9 174.9 -9.4 5.8 7.5 63 63 A A E >> - C 0 262A 28 -2,-0.3 3,-0.9 199,-0.2 4,-0.8 -0.361 46.8-130.7 -62.7 137.1 -8.4 3.1 10.0 64 64 A H H >> S+ 0 0 1 197,-2.2 4,-0.7 1,-0.2 3,-0.7 0.820 102.2 67.4 -59.1 -35.1 -9.4 -0.4 8.9 65 65 A D H >> S+ 0 0 62 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.873 101.6 47.7 -54.9 -38.9 -11.0 -1.2 12.2 66 66 A R H X> S+ 0 0 82 -3,-0.9 4,-2.1 1,-0.2 3,-0.5 0.742 97.3 71.3 -74.9 -23.2 -13.8 1.3 11.5 67 67 A F H S+ 0 0 6 -4,-2.1 5,-2.8 1,-0.2 6,-0.4 0.908 115.3 46.7 -61.6 -41.5 -18.8 0.9 7.4 71 71 A A H ><5S+ 0 0 15 -4,-3.4 3,-1.4 3,-0.2 -2,-0.2 0.849 104.9 60.8 -68.4 -34.8 -18.8 -2.5 5.8 72 72 A Q H 3<5S+ 0 0 113 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.883 108.6 43.4 -59.1 -39.8 -21.4 -3.7 8.2 73 73 A S T 3<5S- 0 0 85 -4,-1.7 -1,-0.3 -3,-0.1 -2,-0.2 0.366 116.7-116.9 -87.2 3.5 -23.7 -1.0 6.9 74 74 A G T < 5S+ 0 0 47 -3,-1.4 -3,-0.2 -5,-0.1 -2,-0.1 0.843 71.4 137.8 65.0 34.6 -22.7 -1.8 3.3 75 75 A L < + 0 0 17 -5,-2.8 193,-2.4 -6,-0.1 2,-0.4 0.603 56.3 68.5 -85.1 -11.9 -21.2 1.6 2.8 76 76 A L B S-F 267 0B 13 -6,-0.4 191,-0.2 191,-0.2 2,-0.2 -0.898 79.1-128.0-115.5 139.0 -18.2 0.2 1.0 77 77 A A - 0 0 15 189,-3.0 189,-0.4 -2,-0.4 2,-0.3 -0.501 33.1-107.7 -77.8 145.8 -18.0 -1.5 -2.4 78 78 A E - 0 0 112 -2,-0.2 26,-0.2 190,-0.1 2,-0.2 -0.622 41.8-129.4 -72.0 130.9 -16.3 -4.9 -2.5 79 79 A I - 0 0 14 24,-2.0 24,-0.2 -2,-0.3 26,-0.1 -0.491 12.7-152.2 -84.4 156.7 -13.0 -4.3 -4.3 80 80 A T + 0 0 98 -2,-0.2 2,-0.1 24,-0.0 -1,-0.1 -0.251 24.5 163.5-124.6 48.3 -11.8 -6.3 -7.2 81 81 A P - 0 0 9 0, 0.0 2,-0.0 0, 0.0 -2,-0.0 -0.416 36.1-125.7 -66.7 138.2 -7.9 -6.3 -7.4 82 82 A D > - 0 0 93 -2,-0.1 4,-2.3 1,-0.1 3,-0.4 -0.277 29.1 -99.3 -75.5 171.4 -6.6 -9.1 -9.6 83 83 A K H > S+ 0 0 132 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.844 120.5 60.5 -61.6 -36.1 -4.0 -11.6 -8.3 84 84 A A H 4 S+ 0 0 67 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.900 110.7 42.0 -60.0 -39.5 -1.1 -9.7 -9.8 85 85 A F H >4 S+ 0 0 6 -3,-0.4 3,-1.7 1,-0.2 4,-0.4 0.913 109.6 56.2 -74.2 -41.7 -2.0 -6.7 -7.7 86 86 A Q H >< S+ 0 0 62 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.881 101.0 60.4 -57.0 -35.8 -2.8 -8.6 -4.6 87 87 A D T 3< S+ 0 0 92 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.692 93.0 67.7 -64.6 -18.9 0.8 -10.1 -4.7 88 88 A K T < S+ 0 0 106 -3,-1.7 217,-2.2 -4,-0.4 218,-0.4 0.602 95.3 62.4 -78.3 -13.3 2.2 -6.6 -4.5 89 89 A L B < S-G 304 0C 3 -3,-1.5 215,-0.2 -4,-0.4 214,-0.1 -0.829 97.3 -92.7-114.4 153.0 1.1 -6.1 -0.9 90 90 A Y >> - 0 0 33 213,-1.8 3,-1.2 -2,-0.3 4,-0.9 -0.391 36.5-125.5 -62.1 134.8 2.0 -8.0 2.3 91 91 A P H >> S+ 0 0 89 0, 0.0 4,-1.2 0, 0.0 3,-0.7 0.844 105.9 56.8 -49.6 -44.1 -0.5 -10.8 3.0 92 92 A F H 3> S+ 0 0 31 1,-0.2 4,-1.1 2,-0.2 -2,-0.1 0.800 98.7 61.5 -64.9 -26.1 -1.5 -9.7 6.5 93 93 A T H <> S+ 0 0 1 -3,-1.2 4,-0.6 1,-0.2 -1,-0.2 0.860 100.3 53.5 -69.6 -32.0 -2.5 -6.3 5.3 94 94 A W H X< S+ 0 0 15 -4,-0.9 3,-1.0 -3,-0.7 -1,-0.2 0.858 103.4 57.4 -68.4 -34.2 -5.2 -7.8 3.1 95 95 A D H >< S+ 0 0 50 -4,-1.2 3,-1.1 1,-0.2 -1,-0.2 0.828 99.9 59.7 -64.8 -29.2 -6.6 -9.6 6.1 96 96 A A H 3< S+ 0 0 5 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.718 107.6 44.9 -71.5 -20.4 -7.0 -6.2 7.8 97 97 A V T << S+ 0 0 0 -3,-1.0 7,-2.8 -4,-0.6 8,-0.5 0.015 89.3 103.1-113.1 25.8 -9.4 -5.0 5.1 98 98 A R E < -H 103 0D 45 -3,-1.1 2,-0.4 5,-0.2 5,-0.2 -0.924 46.9-172.4-109.5 133.0 -11.6 -8.1 4.8 99 99 A Y E > S-H 102 0D 31 3,-2.8 3,-1.9 -2,-0.5 76,-0.1 -0.990 75.3 -12.9-127.2 123.1 -15.0 -8.1 6.4 100 100 A N T 3 S- 0 0 85 -2,-0.4 75,-0.2 1,-0.3 -1,-0.1 0.858 132.5 -52.5 55.6 35.3 -17.1 -11.3 6.5 101 101 A G T 3 S+ 0 0 36 73,-1.2 2,-0.4 1,-0.2 -1,-0.3 0.395 117.0 107.9 84.8 -2.6 -14.6 -12.8 4.1 102 102 A K E < S-H 99 0D 109 -3,-1.9 -3,-2.8 72,-0.1 2,-0.4 -0.899 71.0-119.7-114.9 139.9 -14.8 -10.0 1.5 103 103 A L E +H 98 0D 29 -2,-0.4 -24,-2.0 -5,-0.2 -5,-0.2 -0.603 35.6 167.9 -74.4 123.3 -12.2 -7.4 0.6 104 104 A I + 0 0 12 -7,-2.8 162,-0.4 -2,-0.4 2,-0.3 0.236 56.8 19.3-123.0 13.9 -13.6 -3.9 1.2 105 105 A A S S- 0 0 0 -8,-0.5 160,-0.2 160,-0.2 -1,-0.2 -0.973 71.4-107.5-171.5 163.1 -10.7 -1.5 1.1 106 106 A Y E -D 264 0A 3 158,-2.5 158,-2.5 -2,-0.3 2,-0.3 -0.885 35.4-126.8-102.4 129.2 -7.1 -1.1 -0.1 107 107 A P E +D 263 0A 1 0, 0.0 156,-0.2 0, 0.0 3,-0.1 -0.576 36.0 163.8 -75.8 136.0 -4.3 -1.1 2.6 108 108 A I E + 0 0 4 154,-3.1 195,-2.2 1,-0.4 196,-0.4 0.733 57.6 19.5-115.3 -67.4 -2.0 1.9 2.5 109 109 A A E -DE 262 302A 0 153,-0.7 153,-2.0 193,-0.3 -1,-0.4 -0.798 66.1-140.6-110.8 154.3 0.0 2.4 5.7 110 110 A V E -DE 261 301A 1 191,-2.5 191,-0.8 -2,-0.3 2,-0.4 -0.954 14.1-163.6-119.5 131.6 0.8 -0.2 8.4 111 111 A Y E +D 260 0A 47 149,-3.1 149,-2.1 -2,-0.4 2,-0.3 -0.930 20.6 143.5-120.0 136.5 0.9 0.5 12.2 112 112 A A - 0 0 0 -2,-0.4 212,-0.1 147,-0.2 147,-0.1 -0.958 45.4-104.3-162.5 148.5 2.4 -1.4 15.1 113 113 A L - 0 0 0 145,-0.4 2,-0.3 -2,-0.3 134,-0.2 -0.430 37.3-175.3 -74.5 152.7 4.2 -0.6 18.4 114 114 A S E -I 227 0E 0 113,-2.2 113,-1.6 -2,-0.1 2,-0.6 -0.867 33.2 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-205,-2.4 -2,-0.5 2,-0.5 -0.700 20.3-128.0-106.3 159.4 -12.4 2.3 0.6 266 266 A I E -C 59 0A 6 -189,-0.4 -189,-3.0 -162,-0.4 -207,-0.2 -0.915 30.6-111.2-109.0 127.5 -14.7 3.0 -2.3 267 267 A N B > -F 76 0B 2 -209,-2.5 3,-1.9 -2,-0.5 -191,-0.2 -0.331 18.4-139.0 -56.0 126.4 -18.2 4.4 -1.6 268 268 A A T 3 S+ 0 0 38 -193,-2.4 -1,-0.2 1,-0.3 -192,-0.1 0.730 104.0 52.3 -61.0 -20.4 -20.8 1.7 -2.5 269 269 A A T 3 S+ 0 0 44 -194,-0.3 -267,-0.3 -214,-0.2 -1,-0.3 0.389 82.5 118.4 -96.8 2.5 -22.9 4.5 -4.1 270 270 A S X - 0 0 3 -3,-1.9 3,-0.5 -212,-0.2 -266,-0.1 -0.459 51.3-159.3 -73.5 137.0 -20.2 5.8 -6.3 271 271 A P T 3 S+ 0 0 52 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.377 90.0 66.7 -92.5 5.3 -20.7 5.7 -10.1 272 272 A N T 3> + 0 0 5 1,-0.1 4,-2.6 2,-0.1 5,-0.2 -0.074 56.3 128.4-114.6 31.8 -16.9 6.0 -10.4 273 273 A K H <> S+ 0 0 66 -3,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.827 75.9 49.1 -58.0 -35.8 -15.8 2.6 -8.9 274 274 A E H > S+ 0 0 135 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.863 111.9 48.6 -72.7 -37.9 -13.7 1.7 -11.9 275 275 A L H > S+ 0 0 41 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.899 111.3 51.1 -66.6 -40.6 -12.0 5.2 -11.9 276 276 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.896 110.0 48.7 -63.1 -42.5 -11.4 4.8 -8.1 277 277 A K H X S+ 0 0 50 -4,-1.9 4,-2.9 2,-0.2 5,-0.4 0.915 111.3 50.9 -62.6 -44.3 -9.8 1.4 -8.6 278 278 A E H X S+ 0 0 66 -4,-2.1 4,-2.0 1,-0.2 5,-0.3 0.923 112.9 45.9 -59.6 -46.2 -7.6 2.8 -11.4 279 279 A F H X>S+ 0 0 0 -4,-2.6 5,-2.6 3,-0.2 4,-1.2 0.940 117.3 42.2 -64.4 -47.9 -6.5 5.6 -9.2 280 280 A L H <>S+ 0 0 0 -4,-2.7 5,-2.5 3,-0.2 -2,-0.2 0.926 122.4 36.2 -68.5 -45.3 -5.8 3.5 -6.1 281 281 A E H <5S+ 0 0 10 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.908 128.8 28.1 -76.4 -42.6 -4.1 0.6 -7.8 282 282 A N H <5S+ 0 0 79 -4,-2.0 -3,-0.2 -5,-0.4 -2,-0.2 0.466 132.2 25.1-104.2 -1.0 -2.1 2.2 -10.6 283 283 A Y T <5S+ 0 0 34 -4,-1.2 3,-0.5 -5,-0.3 6,-0.3 0.650 127.2 31.0-122.7 -57.3 -1.4 5.7 -9.2 284 284 A L T S- 0 0 33 -2,-1.8 4,-2.5 -3,-0.5 5,-0.3 -0.878 91.9-103.6-137.5 164.7 3.0 2.6 -6.7 287 287 A D H > S+ 0 0 48 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.923 123.5 48.3 -59.2 -42.3 6.4 3.6 -5.6 288 288 A E H > S+ 0 0 130 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.878 112.3 48.2 -65.2 -40.8 5.9 7.1 -7.2 289 289 A G H > S+ 0 0 3 -6,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.941 113.4 44.6 -67.2 -49.3 2.5 7.5 -5.6 290 290 A L H X S+ 0 0 0 -4,-2.5 4,-3.2 -6,-0.3 -2,-0.2 0.875 110.3 56.2 -65.0 -35.5 3.4 6.6 -2.1 291 291 A E H X S+ 0 0 82 -4,-2.0 4,-2.8 -5,-0.3 -1,-0.2 0.899 103.4 55.2 -62.5 -39.7 6.6 8.7 -2.3 292 292 A A H X S+ 0 0 22 -4,-1.6 4,-0.6 2,-0.2 -1,-0.2 0.906 114.5 38.9 -59.6 -43.3 4.4 11.7 -3.2 293 293 A V H >X S+ 0 0 12 -4,-1.5 4,-2.4 2,-0.2 3,-0.8 0.929 115.9 52.6 -72.0 -43.9 2.4 11.3 -0.0 294 294 A N H 3< S+ 0 0 29 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.846 103.2 56.2 -60.4 -39.4 5.4 10.3 2.1 295 295 A K H 3< S+ 0 0 165 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.753 112.8 43.9 -66.5 -23.9 7.4 13.3 1.1 296 296 A D H << S- 0 0 70 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.1 0.952 140.0 -5.7 -81.6 -65.2 4.6 15.5 2.4 297 297 A K S < S- 0 0 97 -4,-2.4 -281,-0.4 -281,-0.1 -1,-0.3 -0.971 86.3-114.4-133.3 115.2 3.8 13.6 5.6 298 298 A P - 0 0 90 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.186 17.2-157.2 -52.3 136.7 5.7 10.4 6.3 299 299 A L - 0 0 12 1,-0.3 2,-0.5 -9,-0.1 -189,-0.1 0.689 23.7-144.1 -86.8 -21.6 3.4 7.3 6.3 300 300 A G + 0 0 8 -191,-0.1 -1,-0.3 -71,-0.1 2,-0.2 -0.819 68.2 5.2 90.5-128.2 5.8 5.1 8.4 301 301 A A E S-E 110 0A 0 -191,-0.8 -191,-2.5 -2,-0.5 2,-0.3 -0.610 77.8-154.1 -88.0 151.8 5.6 1.5 7.2 302 302 A V E -E 109 0A 0 -193,-0.3 -193,-0.3 -2,-0.2 -194,-0.1 -0.877 23.8-128.7-127.2 160.7 3.5 0.7 4.1 303 303 A A S S+ 0 0 0 -195,-2.2 -213,-1.8 -2,-0.3 2,-0.7 0.708 83.2 94.0 -78.5 -21.6 1.6 -2.3 2.6 304 304 A L B > -G 89 0C 3 -196,-0.4 4,-2.5 -215,-0.2 3,-0.4 -0.644 67.0-152.1 -78.1 113.0 3.3 -2.1 -0.8 305 305 A K H > S+ 0 0 66 -217,-2.2 4,-2.3 -2,-0.7 5,-0.2 0.872 89.0 54.0 -52.0 -49.3 6.3 -4.4 -0.7 306 306 A S H > S+ 0 0 58 -218,-0.4 4,-0.6 1,-0.2 -1,-0.2 0.875 115.7 38.6 -57.9 -40.8 8.4 -2.6 -3.3 307 307 A Y H > S+ 0 0 7 -3,-0.4 4,-2.8 2,-0.2 3,-0.4 0.852 112.2 56.4 -80.4 -34.5 8.2 0.7 -1.5 308 308 A E H X S+ 0 0 4 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.883 102.4 57.1 -62.7 -37.1 8.5 -0.7 2.0 309 309 A E H < S+ 0 0 134 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.833 111.1 43.9 -62.4 -31.1 11.8 -2.4 1.0 310 310 A E H >< S+ 0 0 88 -4,-0.6 3,-1.6 -3,-0.4 -2,-0.2 0.928 113.6 48.6 -77.3 -50.2 13.0 1.1 0.1 311 311 A L H >< S+ 0 0 26 -4,-2.8 3,-2.3 1,-0.3 6,-0.3 0.802 94.7 76.7 -60.3 -30.0 11.7 2.8 3.2 312 312 A A T 3< + 0 0 35 -4,-2.4 -1,-0.3 1,-0.3 6,-0.2 0.496 68.6 84.9 -62.9 -4.7 13.2 0.0 5.4 313 313 A K T < S+ 0 0 185 -3,-1.6 -1,-0.3 -5,-0.1 -2,-0.1 0.689 78.6 76.9 -68.2 -17.2 16.6 1.6 5.0 314 314 A D S X> S- 0 0 47 -3,-2.3 4,-2.1 1,-0.1 3,-1.0 -0.863 84.2-148.5 -91.1 111.9 15.3 3.7 7.9 315 315 A P H 3> S+ 0 0 88 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.773 93.7 60.9 -55.8 -26.3 15.7 1.3 10.8 316 316 A R H 3> S+ 0 0 72 2,-0.2 4,-1.6 1,-0.2 -4,-0.1 0.884 108.6 43.0 -68.7 -37.0 12.7 2.7 12.7 317 317 A I H <> S+ 0 0 7 -3,-1.0 4,-2.4 -6,-0.3 5,-0.2 0.890 111.1 55.0 -74.0 -40.2 10.5 1.7 9.7 318 318 A A H X S+ 0 0 36 -4,-2.1 4,-2.1 -7,-0.2 -2,-0.2 0.917 109.7 47.7 -57.9 -44.0 12.2 -1.7 9.4 319 319 A A H X S+ 0 0 6 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.875 107.9 55.5 -65.0 -39.0 11.4 -2.3 13.1 320 320 A T H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.941 110.9 43.8 -59.8 -47.4 7.8 -1.2 12.6 321 321 A M H X S+ 0 0 10 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.872 110.8 55.3 -66.5 -36.9 7.2 -3.8 9.9 322 322 A E H X S+ 0 0 81 -4,-2.1 4,-0.9 -5,-0.2 -2,-0.2 0.930 111.8 43.1 -61.9 -45.4 9.1 -6.5 11.8 323 323 A N H X S+ 0 0 1 -4,-2.5 4,-0.7 1,-0.2 3,-0.3 0.875 111.9 55.1 -68.4 -35.5 6.7 -6.0 14.8 324 324 A A H >< S+ 0 0 3 -4,-2.2 3,-0.7 -5,-0.2 -2,-0.2 0.906 105.1 52.2 -63.9 -40.9 3.7 -5.8 12.5 325 325 A Q H 3< S+ 0 0 110 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.751 113.7 44.3 -67.8 -22.5 4.5 -9.1 10.9 326 326 A K H 3< S+ 0 0 86 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.497 105.0 91.9 -96.5 -6.3 4.7 -10.7 14.3 327 327 A G S << S- 0 0 15 -3,-0.7 2,-0.5 -4,-0.7 -69,-0.2 -0.007 79.0-101.5 -84.3-174.7 1.6 -9.0 15.5 328 328 A E E -o 258 0I 24 -71,-2.1 -69,-2.8 -72,-0.1 2,-0.1 -0.934 35.1-118.4-110.7 124.6 -2.2 -9.6 15.7 329 329 A I E -o 259 0I 38 -2,-0.5 -69,-0.2 -71,-0.2 -71,-0.1 -0.416 35.0-114.4 -60.9 131.0 -4.5 -8.0 13.1 330 330 A M - 0 0 20 -71,-2.3 -1,-0.1 -2,-0.1 -69,-0.1 -0.566 36.4-116.6 -69.6 121.9 -6.9 -5.7 15.0 331 331 A P - 0 0 3 0, 0.0 -1,-0.1 0, 0.0 -263,-0.1 -0.272 17.4-155.0 -60.7 147.0 -10.3 -7.3 14.6 332 332 A N + 0 0 9 -234,-0.2 -2,-0.0 -264,-0.1 -236,-0.0 -0.109 55.1 112.2-113.8 32.2 -12.9 -5.2 12.7 333 333 A I S > S- 0 0 26 1,-0.1 3,-1.8 -265,-0.1 4,-0.2 -0.712 77.9-113.4-104.4 157.4 -16.1 -6.7 14.2 334 334 A P T > S+ 0 0 58 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.808 110.2 70.5 -58.2 -30.1 -18.6 -5.0 16.5 335 335 A Q T 3> S+ 0 0 63 1,-0.3 4,-1.4 2,-0.2 3,-0.4 0.657 78.9 78.9 -63.2 -15.2 -17.6 -7.3 19.4 336 336 A M H <> S+ 0 0 9 -3,-1.8 4,-2.5 1,-0.2 -1,-0.3 0.767 81.5 66.2 -64.8 -23.8 -14.3 -5.5 19.6 337 337 A S H <> S+ 0 0 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0 0 5 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.920 114.4 48.5 -65.6 -43.0 -5.5 -4.6 33.3 348 348 A I H X S+ 0 0 53 -4,-2.2 4,-1.8 -5,-0.3 6,-0.3 0.933 113.9 46.9 -62.0 -45.6 -6.3 -1.5 35.5 349 349 A N H X>S+ 0 0 22 -4,-2.6 6,-1.9 -5,-0.2 5,-0.8 0.837 113.4 47.5 -66.8 -33.9 -7.7 -3.7 38.2 350 350 A A H <5S+ 0 0 4 -4,-2.1 3,-0.3 -5,-0.2 -1,-0.2 0.898 113.2 48.2 -74.0 -38.8 -4.9 -6.2 38.2 351 351 A A H <5S+ 0 0 20 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.807 113.1 48.1 -70.0 -30.5 -2.2 -3.5 38.3 352 352 A S H <5S- 0 0 73 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.594 110.4-119.6 -85.7 -13.7 -4.0 -1.7 41.1 353 353 A G T <5S+ 0 0 64 -4,-0.7 -3,-0.2 -3,-0.3 -4,-0.1 0.443 81.3 121.7 87.8 -0.3 -4.4 -4.8 43.2 354 354 A R S - 0 0 81 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.405 35.4-111.5 -74.7 161.4 -6.1 -10.8 41.1 357 357 A V H > S+ 0 0 19 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.940 117.0 51.2 -58.3 -48.3 -4.8 -11.5 37.6 358 358 A D H > S+ 0 0 78 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.897 115.8 40.1 -57.4 -45.4 -6.8 -14.7 37.3 359 359 A E H > S+ 0 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369 A T < 0 0 58 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.506 360.0 360.0 -82.6 -3.0 -18.2 -13.9 25.2 370 370 A K 0 0 212 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.923 360.0 360.0 -45.2 360.0 -21.5 -12.9 26.8