==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 07-NOV-05 2EWV . COMPND 2 MOLECULE: TWITCHING MOTILITY PROTEIN PILT; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR K.A.SATYSHUR,K.T.FOREST . 343 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18197.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 10.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 32 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 2 1 0 2 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 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 PARALLEL BRIDGES PER LADDER . 3 0 2 1 0 0 2 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 2 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 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 12 A E 0 0 170 0, 0.0 2,-0.5 0, 0.0 40,-0.0 0.000 360.0 360.0 360.0 -65.9 10.6 45.0 41.1 2 13 A L + 0 0 38 39,-0.1 2,-0.3 4,-0.0 3,-0.1 -0.658 360.0 156.1 -81.9 124.3 9.8 42.8 38.0 3 14 A K >> - 0 0 94 -2,-0.5 3,-2.7 1,-0.1 4,-2.0 -0.892 36.8-152.5-152.0 116.3 6.2 42.1 37.3 4 15 A I H 3> S+ 0 0 6 -2,-0.3 4,-1.9 1,-0.3 5,-0.2 0.835 99.1 67.0 -55.1 -33.1 4.7 41.2 33.9 5 16 A L H 34 S+ 0 0 103 1,-0.2 -1,-0.3 2,-0.2 74,-0.0 0.600 114.0 31.7 -65.5 -8.4 1.4 42.8 35.1 6 17 A E H X> S+ 0 0 98 -3,-2.7 4,-1.3 2,-0.1 3,-0.6 0.603 106.3 66.8-119.3 -26.2 3.4 46.0 35.0 7 18 A I H 3X S+ 0 0 11 -4,-2.0 4,-1.0 1,-0.3 -2,-0.2 0.880 99.5 57.7 -62.1 -35.8 5.8 45.4 32.1 8 19 A I H 3X S+ 0 0 10 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.3 0.743 100.3 59.8 -64.7 -27.1 2.7 45.4 30.0 9 20 A K H <> S+ 0 0 137 -3,-0.6 4,-2.0 2,-0.2 5,-0.2 0.998 104.2 44.2 -64.2 -67.6 1.9 48.9 31.2 10 21 A E H X S+ 0 0 42 -4,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.703 116.5 51.6 -51.3 -22.8 5.1 50.7 30.0 11 22 A A H >X>S+ 0 0 3 -4,-1.0 5,-1.9 -5,-0.2 4,-1.3 0.926 110.0 44.6 -80.9 -49.8 4.6 48.8 26.7 12 23 A I H 3<5S+ 0 0 75 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.713 109.8 60.2 -66.3 -18.8 1.0 49.8 26.2 13 24 A E H 3<5S+ 0 0 150 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.758 110.1 39.6 -78.1 -28.2 2.1 53.3 27.2 14 25 A L H <<5S- 0 0 79 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.580 115.2-117.0 -95.7 -14.0 4.6 53.4 24.3 15 26 A G T <5 + 0 0 56 -4,-1.3 17,-0.3 1,-0.1 -3,-0.2 0.854 47.8 178.2 80.3 38.1 2.1 51.7 21.9 16 27 A A < - 0 0 22 -5,-1.9 15,-0.2 1,-0.1 -1,-0.1 -0.237 28.8-153.3 -70.5 158.4 4.2 48.5 21.3 17 28 A S S S+ 0 0 52 13,-2.8 2,-0.3 1,-0.4 14,-0.1 0.829 80.7 13.2 -96.9 -45.3 2.9 45.7 19.1 18 29 A D E -A 30 0A 42 12,-0.7 12,-3.3 81,-0.1 2,-0.4 -0.910 61.8-155.9-131.1 153.9 4.9 43.0 20.7 19 30 A I E -AB 29 98A 10 79,-2.1 79,-1.4 -2,-0.3 2,-0.4 -0.996 13.6-159.3-130.4 135.7 6.9 42.7 23.9 20 31 A H E -AB 28 97A 65 8,-1.1 8,-2.9 -2,-0.4 2,-0.6 -0.970 8.9-165.6-123.5 131.8 9.7 40.1 24.3 21 32 A L E + B 0 96A 3 75,-2.4 75,-2.3 -2,-0.4 2,-0.1 -0.937 23.4 161.1-115.7 109.3 11.2 38.7 27.5 22 33 A T - 0 0 42 -2,-0.6 23,-0.0 73,-0.2 73,-0.0 -0.227 44.4-105.0-109.5-157.4 14.5 36.9 26.9 23 34 A A S S+ 0 0 24 -2,-0.1 25,-0.1 3,-0.1 -1,-0.0 0.819 106.0 35.6-105.9 -38.3 17.3 36.0 29.3 24 35 A G S S+ 0 0 56 20,-0.1 23,-0.0 2,-0.1 20,-0.0 0.784 109.9 64.3 -87.6 -26.0 20.3 38.3 28.7 25 36 A A S S- 0 0 16 19,-0.2 20,-2.4 1,-0.1 3,-0.1 -0.346 86.1-105.6 -94.8 172.8 18.4 41.5 28.0 26 37 A P S S- 0 0 18 0, 0.0 12,-0.2 0, 0.0 18,-0.2 -0.746 71.3 -62.5 -90.8 143.6 16.0 43.7 30.0 27 38 A P - 0 0 1 0, 0.0 11,-1.3 0, 0.0 -6,-0.2 0.072 67.0-149.5 -32.4 124.3 12.4 43.3 28.9 28 39 A A E -AC 20 37A 7 -8,-2.9 -8,-1.1 9,-0.3 2,-0.3 -0.452 10.9-156.8 -97.3 171.8 12.2 44.4 25.2 29 40 A V E -AC 19 36A 2 7,-1.9 7,-2.8 -10,-0.3 2,-0.8 -0.968 16.6-132.7-154.9 131.9 9.4 45.9 23.1 30 41 A R E +AC 18 35A 79 -12,-3.3 -13,-2.8 -2,-0.3 -12,-0.7 -0.758 33.2 175.0 -89.6 107.7 8.6 46.2 19.4 31 42 A I E > - C 0 34A 34 3,-2.9 3,-3.0 -2,-0.8 -15,-0.1 -0.951 66.4 -16.1-117.9 130.0 7.7 49.8 18.5 32 43 A D T 3 S- 0 0 156 -2,-0.4 -1,-0.1 -17,-0.3 3,-0.1 0.741 132.7 -49.8 51.5 25.2 7.0 51.1 14.9 33 44 A G T 3 S+ 0 0 49 1,-0.3 -1,-0.3 -3,-0.0 2,-0.3 0.274 118.8 112.9 98.5 -8.0 8.6 47.8 13.7 34 45 A Y E < -C 31 0A 154 -3,-3.0 -3,-2.9 2,-0.0 2,-0.7 -0.690 66.0-127.1-103.5 151.1 11.7 48.2 15.9 35 46 A I E +C 30 0A 74 -2,-0.3 2,-0.4 -5,-0.3 -5,-0.2 -0.861 32.7 175.2 -96.5 114.3 13.0 46.3 18.8 36 47 A K E -C 29 0A 110 -7,-2.8 -7,-1.9 -2,-0.7 2,-0.8 -0.987 27.7-134.7-121.9 128.3 13.8 48.6 21.7 37 48 A F E -C 28 0A 109 -2,-0.4 2,-1.5 -9,-0.2 -9,-0.3 -0.729 18.0-141.1 -85.3 108.1 14.9 47.3 25.2 38 49 A L > + 0 0 9 -11,-1.3 3,-0.5 -2,-0.8 -1,-0.1 -0.527 34.5 162.7 -75.5 91.7 12.9 49.2 27.8 39 50 A K T 3 + 0 0 168 -2,-1.5 -1,-0.2 1,-0.2 -11,-0.1 0.419 36.8 121.7 -85.2 -0.6 15.5 49.7 30.5 40 51 A D T 3 S- 0 0 105 1,-0.1 -1,-0.2 -3,-0.1 3,-0.1 0.753 101.9 -30.5 -30.8 -44.6 13.1 52.3 31.9 41 52 A F S < S+ 0 0 132 -3,-0.5 -1,-0.1 1,-0.2 -2,-0.1 0.348 119.2 85.3-143.5 -62.6 13.0 50.4 35.1 42 53 A P - 0 0 10 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.119 64.8-147.2 -51.0 146.5 13.6 46.6 34.6 43 54 A R - 0 0 203 1,-0.2 -5,-0.0 -18,-0.1 -18,-0.0 -0.756 48.1 -46.3-114.6 161.7 17.2 45.5 34.5 44 55 A L S S- 0 0 125 -2,-0.3 -1,-0.2 -18,-0.2 -19,-0.2 0.075 75.4-118.9 -27.7 113.3 18.9 42.7 32.5 45 56 A T - 0 0 6 -20,-2.4 4,-0.1 -3,-0.1 -1,-0.1 -0.384 21.6-134.8 -69.9 137.9 16.5 39.9 33.2 46 57 A P - 0 0 67 0, 0.0 -1,-0.1 0, 0.0 -21,-0.0 -0.349 41.2 -87.1 -82.6 170.0 17.8 36.7 35.1 47 58 A E S > S+ 0 0 120 1,-0.3 2,-0.8 2,-0.1 3,-0.5 0.403 113.2 95.7 -60.0 9.0 16.9 33.1 34.0 48 59 A D T 3 + 0 0 79 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 -0.494 39.8 109.0 -99.6 56.5 14.0 33.9 36.2 49 60 A T T 3> S+ 0 0 5 -2,-0.8 4,-1.4 2,-0.2 -1,-0.2 0.220 70.5 70.7-104.2 -5.7 12.0 34.8 33.2 50 61 A Q H <> S+ 0 0 59 -3,-0.5 4,-1.2 2,-0.2 -2,-0.1 0.680 91.8 55.6 -82.8 -25.5 10.4 31.5 34.2 51 62 A K H > S+ 0 0 123 2,-0.2 4,-1.2 1,-0.1 -2,-0.2 0.907 110.7 41.8 -74.5 -47.8 8.9 33.4 37.2 52 63 A L H 4 S+ 0 0 10 -4,-0.4 3,-0.4 1,-0.2 -2,-0.2 0.918 112.2 56.7 -64.9 -45.1 7.2 36.0 35.1 53 64 A A H X S+ 0 0 5 -4,-1.4 4,-0.7 1,-0.2 3,-0.4 0.835 107.6 47.6 -56.3 -38.3 6.2 33.4 32.6 54 65 A Y H < S+ 0 0 59 -4,-1.2 2,-0.5 1,-0.2 -1,-0.2 0.783 90.2 78.2 -76.1 -27.6 4.4 31.4 35.3 55 66 A S T < S+ 0 0 50 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.1 0.136 112.8 28.7 -67.8 27.1 2.6 34.5 36.7 56 67 A V T 4 S+ 0 0 36 -2,-0.5 2,-0.4 -3,-0.4 -1,-0.3 0.333 100.7 97.2-156.5 -25.8 0.5 33.7 33.6 57 68 A M < - 0 0 9 -4,-0.7 -1,-0.1 1,-0.1 18,-0.0 -0.648 50.0-163.4 -86.6 129.0 0.7 30.0 33.1 58 69 A S - 0 0 66 -2,-0.4 -1,-0.1 -3,-0.1 -2,-0.1 0.699 41.0 -93.3 -73.0-120.5 -2.0 27.6 34.3 59 70 A E S > S+ 0 0 105 3,-0.1 4,-2.1 2,-0.1 5,-0.3 0.562 120.0 58.9-133.0 -38.3 -1.1 23.9 34.5 60 71 A K T 4 S+ 0 0 99 1,-0.2 -3,-0.0 2,-0.2 0, 0.0 0.559 118.4 42.9 -70.1 -5.4 -2.2 22.4 31.3 61 72 A H T > S+ 0 0 23 2,-0.1 4,-1.6 3,-0.1 -1,-0.2 0.793 109.8 49.8-103.6 -50.1 0.2 25.0 30.0 62 73 A R T 4 S+ 0 0 77 1,-0.2 -2,-0.2 2,-0.2 -3,-0.1 0.834 115.6 45.6 -62.4 -32.7 3.2 24.8 32.4 63 74 A Q T >X S+ 0 0 126 -4,-2.1 4,-1.4 1,-0.2 3,-0.9 0.762 107.9 57.5 -80.5 -27.5 3.3 21.0 31.9 64 75 A K H 3> S+ 0 0 92 -5,-0.3 4,-1.6 1,-0.3 6,-0.6 0.804 96.4 62.6 -71.1 -29.6 2.9 21.5 28.1 65 76 A L H 3< S+ 0 0 0 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.559 106.7 49.4 -71.4 -5.4 6.1 23.6 28.1 66 77 A E H <4 S+ 0 0 90 -3,-0.9 -2,-0.2 -5,-0.2 -1,-0.2 0.799 103.3 52.1-101.5 -40.3 7.7 20.5 29.3 67 78 A E H < S+ 0 0 154 -4,-1.4 2,-0.4 1,-0.3 -2,-0.2 0.987 134.1 9.3 -60.1 -56.3 6.6 17.8 26.9 68 79 A N S < S- 0 0 58 -4,-1.6 2,-2.5 2,-0.3 -1,-0.3 -0.919 94.0-107.7-118.9 147.2 7.7 20.1 24.1 69 80 A G S S+ 0 0 25 -2,-0.4 20,-2.2 -3,-0.1 2,-0.3 -0.125 92.0 52.6 -71.0 48.6 9.8 23.2 24.9 70 81 A Q E -D 88 0B 97 -2,-2.5 2,-0.3 -6,-0.6 -2,-0.3 -0.968 53.9-160.2-174.5 156.9 6.9 25.6 24.1 71 82 A V E -D 87 0B 12 16,-2.3 16,-0.8 -2,-0.3 2,-0.6 -0.993 8.2-156.4-146.5 138.4 3.3 26.7 24.6 72 83 A D E +D 86 0B 86 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.936 38.1 137.6-118.9 107.9 1.0 28.8 22.5 73 84 A F E -D 85 0B 3 12,-1.3 12,-3.1 -2,-0.6 2,-0.4 -0.935 42.7-128.6-146.7 169.2 -1.9 30.4 24.6 74 85 A S E +D 84 0B 34 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.943 23.6 176.3-122.9 141.7 -4.0 33.5 25.3 75 86 A F E -D 83 0B 33 8,-1.7 8,-2.3 -2,-0.4 2,-0.4 -0.968 19.5-130.8-141.5 155.4 -4.7 35.1 28.7 76 87 A G E -D 82 0B 60 -2,-0.3 2,-0.5 6,-0.2 6,-0.2 -0.912 7.1-160.8-118.8 137.8 -6.6 38.2 29.9 77 88 A V - 0 0 35 4,-2.0 -2,-0.0 -2,-0.4 0, 0.0 -0.932 19.5-141.2-109.3 131.9 -5.7 41.0 32.2 78 89 A R S S+ 0 0 251 -2,-0.5 -1,-0.1 1,-0.1 4,-0.1 0.698 93.7 71.4 -65.0 -17.7 -8.5 43.1 33.6 79 90 A G S S- 0 0 64 2,-0.1 -1,-0.1 -74,-0.0 -74,-0.0 0.934 119.9 -17.3 -60.2 -94.3 -6.3 46.1 33.2 80 91 A V S S- 0 0 88 1,-0.1 2,-0.1 0, 0.0 -71,-0.0 0.807 102.3 -67.5 -81.0-104.5 -6.1 46.7 29.5 81 92 A G - 0 0 14 1,-0.1 -4,-2.0 -5,-0.0 2,-0.3 -0.039 61.8 -45.9-125.9-134.0 -7.1 43.8 27.2 82 93 A R E -DE 76 101B 59 19,-0.7 19,-2.3 -6,-0.2 2,-0.3 -0.871 44.8-162.5-113.5 146.7 -6.2 40.4 26.0 83 94 A F E -D 75 0B 11 -8,-2.3 -8,-1.7 -2,-0.3 2,-0.5 -0.888 15.8-136.1-128.9 158.4 -2.8 39.0 24.9 84 95 A R E -D 74 0B 11 -2,-0.3 15,-3.8 -10,-0.2 2,-0.2 -0.961 27.2-172.0-115.3 124.9 -1.3 36.1 23.0 85 96 A A E -D 73 0B 2 -12,-3.1 -12,-1.3 -2,-0.5 13,-0.2 -0.712 18.3-173.0-113.3 164.2 1.8 34.5 24.5 86 97 A N E -D 72 0B 58 -2,-0.2 11,-0.3 -14,-0.2 2,-0.2 -0.593 12.8-174.1-157.5 85.2 4.3 31.8 23.3 87 98 A V E +D 71 0B 2 -16,-0.8 -16,-2.3 9,-0.2 2,-0.3 -0.574 12.5 167.3 -84.2 148.8 6.7 30.7 25.9 88 99 A F E -DF 70 95B 61 7,-2.4 7,-2.7 -18,-0.3 2,-0.8 -0.988 45.9 -97.5-158.2 155.0 9.5 28.3 24.9 89 100 A Y + 0 0 96 -20,-2.2 5,-0.1 -2,-0.3 -20,-0.1 -0.680 48.3 178.4 -77.8 113.3 12.8 26.9 26.1 90 101 A Q - 0 0 82 -2,-0.8 -1,-0.2 1,-0.1 -21,-0.0 0.979 64.5 -15.3 -85.9 -76.5 15.2 29.2 24.4 91 102 A R S S- 0 0 215 3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.357 125.4 -52.3-130.9 55.2 18.8 28.5 25.1 92 103 A G S S+ 0 0 70 1,-0.1 -3,-0.1 0, 0.0 0, 0.0 0.743 131.2 62.9 87.1 23.7 18.4 26.3 28.1 93 104 A S S S- 0 0 16 -5,-0.1 2,-0.2 -44,-0.0 -1,-0.1 0.231 93.7 -81.1-132.0-100.7 16.2 28.8 29.9 94 105 A V - 0 0 6 -5,-0.1 2,-0.4 -73,-0.0 -5,-0.2 -0.711 34.8-173.2 175.9 129.9 12.8 30.2 29.0 95 106 A A B -F 88 0B 3 -7,-2.7 -7,-2.4 -2,-0.2 2,-0.3 -0.988 5.8-159.0-137.5 143.1 11.7 32.9 26.7 96 107 A A E -B 21 0A 6 -75,-2.3 -75,-2.4 -2,-0.4 2,-0.3 -0.936 11.0-168.8-126.6 150.2 8.4 34.6 26.1 97 108 A A E -B 20 0A 22 -2,-0.3 2,-0.4 -11,-0.3 -77,-0.2 -0.807 12.5-170.6-137.0 91.6 6.8 36.6 23.3 98 109 A L E -B 19 0A 6 -79,-1.4 -79,-2.1 -2,-0.3 -13,-0.3 -0.685 6.1-175.5 -86.6 134.3 3.5 38.3 24.2 99 110 A R - 0 0 83 -15,-3.8 2,-0.3 -2,-0.4 -81,-0.1 0.015 25.1 -99.6-102.7-146.2 1.6 39.8 21.3 100 111 A S - 0 0 58 -17,-0.2 -17,-0.2 -2,-0.1 -83,-0.0 -0.995 18.8-146.8-148.3 140.4 -1.6 41.8 21.5 101 112 A L B -E 82 0B 6 -19,-2.3 -19,-0.7 -2,-0.3 2,-0.1 -0.922 30.8-106.1-113.4 129.4 -5.3 41.1 20.9 102 113 A P - 0 0 39 0, 0.0 65,-0.5 0, 0.0 3,-0.1 -0.246 25.2-172.3 -54.8 116.3 -7.9 43.6 19.5 103 114 A A S S+ 0 0 95 -2,-0.1 2,-0.4 1,-0.1 64,-0.0 0.710 72.4 47.1 -80.0 -23.6 -10.3 45.0 22.2 104 115 A E S S- 0 0 144 62,-0.0 -1,-0.1 0, 0.0 62,-0.0 -0.970 73.9-135.3-129.5 140.1 -12.4 46.7 19.5 105 116 A I - 0 0 32 -2,-0.4 3,-0.1 62,-0.1 35,-0.0 -0.755 30.8-116.5 -93.7 129.8 -13.9 45.8 16.2 106 117 A P - 0 0 32 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.263 27.7-105.9 -63.1 142.4 -13.6 48.2 13.2 107 118 A E >> - 0 0 117 1,-0.2 3,-2.1 4,-0.0 4,-0.8 -0.602 30.7-124.4 -71.8 119.4 -16.7 49.9 11.6 108 119 A F H 3> S+ 0 0 23 -2,-0.5 4,-0.9 1,-0.3 3,-0.3 0.711 110.6 63.2 -34.2 -31.9 -17.1 48.1 8.2 109 120 A K H 34 S+ 0 0 153 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.943 97.6 54.0 -61.8 -49.1 -16.9 51.5 6.6 110 121 A K H <4 S+ 0 0 126 -3,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.708 97.4 69.9 -57.8 -27.3 -13.3 52.1 7.8 111 122 A L H < S- 0 0 36 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.993 99.6-126.3 -55.0 -72.7 -12.3 48.8 6.2 112 123 A G < + 0 0 42 -4,-0.9 -3,-0.1 1,-0.3 -1,-0.1 0.049 59.4 132.4 146.1 -28.5 -12.6 49.9 2.6 113 124 A L - 0 0 8 -5,-0.2 -1,-0.3 1,-0.1 -2,-0.0 -0.001 61.2 -99.8 -48.6 156.8 -14.8 47.2 1.0 114 125 A P - 0 0 38 0, 0.0 4,-0.5 0, 0.0 3,-0.3 0.010 34.5 -98.8 -69.9-177.0 -17.7 48.5 -1.2 115 126 A D S S+ 0 0 149 1,-0.2 -2,-0.1 2,-0.1 -6,-0.0 0.198 115.6 75.0 -90.5 16.6 -21.3 48.8 -0.1 116 127 A K S >> S+ 0 0 75 2,-0.1 3,-1.9 1,-0.1 4,-0.6 0.843 83.5 62.2 -91.2 -42.7 -21.9 45.5 -1.8 117 128 A V H >> S+ 0 0 0 -3,-0.3 3,-1.5 1,-0.3 4,-0.9 0.853 91.5 64.8 -51.8 -44.3 -20.2 43.3 0.8 118 129 A L H 34 S+ 0 0 40 -4,-0.5 -1,-0.3 1,-0.3 4,-0.1 0.456 96.9 60.8 -63.0 2.7 -22.6 44.3 3.6 119 130 A E H X4 S+ 0 0 88 -3,-1.9 3,-0.6 2,-0.1 -1,-0.3 0.747 90.9 64.4 -98.7 -29.6 -25.3 42.5 1.5 120 131 A L H X< S+ 0 0 8 -3,-1.5 3,-2.8 -4,-0.6 -2,-0.2 0.930 97.3 56.1 -57.4 -48.2 -23.6 39.1 1.6 121 132 A C T 3< S+ 0 0 0 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.1 0.810 102.9 59.3 -53.9 -29.1 -24.1 38.9 5.4 122 133 A H T < S+ 0 0 78 -3,-0.6 -1,-0.3 -4,-0.1 -2,-0.2 0.514 84.8 102.3 -80.6 -4.2 -27.8 39.5 4.6 123 134 A R S < S- 0 0 79 -3,-2.8 3,-0.1 -4,-0.2 102,-0.1 0.082 73.5-128.3 -64.5-172.4 -28.0 36.3 2.4 124 135 A K S S- 0 0 118 1,-0.4 2,-0.3 100,-0.1 101,-0.2 0.635 75.4 -13.5-116.0 -23.2 -29.6 33.2 3.8 125 136 A M S S+ 0 0 84 99,-0.1 -1,-0.4 136,-0.0 100,-0.3 -0.869 81.6 95.7-176.7 143.7 -27.1 30.4 3.2 126 137 A G E -g 225 0C 0 98,-1.4 100,-2.2 -2,-0.3 2,-0.5 -0.977 68.5 -65.0 159.1-168.0 -23.9 29.9 1.2 127 138 A L E -g 226 0C 4 134,-2.4 137,-0.8 -2,-0.3 2,-0.6 -0.768 38.3-172.0-122.1 88.0 -20.1 30.1 1.2 128 139 A I E -gh 227 264C 0 98,-1.8 100,-2.3 -2,-0.5 2,-0.4 -0.670 15.3-163.0 -78.5 117.5 -18.7 33.6 1.8 129 140 A L E -gh 228 265C 1 135,-1.6 137,-1.5 -2,-0.6 2,-0.5 -0.857 17.6-173.3-110.3 139.5 -14.9 33.4 1.2 130 141 A V E + h 0 266C 0 98,-2.2 2,-0.3 -2,-0.4 137,-0.2 -0.981 20.1 172.9-127.9 115.3 -12.2 35.9 2.3 131 142 A T E + h 0 267C 0 135,-0.8 137,-2.5 -2,-0.5 100,-0.2 -0.922 11.4 113.4-128.7 153.2 -8.7 35.1 1.0 132 143 A G - 0 0 0 98,-1.1 137,-0.1 -2,-0.3 101,-0.1 -0.931 63.1 -56.0 166.9 170.3 -5.3 36.7 0.9 133 144 A P S S- 0 0 46 0, 0.0 5,-0.2 0, 0.0 137,-0.1 -0.425 74.3 -84.7 -67.9 144.9 -1.7 36.5 2.0 134 145 A T S S+ 0 0 116 1,-0.2 97,-0.0 97,-0.1 -3,-0.0 -0.319 122.2 42.2 -50.5 117.8 -1.3 36.4 5.8 135 146 A G S S+ 0 0 64 -3,-0.1 135,-0.5 134,-0.0 -1,-0.2 0.778 80.1 108.6 106.9 46.3 -1.5 40.1 6.6 136 147 A S S S- 0 0 1 133,-0.1 133,-0.1 -4,-0.1 -2,-0.1 0.192 93.2 -89.7-138.1 20.2 -4.3 41.4 4.4 137 148 A G S > S+ 0 0 23 131,-0.1 4,-3.8 133,-0.1 5,-0.3 0.437 80.0 133.6 89.0 -0.9 -7.3 42.2 6.6 138 149 A K H > S+ 0 0 23 -5,-0.2 4,-2.4 2,-0.2 5,-0.2 0.924 75.0 44.6 -46.4 -60.1 -9.0 38.8 6.5 139 150 A S H > S+ 0 0 59 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.936 118.9 43.3 -50.6 -55.4 -9.7 38.6 10.3 140 151 A T H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.937 111.2 53.0 -58.5 -52.3 -10.9 42.2 10.4 141 152 A T H X S+ 0 0 2 -4,-3.8 4,-1.2 1,-0.2 -1,-0.2 0.872 114.3 45.3 -52.6 -39.5 -13.0 42.0 7.2 142 153 A I H X S+ 0 0 3 -4,-2.4 4,-3.4 -5,-0.3 5,-0.3 0.915 110.7 49.7 -71.0 -47.3 -14.7 38.9 8.8 143 154 A A H X S+ 0 0 4 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.746 110.0 53.4 -64.8 -24.8 -15.3 40.4 12.3 144 155 A S H X S+ 0 0 4 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.859 114.3 42.0 -76.2 -36.2 -16.8 43.5 10.7 145 156 A M H X S+ 0 0 0 -4,-1.2 4,-1.5 -5,-0.3 -2,-0.2 0.921 115.9 46.4 -75.6 -45.8 -19.2 41.2 8.7 146 157 A I H X S+ 0 0 0 -4,-3.4 4,-2.1 1,-0.2 -3,-0.2 0.845 116.1 48.5 -65.7 -31.7 -20.0 38.9 11.5 147 158 A D H X S+ 0 0 17 -4,-1.3 4,-0.6 -5,-0.3 -1,-0.2 0.745 103.4 57.9 -79.4 -26.0 -20.5 41.9 13.8 148 159 A Y H X S+ 0 0 56 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.878 112.0 45.2 -67.0 -38.0 -22.8 43.8 11.3 149 160 A I H X S+ 0 0 1 -4,-1.5 4,-3.2 2,-0.2 -2,-0.2 0.960 105.4 57.3 -66.4 -58.0 -25.0 40.7 11.5 150 161 A N H < S+ 0 0 0 -4,-2.1 22,-1.9 1,-0.2 23,-0.5 0.709 112.4 47.4 -48.4 -20.1 -24.8 40.4 15.3 151 162 A Q H < S+ 0 0 100 -4,-0.6 -1,-0.2 20,-0.2 -2,-0.2 0.892 122.1 26.1 -92.5 -44.4 -26.2 43.9 15.2 152 163 A T H < S+ 0 0 64 -4,-1.8 2,-0.3 -3,-0.1 -2,-0.2 0.589 112.1 63.0 -99.3 -10.8 -29.1 43.7 12.7 153 164 A K S < S- 0 0 79 -4,-3.2 2,-1.0 -5,-0.1 19,-0.1 -0.821 71.0-129.6-118.1 156.4 -30.2 40.0 12.9 154 165 A S + 0 0 92 -2,-0.3 2,-0.2 19,-0.1 19,-0.2 -0.580 60.6 136.0-100.4 73.4 -31.7 37.7 15.6 155 166 A Y - 0 0 48 -2,-1.0 19,-1.7 -6,-0.1 2,-0.7 -0.672 61.8-126.3-116.9 167.2 -29.3 34.8 15.2 156 167 A H E -i 174 0C 21 -2,-0.2 44,-3.3 42,-0.2 45,-1.0 -0.951 38.1-163.7-109.0 103.8 -27.2 32.3 17.2 157 168 A I E -ij 175 201C 0 17,-1.5 19,-2.2 -2,-0.7 2,-0.5 -0.831 4.6-164.0 -98.5 132.4 -23.7 32.8 15.6 158 169 A I E -ij 176 202C 2 43,-2.9 45,-1.1 -2,-0.5 2,-0.4 -0.947 4.4-171.5-118.3 124.3 -21.1 30.2 16.1 159 170 A T E -ij 177 203C 0 17,-2.6 19,-1.9 -2,-0.5 2,-0.7 -0.956 12.3-160.3-119.7 132.6 -17.3 30.8 15.4 160 171 A I E +ij 178 204C 0 43,-3.7 45,-2.4 -2,-0.4 46,-0.3 -0.893 30.4 175.9-108.4 100.2 -14.6 28.1 15.4 161 172 A E E -i 179 0C 14 17,-1.6 19,-3.4 -2,-0.7 3,-0.4 -0.693 33.4-143.1-112.2 162.1 -11.3 30.0 15.9 162 173 A D S S- 0 0 62 1,-0.7 2,-0.1 -2,-0.2 17,-0.1 -0.610 102.6 -1.5-156.2 88.0 -7.5 29.4 16.3 163 174 A P S S- 0 0 21 0, 0.0 2,-0.8 0, 0.0 -1,-0.7 0.647 92.9-116.0 -95.1 164.1 -6.8 31.6 18.2 164 175 A I + 0 0 25 -3,-0.4 3,-0.1 1,-0.2 15,-0.1 -0.422 40.2 177.5 -60.1 102.9 -9.9 33.7 19.0 165 176 A E + 0 0 48 -2,-0.8 2,-0.3 1,-0.2 -1,-0.2 0.988 63.0 24.4 -71.3 -77.6 -8.6 37.0 17.4 166 177 A Y S S- 0 0 23 -27,-0.1 2,-0.3 -65,-0.1 -1,-0.2 -0.650 77.3-143.6 -91.1 151.9 -11.6 39.3 17.9 167 178 A V - 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0 0 35 -2,-0.6 -22,-0.1 -22,-0.2 5,-0.1 -0.826 33.1-127.9-108.6 95.0 -20.4 38.0 -6.9 287 298 A P + 0 0 14 0, 0.0 2,-0.1 0, 0.0 -28,-0.0 0.194 33.7 173.7 -34.8 151.5 -21.8 35.1 -9.0 288 299 A N - 0 0 68 0, 0.0 4,-0.2 0, 0.0 5,-0.1 -0.286 49.8 -58.7-136.0-141.7 -24.6 35.7 -11.5 289 300 A T S > S+ 0 0 118 3,-0.1 4,-1.2 -2,-0.1 5,-0.1 0.914 130.8 32.0 -80.5 -49.8 -26.7 34.0 -14.2 290 301 A A H >> S+ 0 0 30 2,-0.2 4,-3.5 1,-0.2 3,-0.5 0.995 117.0 50.1 -72.1 -67.5 -23.7 33.2 -16.4 291 302 A I H 3> S+ 0 0 9 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.777 107.6 59.3 -43.1 -34.3 -20.8 32.6 -14.0 292 303 A R H 3> S+ 0 0 66 -4,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.989 114.9 33.3 -59.0 -58.1 -23.1 30.3 -12.1 293 304 A N H S+ 0 0 13 -4,-3.5 4,-1.5 2,-0.2 5,-1.2 0.975 100.2 52.8 -51.1 -67.4 -19.9 28.9 -16.3 295 306 A I H <5S+ 0 0 6 -4,-2.6 3,-0.5 1,-0.3 -1,-0.2 0.842 111.5 48.2 -36.4 -50.4 -18.2 27.5 -13.2 296 307 A R H <5S+ 0 0 67 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.926 113.2 44.7 -61.3 -49.4 -20.1 24.2 -13.7 297 308 A E H <5S- 0 0 146 -4,-2.3 -1,-0.3 -3,-0.3 -2,-0.2 0.583 108.9-132.9 -72.0 -7.3 -19.1 24.0 -17.3 298 309 A N T <5 + 0 0 53 -4,-1.5 2,-1.4 -3,-0.5 3,-0.3 0.714 56.9 148.3 61.6 24.3 -15.7 25.0 -16.1 299 310 A K >>< + 0 0 116 -5,-1.2 4,-0.8 1,-0.2 3,-0.6 -0.157 25.6 154.2 -79.3 42.4 -15.3 27.6 -18.9 300 311 A L H >> + 0 0 28 -2,-1.4 3,-5.5 1,-0.2 4,-0.9 0.883 55.8 49.4 -32.5 -89.9 -13.3 29.2 -16.2 301 312 A Q H >> S+ 0 0 135 1,-0.3 3,-0.6 -3,-0.3 4,-0.5 0.738 110.1 56.0 -25.8 -45.2 -10.8 31.5 -18.0 302 313 A Q H <> S+ 0 0 60 -3,-0.6 4,-0.7 1,-0.2 3,-0.4 0.738 97.9 61.4 -67.6 -24.2 -13.8 32.8 -20.0 303 314 A V H XX S+ 0 0 15 -3,-5.5 4,-0.9 -4,-0.8 3,-0.7 0.845 94.1 62.6 -70.5 -33.6 -15.6 33.8 -16.7 304 315 A Y H << S+ 0 0 48 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.781 100.2 57.0 -60.2 -26.5 -12.8 36.2 -15.9 305 316 A S H 3< S+ 0 0 91 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.2 0.787 97.4 56.9 -76.7 -31.4 -13.8 38.0 -19.1 306 317 A L H << S+ 0 0 74 -3,-0.7 2,-2.3 -4,-0.7 -1,-0.2 0.719 83.8 99.2 -71.6 -19.2 -17.4 38.6 -18.0 307 318 A M < 0 0 12 -4,-0.9 5,-0.5 -3,-0.1 -1,-0.2 -0.424 360.0 360.0 -70.5 73.3 -15.8 40.3 -15.0 308 319 A Q 0 0 183 -2,-2.3 -1,-0.1 3,-0.1 -3,-0.1 -0.519 360.0 360.0 -76.7 360.0 -16.2 43.9 -16.2 309 ! 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 0.0 310 327 A M 0 0 94 0, 0.0 -25,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -25.7 -17.9 42.4 -9.9 311 328 A Q B -M 284 0C 36 -27,-1.3 -27,-1.2 5,-0.0 -3,-0.1 -0.588 360.0-130.7-174.7 108.0 -14.4 44.0 -10.3 312 329 A T - 0 0 10 -5,-0.5 4,-0.4 -29,-0.2 -30,-0.1 -0.065 35.3-107.4 -54.0 162.0 -11.1 42.5 -11.6 313 330 A M S > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -31,-0.3 0.745 119.1 48.4 -66.6 -23.2 -8.1 43.1 -9.5 314 331 A N H > S+ 0 0 4 2,-0.3 4,-1.8 1,-0.2 5,-0.4 0.859 98.1 61.9 -85.7 -38.9 -6.8 45.7 -12.0 315 332 A Q H > S+ 0 0 67 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.663 118.2 38.4 -60.3 -9.9 -9.9 47.7 -12.4 316 333 A T H > S+ 0 0 2 -4,-0.4 4,-1.8 2,-0.2 -2,-0.3 0.793 106.6 58.7-103.1 -49.9 -9.1 48.2 -8.7 317 334 A L H < S+ 0 0 0 -4,-2.2 4,-0.2 1,-0.2 -2,-0.2 0.674 118.1 39.5 -56.6 -15.7 -5.3 48.4 -8.8 318 335 A Y H >X S+ 0 0 81 -4,-1.8 4,-2.5 2,-0.1 3,-1.6 0.833 103.5 63.8 -98.1 -49.9 -6.0 51.4 -11.0 319 336 A K H 3< S+ 0 0 92 -4,-0.6 -2,-0.2 -5,-0.4 -3,-0.1 0.752 102.9 53.4 -49.0 -27.2 -9.1 52.9 -9.3 320 337 A L T 3X S+ 0 0 22 -4,-1.8 4,-1.1 1,-0.2 3,-0.4 0.818 113.8 41.8 -76.9 -32.1 -6.8 53.6 -6.3 321 338 A Y T <4 S+ 0 0 114 -3,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.760 94.5 75.8 -86.0 -28.5 -4.3 55.4 -8.5 322 339 A K T < S+ 0 0 123 -4,-2.5 -1,-0.2 1,-0.2 -3,-0.1 0.490 110.4 36.4 -61.8 1.1 -6.9 57.3 -10.7 323 340 A Q T 4 S- 0 0 155 -3,-0.4 -1,-0.2 -5,-0.3 -2,-0.2 0.683 123.1 -93.6-119.2 -45.5 -7.0 59.4 -7.5 324 341 A G S < S+ 0 0 50 -4,-1.1 -3,-0.2 2,-0.1 3,-0.1 0.650 87.2 96.5 121.2 69.5 -3.5 59.5 -6.0 325 342 A L S S+ 0 0 21 1,-0.4 2,-0.5 -5,-0.3 -51,-0.4 0.368 72.8 48.2-138.8 -70.6 -2.7 56.9 -3.4 326 343 A I S S- 0 0 2 -6,-0.3 -1,-0.4 -53,-0.1 -2,-0.1 -0.718 79.3-130.1 -88.3 128.4 -0.9 53.8 -4.7 327 344 A T > - 0 0 56 -2,-0.5 4,-1.2 -55,-0.2 5,-0.1 -0.188 28.3-103.2 -68.2 165.9 2.1 54.5 -7.0 328 345 A L T 4 S+ 0 0 102 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.815 117.1 49.8 -64.6 -32.1 2.4 52.8 -10.3 329 346 A E T >> S+ 0 0 118 1,-0.2 4,-2.5 2,-0.2 3,-1.3 0.874 110.7 46.7 -75.8 -39.5 5.0 50.2 -9.2 330 347 A D T 34 S+ 0 0 48 1,-0.3 4,-0.2 2,-0.3 -1,-0.2 0.756 103.0 65.3 -72.8 -21.6 3.2 49.1 -6.1 331 348 A A T 3< S+ 0 0 1 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.396 114.6 33.5 -77.2 5.1 0.1 48.9 -8.3 332 349 A M T <4 S+ 0 0 44 -3,-1.3 -2,-0.3 -5,-0.1 -1,-0.2 0.568 107.4 62.5-126.2 -35.9 2.3 46.1 -9.9 333 350 A E S < S+ 0 0 120 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.1 0.338 123.0 28.3 -77.0 8.8 4.2 44.6 -6.9 334 351 A A S S+ 0 0 6 -4,-0.2 -1,-0.2 -5,-0.2 -3,-0.1 0.338 97.8 112.6-137.7 -18.9 0.6 43.7 -5.8 335 352 A S - 0 0 14 -6,-0.2 -3,-0.1 -5,-0.2 -21,-0.1 -0.445 63.1-144.9 -66.2 123.9 -0.9 43.5 -9.2 336 353 A P S S+ 0 0 50 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.413 88.8 16.1 -70.0 4.7 -1.9 39.9 -10.1 337 354 A D > - 0 0 55 1,-0.1 4,-1.0 -5,-0.1 -3,-0.0 -0.534 53.7-162.3 178.9 109.7 -0.9 40.7 -13.7 338 355 A P T 4 S+ 0 0 53 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.894 95.0 59.3 -60.3 -41.4 1.1 43.5 -15.3 339 356 A K T 4 S+ 0 0 129 1,-0.2 4,-0.1 3,-0.1 -2,-0.1 0.916 97.3 56.0 -54.0 -54.6 -0.4 42.7 -18.7 340 357 A E T 4 S+ 0 0 67 2,-0.1 -1,-0.2 3,-0.0 3,-0.2 0.867 119.3 34.0 -49.7 -40.6 -4.1 43.3 -17.7 341 358 A L S < S+ 0 0 7 -4,-1.0 -26,-0.0 -3,-0.3 -9,-0.0 -0.066 77.9 83.0 -97.3-157.6 -3.1 46.8 -16.6 342 359 A E S S+ 0 0 135 1,-0.1 -1,-0.1 -2,-0.1 -3,-0.1 0.421 84.8 84.3 74.1 -3.0 -0.4 49.1 -18.1 343 360 A R 0 0 227 -3,-0.2 -2,-0.1 -4,-0.1 -1,-0.1 0.126 360.0 360.0-110.9 13.1 -3.3 49.9 -20.4 344 361 A M 0 0 131 -26,-0.0 -3,-0.1 0, 0.0 -29,-0.0 0.498 360.0 360.0-134.1 360.0 -4.7 52.4 -17.8