==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 08-NOV-03 1V43 . COMPND 2 MOLECULE: SUGAR-BINDING TRANSPORT ATP-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR T.OSE,T.FUJIE,M.YAO,N.WATANABE,I.TANAKA . 353 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17782.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 258 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 23.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 2.0 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 . 38 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 17.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.4 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 0 0 3 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 PARALLEL BRIDGES PER LADDER . 2 1 2 2 2 2 2 1 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 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 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 7 A V 0 0 153 0, 0.0 2,-0.2 0, 0.0 179,-0.0 0.000 360.0 360.0 360.0 151.2 13.8 20.8 13.5 2 8 A I - 0 0 25 178,-0.1 2,-0.2 1,-0.0 148,-0.1 -0.489 360.0-147.4 -77.8 141.0 16.8 23.1 12.9 3 9 A K - 0 0 122 146,-0.3 2,-0.8 -2,-0.2 180,-0.5 -0.701 16.8-122.5-105.2 158.0 18.5 23.4 9.5 4 10 A M - 0 0 110 -2,-0.2 2,-0.6 178,-0.1 27,-0.2 -0.888 37.2-173.1-101.1 104.9 22.2 24.1 8.7 5 11 A V - 0 0 17 -2,-0.8 27,-0.3 145,-0.6 2,-0.2 -0.884 17.9-141.2-109.3 118.0 22.1 27.3 6.6 6 12 A E - 0 0 61 -2,-0.6 60,-2.9 25,-0.2 2,-0.5 -0.522 18.3-152.3 -72.3 137.7 25.1 28.7 4.8 7 13 A V E -AB 29 65A 0 22,-2.6 22,-3.5 58,-0.2 2,-0.5 -0.960 9.1-167.6-118.2 126.4 25.3 32.5 4.9 8 14 A K E -AB 28 64A 54 56,-1.8 56,-2.7 -2,-0.5 2,-0.6 -0.941 7.4-166.8-114.9 129.9 27.0 34.6 2.3 9 15 A L E -AB 27 63A 4 18,-3.1 18,-2.1 -2,-0.5 2,-0.6 -0.970 16.3-162.0-112.0 119.5 27.8 38.3 2.6 10 16 A E E - B 0 62A 83 52,-3.5 52,-2.0 -2,-0.6 16,-0.2 -0.916 62.3 -35.5-112.7 121.6 28.8 39.7 -0.8 11 17 A N E S- 0 0 49 -2,-0.6 2,-0.4 13,-0.2 13,-0.2 0.858 83.4-173.8 38.2 47.4 30.6 43.0 -1.3 12 18 A L E +A 25 0A 0 13,-2.5 13,-3.3 49,-0.1 2,-0.3 -0.595 9.0 171.1 -75.7 125.1 28.6 44.3 1.7 13 19 A T E - B 0 60A 4 47,-2.2 46,-3.1 -2,-0.4 47,-1.4 -0.976 14.8-174.8-134.6 147.3 29.1 48.0 2.4 14 20 A K E +A 22 0A 31 8,-2.2 7,-2.1 -2,-0.3 8,-1.6 -0.900 4.7 179.5-144.3 111.4 27.3 50.3 4.7 15 21 A R E -A 20 0A 106 -2,-0.3 2,-1.5 5,-0.3 5,-0.3 -0.952 19.6-153.1-119.2 121.3 28.0 54.1 4.8 16 22 A F E > S-A 19 0A 95 3,-2.3 3,-1.5 -2,-0.5 2,-1.3 -0.686 72.2 -62.4 -87.4 86.4 26.1 56.4 7.1 17 23 A G T 3 S- 0 0 70 -2,-1.5 -2,-0.0 1,-0.3 -1,-0.0 -0.601 124.5 -7.0 76.9 -97.5 26.5 59.5 5.0 18 24 A N T 3 S+ 0 0 156 -2,-1.3 2,-0.7 1,-0.0 -1,-0.3 0.647 117.7 87.8-104.7 -24.1 30.2 60.1 4.9 19 25 A F E < -A 16 0A 116 -3,-1.5 -3,-2.3 1,-0.0 2,-1.0 -0.713 66.6-148.9 -85.6 114.6 31.3 57.4 7.4 20 26 A T E +A 15 0A 46 -2,-0.7 -5,-0.3 -5,-0.3 3,-0.2 -0.734 19.8 176.9 -82.3 103.4 31.9 53.9 5.8 21 27 A A E S+ 0 0 4 -7,-2.1 2,-0.4 -2,-1.0 -1,-0.2 0.822 74.2 23.7 -77.0 -34.4 30.9 51.6 8.7 22 28 A V E S-A 14 0A 0 -8,-1.6 -8,-2.2 -3,-0.1 2,-0.8 -0.964 76.3-156.8-136.2 117.1 31.3 48.4 6.7 23 29 A N E - 0 0 65 184,-2.6 186,-0.3 -2,-0.4 -10,-0.2 -0.802 62.7 -47.0-105.8 102.2 33.6 48.4 3.7 24 30 A K E S- 0 0 117 -2,-0.8 2,-0.3 -13,-0.2 -13,-0.2 0.895 72.0-165.4 45.0 56.2 33.1 45.7 1.0 25 31 A L E -A 12 0A 2 -13,-3.3 -13,-2.5 -15,-0.1 2,-0.5 -0.521 8.5-171.0 -73.0 130.0 32.8 42.8 3.4 26 32 A N E + 0 0 95 -2,-0.3 2,-0.3 -15,-0.2 -16,-0.2 -0.983 18.7 154.5-125.2 117.4 33.1 39.4 1.8 27 33 A L E -A 9 0A 10 -18,-2.1 -18,-3.1 -2,-0.5 2,-0.6 -0.981 32.6-160.8-150.0 134.3 32.3 36.5 4.0 28 34 A T E -A 8 0A 74 -2,-0.3 2,-0.7 -20,-0.2 -20,-0.2 -0.922 17.0-161.8-116.3 102.4 31.0 32.9 3.6 29 35 A I E -A 7 0A 0 -22,-3.5 -22,-2.6 -2,-0.6 3,-0.1 -0.769 23.1-124.4 -86.3 112.9 29.6 31.7 6.9 30 36 A K > - 0 0 117 -2,-0.7 3,-2.3 -24,-0.2 -25,-0.2 -0.207 29.5 -94.2 -63.4 143.2 29.5 27.9 6.8 31 37 A D T 3 S+ 0 0 75 1,-0.3 -25,-0.2 -27,-0.2 -1,-0.1 -0.349 109.3 6.0 -56.8 126.3 26.2 26.0 7.5 32 38 A G T 3 S+ 0 0 0 -27,-0.3 -1,-0.3 1,-0.2 2,-0.1 0.504 98.1 129.6 79.3 4.0 26.1 25.1 11.2 33 39 A E < - 0 0 15 -3,-2.3 151,-2.7 148,-0.1 2,-0.7 -0.493 59.1-127.2 -91.4 165.5 29.2 26.9 12.3 34 40 A F E -d 184 0B 0 149,-0.2 165,-2.7 -2,-0.1 166,-1.4 -0.925 31.7-172.2-107.3 101.3 29.6 29.3 15.2 35 41 A L E -de 185 200B 0 149,-3.4 151,-3.2 -2,-0.7 2,-0.4 -0.883 7.7-157.7-102.0 126.2 31.2 32.4 13.7 36 42 A V E -de 186 201B 0 164,-2.2 166,-3.0 -2,-0.6 2,-0.8 -0.855 7.6-150.4-100.7 132.3 32.3 35.2 16.1 37 43 A L E -de 187 202B 0 149,-3.5 151,-2.3 -2,-0.4 2,-0.4 -0.921 26.2-171.7-100.2 110.8 32.7 38.7 14.7 38 44 A L E +de 188 203B 0 164,-2.1 166,-2.7 -2,-0.8 151,-0.2 -0.905 23.7 105.7-111.7 132.7 35.5 40.1 16.9 39 45 A G - 0 0 0 149,-1.2 166,-0.1 -2,-0.4 3,-0.1 -0.926 61.3 -73.2 172.4 164.3 36.6 43.7 17.1 40 46 A P > - 0 0 39 0, 0.0 3,-1.6 0, 0.0 5,-0.3 -0.110 69.8 -65.3 -69.5 171.5 36.6 47.0 19.0 41 47 A S T 3 S+ 0 0 107 1,-0.3 148,-0.0 2,-0.1 0, 0.0 -0.294 123.6 16.2 -57.2 135.6 33.7 49.4 19.3 42 48 A G T 3 S+ 0 0 62 -3,-0.1 -1,-0.3 1,-0.1 165,-0.1 0.672 83.8 124.4 74.8 17.0 32.7 50.9 16.0 43 49 A C S < S- 0 0 1 -3,-1.6 164,-1.6 163,-0.2 162,-0.2 0.560 86.3-104.3 -84.2 -8.3 34.7 48.4 13.9 44 50 A G S > S+ 0 0 4 -4,-0.2 4,-2.6 162,-0.1 5,-0.2 0.298 89.6 116.8 106.3 -8.4 31.5 47.5 12.0 45 51 A K H > S+ 0 0 10 -5,-0.3 4,-2.1 1,-0.2 5,-0.1 0.883 80.6 45.1 -61.3 -40.8 30.7 44.1 13.6 46 52 A T H > S+ 0 0 52 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 111.5 51.8 -70.9 -40.8 27.4 45.3 15.1 47 53 A T H > S+ 0 0 22 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.917 110.2 50.8 -60.4 -42.8 26.3 47.1 11.8 48 54 A T H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.931 109.0 50.0 -60.2 -47.5 27.0 43.8 10.0 49 55 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.928 110.6 51.0 -57.6 -44.0 24.9 41.8 12.4 50 56 A R H X>S+ 0 0 95 -4,-2.5 5,-1.8 1,-0.2 6,-1.4 0.841 109.4 49.4 -63.2 -36.2 22.1 44.3 12.0 51 57 A M H <5S+ 0 0 0 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.902 110.3 51.3 -69.6 -39.8 22.2 44.1 8.2 52 58 A I H <5S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.918 112.2 47.1 -61.2 -40.2 22.2 40.3 8.5 53 59 A A H <5S- 0 0 1 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.754 112.9-122.2 -72.3 -24.8 19.1 40.6 10.8 54 60 A G T <5S+ 0 0 13 -4,-1.4 -3,-0.2 2,-0.3 -4,-0.1 0.556 82.4 118.2 93.1 7.4 17.5 43.1 8.3 55 61 A L S S-BC 7 68A 7 3,-2.3 3,-1.9 -2,-0.3 -58,-0.2 -0.987 80.4 -39.6-124.9 112.8 20.8 32.5 3.3 66 72 A G T 3 S- 0 0 29 -60,-2.9 -58,-0.2 -2,-0.5 -61,-0.0 -0.459 124.2 -31.8 62.2-135.0 21.2 29.3 1.3 67 73 A D T 3 S+ 0 0 159 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.3 0.501 116.6 106.1 -92.9 -4.5 20.3 30.2 -2.3 68 74 A R E < -C 65 0A 100 -3,-1.9 -3,-2.3 2,-0.0 2,-0.7 -0.623 66.9-140.2 -83.8 127.1 17.8 32.8 -1.2 69 75 A D E +C 64 0A 51 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.2 -0.759 28.3 171.3 -80.3 116.8 18.8 36.5 -1.6 70 76 A V > + 0 0 0 -7,-2.5 3,-2.1 -2,-0.7 -1,-0.2 0.316 38.2 115.5-111.5 6.4 17.3 37.9 1.6 71 77 A T T 3 S+ 0 0 0 -8,-0.8 -1,-0.1 1,-0.3 -7,-0.1 0.817 86.9 29.9 -42.8 -44.7 18.9 41.4 1.3 72 78 A Y T 3 S+ 0 0 156 -3,-0.2 -1,-0.3 -9,-0.1 -2,-0.1 0.103 93.8 112.0-110.6 24.2 15.5 43.1 1.0 73 79 A L S < S- 0 0 52 -3,-2.1 5,-0.1 1,-0.1 -3,-0.1 -0.739 75.3-103.1 -96.9 144.1 13.3 40.8 3.0 74 80 A P >> - 0 0 52 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.253 36.8-108.6 -58.7 149.7 11.7 42.0 6.3 75 81 A P G >4>S+ 0 0 50 0, 0.0 3,-1.3 0, 0.0 5,-0.5 0.872 118.2 60.8 -51.9 -33.4 13.5 40.5 9.4 76 82 A K G >45S+ 0 0 152 1,-0.2 3,-0.7 2,-0.2 4,-0.1 0.815 101.3 51.6 -64.1 -31.1 10.4 38.3 10.0 77 83 A D G <45S+ 0 0 78 -3,-1.4 -1,-0.2 1,-0.2 -4,-0.0 0.482 96.4 70.1 -87.0 0.9 10.7 36.5 6.6 78 84 A R G <<5S- 0 0 0 -3,-1.3 -1,-0.2 -4,-0.5 72,-0.2 0.540 98.7-127.9 -91.9 -9.6 14.4 35.7 7.1 79 85 A N T < 5 + 0 0 62 -3,-0.7 71,-3.1 -4,-0.3 72,-1.3 0.972 58.2 140.1 60.7 57.0 13.8 33.1 9.9 80 86 A I E < -f 151 0B 33 -5,-0.5 2,-0.4 69,-0.2 -1,-0.2 -0.837 39.8-155.5-126.4 163.8 16.3 34.6 12.4 81 87 A S E -f 152 0B 13 70,-1.3 72,-2.9 -2,-0.3 2,-0.4 -0.995 12.0-151.2-141.1 136.0 16.3 35.1 16.1 82 88 A M E -f 153 0B 52 -2,-0.4 2,-0.4 70,-0.2 72,-0.2 -0.907 6.2-166.0-113.9 136.6 18.4 37.8 17.9 83 89 A V E +f 154 0B 9 70,-2.7 72,-2.6 -2,-0.4 2,-0.3 -0.974 23.7 158.2-117.5 134.3 19.8 37.6 21.4 84 90 A F E f 155 0B 124 -2,-0.4 72,-0.1 70,-0.2 -2,-0.0 -0.959 360.0 360.0-151.4 171.2 21.1 40.8 22.9 85 91 A Q 0 0 149 70,-0.8 75,-0.4 -2,-0.3 71,-0.1 -0.146 360.0 360.0 93.5 360.0 22.0 42.7 26.1 86 ! 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 87 98 A H 0 0 196 0, 0.0 2,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 5.9 5.3 39.4 34.3 88 99 A M - 0 0 70 1,-0.1 2,-0.1 4,-0.1 3,-0.0 -0.377 360.0-109.8 -79.7 159.8 5.0 36.2 32.2 89 100 A T > - 0 0 20 38,-0.2 4,-4.0 1,-0.1 5,-0.2 -0.445 34.6-103.2 -82.5 162.4 6.0 32.8 33.4 90 101 A V H > S+ 0 0 3 36,-2.3 4,-3.0 33,-0.5 5,-0.3 0.947 128.2 50.3 -50.7 -46.5 9.1 31.1 32.0 91 102 A Y H > S+ 0 0 55 33,-2.5 4,-1.4 1,-0.2 -1,-0.3 0.891 114.7 43.0 -57.6 -42.4 6.7 29.0 29.9 92 103 A E H > S+ 0 0 84 32,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.873 111.2 54.7 -71.9 -38.6 4.9 32.2 28.8 93 104 A N H < S+ 0 0 12 -4,-4.0 3,-0.2 1,-0.2 -2,-0.2 0.979 114.4 40.1 -58.0 -54.9 8.2 34.0 28.2 94 105 A I H < S+ 0 0 0 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.791 117.4 51.5 -64.9 -27.1 9.4 31.3 25.9 95 106 A A H >< S+ 0 0 8 -4,-1.4 3,-2.6 -5,-0.3 -1,-0.2 0.828 86.9 83.5 -79.1 -33.8 5.9 30.9 24.4 96 107 A F T 3< S+ 0 0 149 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.1 0.845 81.8 61.0 -36.8 -57.5 5.5 34.7 23.6 97 108 A P T 3 0 0 37 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.427 360.0 360.0 -57.2 5.8 7.4 34.5 20.3 98 109 A L < 0 0 19 -3,-2.6 3,-0.3 4,-0.1 4,-0.1 -0.715 360.0 360.0-125.0 360.0 4.7 32.0 19.1 99 ! 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 0.0 100 112 A K 0 0 135 0, 0.0 -4,-0.0 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 29.5 3.1 34.7 15.5 101 113 A K + 0 0 202 -3,-0.3 0, 0.0 1,-0.2 0, 0.0 0.975 360.0 161.0 52.5 82.2 0.0 32.6 14.7 102 114 A F - 0 0 56 -4,-0.1 -1,-0.2 4,-0.0 2,-0.1 -0.993 42.4-112.0-136.6 141.1 0.8 29.3 16.4 103 115 A P >> - 0 0 76 0, 0.0 4,-2.8 0, 0.0 3,-1.0 -0.457 25.8-128.3 -68.8 138.6 -1.3 26.3 17.5 104 116 A K H 3> S+ 0 0 178 1,-0.3 4,-1.3 2,-0.2 5,-0.1 0.800 110.2 50.2 -57.3 -29.9 -1.4 25.9 21.3 105 117 A D H 3> S+ 0 0 143 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.675 111.3 46.7 -82.9 -20.8 -0.3 22.2 21.0 106 118 A E H <> S+ 0 0 77 -3,-1.0 4,-2.2 2,-0.2 5,-0.2 0.841 109.9 55.4 -85.0 -39.2 2.6 23.1 18.7 107 119 A I H X S+ 0 0 24 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.862 107.3 49.9 -59.8 -38.7 3.6 25.8 21.2 108 120 A D H X S+ 0 0 49 -4,-1.3 4,-2.0 -5,-0.2 -1,-0.2 0.871 108.6 51.1 -71.4 -37.2 3.7 23.3 24.0 109 121 A K H X S+ 0 0 132 -4,-0.9 4,-2.1 2,-0.2 -2,-0.2 0.928 113.9 44.1 -64.7 -45.5 5.9 20.8 22.1 110 122 A R H X S+ 0 0 25 -4,-2.2 4,-3.4 2,-0.2 5,-0.3 0.908 111.5 52.2 -65.7 -46.3 8.5 23.5 21.2 111 123 A V H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 5,-0.2 0.934 111.8 47.5 -56.8 -46.5 8.5 25.1 24.7 112 124 A R H X S+ 0 0 162 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.923 113.6 48.6 -59.5 -46.2 9.2 21.7 26.3 113 125 A W H X S+ 0 0 70 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.946 115.9 41.9 -60.3 -50.3 11.9 21.0 23.7 114 126 A A H X S+ 0 0 0 -4,-3.4 4,-1.8 1,-0.2 -2,-0.2 0.914 114.0 52.4 -64.6 -43.4 13.6 24.4 24.2 115 127 A A H <>S+ 0 0 0 -4,-3.1 5,-2.9 -5,-0.3 6,-0.6 0.884 110.3 48.0 -61.2 -40.0 13.2 24.2 28.0 116 128 A E H ><5S+ 0 0 88 -4,-2.4 3,-1.2 -5,-0.2 -1,-0.2 0.925 108.9 54.6 -66.9 -42.2 14.8 20.8 28.0 117 129 A L H 3<5S+ 0 0 16 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.826 114.1 40.4 -60.0 -34.7 17.7 22.0 25.8 118 130 A L T 3<5S- 0 0 1 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.401 110.8-122.9 -94.2 2.1 18.4 24.8 28.2 119 131 A Q T < 5S+ 0 0 115 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.899 80.7 115.9 57.9 41.9 17.9 22.6 31.3 120 132 A I > < + 0 0 1 -5,-2.9 3,-2.3 -6,-0.1 4,-0.3 0.142 24.6 118.9-123.0 18.9 15.2 24.9 32.6 121 133 A E G > S+ 0 0 68 -6,-0.6 3,-0.9 1,-0.3 4,-0.2 0.795 74.0 58.6 -55.2 -28.9 12.2 22.5 32.4 122 134 A E G 3 S+ 0 0 139 1,-0.2 -1,-0.3 -7,-0.1 3,-0.1 0.408 102.3 53.0 -83.2 1.7 11.8 22.8 36.2 123 135 A L G X S+ 0 0 9 -3,-2.3 3,-1.8 1,-0.1 -33,-0.5 0.289 74.4 108.5-115.0 5.6 11.3 26.6 36.1 124 136 A L T < S+ 0 0 29 -3,-0.9 -33,-2.5 -4,-0.3 -32,-0.3 0.837 84.7 38.5 -54.6 -38.1 8.6 26.6 33.5 125 137 A N T 3 S+ 0 0 129 -4,-0.2 -1,-0.3 -35,-0.2 2,-0.2 0.338 101.2 98.6 -96.5 8.9 5.8 27.6 36.0 126 138 A R S < S- 0 0 79 -3,-1.8 -36,-2.3 1,-0.0 -35,-0.2 -0.543 70.2-121.5 -93.5 160.6 8.1 30.0 37.8 127 139 A Y > - 0 0 109 -38,-0.2 4,-1.7 -2,-0.2 3,-0.4 -0.662 21.9-111.1-101.2 157.4 8.3 33.8 37.4 128 140 A P T >4 S+ 0 0 42 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.946 118.0 44.3 -46.2 -67.4 11.3 36.0 36.4 129 141 A A T 34 S+ 0 0 112 1,-0.3 -3,-0.0 -3,-0.0 0, 0.0 0.768 119.1 46.9 -52.0 -27.7 11.7 37.8 39.8 130 142 A Q T 34 S+ 0 0 102 -3,-0.4 2,-1.5 2,-0.0 3,-0.4 0.675 79.6 115.6 -88.0 -20.5 11.3 34.4 41.4 131 143 A L << + 0 0 23 -4,-1.7 5,-0.2 -3,-1.5 -8,-0.0 -0.297 29.8 125.8 -56.3 87.9 13.7 32.7 38.9 132 144 A S + 0 0 109 -2,-1.5 -1,-0.2 3,-0.1 -2,-0.0 0.656 59.2 64.1-114.9 -36.7 16.3 31.8 41.6 133 145 A G S S+ 0 0 57 -3,-0.4 2,-0.2 -11,-0.1 -2,-0.1 0.450 118.8 6.7 -71.9 0.9 16.6 28.0 40.9 134 146 A G S S- 0 0 23 -11,-0.1 2,-0.4 -14,-0.0 -14,-0.1 -0.468 92.8 -71.0-147.8-139.8 18.0 28.8 37.4 135 147 A Q > - 0 0 47 -2,-0.2 4,-1.3 1,-0.1 -3,-0.1 -0.996 11.1-151.6-140.1 131.3 19.1 31.6 35.2 136 148 A R H > S+ 0 0 104 -2,-0.4 4,-1.6 -5,-0.2 5,-0.1 0.707 103.5 65.0 -69.4 -18.9 17.1 34.3 33.5 137 149 A Q H > S+ 0 0 36 1,-0.2 4,-1.6 2,-0.2 3,-0.3 0.964 98.6 48.8 -66.6 -51.0 20.0 34.1 31.0 138 150 A R H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.830 107.7 56.4 -57.7 -34.3 19.1 30.5 30.0 139 151 A V H X S+ 0 0 2 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.898 103.4 53.6 -66.1 -41.1 15.4 31.6 29.5 140 152 A A H X S+ 0 0 21 -4,-1.6 4,-1.7 -3,-0.3 -1,-0.2 0.888 110.1 47.7 -60.8 -40.3 16.4 34.3 27.0 141 153 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.914 108.2 53.4 -68.9 -42.1 18.3 31.7 25.0 142 154 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.893 109.4 50.8 -59.4 -38.8 15.4 29.2 25.0 143 155 A R H < S+ 0 0 81 -4,-2.1 4,-0.5 2,-0.2 -1,-0.2 0.889 108.8 51.1 -66.1 -38.9 13.2 31.9 23.7 144 156 A A H >< S+ 0 0 10 -4,-1.7 3,-0.5 1,-0.2 -2,-0.2 0.914 117.3 38.8 -66.1 -40.6 15.6 32.7 20.9 145 157 A I H >< S+ 0 0 2 -4,-2.5 3,-2.1 1,-0.2 -1,-0.2 0.657 92.9 85.9 -86.1 -12.2 15.8 29.1 19.8 146 158 A V T 3< S+ 0 0 0 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.779 87.1 55.2 -58.8 -26.7 12.1 28.2 20.3 147 159 A V T < S- 0 0 26 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.519 107.7-126.7 -83.4 -5.0 11.3 29.6 16.8 148 160 A E < - 0 0 39 -3,-2.1 -145,-0.2 1,-0.1 -3,-0.1 0.980 33.9-156.9 57.6 60.5 13.9 27.2 15.2 149 161 A P - 0 0 3 0, 0.0 -146,-0.3 0, 0.0 -69,-0.2 -0.261 22.1-139.2 -67.1 153.6 15.7 30.0 13.3 150 162 A D S S+ 0 0 13 -71,-3.1 -145,-0.6 1,-0.3 33,-0.6 0.693 97.0 29.1 -82.9 -21.5 17.8 29.2 10.3 151 163 A V E S-fg 80 183B 0 -72,-1.3 -70,-1.3 31,-0.1 2,-0.5 -0.986 74.0-152.5-142.8 127.6 20.3 31.7 11.6 152 164 A L E -fg 81 184B 4 31,-2.8 33,-2.4 -2,-0.4 2,-0.5 -0.873 14.7-167.3-102.4 128.5 21.0 32.6 15.2 153 165 A L E -fg 82 185B 0 -72,-2.9 -70,-2.7 -2,-0.5 2,-0.4 -0.968 6.5-178.7-121.9 129.8 22.3 36.1 15.8 154 166 A M E -fg 83 186B 2 31,-2.3 33,-3.2 -2,-0.5 2,-0.6 -0.989 12.0-163.2-133.8 130.4 23.8 37.3 19.1 155 167 A D E S-fg 84 187B 37 -72,-2.6 -70,-0.8 -2,-0.4 33,-0.1 -0.924 73.6 -49.2-114.0 105.7 25.1 40.8 20.0 156 168 A E S > S+ 0 0 22 31,-3.0 3,-1.2 -2,-0.6 -1,-0.1 0.838 74.1 173.6 33.7 57.4 27.3 40.8 23.1 157 169 A P T 3 S+ 0 0 1 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.641 71.2 45.9 -65.0 -17.8 24.6 38.8 25.0 158 170 A L T > S+ 0 0 0 1,-0.1 3,-0.7 -73,-0.0 -2,-0.1 0.282 70.9 116.2-113.2 10.3 26.8 38.4 28.1 159 171 A S T < S+ 0 0 48 -3,-1.2 2,-0.4 1,-0.3 -1,-0.1 0.756 78.2 48.4 -51.6 -32.6 28.3 41.9 28.7 160 172 A N T 3 S+ 0 0 131 -75,-0.4 2,-0.3 -3,-0.2 -1,-0.3 -0.443 87.6 104.0-111.5 60.0 26.6 42.4 32.1 161 173 A L S < S- 0 0 34 -3,-0.7 5,-0.1 -2,-0.4 -3,-0.0 -0.988 76.1 -97.4-136.9 144.9 27.4 39.1 33.9 162 174 A D >> - 0 0 97 -2,-0.3 4,-2.9 1,-0.1 3,-0.7 -0.323 42.4-109.2 -61.4 141.9 29.8 38.3 36.7 163 175 A A H 3> S+ 0 0 85 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.825 118.0 49.3 -38.7 -48.1 33.1 36.8 35.4 164 176 A K H 3> S+ 0 0 182 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.900 114.2 43.6 -64.4 -42.7 32.2 33.3 36.8 165 177 A L H <> S+ 0 0 47 -3,-0.7 4,-2.3 2,-0.2 -2,-0.2 0.847 108.6 60.2 -72.1 -31.9 28.7 33.3 35.4 166 178 A R H X S+ 0 0 30 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.953 105.0 47.3 -61.3 -47.1 29.9 34.6 32.1 167 179 A V H X S+ 0 0 84 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.911 110.9 52.1 -60.3 -42.8 32.2 31.6 31.6 168 180 A A H X S+ 0 0 51 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.887 111.2 48.0 -60.2 -39.9 29.4 29.2 32.5 169 181 A M H X S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.902 107.1 55.1 -68.5 -42.1 27.2 30.9 29.9 170 182 A R H X S+ 0 0 21 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.963 113.1 42.8 -54.0 -52.7 29.9 30.8 27.1 171 183 A A H X S+ 0 0 41 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.909 114.2 51.2 -59.7 -46.3 30.1 27.1 27.6 172 184 A E H X S+ 0 0 34 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.965 113.9 43.1 -57.1 -53.5 26.3 26.7 27.9 173 185 A I H X S+ 0 0 3 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.935 114.8 49.6 -60.0 -46.6 25.7 28.6 24.6 174 186 A K H X S+ 0 0 23 -4,-2.8 4,-2.1 -5,-0.3 5,-0.2 0.927 112.0 46.7 -60.4 -48.3 28.5 26.9 22.7 175 187 A K H X S+ 0 0 139 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.895 111.8 52.0 -61.8 -40.4 27.5 23.4 23.6 176 188 A L H X S+ 0 0 12 -4,-2.1 4,-2.6 -5,-0.3 3,-0.3 0.928 109.5 49.1 -59.9 -47.2 23.9 24.2 22.8 177 189 A Q H X>S+ 0 0 3 -4,-2.5 4,-3.4 1,-0.2 5,-0.6 0.865 109.5 52.3 -62.6 -36.0 24.9 25.5 19.4 178 190 A Q H <5S+ 0 0 105 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.750 111.0 48.1 -71.5 -25.4 27.0 22.3 18.7 179 191 A K H <5S+ 0 0 137 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.903 121.2 35.4 -78.6 -42.1 24.0 20.2 19.6 180 192 A L H <5S- 0 0 23 -4,-2.6 -2,-0.2 -5,-0.1 -3,-0.2 0.826 87.3-151.3 -80.0 -30.6 21.7 22.3 17.3 181 193 A K T <5 + 0 0 75 -4,-3.4 2,-0.5 1,-0.2 -3,-0.2 0.827 36.6 160.1 59.5 30.8 24.2 23.0 14.6 182 194 A V < - 0 0 2 -5,-0.6 -1,-0.2 -150,-0.1 -178,-0.1 -0.745 51.4-106.3 -84.1 130.2 22.3 26.2 13.9 183 195 A T E - g 0 151B 0 -33,-0.6 -31,-2.8 -180,-0.5 2,-0.4 -0.369 46.1-167.3 -56.1 125.1 24.5 28.7 12.0 184 196 A T E -dg 34 152B 0 -151,-2.7 -149,-3.4 -33,-0.2 2,-0.6 -0.980 20.5-165.6-128.4 130.5 25.3 31.3 14.6 185 197 A I E -dg 35 153B 0 -33,-2.4 -31,-2.3 -2,-0.4 2,-0.5 -0.970 18.7-169.8-115.2 115.5 26.9 34.8 14.0 186 198 A Y E -dg 36 154B 0 -151,-3.2 -149,-3.5 -2,-0.6 2,-0.5 -0.940 9.4-154.4-118.0 122.7 28.1 36.1 17.4 187 199 A V E +dg 37 155B 0 -33,-3.2 -31,-3.0 -2,-0.5 2,-0.3 -0.825 28.5 143.6-100.1 126.7 29.3 39.7 18.0 188 200 A T E -d 38 0B 0 -151,-2.3 -149,-1.2 -2,-0.5 -2,-0.0 -0.990 43.4-154.9-156.2 152.6 31.8 40.5 20.8 189 201 A H S S+ 0 0 93 -2,-0.3 2,-0.9 -151,-0.2 -151,-0.1 0.353 74.3 101.5-105.6 1.8 34.7 42.9 21.5 190 202 A D > - 0 0 35 1,-0.2 4,-2.5 -150,-0.1 3,-0.3 -0.767 56.1-165.2 -92.9 102.0 36.0 40.4 24.1 191 203 A Q H > S+ 0 0 38 -2,-0.9 4,-2.7 1,-0.2 5,-0.2 0.858 87.9 53.4 -55.6 -41.7 38.9 38.3 22.7 192 204 A V H > S+ 0 0 67 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.916 111.4 46.7 -61.5 -40.3 38.8 35.6 25.4 193 205 A E H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 5,-0.3 0.919 111.5 51.9 -66.7 -42.3 35.0 35.1 24.7 194 206 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.951 110.2 47.4 -58.7 -50.0 35.7 35.0 21.0 195 207 A M H < S+ 0 0 56 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.802 113.6 50.8 -61.2 -30.3 38.4 32.3 21.4 196 208 A T H < S+ 0 0 70 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.848 121.7 26.6 -76.7 -36.9 36.1 30.3 23.7 197 209 A M H < S+ 0 0 0 -4,-2.3 2,-0.2 -3,-0.1 -2,-0.2 0.819 94.6 88.9-103.2 -31.5 33.1 30.3 21.4 198 210 A G < - 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