==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECOMBINATION 01-JAN-07 2OES . COMPND 2 MOLECULE: PROTEIN RECA; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR R.KRISHNA,J.RAJAN PRABU,G.P.MANJUNATH,S.DATTA,N.R.CHANDRA, . 319 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15769.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 235 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 10.3 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 . 2 0.6 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 . 29 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 1 2 0 0 1 1 0 2 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 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 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 4 A Q 0 0 64 0, 0.0 5,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 175.2 84.0 48.3 61.9 2 5 A A - 0 0 94 1,-0.2 0, 0.0 3,-0.1 0, 0.0 -0.866 360.0 -38.0 -93.0 108.0 84.3 44.9 60.2 3 6 A P S S+ 0 0 94 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.716 123.6 95.1 15.4 60.0 80.6 44.1 59.3 4 7 A D S > S+ 0 0 102 3,-0.1 4,-1.7 2,-0.1 5,-0.3 0.538 84.1 55.7-124.4 -56.9 79.7 45.5 62.3 5 8 A R H >> S+ 0 0 188 1,-0.3 3,-2.6 2,-0.2 4,-1.2 0.911 116.6 32.1 -40.8 -83.3 79.3 48.4 59.8 6 9 A E H 3> S+ 0 0 100 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.785 116.0 62.8 -44.2 -38.9 76.9 46.5 57.5 7 10 A K H 3> S+ 0 0 38 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.674 110.6 34.1 -71.0 -19.4 75.5 44.7 60.5 8 11 A A H X S+ 0 0 43 -4,-3.0 4,-1.8 2,-0.2 3,-0.5 0.978 115.7 45.5 -55.3 -67.4 69.4 50.7 61.9 13 16 A M H 3X S+ 0 0 57 -4,-4.2 4,-1.9 1,-0.2 3,-0.2 0.883 110.8 57.9 -44.9 -47.5 67.7 50.5 58.5 14 17 A A H 3X S+ 0 0 57 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.896 105.3 46.8 -52.5 -50.8 65.5 47.7 60.0 15 18 A Q H < S+ 0 0 85 -4,-1.9 3,-0.5 2,-0.2 -2,-0.2 0.991 118.4 40.3 -62.2 -60.9 59.6 49.3 61.7 19 22 A N H 3< S+ 0 0 129 -4,-4.2 -2,-0.2 1,-0.2 -3,-0.2 0.846 135.4 18.2 -56.6 -42.6 59.3 52.9 63.1 20 23 A F H 3< S- 0 0 158 -4,-3.6 -1,-0.2 1,-0.4 -2,-0.2 0.183 115.3 -99.6-118.9 15.8 58.2 54.5 59.9 21 24 A G X< - 0 0 34 -4,-1.3 3,-0.6 -3,-0.5 -1,-0.4 -0.165 49.0 -62.6 90.9 171.6 57.0 51.7 57.8 22 25 A K G > S+ 0 0 125 1,-0.2 3,-1.1 2,-0.1 -1,-0.1 0.992 120.3 56.5 -63.6 -74.5 58.7 49.8 55.1 23 26 A G G 3 S+ 0 0 16 220,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.544 80.1 98.9 -39.0 -12.2 59.4 52.3 52.2 24 27 A S G < S+ 0 0 40 -3,-0.6 2,-0.4 1,-0.2 -1,-0.2 0.885 91.4 18.2 -46.3 -54.5 61.3 54.6 54.5 25 28 A V S < S+ 0 0 51 -3,-1.1 2,-0.3 -12,-0.2 -1,-0.2 -0.986 75.1 159.0-126.9 132.8 64.8 53.5 53.5 26 29 A M - 0 0 61 -2,-0.4 2,-0.4 -3,-0.1 219,-0.0 -0.864 37.1-122.7-140.9 173.2 65.7 51.6 50.4 27 30 A R > - 0 0 117 -2,-0.3 3,-0.9 1,-0.1 -2,-0.0 -0.980 24.4-131.8-117.6 131.0 68.7 50.8 48.1 28 31 A L T 3 S+ 0 0 125 -2,-0.4 -1,-0.1 1,-0.2 217,-0.0 0.762 105.2 51.7 -55.4 -17.7 68.2 51.9 44.5 29 32 A G T 3 S+ 0 0 67 -3,-0.0 -1,-0.2 2,-0.0 -3,-0.0 0.715 79.9 100.2 -97.0 -19.2 69.4 48.4 43.7 30 33 A E < - 0 0 128 -3,-0.9 -3,-0.0 1,-0.1 -4,-0.0 -0.228 56.9-145.8 -71.4 159.6 67.4 45.8 45.7 31 34 A E + 0 0 176 214,-0.1 -1,-0.1 3,-0.0 -3,-0.0 0.511 45.5 158.9 -95.9 -10.4 64.6 43.7 44.2 32 35 A V + 0 0 68 213,-0.1 0, 0.0 2,-0.0 0, 0.0 0.558 33.5 8.4 -13.6 153.7 62.6 43.6 47.5 33 36 A R - 0 0 116 1,-0.1 212,-0.0 212,-0.1 211,-0.0 0.191 44.9-164.5 59.4-175.3 58.9 42.9 48.1 34 37 A Q - 0 0 109 210,-0.1 2,-0.2 211,-0.0 -1,-0.1 0.032 6.7-158.6 157.2 86.5 56.0 41.7 45.9 35 38 A P - 0 0 37 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.561 26.0-129.9 -80.6 148.7 52.3 42.0 46.9 36 39 A I S S+ 0 0 123 -2,-0.2 2,-0.3 0, 0.0 16,-0.0 0.281 92.7 84.6 -76.6 15.3 49.9 39.7 45.1 37 40 A S + 0 0 46 20,-0.1 2,-0.2 17,-0.1 17,-0.1 -0.868 49.2 117.4-116.5 150.4 48.1 43.1 44.6 38 41 A V - 0 0 32 -2,-0.3 17,-0.1 18,-0.1 15,-0.0 -0.448 50.6-125.6 154.2 130.1 48.8 45.6 41.8 39 42 A I B -A 55 0A 3 16,-2.4 16,-2.4 -2,-0.2 2,-0.4 -0.857 32.8-120.3 -97.6 128.4 46.8 47.2 38.9 40 43 A P - 0 0 58 0, 0.0 41,-0.2 0, 0.0 14,-0.2 -0.524 9.2-150.4 -69.1 118.9 48.5 46.8 35.5 41 44 A T - 0 0 0 -2,-0.4 37,-0.2 12,-0.2 36,-0.1 0.695 47.9-109.7 -61.4 -17.8 49.1 50.3 34.0 42 45 A G S S+ 0 0 29 35,-0.1 2,-0.3 36,-0.1 -1,-0.1 0.666 94.9 93.8 94.6 19.4 48.7 48.4 30.8 43 46 A S > - 0 0 2 1,-0.1 4,-3.1 210,-0.0 5,-0.2 -0.805 60.7-157.0-146.4 99.7 52.4 48.7 29.9 44 47 A I H > S+ 0 0 33 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.838 100.1 56.6 -43.4 -34.3 54.7 45.9 30.9 45 48 A S H > S+ 0 0 13 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.991 109.2 39.7 -62.1 -64.4 57.3 48.6 30.6 46 49 A L H > S+ 0 0 2 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.883 117.7 53.3 -53.6 -40.0 55.8 51.1 33.1 47 50 A D H >X S+ 0 0 13 -4,-3.1 3,-1.7 2,-0.2 6,-1.0 0.986 107.5 45.5 -61.7 -61.9 54.9 48.1 35.3 48 51 A V H 3< S+ 0 0 50 -4,-2.9 3,-0.3 1,-0.3 -1,-0.2 0.780 113.0 56.4 -54.0 -23.0 58.3 46.5 35.6 49 52 A A H 3< S+ 0 0 7 -4,-1.6 -1,-0.3 -5,-0.2 200,-0.3 0.764 100.8 54.7 -79.2 -28.1 59.4 50.1 36.2 50 53 A L H << S- 0 0 1 -3,-1.7 2,-2.3 -4,-1.3 -1,-0.2 0.524 101.9-142.8 -81.5 -4.3 57.1 50.4 39.1 51 54 A G S < S+ 0 0 27 -4,-0.7 -1,-0.2 -3,-0.3 -4,-0.1 -0.351 89.1 67.2 77.8 -61.5 58.7 47.3 40.4 52 55 A I S S- 0 0 7 -2,-2.3 -1,-0.2 2,-0.2 -4,-0.1 0.527 114.7-106.5 -70.6 -7.7 55.5 45.8 41.9 53 56 A G S S- 0 0 22 -6,-1.0 2,-0.3 -7,-0.2 -5,-0.2 0.412 85.6 -1.4 98.9 -2.6 54.1 45.2 38.4 54 57 A G S S- 0 0 0 -7,-0.4 -2,-0.2 -14,-0.2 -1,-0.1 -0.972 106.6 -35.8 170.8-175.8 51.5 48.0 38.5 55 58 A L B -A 39 0A 1 -16,-2.4 -16,-2.4 -2,-0.3 2,-0.4 -0.542 69.2-114.9 -69.3 124.8 50.0 50.8 40.6 56 59 A P > - 0 0 7 0, 0.0 3,-0.9 0, 0.0 -18,-0.1 -0.469 30.3-129.5 -64.1 116.9 50.0 49.5 44.2 57 60 A R T 3 S+ 0 0 77 -2,-0.4 129,-0.2 1,-0.2 3,-0.1 -0.270 87.5 29.3 -65.0 153.2 46.4 49.1 45.4 58 61 A G T 3 S+ 0 0 10 1,-0.3 128,-0.3 80,-0.3 127,-0.2 -0.065 103.3 87.7 89.7 -35.0 45.5 50.7 48.7 59 62 A R S < S- 0 0 81 -3,-0.9 129,-1.0 126,-0.1 2,-0.4 -0.336 84.9-102.7 -89.4 174.9 48.1 53.4 48.5 60 63 A V E -b 188 0B 2 151,-0.4 153,-2.6 127,-0.2 154,-0.7 -0.877 31.1-154.4-107.3 134.3 47.4 56.8 46.7 61 64 A I E -bc 189 214B 0 127,-3.3 129,-1.5 -2,-0.4 2,-0.5 -0.902 9.1-169.0-116.6 135.1 48.6 57.7 43.2 62 65 A E E -bc 190 215B 4 152,-1.7 154,-2.1 -2,-0.4 2,-0.6 -0.965 1.5-170.0-119.6 121.3 49.4 61.1 41.5 63 66 A I E +bc 191 216B 1 127,-2.7 129,-2.3 -2,-0.5 2,-0.3 -0.924 16.7 175.9-111.5 108.4 50.1 61.4 37.8 64 67 A Y E + c 0 217B 36 152,-2.1 154,-1.4 -2,-0.6 129,-0.2 -0.780 12.9 119.4-114.8 160.3 51.3 64.8 36.8 65 68 A G - 0 0 0 -2,-0.3 129,-0.2 127,-0.2 154,-0.2 -0.757 56.9 -62.0 159.0 155.4 52.5 66.3 33.5 66 69 A P S S- 0 0 29 0, 0.0 3,-0.4 0, 0.0 4,-0.2 -0.002 70.5 -74.1 -52.4 156.8 52.0 69.0 30.8 67 70 A E S S+ 0 0 162 127,-0.3 126,-0.0 1,-0.2 128,-0.0 -0.271 115.5 18.0 -60.2 138.2 48.8 69.2 28.7 68 71 A S S S+ 0 0 99 -3,-0.1 -1,-0.2 151,-0.0 152,-0.1 0.935 91.8 115.1 67.3 50.7 48.4 66.5 26.0 69 72 A S S S- 0 0 8 -3,-0.4 150,-0.2 -4,-0.1 -2,-0.1 0.624 85.2 -92.0-121.1 -26.4 51.0 64.1 27.4 70 73 A G S >> S+ 0 0 8 -4,-0.2 3,-1.2 148,-0.1 4,-1.2 -0.124 78.2 125.0 145.3 -49.1 49.2 61.0 28.5 71 74 A K H >> S+ 0 0 14 1,-0.3 4,-1.9 2,-0.2 3,-1.1 0.579 83.7 41.4 -6.9 -83.1 48.2 61.1 32.1 72 75 A T H 3> S+ 0 0 53 1,-0.3 4,-4.7 2,-0.2 5,-0.5 0.910 110.1 58.3 -41.0 -58.7 44.5 60.4 31.6 73 76 A T H <> S+ 0 0 10 -3,-1.2 4,-1.9 1,-0.2 -1,-0.3 0.864 110.3 45.5 -41.5 -43.9 45.2 57.7 29.0 74 77 A V H S+ 0 0 8 -4,-1.4 5,-1.4 1,-0.3 -1,-0.2 0.729 115.5 49.9 -46.5 -20.3 41.0 46.9 37.6 83 86 A Q H ><5S+ 0 0 19 -4,-1.7 3,-1.4 1,-0.2 -1,-0.3 0.905 99.0 60.9 -84.5 -49.0 37.5 46.8 36.1 84 87 A A H 3<5S+ 0 0 90 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.473 103.9 57.4 -58.7 0.4 38.1 43.9 33.8 85 88 A A T 3<5S- 0 0 83 -4,-0.7 -1,-0.3 2,-0.2 -2,-0.1 -0.138 130.7 -80.1-127.0 37.7 38.8 41.9 37.0 86 89 A G T < 5S+ 0 0 78 -3,-1.4 2,-0.2 1,-0.3 -3,-0.2 0.314 92.2 118.2 88.1 -8.6 35.5 42.4 38.9 87 90 A G < - 0 0 5 -5,-1.4 2,-0.4 -6,-0.2 -1,-0.3 -0.614 54.3-136.4 -95.4 154.6 36.1 45.9 40.3 88 91 A I E -d 137 0B 77 48,-0.6 50,-1.9 -2,-0.2 51,-0.5 -0.900 17.2-147.2-109.2 140.7 34.1 49.0 39.7 89 92 A A E -d 139 0B 2 -2,-0.4 25,-2.2 23,-0.2 2,-0.4 -0.818 3.8-154.8-109.9 145.3 35.7 52.4 39.1 90 93 A A E -de 140 114B 1 49,-1.4 51,-2.2 -2,-0.3 2,-0.6 -0.979 4.2-159.9-122.6 127.1 34.6 55.9 40.0 91 94 A F E -de 141 115B 6 23,-3.5 25,-1.9 -2,-0.4 2,-0.9 -0.919 4.8-157.0-107.9 110.3 35.7 59.0 38.1 92 95 A I E -de 142 116B 0 49,-1.9 51,-2.7 -2,-0.6 2,-0.5 -0.803 20.5-162.7 -90.1 108.0 35.4 62.3 39.9 93 96 A D E +d 143 0B 6 23,-3.0 51,-0.1 -2,-0.9 49,-0.1 -0.809 36.8 146.0-101.2 127.0 35.2 64.8 37.1 94 97 A A S S+ 0 0 23 49,-0.7 -1,-0.1 -2,-0.5 50,-0.1 0.250 74.6 63.0-133.6 2.4 35.8 68.5 37.5 95 98 A E S S- 0 0 79 48,-0.1 49,-0.1 2,-0.0 -2,-0.1 0.464 88.2-145.9-105.1 -5.6 37.4 69.2 34.2 96 99 A H + 0 0 127 1,-0.1 2,-0.1 47,-0.1 21,-0.0 0.877 63.2 113.1 39.5 52.8 34.3 68.2 32.2 97 100 A A + 0 0 72 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.522 31.3 127.9-152.4 79.1 36.4 66.7 29.4 98 101 A L - 0 0 58 -2,-0.1 3,-0.1 -5,-0.0 -5,-0.0 -0.791 40.1-151.4-125.0 166.7 36.1 63.0 29.1 99 102 A D >> - 0 0 92 -2,-0.3 4,-2.0 1,-0.1 3,-1.2 -0.729 6.3-167.9-145.5 90.9 35.3 60.9 26.0 100 103 A P H 3> S+ 0 0 68 0, 0.0 4,-3.3 0, 0.0 5,-0.3 0.856 89.9 67.2 -45.9 -34.8 33.6 57.6 26.6 101 104 A E H 3> S+ 0 0 50 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.917 107.6 35.8 -51.2 -51.2 34.5 56.9 23.0 102 105 A Y H <> S+ 0 0 49 -3,-1.2 4,-1.2 2,-0.2 3,-0.2 0.979 115.1 54.8 -67.3 -58.6 38.2 56.8 23.7 103 106 A A H >X>S+ 0 0 1 -4,-2.0 5,-1.5 1,-0.2 4,-1.5 0.881 109.4 49.8 -41.9 -48.1 37.9 55.2 27.1 104 107 A K H 3<5S+ 0 0 51 -4,-3.3 3,-0.4 1,-0.3 -1,-0.2 0.923 103.8 55.7 -60.9 -48.0 35.9 52.4 25.5 105 108 A K H 3<5S+ 0 0 139 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.686 109.6 52.2 -60.0 -14.0 38.4 51.8 22.7 106 109 A L H <<5S- 0 0 23 -4,-1.2 -1,-0.2 -3,-1.0 -2,-0.2 0.836 129.3 -91.2 -89.3 -36.8 40.8 51.3 25.6 107 110 A G T <5S+ 0 0 49 -4,-1.5 -3,-0.2 -3,-0.4 -2,-0.1 0.192 75.0 139.6 147.2 -17.3 38.8 48.8 27.6 108 111 A V < - 0 0 8 -5,-1.5 2,-1.0 -6,-0.1 -1,-0.2 -0.182 49.8-139.8 -58.2 141.0 36.6 50.7 30.0 109 112 A D > + 0 0 91 1,-0.2 3,-2.2 3,-0.1 4,-0.4 -0.576 26.6 178.8-100.1 67.5 33.0 49.6 30.6 110 113 A T G > S+ 0 0 38 -2,-1.0 3,-3.5 1,-0.3 -1,-0.2 0.839 74.0 66.7 -34.2 -50.8 31.8 53.3 30.7 111 114 A D G 3 S+ 0 0 150 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.859 109.8 34.8 -40.0 -50.5 28.3 51.9 31.2 112 115 A S G < S+ 0 0 45 -3,-2.2 2,-0.4 2,-0.1 -1,-0.3 0.254 96.9 114.1 -92.8 12.2 29.3 50.7 34.6 113 116 A L < - 0 0 26 -3,-3.5 2,-0.5 -4,-0.4 -23,-0.2 -0.713 64.7-135.3 -87.0 129.0 31.6 53.6 35.1 114 117 A L E -e 90 0B 83 -25,-2.2 -23,-3.5 -2,-0.4 2,-0.4 -0.729 23.7-171.8 -85.2 125.4 30.6 56.0 37.9 115 118 A V E -e 91 0B 74 -2,-0.5 2,-0.3 -25,-0.2 -23,-0.2 -0.964 4.3-178.4-119.4 135.0 30.9 59.6 36.9 116 119 A S E -e 92 0B 26 -25,-1.9 -23,-3.0 -2,-0.4 8,-0.0 -0.979 13.8-165.1-132.6 145.2 30.5 62.5 39.3 117 120 A Q - 0 0 114 -2,-0.3 -23,-0.1 -25,-0.2 -25,-0.1 -0.634 16.4-161.8-135.1 79.0 30.7 66.2 38.6 118 121 A P - 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H 0 255B 20 22,-0.9 22,-2.4 -2,-0.2 2,-0.7 -0.956 26.6-120.1-145.4 161.7 53.1 59.6 20.5 234 243 A R E -GH 222 254B 42 -12,-2.9 -13,-2.5 -2,-0.3 -12,-1.4 -0.933 36.4-163.4-104.7 111.8 56.1 58.3 22.4 235 244 A T E -GH 220 253B 1 18,-2.7 18,-2.0 -2,-0.7 2,-0.4 -0.824 6.7-159.2-102.9 139.6 55.5 58.9 26.1 236 245 A R E -GH 219 252B 96 -17,-1.6 -17,-2.0 -2,-0.4 2,-0.5 -0.948 5.5-163.8-116.6 135.9 58.1 58.8 28.8 237 246 A V E -GH 218 251B 1 14,-2.4 14,-1.4 -2,-0.4 2,-0.7 -0.973 5.3-164.8-126.4 122.6 57.3 58.2 32.4 238 247 A K E -GH 217 250B 78 -21,-0.8 -21,-2.2 -2,-0.5 2,-1.8 -0.910 13.8-148.7-108.9 110.8 59.6 58.9 35.3 239 248 A V E +G 216 0B 2 10,-1.2 9,-2.2 -2,-0.7 10,-0.4 -0.597 22.9 177.7 -76.8 86.9 58.5 57.3 38.6 240 249 A V E + 0 0 33 -2,-1.8 2,-0.3 -25,-1.0 -1,-0.2 0.412 65.8 25.5 -75.1 0.8 60.0 60.1 40.7 241 250 A K E +G 215 0B 43 -26,-0.6 -26,-1.6 5,-0.1 -1,-0.2 -0.809 60.2 172.8-164.8 122.2 58.8 58.6 44.0 242 251 A N E > +G 214 0B 5 -2,-0.3 3,-0.8 -28,-0.2 -28,-0.2 -0.551 8.6 174.4-139.6 75.3 58.1 55.0 44.8 243 252 A K T 3 S+ 0 0 77 -30,-1.3 -220,-0.4 1,-0.2 -29,-0.1 0.516 84.8 53.3 -57.0 -2.9 57.3 54.1 48.4 244 253 A V T 3 S- 0 0 9 -31,-0.5 -1,-0.2 1,-0.1 -30,-0.1 0.788 124.9 -5.2-105.4 -33.9 56.5 50.6 47.3 245 254 A S S < S- 0 0 3 -3,-0.8 -3,-0.1 -222,-0.0 -1,-0.1 -0.638 107.0 -48.9-137.4-162.4 59.6 49.5 45.4 246 255 A P - 0 0 2 0, 0.0 3,-0.3 0, 0.0 -5,-0.1 -0.535 60.0-138.9 -79.2 145.8 62.7 51.5 44.4 247 256 A P + 0 0 28 0, 0.0 -7,-0.2 0, 0.0 3,-0.1 -0.185 69.6 56.9 -89.2-173.2 62.1 54.9 42.8 248 257 A F S S+ 0 0 137 -9,-2.2 -8,-0.2 1,-0.2 -220,-0.0 0.514 71.8 126.7 71.4 8.8 63.7 56.8 40.0 249 258 A K - 0 0 74 -10,-0.4 -10,-1.2 -3,-0.3 2,-0.3 -0.111 37.7-168.2 -80.0-174.5 63.1 54.2 37.3 250 259 A Q E -H 238 0B 88 -12,-0.2 2,-0.3 -205,-0.1 -12,-0.2 -0.881 12.7-173.1-176.5 146.7 61.4 55.0 34.0 251 260 A A E -H 237 0B 10 -14,-1.4 -14,-2.4 -2,-0.3 2,-0.3 -0.932 12.4-141.9-141.3 163.0 59.8 53.5 30.9 252 261 A E E +H 236 0B 46 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.868 18.4 171.4-126.4 161.1 58.4 54.6 27.6 253 262 A F E -H 235 0B 0 -18,-2.0 -18,-2.7 -2,-0.3 2,-0.5 -0.968 32.4-102.5-158.7 170.9 55.5 53.5 25.4 254 263 A D E -H 234 0B 3 8,-0.3 8,-3.1 -2,-0.3 2,-0.9 -0.906 19.4-165.3-109.6 124.9 53.4 54.4 22.3 255 264 A I E -HI 233 261B 12 -22,-2.4 -22,-0.9 -2,-0.5 6,-0.3 -0.826 17.5-155.5-104.9 92.4 50.0 56.0 22.6 256 265 A L E >> -HI 232 260B 8 4,-2.0 4,-2.5 -2,-0.9 3,-2.3 -0.478 30.1 -95.5 -72.2 138.1 48.5 55.6 19.2 257 266 A Y T 34 S- 0 0 106 -26,-3.4 -1,-0.1 1,-0.3 -27,-0.0 -0.210 105.3 -1.2 -52.7 132.7 45.8 58.1 18.3 258 267 A G T 34 S+ 0 0 38 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.641 130.1 66.0 59.8 17.4 42.3 56.8 19.0 259 268 A Q T <4 S- 0 0 134 -3,-2.3 -2,-0.2 1,-0.1 2,-0.2 0.558 86.7-143.7-135.8 -30.5 43.7 53.5 20.2 260 269 A G E < -I 256 0B 1 -4,-2.5 -4,-2.0 2,-0.1 2,-0.2 -0.489 54.5 -0.9 95.7-166.6 45.7 54.1 23.4 261 270 A I E S-I 255 0B 14 -6,-0.3 2,-0.6 -188,-0.2 -6,-0.2 -0.433 75.6-123.0 -63.4 125.8 48.9 52.5 24.7 262 271 A S > - 0 0 14 -8,-3.1 4,-1.3 -2,-0.2 -8,-0.3 -0.619 22.5-170.9 -79.6 115.4 50.2 49.9 22.4 263 272 A R H >> S+ 0 0 89 -2,-0.6 4,-1.4 2,-0.2 3,-0.6 0.977 88.9 47.5 -63.7 -57.7 50.6 46.4 23.9 264 273 A E H >> S+ 0 0 41 1,-0.3 4,-1.9 2,-0.2 3,-0.6 0.905 108.4 55.0 -50.3 -50.6 52.4 44.9 20.9 265 274 A G H 3> S+ 0 0 1 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.855 108.0 48.7 -55.0 -37.6 54.8 47.9 20.7 266 275 A S H < S+ 0 0 49 -4,-1.8 3,-3.7 4,-0.2 -1,-0.2 0.829 110.7 55.8-102.7 -48.8 64.7 43.3 22.5 273 282 A E H 3< S+ 0 0 156 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.713 119.7 40.7 -57.6 -12.8 66.1 45.2 25.4 274 283 A H T 3< S- 0 0 38 -4,-1.8 2,-0.6 -5,-0.1 -1,-0.3 0.028 113.1-124.7-119.9 21.9 65.9 41.8 27.0 275 284 A G S < S+ 0 0 46 -3,-3.7 -3,-0.2 2,-0.2 -4,-0.1 0.246 76.8 121.6 56.0 -11.1 67.0 39.9 23.9 276 285 A F S S+ 0 0 58 -2,-0.6 11,-0.5 -6,-0.3 2,-0.4 0.601 81.3 46.3 -57.3 -6.6 64.0 37.6 23.6 277 286 A I E S-J 286 0C 3 -6,-2.0 2,-0.5 -7,-0.2 9,-0.2 -0.972 81.0-151.3-138.5 117.3 63.7 39.2 20.2 278 287 A R E -J 285 0C 197 7,-2.4 7,-3.1 -2,-0.4 2,-0.6 -0.794 8.1-146.0 -95.0 131.2 66.7 39.6 17.9 279 288 A K E -J 284 0C 60 -2,-0.5 5,-0.3 5,-0.2 -2,-0.0 -0.849 10.2-169.9 -95.5 122.7 66.6 42.6 15.5 280 289 A S S S- 0 0 88 3,-3.6 4,-0.1 -2,-0.6 -1,-0.1 -0.031 73.6 -57.5 -99.7 28.8 68.4 41.7 12.3 281 290 A G S S- 0 0 54 2,-0.1 3,-0.1 1,-0.1 -1,-0.1 0.895 119.6 -20.1 94.1 71.6 68.3 45.3 11.1 282 291 A S S S+ 0 0 81 1,-0.1 12,-1.4 11,-0.0 2,-0.9 0.228 120.5 105.6 82.7 -13.9 64.7 46.5 11.0 283 292 A W E - K 0 293C 68 10,-0.2 -3,-3.6 8,-0.1 2,-0.5 -0.828 59.1-161.2-102.3 98.6 63.9 42.8 10.9 284 293 A F E -JK 279 292C 30 8,-1.0 7,-2.6 -2,-0.9 8,-0.9 -0.672 13.3-173.0 -81.1 125.4 62.6 41.8 14.3 285 294 A T E -JK 278 290C 23 -7,-3.1 -7,-2.4 -2,-0.5 2,-0.5 -0.980 18.0-152.1-126.8 132.1 62.9 38.0 14.7 286 295 A Y E -J 277 0C 23 3,-1.5 -9,-0.1 -2,-0.4 -10,-0.1 -0.880 69.6 -46.8-101.2 130.9 61.6 35.7 17.5 287 296 A E S S- 0 0 153 -11,-0.5 2,-1.1 -2,-0.5 -1,-0.2 0.598 120.8 -29.9 -1.9 95.1 63.6 32.5 18.0 288 297 A G S S+ 0 0 71 -3,-0.1 -1,-0.2 0, 0.0 -2,-0.0 -0.737 125.1 75.2 89.1 -95.3 64.0 31.4 14.4 289 298 A E S S- 0 0 80 -2,-1.1 -3,-1.5 -4,-0.1 2,-0.2 -0.218 84.0-123.5 -52.9 132.8 60.8 32.6 12.7 290 299 A Q E -K 285 0C 109 -5,-0.3 -5,-0.3 1,-0.1 -1,-0.1 -0.532 10.0-147.5 -82.6 149.1 61.0 36.3 12.0 291 300 A L E - 0 0 14 -7,-2.6 2,-0.2 1,-0.3 -6,-0.2 0.975 56.4 -60.5 -75.4 -78.8 58.4 38.7 13.2 292 301 A G E -K 284 0C 5 -8,-0.9 -8,-1.0 -10,-0.1 2,-0.5 -0.843 44.5 -93.0-155.5-169.0 58.2 41.4 10.6 293 302 A Q E S+K 283 0C 107 -2,-0.2 -10,-0.2 -10,-0.2 2,-0.1 -0.730 93.3 19.4-125.3 84.4 60.1 44.1 8.8 294 303 A G S >> S- 0 0 23 -12,-1.4 4,-3.6 -2,-0.5 3,-0.6 -0.185 87.9 -95.1 130.1 136.8 59.7 47.5 10.6 295 304 A K H 3> S+ 0 0 61 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.907 130.2 37.0 -44.4 -53.9 58.5 48.4 14.1 296 305 A E H 3> S+ 0 0 81 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.748 114.9 57.7 -72.1 -20.0 54.9 48.9 13.0 297 306 A N H <> S+ 0 0 86 -3,-0.6 4,-1.5 2,-0.2 -2,-0.2 0.903 108.5 45.9 -72.7 -39.1 55.4 46.0 10.6 298 307 A A H X S+ 0 0 0 -4,-3.6 4,-2.4 2,-0.2 -2,-0.2 0.802 112.3 50.5 -71.3 -33.0 56.4 43.8 13.6 299 308 A R H X S+ 0 0 4 -4,-1.8 4,-4.7 -5,-0.3 5,-0.3 0.964 102.5 59.0 -66.8 -55.5 53.4 45.1 15.7 300 309 A K H X S+ 0 0 47 -4,-2.3 4,-1.7 1,-0.3 -2,-0.2 0.899 111.1 44.9 -36.4 -51.2 51.0 44.4 12.9 301 310 A F H X S+ 0 0 67 -4,-1.5 4,-1.0 1,-0.2 -1,-0.3 0.948 115.8 43.2 -61.2 -54.4 52.2 40.9 13.3 302 311 A L H < S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.819 109.0 62.0 -63.6 -29.3 52.1 40.8 17.1 303 312 A L H < S+ 0 0 63 -4,-4.7 -1,-0.2 1,-0.2 -2,-0.2 0.925 111.5 35.4 -62.4 -45.8 48.7 42.5 17.0 304 313 A E H < S+ 0 0 150 -4,-1.7 2,-0.5 -5,-0.3 -1,-0.2 0.507 111.5 65.7 -87.7 -5.9 47.1 39.7 15.0 305 314 A N X + 0 0 38 -4,-1.0 4,-1.7 1,-0.2 5,-0.2 -0.750 52.1 168.6-119.7 84.0 49.0 36.8 16.8 306 315 A T H > S+ 0 0 93 -2,-0.5 4,-3.8 2,-0.2 5,-0.3 0.958 72.3 65.0 -56.2 -53.0 48.0 36.7 20.4 307 316 A D H > S+ 0 0 101 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.863 110.9 30.1 -31.9 -77.9 49.8 33.4 20.9 308 317 A V H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.967 118.1 56.9 -52.5 -60.0 53.3 34.4 20.3 309 318 A A H X S+ 0 0 2 -4,-1.7 4,-2.8 1,-0.3 -1,-0.2 0.855 111.4 44.1 -39.8 -49.3 52.8 38.0 21.6 310 319 A N H X S+ 0 0 53 -4,-3.8 4,-4.5 2,-0.2 5,-0.4 0.955 105.6 60.9 -63.8 -48.9 51.6 36.5 24.9 311 320 A E H X S+ 0 0 91 -4,-2.8 4,-3.7 -5,-0.3 -2,-0.2 0.903 110.9 42.5 -42.8 -46.6 54.5 34.0 24.9 312 321 A I H X S+ 0 0 1 -4,-2.4 4,-4.6 2,-0.2 5,-0.4 0.959 114.6 48.2 -66.2 -52.1 56.7 37.1 24.9 313 322 A E H X S+ 0 0 72 -4,-2.8 4,-2.1 -5,-0.2 5,-0.2 0.964 117.3 43.6 -51.4 -53.2 54.6 39.0 27.5 314 323 A K H X S+ 0 0 47 -4,-4.5 4,-2.8 1,-0.2 3,-0.3 0.965 117.9 46.0 -54.1 -54.6 54.6 35.8 29.6 315 324 A K H X S+ 0 0 10 -4,-3.7 4,-2.2 -5,-0.4 -2,-0.2 0.873 109.5 52.4 -56.4 -45.5 58.3 35.3 28.9 316 325 A I H < S+ 0 0 3 -4,-4.6 -1,-0.2 1,-0.2 5,-0.2 0.856 113.3 46.4 -61.4 -35.0 59.3 38.9 29.6 317 326 A K H >X S+ 0 0 35 -4,-2.1 4,-3.2 -5,-0.4 3,-2.3 0.911 108.7 54.2 -73.1 -44.1 57.5 38.6 32.9 318 327 A E H 3< S+ 0 0 161 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.865 102.1 59.2 -58.6 -34.8 59.2 35.3 33.6 319 328 A K T 3< S+ 0 0 119 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.449 131.7 3.8 -74.7 3.6 62.5 36.9 33.1 320 329 A L T <4 0 0 86 -3,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.456 360.0 360.0-150.4 -51.7 61.7 39.3 35.9 321 330 A G < 0 0 78 -4,-3.2 -3,-0.1 -5,-0.2 -4,-0.1 -0.313 360.0 360.0 97.8 360.0 58.4 38.8 37.8