==== 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 RNA BINDING PROTEIN, GENE REGULATION 16-FEB-05 1YVU . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN AQ_1447; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR Y.R.YUAN,Y.PEI,J.B.MA,V.KURYAVYI,M.ZHADINA,G.MEISTER,H.Y.CHE . 682 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35148.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 476 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 118 17.3 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 . 6 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 1 0.1 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 . 70 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 0 3 1 0 2 2 0 2 0 3 2 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 2 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 PARALLEL BRIDGES PER LADDER . 2 8 8 4 2 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 6 2 0 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 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 E 0 0 196 0, 0.0 303,-0.6 0, 0.0 586,-0.1 0.000 360.0 360.0 360.0 62.3 65.4 57.5 45.2 2 5 A A - 0 0 7 301,-0.2 302,-2.4 584,-0.1 585,-0.2 0.954 360.0-139.7 69.9 105.4 63.2 59.6 42.9 3 6 A L E -AB 303 586A 25 583,-2.7 583,-3.2 300,-0.2 2,-0.3 -0.525 15.3-163.8 -92.0 153.7 59.9 61.2 44.2 4 7 A L E -AB 302 585A 0 298,-1.0 2,-2.0 2,-0.2 298,-1.0 -0.979 37.7-103.1-136.5 158.3 56.5 61.5 42.4 5 8 A N S S+ 0 0 0 579,-0.5 149,-1.9 -2,-0.3 2,-0.5 0.017 85.7 114.9 -61.6 20.8 53.2 63.4 42.6 6 9 A L E +C 153 0B 0 -2,-2.0 296,-1.3 296,-0.3 2,-0.4 -0.929 38.9 173.4-109.0 127.6 51.7 60.2 44.0 7 10 A Y E -C 152 0B 0 145,-1.5 145,-3.4 -2,-0.5 294,-0.1 -0.995 38.7-107.7-134.0 133.1 50.3 60.0 47.6 8 11 A R E -C 151 0B 70 292,-0.5 290,-2.8 -2,-0.4 2,-0.4 -0.304 39.9-163.0 -60.3 119.1 48.4 57.1 49.2 9 12 A I E -F 297 0C 5 141,-2.4 141,-0.5 288,-0.2 2,-0.3 -0.893 9.1-176.7-108.3 143.6 44.9 58.2 49.6 10 13 A E E -F 296 0C 49 286,-2.9 286,-2.9 -2,-0.4 2,-0.4 -0.991 16.2-157.9-143.1 146.8 42.3 56.6 51.9 11 14 A Y E +F 295 0C 28 -2,-0.3 284,-0.2 284,-0.2 76,-0.1 -0.968 22.0 157.0-130.2 114.4 38.7 56.9 52.8 12 15 A R - 0 0 176 282,-2.6 283,-0.1 -2,-0.4 282,-0.1 -0.621 31.7-155.4-133.0 72.3 37.3 55.6 56.1 13 16 A P - 0 0 20 0, 0.0 3,-0.2 0, 0.0 281,-0.2 -0.055 17.3-149.1 -58.9 146.4 34.0 57.7 56.7 14 17 A K S S+ 0 0 153 1,-0.3 2,-1.3 278,-0.2 279,-0.1 0.974 97.5 41.4 -72.7 -69.8 32.4 58.4 60.1 15 18 A D S S- 0 0 98 1,-0.2 -1,-0.3 2,-0.1 0, 0.0 -0.669 75.0-177.6 -83.1 93.7 28.7 58.5 59.0 16 19 A T + 0 0 41 -2,-1.3 69,-1.6 -3,-0.2 2,-0.4 0.269 38.3 123.4 -79.5 11.0 28.9 55.6 56.5 17 20 A T E -G 84 0D 17 67,-0.2 41,-0.4 40,-0.1 2,-0.4 -0.659 37.7-179.2 -84.4 123.9 25.3 56.1 55.4 18 21 A F E -G 83 0D 1 65,-1.5 65,-1.5 -2,-0.4 2,-0.5 -0.987 23.8-133.7-126.0 137.5 24.7 56.6 51.7 19 22 A T B -H 56 0E 1 37,-1.8 37,-2.2 39,-0.7 2,-0.3 -0.760 22.9-147.4 -94.3 120.9 21.6 57.2 49.5 20 23 A V - 0 0 5 -2,-0.5 2,-0.4 35,-0.2 35,-0.2 -0.642 13.1-172.3 -90.9 143.8 21.3 55.0 46.4 21 24 A F + 0 0 0 33,-0.4 33,-3.7 -2,-0.3 59,-0.2 -0.987 3.9 179.4-136.3 119.0 19.7 56.2 43.1 22 25 A K E -J 79 0F 96 57,-1.3 57,-1.7 -2,-0.4 31,-0.1 -0.969 31.1-113.2-120.9 139.9 19.1 53.9 40.1 23 26 A P E -J 78 0F 32 0, 0.0 55,-0.2 0, 0.0 4,-0.0 -0.297 6.8-141.8 -68.6 155.9 17.4 55.1 36.8 24 27 A T S S+ 0 0 76 53,-1.6 54,-0.1 2,-0.1 52,-0.0 0.575 91.6 45.3 -90.8 -7.8 14.0 53.8 35.8 25 28 A H S S- 0 0 100 52,-0.5 2,-0.1 1,-0.2 51,-0.0 0.232 100.4 -57.6-103.0-136.9 15.3 53.8 32.2 26 29 A E - 0 0 159 1,-0.0 2,-0.4 -2,-0.0 -1,-0.2 -0.336 43.8 -89.8-109.5-175.0 18.6 52.6 30.7 27 30 A I - 0 0 102 -2,-0.1 2,-0.3 -4,-0.0 25,-0.1 -0.849 32.1-179.1-100.1 127.1 22.4 52.9 30.7 28 31 A Q >> - 0 0 88 -2,-0.4 4,-1.2 1,-0.1 3,-1.1 -0.781 15.2-154.6-134.1 90.6 24.1 55.5 28.4 29 32 A K H 3> S+ 0 0 149 -2,-0.3 4,-0.6 1,-0.3 -1,-0.1 0.619 90.4 40.7 -26.8 -53.3 27.9 55.5 28.6 30 33 A E H 34 S+ 0 0 161 1,-0.2 4,-0.3 2,-0.2 3,-0.3 0.861 119.9 47.5 -73.4 -34.3 28.8 59.1 27.5 31 34 A K H <> S+ 0 0 54 -3,-1.1 4,-2.0 1,-0.2 3,-0.3 0.600 92.5 77.3 -83.1 -17.0 25.8 60.5 29.5 32 35 A L H X S+ 0 0 19 -4,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.907 95.0 49.5 -61.9 -39.7 26.5 58.5 32.7 33 36 A N H X S+ 0 0 87 -4,-0.6 4,-0.6 -3,-0.3 -1,-0.2 0.734 111.6 50.2 -70.8 -24.7 29.3 60.9 33.6 34 37 A K H > S+ 0 0 64 -4,-0.3 4,-1.6 -3,-0.3 -1,-0.2 0.805 110.2 48.4 -81.6 -36.3 27.0 63.9 33.0 35 38 A V H X S+ 0 0 12 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.923 107.0 55.4 -70.1 -46.6 24.2 62.5 35.1 36 39 A R H X S+ 0 0 14 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.817 107.5 51.6 -54.9 -33.1 26.5 61.7 38.0 37 40 A W H X S+ 0 0 56 -4,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.930 112.6 44.7 -70.7 -42.8 27.5 65.4 37.9 38 41 A R H X S+ 0 0 23 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.791 106.9 58.0 -72.8 -29.8 23.8 66.5 38.0 39 42 A V H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 5,-0.4 0.884 109.6 46.9 -66.8 -39.5 23.0 64.0 40.8 40 43 A F H X S+ 0 0 9 -4,-1.5 4,-1.6 -5,-0.2 -2,-0.2 0.864 112.1 51.4 -70.2 -34.0 25.7 65.8 42.8 41 44 A L H < S+ 0 0 76 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.936 114.7 38.2 -69.3 -48.5 24.2 69.2 41.8 42 45 A Q H < S+ 0 0 112 -4,-2.5 -1,-0.2 1,-0.1 -2,-0.2 0.827 126.0 39.1 -70.9 -35.4 20.5 68.7 42.8 43 46 A T H < S- 0 0 24 -4,-1.5 -3,-0.2 -5,-0.3 -2,-0.2 0.972 89.0-146.4 -77.2 -66.0 21.4 66.7 45.9 44 47 A G < + 0 0 23 -4,-1.6 -4,-0.1 1,-0.4 -3,-0.1 0.370 62.8 109.2 107.1 -0.5 24.4 68.7 47.1 45 48 A L S S- 0 0 43 -6,-0.3 -1,-0.4 13,-0.1 -2,-0.2 -0.913 81.1 -93.3-112.4 134.6 26.1 65.6 48.5 46 49 A P - 0 0 7 0, 0.0 11,-3.3 0, 0.0 2,-0.3 -0.094 49.0-159.5 -42.4 136.9 29.3 63.9 46.9 47 50 A T E -I 56 0E 0 49,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.920 18.2-174.1-132.0 148.6 28.4 61.2 44.5 48 51 A F E -I 55 0E 0 7,-2.3 7,-1.4 -2,-0.3 2,-0.6 -0.966 25.5-122.8-134.8 157.1 30.0 58.2 42.8 49 52 A R E -I 54 0E 39 -2,-0.3 2,-0.9 5,-0.2 5,-0.2 -0.889 19.2-175.0-106.2 110.1 28.8 55.8 40.1 50 53 A R E > -I 53 0E 30 3,-2.5 3,-2.2 -2,-0.6 2,-0.8 -0.890 66.8 -72.2-104.2 94.5 28.8 52.0 41.0 51 54 A E T 3 S- 0 0 138 -2,-0.9 -2,-0.0 1,-0.3 3,-0.0 -0.321 116.7 -12.1 54.3 -89.7 27.8 50.5 37.7 52 55 A D T 3 S+ 0 0 47 -2,-0.8 2,-0.4 -25,-0.1 -1,-0.3 0.618 120.7 85.6-109.4 -23.8 24.1 51.6 37.4 53 56 A E E < - I 0 50E 72 -3,-2.2 -3,-2.5 -31,-0.1 2,-0.9 -0.711 68.0-144.2 -86.6 131.8 23.5 52.8 40.9 54 57 A F E - I 0 49E 2 -33,-3.7 -33,-0.4 -2,-0.4 2,-0.4 -0.803 17.5-157.9-100.9 98.4 24.4 56.4 41.9 55 58 A W E - I 0 48E 4 -7,-1.4 -7,-2.3 -2,-0.9 2,-0.4 -0.589 6.5-162.6 -79.7 125.9 25.7 56.4 45.4 56 59 A C E -HI 19 47E 0 -37,-2.2 -37,-1.8 -2,-0.4 2,-1.5 -0.927 22.6-117.0-116.0 136.0 25.5 59.7 47.3 57 60 A A S S- 0 0 16 -11,-3.3 2,-0.2 -2,-0.4 -39,-0.2 -0.431 76.5 -10.6 -73.0 84.0 27.4 60.6 50.5 58 61 A G S S- 0 0 9 -2,-1.5 -39,-0.7 -41,-0.4 2,-0.5 -0.777 90.9 -43.0 127.8-174.5 24.8 61.2 53.3 59 62 A K - 0 0 134 -2,-0.2 2,-0.6 -41,-0.1 -2,-0.1 -0.826 35.0-165.8-103.0 126.7 21.1 61.7 54.0 60 63 A V > - 0 0 35 -2,-0.5 3,-0.8 3,-0.0 2,-0.2 -0.968 25.8-132.6-107.0 118.5 18.8 63.8 51.9 61 64 A E T 3 S+ 0 0 174 -2,-0.6 -2,-0.0 1,-0.2 0, 0.0 -0.496 82.3 5.5 -75.5 143.9 15.5 64.4 53.8 62 65 A K T 3 S+ 0 0 201 1,-0.2 -1,-0.2 -2,-0.2 2,-0.2 0.494 86.5 165.2 61.8 11.6 12.2 63.8 51.9 63 66 A D < + 0 0 45 -3,-0.8 -1,-0.2 1,-0.1 3,-0.1 -0.360 9.7 142.9 -63.5 122.1 14.0 62.4 48.8 64 67 A T + 0 0 100 1,-0.4 2,-0.3 -2,-0.2 -1,-0.1 0.550 61.8 4.5-118.8 -82.3 11.7 60.6 46.4 65 68 A L - 0 0 78 14,-0.1 2,-0.5 -44,-0.0 -1,-0.4 -0.819 54.9-145.8-116.2 148.6 12.5 61.1 42.7 66 69 A Y E -K 78 0F 18 12,-2.1 12,-0.9 -2,-0.3 2,-0.7 -0.964 9.0-171.2-116.4 116.9 15.3 63.0 40.9 67 70 A L E +K 77 0F 110 -2,-0.5 10,-0.2 10,-0.2 2,-0.2 -0.623 15.8 175.6-108.6 68.6 14.4 64.6 37.6 68 71 A T E -K 76 0F 0 8,-1.3 8,-2.6 -2,-0.7 2,-0.5 -0.522 18.3-148.0 -76.0 137.9 17.8 65.7 36.2 69 72 A L E -K 75 0F 48 6,-0.2 6,-0.2 -2,-0.2 5,-0.1 -0.954 13.4-149.5-110.9 125.1 17.8 67.3 32.7 70 73 A S - 0 0 4 4,-2.2 -39,-0.0 -2,-0.5 -35,-0.0 -0.092 31.0 -97.5 -85.6 179.9 20.8 66.8 30.4 71 74 A N S S+ 0 0 52 1,-0.1 142,-0.1 2,-0.1 -1,-0.1 0.837 121.5 59.3 -62.6 -37.9 22.5 68.9 27.7 72 75 A G S S- 0 0 52 2,-0.1 -1,-0.1 1,-0.1 3,-0.1 0.981 117.1-111.4 -53.0 -63.3 20.6 66.9 25.0 73 76 A E S S+ 0 0 120 1,-0.2 2,-0.2 140,-0.0 -2,-0.1 -0.005 73.5 137.1 142.8 -5.3 17.2 67.9 26.5 74 77 A I - 0 0 78 -5,-0.1 -4,-2.2 1,-0.1 2,-0.3 -0.426 48.1-139.8 -67.7 130.7 16.5 64.3 27.7 75 78 A V E - K 0 69F 84 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.726 15.8-158.0 -93.8 143.5 14.9 64.2 31.1 76 79 A E E - K 0 68F 22 -8,-2.6 -8,-1.3 -2,-0.3 2,-0.4 -0.992 4.1-161.4-127.2 127.9 16.1 61.4 33.5 77 80 A L E + K 0 67F 44 -2,-0.4 -53,-1.6 -10,-0.2 -52,-0.5 -0.837 13.6 169.6-111.6 141.1 14.4 60.0 36.5 78 81 A K E +JK 23 66F 1 -12,-0.9 -12,-2.1 -2,-0.4 2,-0.1 -0.971 2.3 159.2-150.4 139.7 15.9 58.0 39.3 79 82 A R E +J 22 0F 115 -57,-1.7 -57,-1.3 -2,-0.3 -14,-0.1 -0.332 15.6 109.5-132.1-147.1 14.8 56.8 42.8 80 83 A V - 0 0 90 -59,-0.2 2,-0.2 -2,-0.1 -2,-0.0 -0.013 45.8-115.0 84.6 169.0 15.5 54.1 45.6 81 84 A G - 0 0 37 1,-0.2 -62,-0.0 -62,-0.1 -2,-0.0 -0.708 43.4 -16.0-128.3-174.6 16.9 54.4 49.1 82 85 A E + 0 0 112 -2,-0.2 2,-0.2 -63,-0.1 -1,-0.2 0.556 34.3 158.2 -29.1 154.5 19.8 53.5 51.5 83 86 A E E -G 18 0D 101 -65,-1.5 -65,-1.5 -67,-0.1 2,-0.5 -0.888 39.0-110.7-172.8 146.0 22.8 51.1 51.8 84 87 A E E -G 17 0D 121 -2,-0.2 2,-0.2 -67,-0.2 -67,-0.2 -0.832 32.2-119.3 -98.8 127.1 26.0 51.3 53.9 85 88 A F + 0 0 6 -69,-1.6 2,-0.3 -2,-0.5 3,-0.1 -0.388 26.2 180.0 -68.0 124.5 29.4 51.8 52.2 86 89 A R - 0 0 227 1,-0.4 -1,-0.1 -2,-0.2 -74,-0.0 -0.511 57.7 -67.1-125.2 65.2 32.3 49.3 52.5 87 90 A G - 0 0 34 -2,-0.3 -1,-0.4 -76,-0.1 2,-0.2 -0.051 68.0 -65.5 77.8 174.5 35.2 50.7 50.5 88 91 A F - 0 0 40 1,-0.1 3,-0.1 -3,-0.1 -38,-0.0 -0.650 20.5-160.2-100.2 163.5 35.6 51.3 46.8 89 92 A Q S S+ 0 0 114 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.593 80.0 33.5-108.3 -25.6 35.7 48.9 43.8 90 93 A N > - 0 0 49 1,-0.1 4,-1.4 0, 0.0 -1,-0.2 -0.935 67.3-132.1-132.5 161.0 37.3 51.4 41.4 91 94 A E H > S+ 0 0 39 -2,-0.3 4,-2.4 2,-0.2 51,-0.2 0.787 111.4 64.1 -75.1 -32.7 39.8 54.2 41.4 92 95 A R H > S+ 0 0 54 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.924 100.7 47.5 -57.8 -49.4 37.2 55.9 39.3 93 96 A E H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.911 110.5 52.9 -61.6 -41.2 34.7 55.9 42.2 94 97 A C H X S+ 0 0 2 -4,-1.4 4,-3.2 2,-0.2 -1,-0.2 0.912 113.1 43.9 -60.4 -44.8 37.3 57.2 44.6 95 98 A Q H X S+ 0 0 37 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.957 111.5 52.6 -64.7 -51.2 38.1 60.1 42.2 96 99 A E H X S+ 0 0 4 -4,-2.9 4,-1.4 1,-0.2 -49,-0.3 0.928 117.4 38.6 -51.8 -50.2 34.4 60.9 41.5 97 100 A L H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 3,-0.3 0.949 115.6 51.7 -69.5 -48.4 33.7 61.1 45.2 98 101 A F H >X S+ 0 0 1 -4,-3.2 4,-1.5 -5,-0.2 3,-1.1 0.893 108.1 52.5 -53.4 -48.4 37.0 62.8 46.2 99 102 A R H 3X S+ 0 0 85 -4,-3.2 4,-1.2 1,-0.3 -1,-0.2 0.882 104.5 54.6 -56.3 -43.9 36.5 65.6 43.5 100 103 A D H 3X S+ 0 0 3 -4,-1.4 4,-2.3 -5,-0.3 -1,-0.3 0.666 105.1 55.4 -67.2 -18.3 33.1 66.5 44.7 101 104 A F H < S+ 0 0 60 -4,-1.2 3,-1.8 -5,-0.2 -2,-0.2 0.947 114.4 43.9 -84.4 -60.2 34.1 71.3 45.3 104 107 A K H 3< S+ 0 0 123 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.739 119.0 45.3 -60.7 -23.9 31.6 71.2 48.1 105 108 A T T 3< S- 0 0 47 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.345 101.1-142.7 -97.4 -1.2 34.3 72.2 50.7 106 109 A K <> + 0 0 128 -3,-1.8 4,-1.7 -5,-0.2 -3,-0.2 0.604 53.9 139.7 45.1 27.2 35.5 74.9 48.2 107 110 A V H > + 0 0 10 -5,-0.4 4,-1.6 -6,-0.3 -1,-0.1 0.742 68.4 51.6 -69.2 -26.1 39.1 74.2 49.2 108 111 A K H > S+ 0 0 33 -6,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.806 111.2 50.4 -80.9 -26.0 40.4 74.4 45.6 109 112 A D H > S+ 0 0 90 -7,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.833 107.9 51.3 -78.7 -33.5 38.6 77.8 45.4 110 113 A K H X S+ 0 0 128 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.910 113.1 48.1 -68.9 -37.4 40.2 79.0 48.7 111 114 A F H X S+ 0 0 5 -4,-1.6 4,-1.8 2,-0.2 3,-0.2 0.934 108.9 49.6 -66.6 -54.4 43.6 78.0 47.2 112 115 A I H >X S+ 0 0 46 -4,-2.3 4,-0.9 1,-0.2 3,-0.6 0.959 115.3 46.0 -52.0 -45.0 43.1 79.7 43.8 113 116 A S H 3X S+ 0 0 50 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.766 112.8 49.0 -70.2 -28.5 42.0 82.9 45.6 114 117 A D H 3X S+ 0 0 43 -4,-1.6 4,-1.0 -3,-0.2 -1,-0.2 0.684 108.7 53.9 -83.4 -19.5 44.9 82.7 48.2 115 118 A F H X S+ 0 0 66 -4,-1.1 4,-3.3 -5,-0.2 3,-0.9 0.483 78.6 103.2-102.1 -1.0 51.2 86.0 43.5 120 123 A R H 3X S+ 0 0 126 -4,-3.1 4,-0.8 1,-0.3 -1,-0.1 0.720 88.2 50.9 -48.0 -30.9 48.9 88.3 41.3 121 124 A D H 34 S+ 0 0 121 -3,-0.2 -1,-0.3 -5,-0.2 -2,-0.1 0.849 116.2 39.0 -76.8 -38.9 51.9 90.5 40.7 122 125 A K H <4 S+ 0 0 143 -3,-0.9 -2,-0.2 1,-0.2 -1,-0.1 0.829 111.4 58.6 -82.2 -36.2 54.1 87.6 39.7 123 126 A I H < S+ 0 0 12 -4,-3.3 11,-1.3 -7,-0.1 2,-0.3 0.767 94.8 82.2 -64.3 -31.3 51.2 85.8 37.8 124 127 A T E < -D 133 0B 31 -4,-0.8 2,-0.3 -5,-0.3 9,-0.2 -0.588 55.6-173.7 -88.1 139.8 50.8 88.9 35.5 125 128 A V E -D 132 0B 14 7,-2.3 7,-1.8 -2,-0.3 2,-0.3 -0.960 9.4-157.3-126.6 140.8 52.9 89.7 32.4 126 129 A Q E +D 131 0B 140 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.960 13.9 170.1-124.5 148.3 52.6 93.0 30.3 127 130 A G - 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0 0 94 16,-0.1 -4,-0.7 11,-0.1 2,-0.4 -0.660 23.1-148.5 -79.2 124.7 81.6 48.6 15.5 321 329 A N E +A 315 0K 90 -2,-0.4 2,-0.2 -6,-0.2 -6,-0.2 -0.780 29.4 150.2 -99.4 139.6 79.9 48.3 18.9 322 330 A T E -A 314 0K 48 -8,-1.2 -8,-1.4 -2,-0.4 -2,-0.0 -0.826 43.2-113.9-165.7 130.4 79.6 51.0 21.5 323 331 A K - 0 0 136 -2,-0.2 2,-0.6 -10,-0.2 5,-0.4 -0.241 31.1-123.9 -62.5 148.2 76.9 51.7 24.2 324 332 A V + 0 0 10 -12,-0.4 -1,-0.1 1,-0.2 319,-0.0 -0.907 57.5 132.7-105.0 110.7 74.8 54.8 23.7 325 333 A I S S- 0 0 109 -2,-0.6 -1,-0.2 323,-0.0 -2,-0.0 0.475 106.6 -17.3-123.5 -25.2 74.8 57.2 26.7 326 334 A T S S- 0 0 85 -3,-0.2 -2,-0.1 0, 0.0 -3,-0.0 0.105 102.4-109.2-162.6 6.5 75.5 60.4 24.6 327 335 A N - 0 0 13 -4,-0.2 -3,-0.1 322,-0.0 5,-0.1 0.950 42.5 -96.7 48.3 105.2 76.7 58.4 21.4 328 336 A L > - 0 0 79 -5,-0.4 4,-1.9 1,-0.2 320,-0.1 0.052 14.2-143.9 -46.9 141.4 80.4 59.0 21.1 329 337 A R H > S+ 0 0 93 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.847 109.6 58.8 -69.0 -34.5 81.6 61.7 18.7 330 338 A K H >> S+ 0 0 153 2,-0.2 4,-2.3 1,-0.2 3,-0.9 0.907 103.6 47.7 -57.4 -49.0 84.3 59.1 18.3 331 339 A F H 3> S+ 0 0 9 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.951 113.2 48.4 -61.5 -45.0 81.8 56.5 17.2 332 340 A L H 3< S+ 0 0 2 -4,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.576 110.2 52.6 -73.3 -10.0 80.2 58.9 14.7 333 341 A E H << S+ 0 0 106 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.914 119.5 33.0 -86.0 -46.9 83.6 59.9 13.3 334 342 A L H < S+ 0 0 118 -4,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.584 93.5 115.3 -84.6 -17.5 84.6 56.4 12.6 335 343 A C < - 0 0 2 -4,-2.2 130,-0.1 -5,-0.2 -20,-0.0 -0.289 53.7-147.1 -65.8 138.2 81.2 54.8 11.7 336 344 A R - 0 0 138 128,-0.1 -19,-3.3 -2,-0.1 -18,-0.3 -0.911 25.8-137.4-103.1 115.7 80.3 53.4 8.3 337 345 A P - 0 0 3 0, 0.0 2,-1.0 0, 0.0 126,-0.2 -0.014 19.9-103.2 -67.1 173.6 76.5 54.0 7.6 338 346 A F - 0 0 50 125,-2.2 125,-0.5 127,-0.1 2,-0.2 -0.854 46.5-138.5-100.6 95.5 74.0 51.6 6.0 339 347 A V + 0 0 84 -2,-1.0 3,-0.2 123,-0.2 123,-0.1 -0.381 39.9 160.9 -64.6 120.9 73.8 53.1 2.5 340 348 A K S S+ 0 0 94 1,-0.3 2,-0.3 -2,-0.2 -1,-0.2 0.663 82.2 22.3-105.2 -30.4 70.4 53.3 0.9 341 349 A K - 0 0 91 1,-0.1 -1,-0.3 119,-0.1 121,-0.1 -0.844 62.1-169.1-143.8 101.3 71.4 56.0 -1.7 342 350 A D S S+ 0 0 108 -2,-0.3 32,-2.3 -3,-0.2 2,-0.4 0.797 80.6 40.9 -58.4 -31.2 75.1 56.3 -2.6 343 351 A V E S-c 374 0L 47 30,-0.2 2,-0.3 2,-0.0 32,-0.2 -0.969 75.9-161.7-123.3 134.9 74.5 59.6 -4.5 344 352 A L E -c 375 0L 3 30,-3.2 32,-2.5 -2,-0.4 2,-0.6 -0.891 17.4-142.1-124.9 147.9 72.2 62.5 -3.3 345 353 A S E -c 376 0L 24 -2,-0.3 61,-3.1 59,-0.2 62,-1.3 -0.914 30.8-178.2-106.6 112.4 70.4 65.6 -4.8 346 354 A V E -cd 377 407L 1 30,-1.6 32,-3.1 -2,-0.6 33,-1.0 -0.903 19.3-157.3-116.2 139.8 70.4 68.5 -2.4 347 355 A E E -cd 379 408L 5 60,-1.4 62,-3.1 -2,-0.3 2,-0.3 -0.867 18.3-153.1-107.7 145.3 68.9 72.1 -2.6 348 356 A I E -cd 380 409L 11 31,-1.5 33,-2.6 -2,-0.3 2,-0.4 -0.918 10.5-170.8-122.8 149.1 70.4 74.8 -0.3 349 357 A I E -cd 381 410L 1 60,-2.3 62,-3.7 -2,-0.3 2,-0.4 -0.993 1.7-168.2-139.4 136.7 69.0 78.0 1.2 350 358 A S E -cd 382 411L 19 31,-1.6 33,-3.0 -2,-0.4 2,-0.6 -0.984 9.5-162.6-130.4 135.6 70.6 80.8 3.0 351 359 A V E +c 383 0L 1 60,-2.6 2,-0.2 -2,-0.4 33,-0.2 -0.982 33.1 169.7-112.8 109.0 69.0 83.5 4.9 352 360 A S E c 384 0L 26 31,-1.9 33,-2.3 -2,-0.6 61,-0.1 -0.739 360.0 360.0-125.6 173.2 71.6 86.3 5.3 353 361 A V 0 0 131 -2,-0.2 -1,-0.1 31,-0.2 34,-0.0 0.595 360.0 360.0-120.9 360.0 72.1 89.9 6.4 354 ! 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 0.0 355 367 A W > 0 0 230 0, 0.0 4,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 24.0 82.0 82.4 3.9 356 368 A R H > + 0 0 137 2,-0.2 4,-2.0 3,-0.1 5,-0.1 0.774 360.0 49.1 -95.5 -45.2 81.4 80.4 7.1 357 369 A K H > S+ 0 0 30 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.926 114.3 48.1 -63.4 -42.3 78.3 78.6 5.8 358 370 A E H > S+ 0 0 62 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 109.6 49.8 -64.7 -47.0 80.2 77.7 2.7 359 371 A E H X S+ 0 0 122 -4,-0.6 4,-1.7 1,-0.2 -1,-0.2 0.900 115.9 45.7 -60.0 -39.9 83.4 76.5 4.5 360 372 A F H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.873 108.7 53.0 -70.9 -46.1 81.1 74.3 6.6 361 373 A L H X S+ 0 0 8 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.884 110.4 50.4 -59.3 -36.9 78.9 73.0 3.8 362 374 A K H X S+ 0 0 127 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.915 109.7 48.7 -69.8 -39.7 82.2 71.9 2.1 363 375 A E H X S+ 0 0 93 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.836 112.5 50.2 -68.4 -33.7 83.4 70.2 5.3 364 376 A L H X S+ 0 0 9 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.981 108.7 50.2 -62.9 -60.7 80.1 68.4 5.6 365 377 A I H X S+ 0 0 20 -4,-2.5 4,-1.5 1,-0.2 10,-0.2 0.850 114.5 46.9 -47.7 -40.4 80.1 67.2 2.0 366 378 A N H X S+ 0 0 84 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.923 107.6 53.5 -74.6 -38.7 83.6 65.9 2.7 367 379 A F H < S+ 0 0 46 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.922 115.4 41.6 -59.5 -42.7 82.8 64.2 5.9 368 380 A L H ><>S+ 0 0 9 -4,-2.5 5,-1.9 1,-0.2 3,-1.0 0.718 108.5 58.8 -76.6 -27.4 80.0 62.3 4.2 369 381 A K H ><5S+ 0 0 93 -4,-1.5 3,-2.1 -5,-0.3 -2,-0.2 0.934 104.1 52.2 -67.2 -40.8 81.9 61.5 1.0 370 382 A N T 3<5S+ 0 0 128 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.210 107.8 54.8 -79.2 11.0 84.5 59.8 3.1 371 383 A K T < 5S- 0 0 22 -3,-1.0 -1,-0.3 2,-0.3 -2,-0.2 0.142 125.3-101.4-127.3 10.5 81.5 57.9 4.5 372 384 A G T < 5S+ 0 0 34 -3,-2.1 2,-0.5 1,-0.2 -3,-0.2 0.118 90.3 106.6 93.4 -21.9 80.3 56.7 1.1 373 385 A I < - 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