==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-AUG-12 4GLJ . COMPND 2 MOLECULE: RSFP; . SOURCE 2 ORGANISM_SCIENTIFIC: UNCULTURED BACTERIUM; . AUTHOR A.BUJACZ,G.BUJACZ,H.CIESLINSKI,P.BARTASUN . 287 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12881.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 7.7 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 . 2 0.7 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 . 22 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 0 0 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 2 0 0 1 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 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 11 A K 0 0 252 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 6.3 11.0 47.0 73.6 2 12 A N + 0 0 76 2,-0.0 2,-0.3 39,-0.0 24,-0.0 -0.551 360.0 148.0 -77.9 111.3 14.2 46.9 71.4 3 13 A A - 0 0 58 -2,-0.6 2,-0.3 76,-0.1 76,-0.2 -0.945 21.7-179.4-145.2 147.2 13.4 45.3 68.1 4 14 A A - 0 0 6 74,-2.1 45,-0.1 -2,-0.3 3,-0.1 -0.964 19.6-160.2-152.5 143.5 14.6 45.8 64.5 5 15 A D S S+ 0 0 40 43,-0.7 76,-2.8 -2,-0.3 77,-1.8 0.636 82.4 46.5 -93.0 -20.1 13.5 44.1 61.4 6 16 A I E -ab 49 82A 1 42,-0.6 44,-2.3 74,-0.2 2,-0.4 -0.977 64.0-170.9-133.0 135.6 16.7 45.0 59.5 7 17 A A E -ab 50 83A 0 75,-2.3 77,-2.4 -2,-0.4 2,-0.5 -0.977 11.6-154.0-130.2 144.0 20.4 44.8 60.5 8 18 A I E -ab 51 84A 0 42,-3.2 44,-2.8 -2,-0.4 2,-0.7 -0.978 7.1-158.6-113.4 129.4 23.6 46.1 58.9 9 19 A I E -ab 52 85A 0 75,-2.3 77,-3.0 -2,-0.5 2,-0.5 -0.928 19.4-147.5-108.6 111.8 26.8 44.2 59.7 10 20 A G E -ab 53 86A 0 42,-3.0 44,-2.4 -2,-0.7 45,-0.5 -0.781 14.2-166.4 -93.7 127.7 29.6 46.6 59.0 11 21 A G > - 0 0 1 75,-2.1 3,-2.2 -2,-0.5 76,-0.2 0.261 50.8 -23.0 -86.2-157.5 33.0 45.3 57.7 12 22 A S T 3 S+ 0 0 30 1,-0.3 -1,-0.3 76,-0.1 3,-0.0 -0.326 134.2 18.4 -58.6 133.0 36.4 47.0 57.5 13 23 A G T 3 S+ 0 0 20 -3,-0.1 2,-0.6 1,-0.1 -1,-0.3 0.208 103.9 97.3 89.3 -16.5 36.1 50.8 57.3 14 24 A L < + 0 0 2 -3,-2.2 40,-0.2 1,-0.1 -4,-0.1 -0.773 30.2 142.1-107.4 91.3 32.5 50.7 58.8 15 25 A Y S S+ 0 0 70 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.642 70.8 15.7-105.1 -20.4 32.7 51.4 62.6 16 26 A Q - 0 0 107 -3,-0.2 2,-0.6 36,-0.1 -1,-0.2 -0.988 58.3-132.8-147.3 162.5 29.5 53.4 62.8 17 27 A M > - 0 0 9 -2,-0.3 3,-1.4 1,-0.1 -3,-0.0 -0.788 27.3-175.7-106.6 83.6 26.4 54.5 61.0 18 28 A Q T 3 S+ 0 0 141 -2,-0.6 -1,-0.1 1,-0.2 0, 0.0 0.775 73.5 61.1 -40.4 -44.3 26.5 58.3 61.5 19 29 A A T 3 S+ 0 0 43 2,-0.0 -1,-0.2 23,-0.0 24,-0.1 0.684 75.7 108.8 -73.6 -15.8 23.1 59.1 59.9 20 30 A L < - 0 0 4 -3,-1.4 3,-0.4 24,-0.1 2,-0.2 -0.347 60.6-140.5 -62.4 139.3 20.9 57.0 62.4 21 31 A T E S+C 43 0A 75 22,-2.6 22,-2.0 1,-0.2 3,-0.1 -0.674 76.9 18.8 -97.3 158.6 18.8 59.1 64.8 22 32 A N E S- 0 0 130 -2,-0.2 -1,-0.2 20,-0.2 19,-0.1 0.877 85.2-164.5 46.9 45.6 18.0 58.4 68.4 23 33 A K E + 0 0 95 -3,-0.4 2,-0.3 19,-0.1 19,-0.2 -0.233 15.3 170.3 -52.6 140.1 21.1 56.1 68.5 24 34 A R E -C 41 0A 80 17,-1.6 17,-3.2 -3,-0.1 2,-0.4 -0.945 25.1-132.8-154.8 143.6 21.2 53.8 71.5 25 35 A S E -C 40 0A 75 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.796 14.7-163.3-101.8 142.0 23.4 50.8 72.3 26 36 A V E -C 39 0A 22 13,-2.9 13,-2.2 -2,-0.4 2,-0.6 -0.987 10.6-150.3-125.5 133.1 22.3 47.5 73.6 27 37 A K - 0 0 132 -2,-0.4 2,-0.5 11,-0.2 11,-0.1 -0.907 21.0-165.6 -95.2 121.6 24.5 44.8 75.2 28 38 A I - 0 0 22 -2,-0.6 2,-0.3 42,-0.0 46,-0.1 -0.960 9.8-147.6-112.6 127.8 22.9 41.5 74.4 29 39 A E - 0 0 143 -2,-0.5 5,-0.1 5,-0.1 -2,-0.0 -0.698 22.6-176.2 -85.7 140.8 24.0 38.3 76.2 30 40 A T > - 0 0 17 -2,-0.3 3,-1.7 3,-0.3 40,-0.1 -0.954 43.0-111.3-131.2 164.6 23.9 35.1 74.1 31 41 A P T 3 S+ 0 0 65 0, 0.0 3,-0.1 0, 0.0 39,-0.1 0.634 120.7 55.3 -64.5 -7.6 24.5 31.4 74.8 32 42 A Y T 3 S- 0 0 35 1,-0.5 38,-0.4 37,-0.1 2,-0.2 0.116 118.0-108.9-109.7 15.8 27.6 31.9 72.5 33 43 A G < - 0 0 36 -3,-1.7 -1,-0.5 37,-0.1 -3,-0.3 -0.487 65.0 -14.6 87.8-158.9 29.1 34.8 74.6 34 44 A E - 0 0 111 -2,-0.2 37,-0.2 -5,-0.1 36,-0.2 -0.525 62.8-119.0 -86.8 143.4 29.2 38.4 73.6 35 45 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 33,-0.1 -0.206 45.6 -89.1 -62.8 172.3 28.7 39.8 70.2 36 46 A S S S- 0 0 0 31,-0.2 21,-0.3 1,-0.1 2,-0.3 0.771 101.8 -20.8 -58.5 -33.5 31.6 41.7 68.6 37 47 A D S S- 0 0 47 19,-0.2 -1,-0.1 34,-0.0 19,-0.0 -0.938 92.9 -60.8-159.8 170.8 30.5 45.0 70.1 38 48 A D - 0 0 50 -2,-0.3 2,-0.4 1,-0.1 15,-0.3 -0.357 60.8-115.4 -55.0 134.6 27.3 46.6 71.6 39 49 A I E -C 26 0A 1 -13,-2.2 -13,-2.9 13,-0.1 2,-0.5 -0.698 25.7-139.6 -76.4 128.1 24.6 46.6 68.9 40 50 A V E -CD 25 51A 35 11,-2.6 11,-3.1 -2,-0.4 2,-0.4 -0.818 15.8-164.4 -90.3 127.3 23.6 50.2 67.9 41 51 A L E +CD 24 50A 0 -17,-3.2 -17,-1.6 -2,-0.5 2,-0.3 -0.927 24.2 139.0-108.8 137.1 19.9 50.8 67.2 42 52 A G E - D 0 49A 0 7,-1.8 7,-3.2 -2,-0.4 2,-0.4 -0.956 46.0 -99.9-162.9 174.2 18.7 53.9 65.5 43 53 A E E -CD 21 48A 25 -22,-2.0 -22,-2.6 -2,-0.3 2,-0.6 -0.902 14.6-165.3-111.7 133.9 16.2 55.1 62.9 44 54 A L E > S- D 0 47A 11 3,-2.5 3,-2.3 -2,-0.4 -24,-0.1 -0.993 92.1 -21.8-111.0 111.2 17.0 55.9 59.2 45 55 A N T 3 S- 0 0 154 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.897 128.5 -51.1 46.6 49.5 13.9 57.8 58.2 46 56 A G T 3 S+ 0 0 65 1,-0.2 2,-0.6 -25,-0.0 -1,-0.3 0.409 112.6 121.6 73.7 -7.2 11.8 56.4 61.0 47 57 A V E < - D 0 44A 37 -3,-2.3 -3,-2.5 -43,-0.0 2,-0.3 -0.816 63.8-131.0 -87.7 123.0 12.8 52.8 60.1 48 58 A T E - D 0 43A 41 -2,-0.6 -43,-0.7 -5,-0.2 -42,-0.6 -0.607 30.8-179.3 -75.2 127.8 14.6 51.1 63.0 49 59 A V E -aD 6 42A 0 -7,-3.2 -7,-1.8 -2,-0.3 2,-0.4 -0.967 22.2-139.3-127.4 143.4 17.9 49.4 62.0 50 60 A A E -aD 7 41A 0 -44,-2.3 -42,-3.2 -2,-0.4 2,-0.5 -0.909 17.5-161.6 -99.1 133.0 20.4 47.4 64.1 51 61 A F E -aD 8 40A 3 -11,-3.1 -11,-2.6 -2,-0.4 2,-0.4 -0.964 8.6-177.5-118.6 125.2 24.1 48.2 63.3 52 62 A L E -a 9 0A 0 -44,-2.8 -42,-3.0 -2,-0.5 2,-0.8 -0.995 21.5-141.4-125.0 122.8 26.8 45.7 64.4 53 63 A T E > -a 10 0A 4 -2,-0.4 3,-1.4 -15,-0.3 -42,-0.2 -0.811 13.3-153.2 -82.8 110.8 30.6 46.4 63.7 54 64 A R T 3 S+ 0 0 0 -44,-2.4 -1,-0.2 -2,-0.8 -43,-0.2 0.852 90.6 41.5 -54.4 -41.9 31.9 43.0 62.8 55 65 A H T 3 S- 0 0 5 -45,-0.5 6,-2.1 1,-0.2 5,-0.4 0.452 111.9-121.9 -88.4 4.2 35.5 43.7 64.0 56 66 A G X - 0 0 0 -3,-1.4 3,-1.8 3,-0.2 -1,-0.2 0.008 51.4 -33.8 76.0 172.9 34.5 45.5 67.1 57 67 A Q G > S+ 0 0 105 -21,-0.3 3,-0.6 1,-0.3 -42,-0.0 -0.331 134.9 15.7 -62.4 136.9 35.3 49.0 68.1 58 68 A G G 3 S- 0 0 66 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.620 122.8 -84.3 76.5 13.8 38.8 50.0 67.0 59 69 A H G < S+ 0 0 66 -3,-1.8 -1,-0.2 1,-0.1 -3,-0.2 0.947 76.3 161.7 50.2 58.1 38.9 47.1 64.6 60 70 A R < + 0 0 154 -3,-0.6 2,-0.4 -5,-0.4 -4,-0.2 0.640 42.1 71.3 -84.3 -17.6 40.0 44.8 67.4 61 71 A L - 0 0 19 -6,-2.1 5,-0.1 -5,-0.1 -25,-0.0 -0.845 66.8-138.8-106.7 141.9 39.2 41.3 66.0 62 72 A T >> - 0 0 59 -2,-0.4 3,-1.3 1,-0.1 4,-0.6 -0.557 37.1-104.9 -82.2 157.6 40.7 39.3 63.2 63 73 A P G >4 S+ 0 0 16 0, 0.0 3,-1.0 0, 0.0 103,-0.1 0.857 118.2 56.9 -51.1 -42.8 38.3 37.5 60.9 64 74 A S G 34 S+ 0 0 39 1,-0.2 102,-0.1 101,-0.2 101,-0.0 0.745 110.7 42.0 -65.4 -25.6 39.1 34.1 62.5 65 75 A E G <4 S+ 0 0 107 -3,-1.3 -1,-0.2 2,-0.1 49,-0.0 0.390 78.2 125.3-108.6 6.4 38.1 35.2 66.0 66 76 A V << - 0 0 7 -3,-1.0 2,-2.4 -4,-0.6 3,-0.2 -0.441 69.5-122.1 -59.3 136.8 34.9 37.2 65.2 67 77 A P > + 0 0 35 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.426 43.5 169.3 -83.4 80.7 32.2 35.7 67.4 68 78 A Y H > S+ 0 0 9 -2,-2.4 4,-2.0 1,-0.2 5,-0.2 0.848 71.5 50.7 -61.0 -42.8 29.9 34.8 64.4 69 79 A R H > S+ 0 0 79 -3,-0.2 4,-2.6 1,-0.2 5,-0.2 0.942 112.1 46.8 -64.4 -46.9 27.4 32.7 66.4 70 80 A A H > S+ 0 0 1 -38,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.885 112.1 51.5 -53.9 -44.0 26.9 35.4 69.1 71 81 A N H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.934 115.4 39.3 -63.7 -44.4 26.5 38.2 66.5 72 82 A I H X S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.916 116.4 51.6 -75.9 -39.5 23.8 36.3 64.5 73 83 A Y H X S+ 0 0 16 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.938 109.7 49.9 -62.2 -45.9 22.1 35.0 67.7 74 84 A A H X S+ 0 0 0 -4,-2.7 4,-0.8 -5,-0.2 -1,-0.2 0.916 110.7 48.9 -57.2 -39.9 22.0 38.5 69.1 75 85 A L H ><>S+ 0 0 0 -4,-1.8 5,-1.8 1,-0.2 3,-0.9 0.919 108.4 55.3 -73.0 -41.5 20.4 40.0 65.9 76 86 A K H ><5S+ 0 0 52 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 0.912 102.1 56.3 -49.9 -44.3 17.9 37.1 66.0 77 87 A T H 3<5S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.755 102.9 55.7 -64.3 -20.0 16.9 38.1 69.5 78 88 A L T <<5S- 0 0 11 -3,-0.9 -74,-2.1 -4,-0.8 -1,-0.3 0.528 120.3-110.3 -87.1 -7.0 16.1 41.6 68.2 79 89 A G T < 5 + 0 0 40 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.1 0.656 53.5 173.6 87.3 19.0 13.7 40.1 65.6 80 90 A V < + 0 0 1 -5,-1.8 -1,-0.2 1,-0.2 -74,-0.2 -0.371 15.1 173.4 -64.6 132.8 15.9 40.9 62.6 81 91 A R + 0 0 86 -76,-2.8 122,-2.2 1,-0.3 2,-0.4 0.520 66.7 44.9-112.8 -19.5 14.5 39.4 59.4 82 92 A Y E -be 6 203A 0 -77,-1.8 -75,-2.3 120,-0.2 2,-0.4 -0.996 61.2-172.9-134.7 129.9 16.9 41.0 57.0 83 93 A I E -be 7 204A 0 120,-2.9 122,-1.9 -2,-0.4 2,-0.5 -0.987 7.4-166.5-119.2 133.0 20.7 41.4 57.2 84 94 A V E -be 8 205A 0 -77,-2.4 -75,-2.3 -2,-0.4 2,-0.5 -0.976 13.1-157.8-109.5 120.7 22.9 43.3 54.8 85 95 A S E -be 9 206A 0 120,-2.8 122,-3.4 -2,-0.5 2,-0.6 -0.796 2.2-158.4 -96.7 131.0 26.6 42.5 55.4 86 96 A V E +be 10 207A 0 -77,-3.0 -75,-2.1 -2,-0.5 2,-0.4 -0.956 22.3 174.2-117.2 112.2 28.9 45.1 54.1 87 97 A S E - e 0 208A 1 120,-2.0 122,-3.1 -2,-0.6 2,-0.3 -0.973 34.1-127.9-133.1 141.2 32.4 43.7 53.5 88 98 A A E + e 0 209A 25 -2,-0.4 100,-0.3 120,-0.2 2,-0.3 -0.602 39.7 179.1 -81.2 136.8 35.7 44.8 52.0 89 99 A V E - e 0 210A 3 120,-2.9 122,-3.1 -2,-0.3 123,-0.8 -0.922 28.6-123.9-136.6 160.5 36.9 42.4 49.4 90 100 A G E -Fe 186 212A 11 96,-2.7 96,-2.0 -2,-0.3 2,-0.4 -0.819 32.2-121.1 -95.1 149.6 39.8 41.8 47.0 91 101 A S E -Fe 185 213A 0 121,-3.0 123,-2.5 -2,-0.4 94,-0.3 -0.736 23.9-177.7 -93.0 137.7 39.1 41.4 43.3 92 102 A L + 0 0 0 92,-3.0 2,-0.4 -2,-0.4 93,-0.2 0.294 68.4 69.1-105.3 10.1 40.0 38.3 41.3 93 103 A Q S > S- 0 0 42 91,-0.5 3,-1.7 3,-0.3 91,-0.0 -0.980 76.9-131.9-138.3 133.9 38.8 39.6 38.0 94 104 A E T 3 S+ 0 0 91 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.0 0.826 107.1 54.0 -46.8 -41.3 40.1 42.5 35.7 95 105 A T T 3 S+ 0 0 92 1,-0.1 2,-0.8 2,-0.1 -1,-0.3 0.605 91.3 79.2 -79.9 -11.2 36.7 44.0 35.3 96 106 A L S < S- 0 0 9 -3,-1.7 -3,-0.3 88,-0.1 -1,-0.1 -0.860 72.8-174.9 -96.5 103.3 36.0 44.3 39.1 97 107 A K > - 0 0 87 -2,-0.8 3,-2.7 1,-0.1 113,-0.2 -0.603 33.6 -79.6-101.4 155.6 38.1 47.4 40.0 98 108 A P T 3 S+ 0 0 27 0, 0.0 113,-0.2 0, 0.0 -1,-0.1 -0.252 119.7 25.1 -50.7 138.2 38.9 49.2 43.3 99 109 A L T 3 S+ 0 0 32 111,-3.0 2,-0.1 1,-0.4 112,-0.1 0.219 96.9 117.9 77.9 -7.1 36.0 51.3 44.5 100 110 A D < - 0 0 7 -3,-2.7 110,-2.7 53,-0.2 -1,-0.4 -0.481 58.8-136.8 -72.3 158.5 33.5 49.1 42.5 101 111 A M E -gH 155 209A 0 53,-2.2 55,-2.2 108,-0.2 2,-0.4 -0.872 13.7-160.2-112.3 157.6 30.9 47.3 44.5 102 112 A V E -gH 156 208A 0 106,-2.2 106,-3.0 -2,-0.3 55,-0.2 -0.997 11.7-160.3-137.7 132.6 29.9 43.7 43.9 103 113 A I E -g 157 0A 2 53,-3.1 55,-1.2 -2,-0.4 56,-0.6 -0.851 25.9-155.3-112.7 93.1 26.7 42.0 45.0 104 114 A P E -g 159 0A 0 0, 0.0 102,-0.4 0, 0.0 56,-0.2 -0.254 20.1-167.6 -71.1 155.5 27.6 38.3 44.9 105 115 A D E S+ 0 0 58 54,-2.6 28,-0.6 1,-0.1 2,-0.3 0.479 72.7 42.0-112.7 -9.4 25.0 35.6 44.4 106 116 A Q E -g 160 0A 57 53,-2.4 55,-2.5 25,-0.1 2,-0.3 -0.897 60.7-167.1-134.7 169.2 27.3 32.7 45.3 107 117 A M E -g 161 0A 16 -2,-0.3 2,-0.4 53,-0.3 55,-0.2 -0.976 11.5-153.3-151.4 150.7 29.9 31.9 47.9 108 118 A I E -g 162 0A 53 53,-2.3 55,-2.6 -2,-0.3 2,-1.0 -0.993 19.3-140.7-129.7 125.3 32.6 29.2 48.5 109 119 A D E +g 163 0A 41 -2,-0.4 55,-0.1 53,-0.2 53,-0.1 -0.770 35.0 157.1 -91.4 99.3 33.6 28.5 52.1 110 120 A M + 0 0 55 53,-2.3 55,-0.4 -2,-1.0 54,-0.2 0.305 33.7 124.9 -96.3 5.1 37.3 27.9 52.3 111 121 A T - 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0 0 12 -123,-2.5 3,-0.7 -2,-0.2 -1,-0.1 -0.166 54.8 -74.1 -64.9 179.4 44.1 40.5 45.3 215 225 A C T 3 S+ 0 0 31 1,-0.2 4,-0.1 -45,-0.2 -43,-0.1 0.467 112.5 99.4 -56.1 -12.7 47.9 39.9 44.9 216 226 A W T 3 S+ 0 0 63 -45,-0.1 -1,-0.2 2,-0.1 -124,-0.0 0.449 77.9 74.1 -60.4 3.6 47.5 38.4 41.4 217 227 A H S < S- 0 0 46 -3,-0.7 2,-2.2 -4,-0.0 -1,-0.0 -0.988 92.4-123.8-119.7 122.4 48.6 42.0 40.5 218 228 A P > + 0 0 101 0, 0.0 3,-0.6 0, 0.0 -2,-0.1 -0.403 33.0 174.0 -64.6 76.2 52.2 43.2 40.9 219 229 A N T 3 + 0 0 60 -2,-2.2 6,-0.1 1,-0.2 5,-0.1 0.335 38.2 126.2 -61.8 8.2 51.5 46.2 43.2 220 230 A E T 3 + 0 0 162 2,-0.1 -1,-0.2 3,-0.1 4,-0.1 0.734 37.7 94.0 -41.6 -48.4 55.3 46.5 43.4 221 231 A Q S < S- 0 0 134 -3,-0.6 3,-0.3 1,-0.2 0, 0.0 -0.110 94.0-106.5 -50.6 145.6 55.6 50.2 42.4 222 232 A A S S+ 0 0 98 1,-0.2 3,-0.3 2,-0.1 2,-0.3 0.507 106.0 87.6 -55.2 -2.8 55.8 52.7 45.3 223 233 A V S S+ 0 0 109 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.145 76.2 60.6 -92.4 37.5 52.2 53.7 44.3 224 234 A S S > S+ 0 0 25 -3,-0.3 4,-0.7 -2,-0.3 -1,-0.2 0.670 75.2 75.3-133.9 -31.7 50.1 51.1 46.3 225 235 A A T 4 S+ 0 0 86 -3,-0.3 4,-0.2 1,-0.2 -2,-0.1 0.913 103.9 24.3 -68.1 -53.9 50.5 51.3 50.2 226 236 A D T >> S+ 0 0 135 1,-0.2 4,-1.1 2,-0.2 3,-0.9 0.691 110.4 65.6 -93.1 -23.6 48.5 54.3 51.5 227 237 A Y H 3> S+ 0 0 92 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.841 92.6 71.2 -60.7 -30.7 46.0 54.8 48.8 228 238 A A H 3X S+ 0 0 30 -4,-0.7 4,-0.6 1,-0.2 -1,-0.2 0.670 101.0 40.0 -62.9 -27.3 44.6 51.4 49.9 229 239 A I H <> S+ 0 0 98 -3,-0.9 4,-1.6 2,-0.2 -1,-0.2 0.734 114.0 55.1 -87.1 -31.3 43.2 52.8 53.2 230 240 A Q H X S+ 0 0 145 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.823 110.0 45.1 -74.5 -34.9 42.0 56.0 51.5 231 241 A N H X S+ 0 0 10 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.825 109.6 55.7 -76.5 -31.6 40.0 53.9 49.0 232 242 A L H X S+ 0 0 40 -4,-0.6 4,-2.0 -5,-0.3 -2,-0.2 0.868 110.7 47.0 -61.3 -33.6 38.8 51.7 51.9 233 243 A M H X S+ 0 0 128 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.907 112.4 47.7 -79.2 -35.3 37.5 55.0 53.5 234 244 A K H X S+ 0 0 95 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.931 111.6 50.9 -67.9 -43.7 35.9 56.2 50.2 235 245 A N H X S+ 0 0 0 -4,-3.0 4,-3.2 1,-0.2 -2,-0.2 0.938 108.1 53.4 -52.8 -52.3 34.3 52.7 49.8 236 246 A A H X S+ 0 0 8 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.899 109.8 46.7 -53.7 -47.8 32.9 52.9 53.3 237 247 A D H X S+ 0 0 92 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.923 113.2 48.4 -65.4 -39.8 31.3 56.4 52.7 238 248 A N H X S+ 0 0 17 -4,-2.5 4,-2.0 2,-0.2 3,-0.4 0.935 108.5 56.9 -56.7 -44.4 29.8 55.2 49.3 239 249 A A H X S+ 0 0 0 -4,-3.2 4,-2.8 1,-0.2 5,-0.2 0.911 99.8 57.8 -56.4 -43.9 28.5 52.1 51.2 240 250 A Q H X S+ 0 0 30 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.872 106.4 48.9 -54.3 -41.7 26.6 54.3 53.7 241 251 A Q H X S+ 0 0 68 -4,-1.3 4,-2.1 -3,-0.4 -1,-0.2 0.922 112.2 48.9 -64.7 -38.9 24.7 55.9 50.8 242 252 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.923 110.1 49.9 -66.0 -47.7 23.8 52.5 49.4 243 253 A I H X S+ 0 0 1 -4,-2.8 4,-3.2 2,-0.2 5,-0.3 0.895 106.8 56.6 -54.7 -47.8 22.7 51.2 52.9 244 254 A K H X S+ 0 0 65 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.965 112.6 41.5 -49.4 -51.5 20.4 54.3 53.3 245 255 A Q H X S+ 0 0 67 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.873 115.0 51.0 -63.7 -38.8 18.7 53.4 50.0 246 256 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.899 106.3 52.7 -71.0 -40.3 18.6 49.7 50.7 247 257 A V H X S+ 0 0 2 -4,-3.2 4,-2.9 1,-0.2 5,-0.2 0.945 108.8 52.8 -60.3 -42.3 17.0 50.1 54.2 248 258 A A H X S+ 0 0 46 -4,-1.8 4,-1.9 -5,-0.3 -2,-0.2 0.934 111.6 44.9 -57.6 -47.3 14.3 52.2 52.5 249 259 A L H X S+ 0 0 20 -4,-1.9 4,-2.4 1,-0.2 5,-0.4 0.857 112.8 49.2 -67.6 -39.0 13.6 49.5 50.0 250 260 A I H X S+ 0 0 1 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.917 111.2 51.3 -66.5 -43.0 13.5 46.7 52.4 251 261 A A H < S+ 0 0 30 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.886 118.2 36.2 -61.9 -38.5 11.2 48.6 54.7 252 262 A S H < S+ 0 0 93 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.853 125.5 37.7 -86.3 -29.2 8.7 49.4 52.0 253 263 A E H < S- 0 0 85 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.816 74.1-168.3 -97.4 -32.6 8.9 46.1 50.0 254 264 A Q < - 0 0 85 -4,-2.6 -4,-0.1 -5,-0.4 -3,-0.1 0.894 22.7-151.8 48.2 50.0 9.3 43.5 52.8 255 265 A P - 0 0 18 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.108 13.7-113.2 -58.7 148.2 10.2 40.8 50.3 256 266 A K - 0 0 178 3,-0.0 2,-0.4 -120,-0.0 -120,-0.1 -0.640 35.8-157.3 -78.7 137.5 9.4 37.2 51.2 257 267 A S > - 0 0 7 -2,-0.3 3,-1.4 1,-0.1 4,-0.3 -0.975 26.5-141.6-120.6 138.0 12.6 35.2 51.7 258 268 A I G > S+ 0 0 107 -2,-0.4 3,-1.4 1,-0.2 -1,-0.1 0.827 103.5 69.9 -59.0 -23.9 13.2 31.5 51.4 259 269 A A G > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.800 82.9 73.4 -62.0 -27.5 15.5 32.0 54.5 260 270 A H G < S+ 0 0 50 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.708 109.0 27.2 -64.3 -24.7 12.5 32.7 56.6 261 271 A T G <> S+ 0 0 80 -3,-1.4 4,-0.7 -4,-0.3 3,-0.4 0.100 86.3 118.6-119.2 20.9 11.4 29.1 56.6 262 272 A A T <4 S+ 0 0 14 -3,-1.8 4,-0.4 1,-0.2 -134,-0.2 0.802 74.5 49.9 -62.7 -32.1 14.9 27.5 56.2 263 273 A L T >> S+ 0 0 4 -4,-0.3 4,-1.9 1,-0.2 3,-0.6 0.862 93.2 75.2 -75.9 -28.9 14.9 25.7 59.5 264 274 A T T 34 S+ 0 0 93 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.798 107.9 25.5 -64.1 -41.3 11.5 24.0 59.3 265 275 A Q T 3< S+ 0 0 140 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.1 0.521 121.4 58.8 -95.1 -0.1 12.3 21.2 56.8 266 276 A A T <4 S+ 0 0 11 -3,-0.6 -140,-2.3 -4,-0.4 2,-0.3 0.681 78.7 98.5 -92.4 -20.2 16.0 21.1 57.7 267 277 A L B < +K 125 0C 41 -4,-1.9 -142,-0.3 -142,-0.3 4,-0.1 -0.516 43.9 177.6 -76.5 124.7 15.6 20.3 61.4 268 278 A V + 0 0 93 -144,-3.3 -143,-0.2 -2,-0.3 -1,-0.2 0.859 62.6 70.0 -93.3 -41.1 16.1 16.6 62.0 269 279 A T S S- 0 0 23 -145,-1.8 -1,-0.1 1,-0.0 5,-0.1 -0.686 86.7-126.6 -81.8 119.3 15.8 16.5 65.8 270 280 A P >> - 0 0 69 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.328 18.2-122.8 -59.2 140.9 12.2 17.2 67.0 271 281 A V G >4 S+ 0 0 40 1,-0.3 3,-1.6 2,-0.2 8,-0.1 0.895 114.2 58.7 -53.6 -36.0 12.1 20.0 69.5 272 282 A E G 34 S+ 0 0 165 1,-0.3 -1,-0.3 7,-0.0 -3,-0.0 0.727 102.3 55.1 -69.4 -17.8 10.3 17.6 71.9 273 283 A A G <4 S+ 0 0 67 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.520 88.4 100.9 -87.4 -11.7 13.4 15.3 71.6 274 284 A M S << S- 0 0 9 -3,-1.6 -151,-0.1 -4,-0.5 -152,-0.1 -0.480 75.7-114.8 -76.8 150.8 15.9 18.0 72.7 275 285 A S > - 0 0 59 -153,-0.2 4,-2.9 -2,-0.1 5,-0.2 -0.328 30.0-108.0 -69.4 163.8 17.4 18.2 76.2 276 286 A A H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.876 122.8 51.9 -57.2 -39.7 16.5 21.3 78.4 277 287 A E H > S+ 0 0 137 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.927 111.4 45.6 -67.8 -42.1 20.1 22.5 77.9 278 288 A T H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.954 112.7 48.8 -66.2 -50.8 19.9 22.2 74.0 279 289 A K H < S+ 0 0 78 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.873 112.6 50.1 -55.4 -38.1 16.4 23.9 73.8 280 290 A T H >< S+ 0 0 101 -4,-2.0 3,-1.0 -5,-0.2 4,-0.3 0.929 111.0 47.8 -70.2 -45.0 17.7 26.7 76.0 281 291 A R H 3< S+ 0 0 37 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.827 121.4 36.7 -64.4 -35.1 20.8 27.2 73.9 282 292 A L T >X S+ 0 0 0 -4,-2.3 3,-2.0 -5,-0.2 4,-1.0 0.375 82.2 119.1 -97.6 7.4 18.8 27.2 70.6 283 293 A A G X4 S+ 0 0 55 -3,-1.0 3,-1.2 -4,-0.4 -1,-0.2 0.836 71.9 48.6 -47.6 -54.5 15.8 29.0 71.9 284 294 A A G 34 S+ 0 0 31 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.709 112.5 50.7 -61.2 -18.0 15.8 32.1 69.6 285 295 A L G <4 S+ 0 0 8 -3,-2.0 -1,-0.2 -22,-0.0 -2,-0.2 0.633 95.4 85.1 -94.1 -16.8 16.3 30.0 66.5 286 296 A L << 0 0 24 -3,-1.2 -86,-0.0 -4,-1.0 -22,-0.0 -0.587 360.0 360.0 -93.6 150.2 13.5 27.6 67.1 287 297 A P 0 0 157 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.957 360.0 360.0 -65.8 360.0 9.8 28.1 66.2