==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 24-AUG-06 2I5H . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN AF1531; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR S.ESWARAMOORTHY,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX . 178 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 7 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 0 1 1 0 0 0 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 16 A E 0 0 63 0, 0.0 3,-0.1 0, 0.0 31,-0.0 0.000 360.0 360.0 360.0 137.5 9.3 28.8 14.6 2 17 A D + 0 0 80 1,-0.3 55,-2.6 56,-0.1 56,-0.8 0.668 360.0 26.3-106.4 -29.9 6.2 30.9 14.1 3 18 A Y E -A 56 0A 75 53,-0.2 30,-2.2 54,-0.2 31,-0.4 -0.975 64.3-178.4-135.8 149.6 8.0 34.3 13.8 4 19 A A E -AB 55 32A 0 51,-2.3 51,-3.3 -2,-0.3 2,-0.4 -0.944 22.9-122.5-142.3 163.0 11.4 35.4 12.6 5 20 A Y E -AB 54 31A 16 26,-2.7 26,-2.1 -2,-0.3 2,-0.3 -0.901 31.2-111.3-112.5 137.4 13.4 38.7 12.3 6 21 A V E + B 0 30A 0 47,-2.5 46,-2.6 -2,-0.4 24,-0.2 -0.476 33.4 171.9 -70.8 128.5 14.9 39.9 9.1 7 22 A L E S- 0 0 0 22,-3.0 2,-0.3 1,-0.4 77,-0.2 0.719 71.8 -4.4-102.0 -34.0 18.7 39.9 8.9 8 23 A D E - B 0 29A 30 21,-1.3 21,-2.3 42,-0.1 2,-0.5 -0.935 58.7-151.0-164.2 135.6 19.1 40.8 5.2 9 24 A F E - B 0 28A 41 -2,-0.3 19,-0.2 19,-0.2 42,-0.1 -0.964 7.4-169.7-116.7 129.0 16.7 41.3 2.2 10 25 A M E > - B 0 27A 16 17,-3.6 17,-2.5 -2,-0.5 3,-2.3 -0.865 7.3-165.6-120.1 96.2 17.8 40.6 -1.4 11 26 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.839 96.1 27.7 -46.2 -42.9 15.3 41.9 -4.0 12 27 A Y T 3 S- 0 0 151 1,-0.4 5,-0.1 14,-0.1 13,-0.1 0.106 113.1-121.9-108.9 21.2 17.0 39.8 -6.7 13 28 A G < + 0 0 8 -3,-2.3 -1,-0.4 14,-0.2 11,-0.0 -0.283 68.4 1.8 74.4-160.4 18.3 37.0 -4.5 14 29 A H > - 0 0 47 1,-0.1 3,-2.2 -3,-0.1 -4,-0.0 -0.396 64.3-133.2 -66.3 131.9 22.0 36.0 -4.2 15 30 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.762 106.1 52.8 -55.5 -26.5 24.3 38.2 -6.3 16 31 A D T 3 S+ 0 0 142 2,-0.0 -2,-0.1 0, 0.0 -3,-0.0 0.391 75.4 139.8 -92.0 4.6 26.1 35.1 -7.6 17 32 A D < - 0 0 31 -3,-2.2 7,-0.1 1,-0.2 4,-0.0 -0.234 40.2-158.7 -50.0 127.0 22.9 33.4 -8.8 18 33 A K + 0 0 210 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.531 60.1 97.8 -89.8 -7.0 23.6 31.7 -12.1 19 34 A R S S- 0 0 84 1,-0.1 5,-0.1 2,-0.1 -2,-0.0 -0.448 90.3 -85.0 -80.5 154.2 20.0 31.6 -13.3 20 35 A P > - 0 0 77 0, 0.0 3,-2.3 0, 0.0 4,-0.5 -0.249 44.0-110.4 -56.2 146.5 18.6 34.2 -15.7 21 36 A I G > S+ 0 0 108 1,-0.3 3,-1.4 2,-0.2 -2,-0.1 0.814 113.7 62.6 -49.4 -39.8 17.3 37.3 -13.9 22 37 A H G 3 S+ 0 0 154 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.622 103.4 50.8 -66.3 -11.3 13.6 36.6 -14.6 23 38 A R G < S+ 0 0 137 -3,-2.3 2,-0.4 2,-0.1 -1,-0.3 0.521 87.1 99.4-102.4 -6.2 13.8 33.4 -12.6 24 39 A R < - 0 0 67 -3,-1.4 -11,-0.1 -4,-0.5 3,-0.0 -0.635 60.0-154.4 -82.9 133.5 15.4 34.9 -9.5 25 40 A E - 0 0 51 -2,-0.4 2,-0.2 -13,-0.1 19,-0.1 -0.711 26.6 -93.1-107.9 159.1 13.0 35.6 -6.6 26 41 A P - 0 0 37 0, 0.0 17,-2.4 0, 0.0 2,-0.3 -0.510 50.6-170.5 -68.5 132.8 13.3 38.1 -3.8 27 42 A L E -BC 10 42A 10 -17,-2.5 -17,-3.6 15,-0.3 2,-0.3 -0.897 16.4-167.3-126.9 155.3 14.8 36.4 -0.7 28 43 A A E -BC 9 41A 0 13,-2.5 13,-2.6 -2,-0.3 2,-0.5 -0.990 16.1-141.6-137.0 145.7 15.4 37.2 2.9 29 44 A Q E +BC 8 40A 0 -21,-2.3 -22,-3.0 -2,-0.3 -21,-1.3 -0.942 32.8 179.8-105.7 129.9 17.6 35.6 5.5 30 45 A V E -BC 6 39A 0 9,-3.0 9,-2.6 -2,-0.5 2,-0.4 -0.859 26.2-138.1-129.9 163.6 15.9 35.5 8.9 31 46 A V E -BC 5 38A 0 -26,-2.1 -26,-2.7 -2,-0.3 7,-0.2 -0.990 29.1-119.4-124.1 126.0 16.4 34.3 12.5 32 47 A G E > -B 4 0A 0 5,-2.8 4,-1.0 -2,-0.4 -28,-0.3 -0.375 12.5-141.1 -63.4 138.9 13.7 32.7 14.4 33 48 A E T 4 S+ 0 0 51 -30,-2.2 -1,-0.1 2,-0.1 -29,-0.1 0.664 94.6 44.8 -77.4 -14.7 12.6 34.4 17.6 34 49 A R T 4 S+ 0 0 163 -31,-0.4 -1,-0.1 3,-0.1 -30,-0.1 0.921 135.0 4.4 -92.9 -54.6 12.1 31.3 19.7 35 50 A N T 4 S- 0 0 59 143,-0.1 -2,-0.1 2,-0.1 142,-0.1 0.279 95.4-115.6-115.9 7.6 15.1 29.0 19.0 36 51 A F < + 0 0 3 -4,-1.0 2,-0.2 1,-0.2 -3,-0.1 0.840 48.2 177.5 59.5 38.6 17.2 31.4 16.8 37 52 A T - 0 0 20 -6,-0.1 -5,-2.8 1,-0.1 2,-0.5 -0.523 25.8-132.1 -72.3 134.0 16.8 29.1 13.7 38 53 A L E +C 31 0A 5 34,-0.4 34,-2.8 -7,-0.2 2,-0.3 -0.808 34.2 174.4 -92.3 127.0 18.5 30.6 10.6 39 54 A L E -CD 30 71A 16 -9,-2.6 -9,-3.0 -2,-0.5 2,-0.5 -0.955 30.1-146.4-134.9 150.6 16.3 30.4 7.6 40 55 A E E +CD 29 70A 5 30,-2.4 29,-2.1 -2,-0.3 30,-1.5 -0.967 31.0 175.9-112.6 129.5 16.3 31.6 4.0 41 56 A V E -CD 28 68A 0 -13,-2.6 -13,-2.5 -2,-0.5 27,-0.2 -0.951 30.3-119.1-133.5 154.1 12.8 32.5 2.7 42 57 A S E -C 27 0A 0 25,-2.9 24,-3.1 -2,-0.3 2,-0.4 -0.621 30.6-135.8 -88.1 154.4 11.3 33.9 -0.4 43 58 A I E - D 0 65A 7 -17,-2.4 22,-0.2 22,-0.3 3,-0.1 -0.889 18.7-109.2-114.3 142.7 9.4 37.2 -0.1 44 59 A R > - 0 0 115 20,-2.8 3,-1.3 -2,-0.4 22,-0.1 -0.250 46.2 -83.5 -66.7 155.8 6.0 38.0 -1.7 45 60 A K T 3 S+ 0 0 199 1,-0.2 -1,-0.1 3,-0.0 3,-0.1 -0.215 111.4 22.5 -58.8 145.8 5.7 40.5 -4.6 46 61 A G T 3 S+ 0 0 75 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.528 94.1 120.1 76.6 5.8 5.5 44.2 -3.6 47 62 A K < - 0 0 94 -3,-1.3 -1,-0.2 17,-0.1 -4,-0.1 -0.827 40.6-172.9-106.2 145.4 7.1 43.8 -0.2 48 63 A Q - 0 0 164 -2,-0.4 -39,-0.0 -3,-0.1 -3,-0.0 -0.656 18.9-158.6-134.7 74.7 10.3 45.5 0.8 49 64 A P - 0 0 10 0, 0.0 2,-0.3 0, 0.0 -40,-0.1 -0.206 6.5-142.2 -56.5 143.5 11.3 44.0 4.2 50 65 A L > - 0 0 113 1,-0.1 3,-2.2 -42,-0.1 -44,-0.3 -0.776 28.5 -91.6-108.3 151.8 13.6 45.9 6.5 51 66 A V T 3 S+ 0 0 57 -2,-0.3 -44,-0.2 1,-0.3 3,-0.1 -0.374 116.8 26.0 -58.2 139.7 16.3 44.6 8.8 52 67 A M T 3 S+ 0 0 73 -46,-2.6 -1,-0.3 1,-0.3 -45,-0.1 0.316 87.9 140.8 85.3 -6.8 14.8 44.0 12.2 53 68 A D < - 0 0 63 -3,-2.2 -47,-2.5 -47,-0.1 2,-0.6 -0.424 50.4-133.0 -66.4 143.6 11.3 43.4 10.8 54 69 A R E -A 5 0A 121 -49,-0.2 2,-0.4 -3,-0.1 -49,-0.2 -0.882 28.6-171.4-100.2 123.1 9.3 40.7 12.5 55 70 A V E -A 4 0A 5 -51,-3.3 -51,-2.3 -2,-0.6 2,-0.5 -0.910 23.8-120.7-121.5 146.8 7.7 38.3 10.0 56 71 A Y E +A 3 0A 56 -2,-0.4 9,-0.5 -53,-0.2 8,-0.3 -0.697 31.2 167.8 -84.4 127.6 5.2 35.5 10.3 57 72 A I + 0 0 5 -55,-2.6 -54,-0.2 -2,-0.5 -1,-0.1 0.099 39.4 116.1-124.6 20.0 6.5 32.2 9.0 58 73 A G S S- 0 0 2 -56,-0.8 -56,-0.1 3,-0.1 -2,-0.0 -0.002 81.5 -87.7 -79.3-171.5 3.8 29.9 10.4 59 74 A K S S+ 0 0 200 2,-0.0 3,-0.1 3,-0.0 -1,-0.1 0.688 99.8 75.4 -74.4 -21.4 1.2 27.7 8.7 60 75 A G S S- 0 0 44 1,-0.2 2,-0.2 0, 0.0 0, 0.0 0.106 104.6 -44.3 -77.2-163.6 -1.5 30.3 8.3 61 76 A E - 0 0 166 1,-0.0 2,-0.5 2,-0.0 -1,-0.2 -0.455 58.1-149.8 -64.2 132.8 -1.7 33.2 5.9 62 77 A R - 0 0 48 -2,-0.2 -5,-0.1 3,-0.1 -1,-0.0 -0.942 10.3-164.4-111.0 124.0 1.6 35.0 5.6 63 78 A D S S+ 0 0 105 -2,-0.5 -1,-0.1 1,-0.1 3,-0.1 0.752 86.0 8.7 -78.1 -25.6 1.6 38.7 4.8 64 79 A V S S+ 0 0 40 -8,-0.3 -20,-2.8 1,-0.1 2,-0.2 0.727 111.3 72.3-123.0 -48.3 5.2 39.1 3.8 65 80 A V E -D 43 0A 1 -9,-0.5 -22,-0.3 -22,-0.2 -3,-0.1 -0.500 51.5-172.5 -74.5 140.2 7.0 35.7 3.6 66 81 A Y E - 0 0 111 -24,-3.1 2,-0.3 1,-0.4 -23,-0.2 0.828 63.7 -10.5 -93.7 -77.6 6.1 33.6 0.6 67 82 A K E - 0 0 109 -25,-0.1 -25,-2.9 0, 0.0 2,-0.7 -0.900 60.6-120.4-126.8 152.3 7.9 30.2 1.1 68 83 A I E -D 41 0A 68 -2,-0.3 -27,-0.3 -27,-0.2 3,-0.1 -0.818 30.3-174.8 -88.0 119.5 10.5 28.9 3.5 69 84 A K E - 0 0 101 -29,-2.1 2,-0.3 -2,-0.7 -28,-0.2 0.944 50.8 -37.0 -82.8 -52.3 13.4 27.7 1.3 70 85 A R E -D 40 0A 140 -30,-1.5 -30,-2.4 2,-0.0 -1,-0.3 -0.972 53.6 -98.3-172.2 154.8 15.9 26.1 3.6 71 86 A R E -D 39 0A 182 -2,-0.3 2,-0.3 -32,-0.2 -32,-0.3 -0.575 45.1-142.4 -79.1 146.4 17.5 26.1 7.0 72 87 A L - 0 0 15 -34,-2.8 -34,-0.4 -2,-0.2 2,-0.2 -0.794 8.3-137.6-116.2 154.8 20.9 27.8 7.0 73 88 A R > - 0 0 140 -2,-0.3 3,-1.2 1,-0.1 4,-0.4 -0.584 42.5-101.1 -95.2 166.1 24.3 27.2 8.8 74 89 A Y G > S+ 0 0 54 93,-0.5 3,-1.5 1,-0.3 94,-0.1 0.893 123.0 57.8 -56.6 -38.4 26.1 30.3 10.0 75 90 A E G 3 S+ 0 0 123 1,-0.3 -1,-0.3 93,-0.1 7,-0.1 0.721 96.4 63.0 -65.8 -21.8 28.4 30.2 7.0 76 91 A D G < S+ 0 0 54 -3,-1.2 -1,-0.3 2,-0.0 -2,-0.2 0.575 80.7 104.5 -80.3 -9.6 25.4 30.4 4.6 77 92 A L S < S- 0 0 7 -3,-1.5 -37,-0.0 -4,-0.4 -39,-0.0 -0.449 78.5-114.0 -71.3 145.0 24.5 33.9 5.9 78 93 A T > - 0 0 17 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.263 31.0-105.0 -70.1 166.1 25.4 36.8 3.7 79 94 A P H > S+ 0 0 109 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.914 124.5 49.7 -60.0 -41.1 28.0 39.2 5.0 80 95 A A H > S+ 0 0 44 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.910 109.8 50.9 -63.8 -42.9 25.3 41.8 5.8 81 96 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.895 108.8 51.2 -63.0 -40.4 23.3 39.1 7.6 82 97 A K H < S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.907 109.7 50.1 -63.7 -41.3 26.3 38.1 9.7 83 98 A T H < S+ 0 0 88 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.905 115.4 43.2 -63.6 -40.0 26.9 41.7 10.7 84 99 A E H >X S+ 0 0 63 -4,-2.1 4,-2.4 -77,-0.2 3,-0.5 0.763 92.1 85.9 -77.8 -26.0 23.3 42.2 11.7 85 100 A L H 3X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.874 89.4 46.2 -44.7 -55.4 22.9 38.8 13.6 86 101 A P H 3> S+ 0 0 44 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.882 114.8 48.3 -59.6 -36.7 24.2 40.0 17.0 87 102 A Y H <> S+ 0 0 137 -3,-0.5 4,-1.7 -4,-0.4 -2,-0.2 0.875 113.6 46.5 -69.4 -38.9 22.1 43.2 16.9 88 103 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.906 111.3 50.7 -71.0 -42.1 18.9 41.3 15.9 89 104 A I H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.3 5,-0.2 0.919 109.6 51.9 -61.2 -41.5 19.4 38.6 18.5 90 105 A E H X S+ 0 0 65 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.903 108.6 51.2 -60.4 -40.9 19.9 41.3 21.1 91 106 A H H X S+ 0 0 54 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.926 109.6 50.9 -61.1 -46.7 16.6 42.9 20.0 92 107 A I H >< S+ 0 0 6 -4,-2.5 3,-0.9 1,-0.2 4,-0.3 0.923 109.7 47.4 -59.0 -49.3 14.8 39.5 20.3 93 108 A I H >< S+ 0 0 4 -4,-2.5 3,-1.1 1,-0.3 7,-0.3 0.840 107.5 57.7 -65.3 -30.6 16.0 38.8 23.8 94 109 A K H >< S+ 0 0 101 -4,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.716 101.1 57.0 -70.7 -20.3 15.0 42.3 24.9 95 110 A Q T << S+ 0 0 111 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.486 119.1 31.4 -87.6 -3.5 11.5 41.7 23.8 96 111 A D T X> S+ 0 0 70 -3,-1.1 4,-1.0 -4,-0.3 3,-0.7 -0.262 71.9 148.6-147.2 47.2 11.3 38.7 26.1 97 112 A E H X> + 0 0 72 -3,-0.6 4,-3.2 1,-0.2 3,-0.6 0.873 66.9 67.5 -51.4 -43.2 13.6 39.8 29.0 98 113 A K H 3> S+ 0 0 155 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.884 99.1 49.1 -45.3 -51.4 11.5 37.8 31.4 99 114 A K H <4 S+ 0 0 131 -3,-0.7 4,-0.4 1,-0.2 -1,-0.2 0.830 118.2 38.1 -62.8 -35.6 12.5 34.4 29.9 100 115 A Y H XX S+ 0 0 27 -4,-1.0 4,-1.2 -3,-0.6 3,-0.8 0.856 110.9 54.6 -87.0 -37.5 16.3 35.2 29.9 101 116 A V H 3X S+ 0 0 13 -4,-3.2 4,-1.7 1,-0.3 38,-0.2 0.746 105.3 61.1 -65.0 -18.4 16.5 37.1 33.2 102 117 A D H 3< S+ 0 0 81 -4,-0.9 -1,-0.3 -5,-0.4 -2,-0.2 0.819 94.0 61.2 -74.3 -32.9 14.9 33.9 34.4 103 118 A F H <4 S+ 0 0 28 -3,-0.8 -2,-0.2 -4,-0.4 -1,-0.2 0.898 105.8 47.0 -60.2 -42.5 17.9 31.9 33.2 104 119 A F H < 0 0 2 -4,-1.2 -2,-0.2 3,-0.0 -1,-0.2 0.973 360.0 360.0 -64.4 -57.4 20.2 33.8 35.6 105 120 A N < 0 0 45 -4,-1.7 -3,-0.1 34,-0.1 35,-0.0 0.385 360.0 360.0 -95.9 360.0 18.0 33.5 38.6 106 ! 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 0.0 107 123 A D 0 0 30 0, 0.0 9,-0.2 0, 0.0 8,-0.1 0.000 360.0 360.0 360.0 79.5 20.0 28.3 36.7 108 124 A S - 0 0 77 1,-0.1 7,-0.7 7,-0.1 2,-0.3 0.242 360.0-109.3 -55.8-173.6 20.8 24.7 37.8 109 125 A I B -E 114 0B 114 5,-0.2 5,-0.2 1,-0.2 -1,-0.1 -0.822 16.7-162.5-122.5 161.3 24.2 23.1 37.9 110 126 A T - 0 0 44 3,-1.5 4,-0.2 -2,-0.3 -1,-0.2 0.779 53.3 -73.6-104.0 -79.5 26.0 20.5 35.8 111 127 A T S S- 0 0 104 2,-1.7 3,-0.1 0, 0.0 0, 0.0 -0.465 102.9 -13.0 170.3 112.2 29.1 19.0 37.6 112 128 A R S S+ 0 0 98 -2,-0.1 2,-0.3 1,-0.1 -3,-0.0 0.547 133.9 70.5 62.4 2.6 32.5 20.6 38.2 113 129 A M S S- 0 0 76 11,-0.0 -2,-1.7 5,-0.0 -3,-1.5 -0.975 74.6-151.5-149.7 130.8 30.9 23.0 35.6 114 130 A H B > -E 109 0B 16 -2,-0.3 3,-1.6 -5,-0.2 4,-0.4 -0.818 24.4-121.9-107.2 148.4 28.1 25.4 36.2 115 131 A Q G >> S+ 0 0 40 -7,-0.7 3,-2.3 -2,-0.3 4,-0.5 0.845 110.5 63.6 -54.6 -38.0 25.6 26.5 33.5 116 132 A L G >4 S+ 0 0 0 1,-0.3 3,-1.1 -8,-0.3 -1,-0.3 0.805 95.4 61.4 -57.5 -28.4 26.6 30.2 34.0 117 133 A E G <4 S+ 0 0 32 -3,-1.6 -1,-0.3 1,-0.3 5,-0.3 0.649 87.7 71.6 -73.1 -14.7 30.0 29.2 32.8 118 134 A L G <4 S+ 0 0 17 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.767 79.5 92.9 -70.2 -23.5 28.6 28.2 29.5 119 135 A L S X< S- 0 0 1 -3,-1.1 3,-1.5 -4,-0.5 40,-0.1 -0.596 90.6-116.4 -74.8 118.1 28.1 31.9 28.9 120 136 A P T 3 S+ 0 0 50 0, 0.0 41,-0.1 0, 0.0 42,-0.1 -0.341 103.1 27.8 -55.8 122.3 31.1 33.3 27.0 121 137 A G T 3 S+ 0 0 58 -4,-0.2 2,-0.4 1,-0.1 32,-0.3 0.587 98.2 102.4 99.4 12.7 32.7 35.9 29.3 122 138 A V < + 0 0 8 -3,-1.5 -1,-0.1 -5,-0.3 -3,-0.1 -0.901 44.5 165.0-132.9 104.1 31.6 34.2 32.6 123 139 A G > - 0 0 39 -2,-0.4 4,-3.0 -3,-0.1 5,-0.2 -0.288 55.5 -68.6-104.9-167.9 34.1 32.2 34.5 124 140 A K H > S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.901 130.9 47.4 -48.3 -52.1 34.4 30.7 38.0 125 141 A K H > S+ 0 0 181 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.941 115.4 45.0 -58.2 -49.5 34.8 34.1 39.7 126 142 A M H > S+ 0 0 31 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.888 109.4 54.5 -64.2 -42.1 31.9 35.6 37.8 127 143 A M H X S+ 0 0 6 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.934 110.7 45.7 -59.2 -46.7 29.5 32.7 38.3 128 144 A W H X S+ 0 0 155 -4,-2.0 4,-2.8 -5,-0.2 -1,-0.2 0.857 110.4 54.8 -64.7 -33.6 30.0 32.8 42.0 129 145 A A H X S+ 0 0 39 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.886 111.2 45.0 -65.3 -38.2 29.5 36.5 41.9 130 146 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.883 114.7 47.7 -71.6 -40.3 26.2 36.0 40.2 131 147 A I H X S+ 0 0 18 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.874 107.2 56.9 -68.5 -38.3 25.2 33.2 42.6 132 148 A E H X S+ 0 0 60 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.865 111.9 41.7 -61.4 -38.1 26.1 35.3 45.6 133 149 A E H X S+ 0 0 9 -4,-1.3 4,-1.1 1,-0.2 -1,-0.2 0.838 105.6 63.8 -78.7 -34.5 23.8 38.1 44.5 134 150 A R H < S+ 0 0 54 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.852 94.7 62.8 -57.4 -36.8 21.0 35.7 43.5 135 151 A K H < S+ 0 0 153 -4,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.958 99.6 51.9 -53.3 -59.2 20.7 34.5 47.1 136 152 A K H < S- 0 0 178 -4,-0.7 -2,-0.2 1,-0.2 -1,-0.1 0.935 132.7 -21.9 -41.2 -76.6 19.6 37.9 48.5 137 153 A R S < S- 0 0 48 -4,-1.1 -1,-0.2 0, 0.0 3,-0.1 -0.998 74.0-103.5-143.2 136.9 16.8 38.5 46.0 138 154 A P - 0 0 86 0, 0.0 -4,-0.1 0, 0.0 -36,-0.1 -0.281 48.9 -98.0 -59.2 143.3 16.1 37.1 42.5 139 155 A F - 0 0 6 -38,-0.2 -34,-0.1 1,-0.1 3,-0.1 -0.336 28.4-163.3 -63.3 143.1 16.9 39.4 39.7 140 156 A E - 0 0 85 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.351 66.0 -17.6-108.8 3.2 13.9 41.3 38.3 141 157 A S S > S- 0 0 31 -40,-0.1 4,-0.7 1,-0.1 -1,-0.1 -0.982 72.6 -83.4 178.5-174.5 15.6 42.4 35.0 142 158 A F H > S+ 0 0 6 -2,-0.3 4,-2.5 2,-0.2 3,-0.4 0.898 124.2 50.0 -79.5 -45.7 18.8 43.0 33.0 143 159 A E H > S+ 0 0 121 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.866 108.2 56.6 -60.3 -35.2 19.5 46.4 34.4 144 160 A D H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.834 108.5 46.5 -64.9 -33.6 19.0 44.8 37.8 145 161 A I H X S+ 0 0 0 -4,-0.7 4,-2.0 -3,-0.4 -2,-0.2 0.900 111.8 48.8 -75.1 -43.6 21.7 42.3 37.0 146 162 A A H < S+ 0 0 29 -4,-2.5 5,-0.2 1,-0.2 -2,-0.2 0.743 116.2 45.4 -68.4 -23.9 24.2 44.9 35.7 147 163 A Q H < S+ 0 0 75 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.872 120.7 34.6 -86.8 -42.5 23.6 47.0 38.8 148 164 A R H < S+ 0 0 73 -4,-1.9 2,-1.3 -5,-0.2 -3,-0.2 0.941 107.2 65.7 -79.3 -52.3 23.8 44.3 41.4 149 165 A V S >< S- 0 0 3 -4,-2.0 3,-1.5 -5,-0.3 -1,-0.2 -0.613 88.6-140.3 -75.5 98.2 26.5 42.0 39.9 150 166 A K T 3 S+ 0 0 89 -2,-1.3 3,-0.1 1,-0.2 -3,-0.1 -0.349 77.4 6.1 -64.0 136.5 29.5 44.3 40.0 151 167 A G T 3 S+ 0 0 78 1,-0.2 2,-0.3 -5,-0.2 -1,-0.2 0.418 90.8 143.6 72.7 0.1 31.8 44.2 37.0 152 168 A I < - 0 0 16 -3,-1.5 -1,-0.2 -7,-0.2 -30,-0.1 -0.545 53.3-120.2 -75.1 132.4 29.5 41.8 35.1 153 169 A Q - 0 0 87 -32,-0.3 5,-0.1 -2,-0.3 -1,-0.1 -0.263 55.3 -64.8 -64.1 157.9 29.3 42.5 31.4 154 170 A R > - 0 0 95 1,-0.2 4,-1.8 3,-0.1 3,-0.2 -0.200 46.0-136.4 -46.9 127.4 25.9 43.4 30.1 155 171 A P H > S+ 0 0 4 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.854 103.9 56.7 -57.4 -34.8 23.7 40.3 30.6 156 172 A E H > S+ 0 0 22 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.918 105.7 49.8 -62.8 -43.7 22.2 40.7 27.1 157 173 A K H > S+ 0 0 102 -3,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.872 109.2 52.2 -62.8 -38.2 25.7 40.6 25.6 158 174 A L H X S+ 0 0 1 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.925 112.5 45.4 -63.6 -44.5 26.5 37.4 27.5 159 175 A I H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.935 112.2 50.2 -64.6 -47.7 23.3 35.9 26.2 160 176 A V H X S+ 0 0 12 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.905 109.0 53.4 -57.5 -42.6 23.9 37.0 22.6 161 177 A S H X S+ 0 0 37 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.888 110.5 46.5 -59.9 -41.8 27.4 35.6 22.8 162 178 A R H X S+ 0 0 10 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.932 111.9 49.9 -68.0 -45.7 26.1 32.2 23.9 163 179 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.942 112.3 47.2 -58.6 -47.9 23.4 32.1 21.3 164 180 A I H X S+ 0 0 28 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.900 110.2 54.4 -61.1 -38.5 25.8 32.9 18.5 165 181 A Y H X S+ 0 0 98 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.931 110.1 45.9 -60.6 -45.3 28.2 30.3 19.9 166 182 A E H < S+ 0 0 2 -4,-2.5 6,-0.2 2,-0.2 -2,-0.2 0.896 110.2 53.3 -65.5 -40.5 25.5 27.6 19.7 167 183 A I H < S+ 0 0 26 -4,-2.5 -93,-0.5 1,-0.2 -1,-0.2 0.893 113.8 43.3 -61.5 -38.9 24.5 28.7 16.2 168 184 A K H < S+ 0 0 101 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.753 120.0 43.6 -78.1 -25.1 28.1 28.4 15.0 169 185 A N >< + 0 0 49 -4,-1.7 3,-2.3 -5,-0.2 -1,-0.2 -0.615 57.7 165.6-124.0 74.2 28.6 25.1 16.9 170 186 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.689 80.2 60.1 -60.2 -16.5 25.6 22.8 16.4 171 187 A Q T 3 S+ 0 0 134 -3,-0.1 -5,-0.1 -5,-0.0 -2,-0.0 0.507 74.5 120.9 -90.2 -4.5 27.8 20.0 17.7 172 188 A T S < S- 0 0 27 -3,-2.3 -3,-0.0 -6,-0.2 -6,-0.0 -0.299 70.9-125.2 -57.6 144.3 28.3 21.7 21.1 173 189 A K S S+ 0 0 167 1,-0.1 2,-0.5 2,-0.0 -1,-0.1 0.794 90.7 54.1 -65.2 -30.3 27.1 19.4 23.9 174 190 A Y - 0 0 83 -56,-0.0 2,-0.7 5,-0.0 -1,-0.1 -0.926 56.0-173.1-116.2 126.2 24.8 22.0 25.4 175 191 A K + 0 0 65 -2,-0.5 4,-0.4 1,-0.2 -12,-0.0 -0.808 15.8 165.2-113.3 87.5 22.0 24.0 23.6 176 192 A L S S+ 0 0 40 -2,-0.7 -1,-0.2 1,-0.1 -13,-0.1 0.891 80.2 6.4 -70.4 -43.1 20.8 26.5 26.2 177 193 A F S S+ 0 0 22 -15,-0.1 -1,-0.1 -18,-0.1 -2,-0.1 0.489 128.7 53.4-121.5 -6.4 18.9 28.8 23.9 178 194 A T 0 0 23 -142,-0.1 -2,-0.1 -15,-0.0 -143,-0.1 0.231 360.0 360.0-115.1 13.7 18.9 27.2 20.5 179 195 A A 0 0 88 -4,-0.4 -3,-0.0 -143,-0.0 -5,-0.0 -0.166 360.0 360.0 -63.3 360.0 17.5 23.7 21.4