==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-DEC-05 2FB1 . COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR C.CHANG,E.DUGGAN,J.ABDULLAH,A.JOACHIMIAK,MIDWEST CENTER FOR . 900 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46699.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 611 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 169 18.8 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 97 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 199 22.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 4 0 0 4 0 0 4 4 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 4 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 . 0 8 2 8 4 1 7 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 4 0 0 0 0 2 2 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 3 A N > 0 0 121 0, 0.0 3,-0.5 0, 0.0 314,-0.0 0.000 360.0 360.0 360.0 -67.1 35.5 31.0 23.8 2 4 A Y T 3 + 0 0 127 1,-0.2 3,-0.5 2,-0.1 260,-0.0 0.762 360.0 48.9 -77.6 -32.3 31.7 30.4 23.5 3 5 A Y T > S+ 0 0 24 1,-0.2 3,-1.9 2,-0.1 -1,-0.2 0.558 79.8 94.8 -89.3 -10.3 30.0 33.1 25.6 4 6 A S T < S+ 0 0 88 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.578 70.5 69.2 -71.5 -9.5 31.8 36.2 24.3 5 7 A S T 3 S+ 0 0 104 -3,-0.5 -1,-0.3 2,-0.1 -2,-0.1 0.409 89.7 83.2 -86.0 3.7 29.2 37.2 21.7 6 8 A N S < S- 0 0 33 -3,-1.9 270,-0.1 1,-0.1 269,-0.1 -0.794 86.0-109.5-100.8 151.5 26.8 38.0 24.5 7 9 A P - 0 0 21 0, 0.0 231,-0.5 0, 0.0 2,-0.3 -0.267 24.0-136.6 -70.5 162.2 26.8 41.3 26.5 8 10 A T - 0 0 55 229,-0.2 2,-0.3 -4,-0.1 229,-0.2 -0.838 18.6-156.3-116.5 160.2 27.9 41.8 30.0 9 11 A F E -A 236 0A 8 227,-2.5 227,-2.4 -2,-0.3 2,-0.2 -0.977 24.9-103.5-139.5 145.5 26.1 43.8 32.8 10 12 A Y E -Ab 235 90A 35 79,-0.7 81,-2.0 -2,-0.3 2,-0.6 -0.489 36.9-147.0 -58.1 133.1 26.8 45.6 36.0 11 13 A L E - b 0 91A 0 223,-0.5 37,-3.4 37,-0.3 81,-0.2 -0.909 15.9-166.2-112.1 104.7 25.5 43.5 38.9 12 14 A G E -Cb 47 92A 3 79,-2.0 81,-2.3 -2,-0.6 2,-0.4 -0.375 9.7-150.6 -81.4 163.8 24.1 45.4 41.7 13 15 A I E -Cb 46 93A 0 33,-1.9 33,-1.9 79,-0.2 2,-0.4 -0.989 12.3-172.2-122.1 136.7 23.3 44.2 45.2 14 16 A D E -Cb 45 94A 9 79,-1.7 81,-2.6 -2,-0.4 2,-0.5 -0.998 8.5-152.2-127.9 138.7 20.6 45.8 47.3 15 17 A C E -Cb 44 95A 3 29,-3.1 29,-1.0 -2,-0.4 2,-0.7 -0.931 9.8-161.6-114.6 124.0 19.9 45.0 51.0 16 18 A I E - b 0 96A 0 79,-2.8 81,-2.4 -2,-0.5 2,-0.7 -0.899 21.3-162.9 -94.1 114.3 16.6 45.3 52.8 17 19 A I E - b 0 97A 0 -2,-0.7 11,-1.7 11,-0.4 2,-0.3 -0.871 1.5-159.5-112.6 108.2 17.7 45.4 56.4 18 20 A F E +Db 27 98A 1 79,-2.8 81,-2.1 -2,-0.7 2,-0.3 -0.645 14.0 172.4 -89.4 140.7 15.0 44.6 58.9 19 21 A G E -D 26 0A 0 7,-2.2 7,-2.1 -2,-0.3 2,-0.4 -0.908 18.7-142.4-136.7 165.8 15.2 45.6 62.6 20 22 A F E +D 25 0A 16 133,-0.4 2,-0.3 79,-0.3 81,-0.3 -0.994 25.9 154.2-136.0 129.6 12.7 45.5 65.4 21 23 A N E > -D 24 0A 78 3,-2.8 3,-1.9 -2,-0.4 -2,-0.1 -0.964 63.9 -7.6-152.9 138.1 12.1 47.9 68.2 22 24 A E T 3 S- 0 0 162 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.835 128.6 -47.6 52.4 43.0 9.2 48.9 70.5 23 25 A G T 3 S+ 0 0 29 1,-0.2 2,-0.4 139,-0.1 -1,-0.3 0.598 119.6 105.9 75.6 10.6 6.6 46.8 68.7 24 26 A E E < -D 21 0A 99 -3,-1.9 -3,-2.8 94,-0.0 2,-0.4 -0.969 60.7-142.3-130.4 141.8 7.7 48.1 65.3 25 27 A I E +D 20 0A 5 -2,-0.4 94,-2.4 -5,-0.2 95,-0.4 -0.783 28.3 178.6 -91.1 137.9 9.6 46.8 62.3 26 28 A S E -DE 19 118A 16 -7,-2.1 -7,-2.2 -2,-0.4 2,-0.3 -0.936 22.1-131.1-133.3 160.0 11.9 49.3 60.6 27 29 A L E -DE 18 117A 0 90,-2.6 90,-2.3 -2,-0.3 2,-0.7 -0.844 20.5-124.2-106.6 149.5 14.3 49.3 57.7 28 30 A L E + E 0 116A 0 -11,-1.7 16,-0.5 -2,-0.3 -11,-0.4 -0.869 44.2 179.5 -88.7 116.5 17.9 50.6 57.7 29 31 A L E - E 0 115A 0 86,-2.9 86,-2.4 -2,-0.7 2,-0.4 -0.823 26.0-125.4-120.5 153.6 17.9 53.1 54.8 30 32 A L E -FE 42 114A 6 12,-3.4 12,-2.2 -2,-0.3 2,-0.8 -0.821 2.3-158.1 -93.6 135.9 20.4 55.5 53.2 31 33 A K E -F 41 0A 34 82,-2.2 10,-0.2 -2,-0.4 7,-0.1 -0.947 49.4-115.2-100.6 100.6 19.7 59.2 52.8 32 34 A R - 0 0 11 8,-2.5 7,-3.3 -2,-0.8 8,-0.1 -0.057 37.6-175.8 -56.0 128.4 22.3 59.3 50.0 33 35 A N S S+ 0 0 38 79,-0.3 2,-0.3 5,-0.2 -1,-0.2 0.066 70.6 56.1-103.7 19.1 25.4 61.3 50.6 34 36 A F S S- 0 0 60 2,-0.2 5,-0.1 3,-0.1 -2,-0.0 -0.980 89.9 -71.9-144.8 156.9 26.6 60.7 47.1 35 37 A E S S+ 0 0 86 -2,-0.3 2,-0.1 2,-0.1 -2,-0.1 -0.627 92.9 66.3 -81.8 151.2 25.5 61.0 43.6 36 38 A P S S- 0 0 17 0, 0.0 -2,-0.2 0, 0.0 4,-0.1 0.515 131.0 -3.9 -72.6 154.6 23.4 59.7 41.9 37 39 A A S > S- 0 0 12 1,-0.2 3,-2.2 -2,-0.1 -5,-0.3 0.857 82.7-167.6 66.6 40.5 20.3 60.8 43.8 38 40 A X T 3 S+ 0 0 64 1,-0.3 -5,-0.2 -5,-0.1 -1,-0.2 -0.349 73.9 20.1 -56.0 135.8 22.1 62.6 46.6 39 41 A G T 3 S+ 0 0 18 -7,-3.3 -1,-0.3 1,-0.3 2,-0.2 0.310 100.7 116.0 83.8 -8.9 19.6 63.4 49.4 40 42 A E < - 0 0 105 -3,-2.2 -8,-2.5 -8,-0.1 -1,-0.3 -0.610 69.7-109.9 -91.2 152.6 17.2 60.8 48.1 41 43 A W E +Fg 31 125A 44 83,-0.6 85,-1.8 -10,-0.2 2,-0.3 -0.628 47.6 153.0 -85.2 141.1 16.3 57.7 50.2 42 44 A S E -F 30 0A 0 -12,-2.2 -12,-3.4 -2,-0.3 2,-0.1 -0.982 44.6 -89.2-155.4 166.3 17.4 54.2 49.2 43 45 A L - 0 0 0 -2,-0.3 2,-0.2 -14,-0.2 -27,-0.1 -0.393 56.4 -94.0 -67.8 155.1 18.3 50.7 50.2 44 46 A X E +C 15 0A 6 -29,-1.0 -29,-3.1 -16,-0.5 2,-0.3 -0.575 64.3 168.0 -68.7 138.5 21.9 50.0 51.1 45 47 A G E +C 14 0A 19 -31,-0.2 2,-0.3 -2,-0.2 -31,-0.2 -0.878 22.5 159.8-153.2 174.3 23.6 48.8 47.9 46 48 A G E -C 13 0A 18 -33,-1.9 -33,-1.9 -2,-0.3 2,-0.3 -0.921 35.5 -90.8-176.6-165.7 26.7 48.0 46.0 47 49 A F E -C 12 0A 17 -35,-0.3 -35,-0.3 -2,-0.3 2,-0.1 -0.993 35.5-103.5-135.5 145.3 28.1 46.0 43.0 48 50 A V - 0 0 0 -37,-3.4 -37,-0.3 -2,-0.3 2,-0.2 -0.451 39.3-152.8 -63.7 131.9 29.4 42.5 42.6 49 51 A Q > - 0 0 58 4,-0.2 3,-1.2 -2,-0.1 8,-0.1 -0.634 23.4-109.1-100.7 165.6 33.2 42.5 42.3 50 52 A K T 3 S+ 0 0 163 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.760 112.9 56.5 -67.2 -30.0 35.4 40.0 40.4 51 53 A D T 3 S+ 0 0 134 2,-0.0 2,-0.4 258,-0.0 -1,-0.3 0.368 104.1 71.3 -84.2 8.7 36.9 38.3 43.4 52 54 A E S < S- 0 0 15 -3,-1.2 2,-0.1 257,-0.1 0, 0.0 -0.946 70.6-125.8-140.1 145.1 33.5 37.4 44.9 53 55 A S > - 0 0 16 -2,-0.4 4,-1.7 1,-0.1 255,-0.2 -0.299 42.1-107.8 -66.7 163.4 30.4 35.3 44.7 54 56 A V H > S+ 0 0 1 253,-0.8 4,-1.5 1,-0.2 -1,-0.1 0.891 120.2 51.7 -64.2 -40.1 27.0 37.0 44.6 55 57 A D H > S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 108.0 51.1 -60.9 -42.8 26.2 35.9 48.2 56 58 A D H > S+ 0 0 81 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.851 104.3 56.8 -70.1 -32.3 29.5 37.3 49.5 57 59 A A H X S+ 0 0 0 -4,-1.7 4,-3.3 2,-0.2 5,-0.2 0.918 106.6 50.9 -58.8 -43.7 28.9 40.7 47.9 58 60 A A H X S+ 0 0 1 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.964 111.2 47.5 -59.7 -47.9 25.7 40.8 49.9 59 61 A K H X S+ 0 0 100 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.898 114.3 48.8 -56.1 -42.0 27.6 40.0 53.1 60 62 A R H X S+ 0 0 66 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.980 109.1 49.0 -62.0 -58.4 30.1 42.6 52.1 61 63 A V H X S+ 0 0 0 -4,-3.3 4,-1.3 1,-0.2 -2,-0.2 0.898 114.1 48.9 -50.9 -43.6 27.6 45.4 51.4 62 64 A L H X S+ 0 0 2 -4,-2.5 4,-2.3 -5,-0.2 6,-0.4 0.936 111.9 46.9 -61.1 -50.1 26.0 44.6 54.7 63 65 A A H X S+ 0 0 27 -4,-2.5 4,-3.2 1,-0.2 -2,-0.2 0.920 105.7 59.6 -59.2 -47.3 29.3 44.6 56.7 64 66 A E H < S+ 0 0 83 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.843 116.4 34.8 -44.8 -41.7 30.4 48.0 55.0 65 67 A L H < S+ 0 0 0 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.841 135.6 17.4 -84.7 -36.4 27.3 49.6 56.5 66 68 A T H < S- 0 0 1 -4,-2.3 39,-2.6 2,-0.2 -3,-0.2 0.525 86.1-123.8-121.3 -10.8 26.8 47.8 59.8 67 69 A G < + 0 0 43 -4,-3.2 2,-0.3 -5,-0.3 -4,-0.2 0.501 65.9 141.3 71.7 4.2 30.1 46.1 60.8 68 70 A L + 0 0 32 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.2 -0.582 27.9 177.0 -90.5 141.7 28.1 42.8 61.0 69 71 A E + 0 0 159 -2,-0.3 -9,-0.0 1,-0.2 -10,-0.0 -0.875 64.5 35.4-129.1 163.9 29.2 39.3 59.9 70 72 A N S S+ 0 0 168 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.924 83.0 168.1 55.0 45.9 27.4 35.9 60.2 71 73 A V - 0 0 22 -3,-0.2 2,-0.7 1,-0.0 -1,-0.2 -0.716 44.9-108.8 -94.9 139.5 24.1 37.7 59.6 72 74 A Y E +H 98 0A 48 26,-0.6 26,-2.0 -2,-0.3 2,-0.4 -0.561 53.6 169.2 -65.5 113.1 20.9 35.9 58.8 73 75 A X E -H 97 0A 40 -2,-0.7 2,-0.4 24,-0.2 24,-0.2 -0.980 21.9-169.7-131.0 142.5 20.3 36.7 55.1 74 76 A E E -H 96 0A 57 22,-2.3 22,-2.6 -2,-0.4 2,-0.4 -0.975 27.4-119.4-124.8 144.6 17.9 35.6 52.3 75 77 A Q E -H 95 0A 36 -2,-0.4 20,-0.3 20,-0.2 3,-0.1 -0.685 22.4-172.6 -77.0 129.5 18.0 36.2 48.6 76 78 A V E - 0 0 7 18,-2.5 2,-0.3 -2,-0.4 19,-0.2 0.836 50.3 -81.8 -90.6 -43.1 14.8 38.0 47.4 77 79 A G E -H 94 0A 4 17,-1.3 17,-2.4 2,-0.0 2,-0.5 -0.911 40.3 -73.1 161.3 176.4 15.4 37.9 43.6 78 80 A A E -H 93 0A 8 -2,-0.3 2,-0.6 15,-0.2 15,-0.2 -0.897 37.7-154.5 -99.4 128.6 17.1 39.3 40.6 79 81 A F E +H 92 0A 18 13,-3.1 13,-2.2 -2,-0.5 49,-0.0 -0.914 25.8 158.4-104.6 117.5 15.6 42.7 39.4 80 82 A G + 0 0 9 -2,-0.6 201,-1.1 11,-0.2 2,-0.1 -0.024 8.0 146.4-138.1 31.5 16.2 43.2 35.7 81 83 A A > - 0 0 52 199,-0.2 3,-1.2 1,-0.1 4,-0.3 -0.487 56.4-121.4 -64.8 142.2 13.8 45.7 34.1 82 84 A I T 3 S+ 0 0 73 1,-0.2 3,-0.4 2,-0.1 8,-0.3 0.911 107.6 35.4 -55.5 -45.3 15.7 47.6 31.4 83 85 A D T 3 S+ 0 0 138 1,-0.2 -1,-0.2 6,-0.1 44,-0.0 0.168 76.8 112.7 -97.7 14.4 15.0 51.0 33.1 84 86 A R S < S+ 0 0 14 -3,-1.2 -1,-0.2 1,-0.2 44,-0.2 0.860 87.1 41.7 -57.9 -33.0 15.2 50.2 36.8 85 87 A D S S- 0 0 10 -3,-0.4 3,-0.4 -4,-0.3 -1,-0.2 -0.953 77.2-161.1-113.5 114.0 18.4 52.3 37.0 86 88 A P S S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.707 85.1 52.1 -71.4 -20.6 18.0 55.4 34.9 87 89 A G S S- 0 0 52 1,-0.3 2,-0.3 -4,-0.0 143,-0.1 0.794 123.2 -8.7 -86.1 -31.2 21.7 56.1 34.5 88 90 A E S S- 0 0 85 -3,-0.4 2,-0.6 2,-0.1 -1,-0.3 -0.972 81.0 -84.4-160.7 156.7 22.9 52.8 33.3 89 91 A R + 0 0 31 -2,-0.3 -79,-0.7 -3,-0.1 2,-0.4 -0.669 56.2 166.5 -69.4 119.5 21.7 49.2 32.7 90 92 A V E -b 10 0A 2 -2,-0.6 2,-0.6 -8,-0.3 -79,-0.2 -0.969 28.3-155.9-140.4 123.5 22.1 47.4 36.0 91 93 A V E -b 11 0A 0 -81,-2.0 -79,-2.0 -2,-0.4 2,-0.5 -0.858 23.5-158.5 -92.7 124.4 20.6 44.1 37.1 92 94 A S E -bH 12 79A 0 -13,-2.2 -13,-3.1 -2,-0.6 2,-0.7 -0.878 14.2-151.0-115.1 134.8 20.4 44.0 40.9 93 95 A I E -bH 13 78A 0 -81,-2.3 -79,-1.7 -2,-0.5 2,-0.3 -0.870 21.2-152.1 -99.0 117.8 20.1 41.1 43.2 94 96 A A E -bH 14 77A 0 -17,-2.4 -18,-2.5 -2,-0.7 -17,-1.3 -0.652 14.9-178.6 -94.7 146.5 18.2 42.0 46.3 95 97 A Y E -bH 15 75A 8 -81,-2.6 -79,-2.8 -2,-0.3 2,-0.3 -0.923 15.5-142.4-131.0 157.0 18.7 40.3 49.7 96 98 A Y E -bH 16 74A 2 -22,-2.6 -22,-2.3 -2,-0.3 2,-0.4 -0.934 14.2-165.2-119.1 153.8 17.1 40.8 53.1 97 99 A A E -bH 17 73A 1 -81,-2.4 -79,-2.8 -2,-0.3 2,-0.5 -0.975 12.8-148.4-135.0 145.6 18.8 40.6 56.4 98 100 A L E +bH 18 72A 4 -26,-2.0 -26,-0.6 -2,-0.4 2,-0.3 -0.971 30.1 171.1-115.5 116.4 17.5 40.3 59.9 99 101 A I - 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0 0 4 -81,-2.2 2,-0.9 -2,-0.6 -79,-0.4 -0.938 40.2-108.3-127.5 152.2 41.3 77.2 58.8 781 102 D N > - 0 0 29 -2,-0.3 3,-2.3 1,-0.2 4,-0.4 -0.675 29.7-149.7 -72.5 107.4 43.9 75.1 57.0 782 103 D I T 3 S+ 0 0 22 -2,-0.9 -1,-0.2 52,-0.4 3,-0.1 0.563 92.6 61.5 -59.1 -10.8 41.8 73.0 54.8 783 104 D N T 3 S+ 0 0 93 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.377 101.0 55.6 -92.2 6.6 44.4 70.2 55.0 784 105 D E S < S+ 0 0 124 -3,-2.3 -2,-0.2 2,-0.1 -1,-0.1 0.503 72.7 110.5-125.1 -9.2 44.0 69.8 58.7 785 106 D Y S S- 0 0 35 -4,-0.4 2,-0.5 -3,-0.1 -37,-0.2 -0.412 79.1 -97.6 -75.5 149.2 40.3 69.2 59.6 786 107 D D > - 0 0 68 -39,-2.8 4,-1.4 1,-0.2 5,-0.1 -0.505 32.9-150.5 -61.9 113.2 39.1 65.8 60.9 787 108 D R H > S+ 0 0 138 -2,-0.5 4,-0.7 1,-0.2 -1,-0.2 0.702 89.1 39.0 -69.2 -15.2 37.8 64.1 57.8 788 109 D E H > S+ 0 0 89 2,-0.2 4,-2.2 3,-0.1 -1,-0.2 0.728 101.1 63.2-114.8 -16.9 35.2 62.1 59.7 789 110 D L H > S+ 0 0 48 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.905 110.5 49.2 -58.6 -38.3 33.9 64.3 62.3 790 111 D V H <>S+ 0 0 9 -4,-1.4 5,-2.2 1,-0.2 -2,-0.2 0.872 108.4 50.2 -71.6 -31.5 32.8 66.2 59.1 791 112 D Q H ><5S+ 0 0 87 -4,-0.7 3,-1.1 1,-0.2 -1,-0.2 0.867 105.6 58.1 -68.7 -40.1 31.3 63.0 57.5 792 113 D K H 3<5S+ 0 0 32 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.782 110.4 42.7 -48.2 -41.3 29.4 62.4 60.7 793 114 D H T 3<5S- 0 0 50 -4,-1.0 -81,-0.4 -3,-0.2 -79,-0.3 0.340 110.6-123.7 -93.3 4.2 27.8 65.9 60.3 794 115 D N T < 5 + 0 0 8 -3,-1.1 -82,-2.3 1,-0.2 2,-0.2 0.934 57.3 158.3 53.9 47.9 27.2 65.3 56.6 795 116 D A E < -G 711 0G 6 -5,-2.2 2,-0.3 -84,-0.2 -84,-0.3 -0.693 22.3-167.7-106.8 158.2 29.2 68.5 55.8 796 117 D Y E -G 710 0G 67 -86,-2.8 -86,-2.1 -2,-0.2 2,-0.5 -1.000 24.6-119.5-149.9 141.2 31.0 69.6 52.6 797 118 D W E -G 709 0G 50 -2,-0.3 2,-0.4 -88,-0.2 -88,-0.2 -0.694 37.6-178.1 -74.7 126.1 33.4 72.2 51.4 798 119 D V E -G 708 0G 26 -90,-2.8 -90,-2.7 -2,-0.5 5,-0.1 -0.996 34.5-101.8-134.3 139.0 31.8 74.3 48.7 799 120 D N E > -G 707 0G 31 -2,-0.4 3,-2.0 -92,-0.2 -92,-0.3 -0.268 29.2-133.6 -49.4 128.8 33.3 77.1 46.6 800 121 D I G > S+ 0 0 9 -94,-2.3 3,-0.5 1,-0.3 -1,-0.2 0.743 107.4 53.1 -62.6 -24.7 32.0 80.5 48.0 801 122 D N G 3 S+ 0 0 115 -95,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.517 113.2 42.4 -86.9 -6.2 31.1 81.6 44.5 802 123 D E G < S+ 0 0 152 -3,-2.0 -1,-0.2 2,-0.0 -3,-0.2 -0.219 81.7 157.4-130.1 47.1 29.0 78.5 43.8 803 124 D L < - 0 0 53 -3,-0.5 3,-0.1 -5,-0.1 -3,-0.1 -0.370 41.2-119.6 -72.9 146.2 27.1 78.1 47.1 804 125 D P - 0 0 37 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.332 50.4 -79.5 -67.1 164.3 23.8 76.2 47.4 805 126 D A - 0 0 92 -2,-0.0 -83,-0.5 1,-0.0 2,-0.4 -0.470 55.0-144.6 -60.4 135.6 20.9 78.2 48.6 806 127 D L B -i 722 0G 22 -2,-0.1 -83,-0.2 2,-0.1 -1,-0.0 -0.890 10.7-113.5-111.2 150.2 21.2 78.5 52.4 807 128 D I S > S- 0 0 15 -85,-2.0 3,-2.0 -2,-0.4 -83,-0.2 -0.114 70.9 -7.2 -74.0 165.2 18.5 78.5 55.0 808 129 D F T 3 S- 0 0 64 1,-0.3 -42,-0.1 2,-0.1 -2,-0.1 -0.187 122.8 -35.1 57.2-138.6 17.3 81.2 57.3 809 130 D D T 3> S+ 0 0 18 -44,-0.2 4,-2.0 1,-0.2 3,-0.4 0.015 101.8 116.5-101.9 22.0 19.4 84.4 57.3 810 131 D H H <> S+ 0 0 2 -3,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.848 71.8 57.2 -63.2 -32.8 22.7 82.4 56.8 811 132 D P H > S+ 0 0 54 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.872 106.0 51.8 -64.5 -31.8 23.3 84.0 53.4 812 133 D E H > S+ 0 0 118 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.910 110.6 47.9 -66.0 -41.9 23.2 87.4 55.3 813 134 D X H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.917 109.3 52.2 -64.0 -41.2 25.7 86.1 57.7 814 135 D V H X S+ 0 0 4 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.936 109.5 50.9 -62.7 -44.2 28.0 84.8 55.0 815 136 D D H X S+ 0 0 100 -4,-2.1 4,-1.7 1,-0.2 5,-0.2 0.907 110.8 47.3 -56.7 -45.7 27.9 88.3 53.3 816 137 D K H X S+ 0 0 81 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.911 112.4 49.4 -66.0 -39.7 28.8 90.0 56.5 817 138 D A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.878 107.7 55.8 -67.1 -39.8 31.7 87.6 57.2 818 139 D R H X S+ 0 0 55 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.917 109.2 42.4 -57.2 -53.5 33.1 88.0 53.7 819 140 D E H X S+ 0 0 125 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.857 115.6 51.7 -69.5 -30.2 33.5 91.7 53.7 820 141 D X H X S+ 0 0 48 -4,-1.6 4,-2.6 -5,-0.2 -2,-0.2 0.921 111.9 44.7 -65.3 -46.0 34.9 91.7 57.2 821 142 D X H X S+ 0 0 3 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.896 113.6 50.2 -65.9 -45.0 37.5 89.1 56.4 822 143 D K H X S+ 0 0 62 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.865 113.1 46.9 -57.6 -43.0 38.5 90.8 53.1 823 144 D Q H >X S+ 0 0 94 -4,-1.8 4,-1.0 2,-0.2 3,-0.7 0.940 116.0 43.7 -67.1 -50.9 38.9 94.1 55.0 824 145 D K H 3X S+ 0 0 49 -4,-2.6 4,-1.0 1,-0.2 3,-0.4 0.865 109.7 57.3 -66.3 -35.9 40.9 92.6 57.8 825 146 D A H 3< S+ 0 0 0 -4,-2.8 6,-0.2 1,-0.2 79,-0.2 0.668 103.2 54.0 -71.3 -19.4 43.0 90.5 55.4 826 147 D S H << S+ 0 0 42 -4,-0.8 78,-0.7 -3,-0.7 -1,-0.2 0.785 118.5 33.0 -82.2 -29.3 44.2 93.6 53.5 827 148 D V H < S+ 0 0 66 -4,-1.0 75,-0.3 -3,-0.4 -2,-0.2 0.445 123.2 42.3-105.9 -2.0 45.4 95.3 56.6 828 149 D E S >< S- 0 0 66 -4,-1.0 2,-2.3 -5,-0.1 3,-0.6 -0.995 83.2-109.9-149.9 152.1 46.6 92.3 58.6 829 150 D P G > S+ 0 0 11 0, 0.0 3,-0.6 0, 0.0 4,-0.1 -0.131 73.1 124.4 -79.8 50.5 48.4 89.0 58.1 830 151 D I G > + 0 0 10 -2,-2.3 3,-2.1 -6,-0.3 4,-0.3 0.854 52.8 72.6 -80.8 -32.8 45.3 87.0 58.6 831 152 D G G X S+ 0 0 1 -3,-0.6 3,-1.8 1,-0.3 4,-0.2 0.687 79.5 77.4 -58.4 -20.3 45.3 85.0 55.4 832 153 D F G X S+ 0 0 20 -3,-0.6 3,-1.2 1,-0.3 -1,-0.3 0.729 79.4 68.8 -67.3 -21.9 48.2 82.9 56.6 833 154 D N G < S+ 0 0 66 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.677 96.8 56.3 -65.7 -17.7 45.8 80.8 58.8 834 155 D L G < S+ 0 0 2 -3,-1.8 -52,-0.4 -4,-0.3 -133,-0.4 0.517 103.2 66.3 -88.3 -8.9 44.4 79.5 55.4 835 156 D L S < S- 0 0 11 -3,-1.2 4,-0.1 -4,-0.2 -54,-0.1 -0.784 90.9-106.1-109.7 152.8 47.9 78.3 54.4 836 157 D P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.267 45.4 -94.5 -66.6 168.9 50.0 75.5 55.8 837 158 D K S S+ 0 0 176 1,-0.1 54,-0.6 53,-0.1 2,-0.5 0.919 119.0 45.5 -54.8 -44.6 53.0 76.6 57.9 838 159 D L E S+K 890 0H 54 52,-0.1 2,-0.3 50,-0.1 52,-0.2 -0.882 77.2 160.4-103.7 126.1 55.2 76.2 54.7 839 160 D F E -K 889 0H 2 50,-1.9 50,-3.5 -2,-0.5 2,-0.2 -0.951 32.0-121.7-142.5 156.1 53.8 77.8 51.6 840 161 D T > - 0 0 6 -2,-0.3 4,-2.4 48,-0.2 48,-0.1 -0.566 27.5-113.4 -96.9 162.0 55.1 78.9 48.2 841 162 D L H > S+ 0 0 17 46,-0.4 4,-2.9 2,-0.2 5,-0.3 0.897 117.7 57.8 -59.8 -40.4 54.8 82.4 46.6 842 163 D S H > S+ 0 0 62 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.943 109.6 44.6 -50.3 -48.1 52.5 80.9 43.9 843 164 D Q H > S+ 0 0 58 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.915 111.8 51.4 -68.8 -42.6 50.1 79.8 46.6 844 165 D L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.944 113.7 44.4 -55.7 -49.5 50.3 83.1 48.5 845 166 D Q H X S+ 0 0 13 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.920 112.0 53.4 -61.8 -42.6 49.5 85.1 45.3 846 167 D S H X S+ 0 0 36 -4,-2.6 4,-1.1 -5,-0.3 -1,-0.2 0.831 108.1 50.9 -64.3 -34.4 46.8 82.6 44.4 847 168 D L H >X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 3,-0.8 0.967 109.8 48.3 -63.0 -55.5 45.2 83.1 47.9 848 169 D Y H 3X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.3 -2,-0.2 0.833 109.2 53.8 -61.3 -29.6 45.2 86.9 47.6 849 170 D E H 3X>S+ 0 0 54 -4,-2.2 4,-1.9 1,-0.2 5,-0.7 0.802 110.0 49.1 -69.7 -31.4 43.7 86.6 44.1 850 171 D A H <<5S+ 0 0 21 -4,-1.1 -2,-0.2 -3,-0.8 -1,-0.2 0.909 108.4 50.8 -73.1 -44.4 40.9 84.5 45.6 851 172 D I H <5S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.839 124.9 29.2 -63.4 -31.3 40.1 86.8 48.5 852 173 D Y H <5S- 0 0 65 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.710 98.8-129.3-104.5 -23.6 39.8 89.8 46.2 853 174 D G T <5S+ 0 0 65 -4,-1.9 -3,-0.2 1,-0.2 -4,-0.1 0.826 73.0 92.9 75.9 32.3 38.6 88.2 42.9 854 175 D E S - 0 0 87 -2,-0.2 4,-1.2 1,-0.2 5,-0.2 -0.883 33.3-151.9 -83.0 120.8 50.9 91.5 38.9 858 179 D K H > S+ 0 0 101 -2,-0.7 4,-2.1 2,-0.2 3,-0.2 0.921 89.6 55.9 -56.7 -44.6 53.1 88.5 39.6 859 180 D R H 4 S+ 0 0 202 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.935 114.5 31.6 -59.6 -60.2 56.2 90.6 39.3 860 181 D N H > S+ 0 0 73 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.533 113.8 61.0 -85.2 -5.0 55.6 93.4 41.8 861 182 D F H X S+ 0 0 1 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.872 101.5 54.4 -77.7 -42.2 53.6 91.1 44.2 862 183 D R H X S+ 0 0 90 -4,-2.1 4,-0.6 -5,-0.2 -2,-0.2 0.695 108.9 52.3 -56.2 -21.1 56.8 89.0 44.4 863 184 D K H > S+ 0 0 122 -4,-0.3 4,-2.3 2,-0.2 3,-0.2 0.888 100.7 54.8 -90.9 -45.6 58.4 92.4 45.4 864 185 D R H < S+ 0 0 82 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.1 0.876 110.8 50.6 -49.6 -39.6 56.1 93.4 48.2 865 186 D V H >X S+ 0 0 2 -4,-1.6 3,-1.0 1,-0.2 4,-1.0 0.796 105.3 55.9 -71.6 -32.5 56.9 90.0 49.8 866 187 D A H 3< S+ 0 0 56 -4,-0.6 2,-0.7 1,-0.3 -2,-0.2 0.986 109.2 45.5 -62.7 -57.1 60.6 90.6 49.4 867 188 D E T 3< S+ 0 0 142 -4,-2.3 -1,-0.3 1,-0.1 -2,-0.1 -0.112 110.0 59.1 -85.1 40.3 60.5 93.8 51.4 868 189 D X T <4 + 0 0 34 -3,-1.0 -2,-0.2 -2,-0.7 -3,-0.1 0.429 64.6 167.6-114.4 -82.2 58.3 92.3 54.0 869 190 D D < + 0 0 91 -4,-1.0 3,-0.1 2,-0.2 -3,-0.1 0.912 52.0 103.9 55.4 48.1 60.2 89.4 55.5 870 191 D F S S+ 0 0 7 25,-0.1 22,-4.2 2,-0.0 2,-0.7 -0.224 84.0 79.4 -94.4 4.7 58.4 88.4 58.5 871 192 D I E S-L 891 0H 0 20,-0.2 2,-0.4 -6,-0.2 20,-0.2 -0.920 84.6-162.4-103.0 96.4 58.0 86.2 55.5 872 193 D E E -L 890 0H 74 18,-2.6 18,-2.0 -2,-0.7 2,-0.3 -0.700 16.2-131.1 -86.4 130.8 61.2 84.2 55.6 873 194 D K E -L 889 0H 141 -2,-0.4 16,-0.2 16,-0.2 2,-0.2 -0.650 29.7-154.2 -72.3 138.7 62.5 82.2 52.6 874 195 D T E - 0 0 28 14,-2.2 14,-0.2 -2,-0.3 -1,-0.0 -0.576 24.2-120.1-111.1 167.1 63.4 78.7 53.7 875 196 D D E S+ 0 0 177 -2,-0.2 2,-0.3 12,-0.1 14,-0.1 0.236 85.6 91.8 -92.9 16.2 65.9 76.1 52.3 876 197 D K E - 0 0 132 12,-0.3 12,-1.9 0, 0.0 2,-0.3 -0.739 60.9-149.1-108.3 154.6 63.0 73.6 51.6 877 198 D I E -L 887 0H 78 -2,-0.3 2,-0.5 10,-0.2 10,-0.2 -0.880 19.5-116.6-121.0 156.2 60.9 73.0 48.5 878 199 D D E -L 886 0H 51 8,-2.5 8,-0.7 -2,-0.3 2,-0.6 -0.797 31.8-158.1 -87.4 125.6 57.3 71.8 48.0 879 200 D K E +L 885 0H 148 -2,-0.5 2,-0.3 6,-0.2 6,-0.2 -0.929 24.3 169.7-113.3 119.2 57.3 68.5 46.1 880 201 D L S S- 0 0 117 4,-1.1 3,-0.3 -2,-0.6 2,-0.1 -0.685 74.1 -33.6-115.9 76.5 54.2 67.3 44.2 881 202 D G S > S- 0 0 58 -2,-0.3 3,-0.6 1,-0.2 -1,-0.2 -0.399 92.5 -58.5 101.9 179.0 55.8 64.3 42.3 882 203 D S T 3 S+ 0 0 116 1,-0.2 -1,-0.2 -2,-0.1 3,-0.0 0.650 131.7 42.4 -70.8 -13.1 59.2 63.8 40.9 883 204 D K T 3 S+ 0 0 195 -3,-0.3 2,-0.5 1,-0.1 -1,-0.2 0.427 94.9 80.5-117.1 -3.3 59.0 66.8 38.6 884 205 D R < + 0 0 183 -3,-0.6 -4,-1.1 2,-0.0 2,-0.3 -0.942 46.0 149.3-119.8 125.7 57.5 69.7 40.6 885 206 D G E + L 0 879H 59 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.990 11.6 172.2-152.9 142.9 59.2 71.9 43.1 886 207 D A E - L 0 878H 42 -8,-0.7 -8,-2.5 -2,-0.3 -2,-0.0 -0.990 41.4 -94.3-148.4 142.8 59.0 75.5 44.4 887 208 D A E - L 0 877H 36 -2,-0.3 -46,-0.4 -10,-0.2 2,-0.4 -0.225 40.2-134.2 -57.5 148.4 60.8 77.3 47.2 888 209 D L E - 0 0 11 -12,-1.9 -14,-2.2 -14,-0.2 -12,-0.3 -0.889 17.9-165.6-113.7 135.0 58.9 77.4 50.6 889 210 D Y E -KL 839 873H 30 -50,-3.5 -50,-1.9 -2,-0.4 2,-0.4 -0.695 6.1-148.5-113.5 170.0 58.4 80.4 52.8 890 211 D K E -KL 838 872H 77 -18,-2.0 -18,-2.6 -2,-0.2 2,-0.4 -0.999 17.2-128.2-141.9 130.5 57.3 80.8 56.4 891 212 D F E - L 0 871H 50 -54,-0.6 -20,-0.2 -2,-0.4 3,-0.1 -0.689 22.3-155.1 -74.7 128.9 55.4 83.5 58.1 892 213 D N - 0 0 52 -22,-4.2 2,-2.7 -2,-0.4 -1,-0.2 0.891 11.4-174.5 -82.9 -37.6 57.5 84.4 61.1 893 214 D G S S+ 0 0 12 -23,-0.3 -1,-0.2 1,-0.2 -22,-0.0 -0.380 80.6 55.5 81.1 -66.4 54.8 85.8 63.5 894 215 D K S S+ 0 0 166 -2,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.914 106.6 50.0 -67.3 -42.0 57.3 86.8 66.1 895 216 D A S >> S+ 0 0 35 -25,-0.1 3,-2.1 2,-0.1 4,-0.6 0.988 102.3 72.1 -53.7 -60.0 59.3 88.9 63.5 896 217 D Y T 34 S+ 0 0 26 1,-0.2 -27,-0.0 -26,-0.2 -5,-0.0 -0.332 95.4 39.4 -50.7 136.0 56.0 90.5 62.6 897 218 D R T 34 S+ 0 0 136 2,-0.4 -1,-0.2 0, 0.0 -2,-0.1 0.052 88.1 86.1 99.3 -20.9 55.0 92.8 65.5 898 219 D K T <4 S+ 0 0 159 -3,-2.1 -2,-0.2 1,-0.4 -3,-0.1 0.808 126.1 1.5 -65.9 -33.9 58.5 94.1 66.1 899 220 D D S < S- 0 0 88 -4,-0.6 2,-2.6 0, 0.0 -2,-0.4 -0.775 81.1-151.3-145.1 111.6 57.0 96.2 63.4 900 221 D P + 0 0 87 0, 0.0 2,-1.0 0, 0.0 -4,-0.1 -0.273 42.0 147.1 -76.6 58.2 53.4 95.3 62.5 901 222 D K + 0 0 160 -2,-2.6 2,-0.5 -33,-0.1 -73,-0.1 -0.411 12.4 153.2 -98.7 58.1 53.7 96.5 58.9 902 223 D F + 0 0 3 -2,-1.0 2,-0.2 -75,-0.3 -34,-0.0 -0.767 2.5 145.3 -90.0 129.1 51.5 94.2 56.9 903 224 D K 0 0 136 -2,-0.5 -76,-0.1 -39,-0.1 -77,-0.1 -0.659 360.0 360.0-160.5 99.5 50.0 95.5 53.6 904 225 D L 0 0 18 -78,-0.7 -78,-0.1 -79,-0.2 -79,-0.0 0.030 360.0 360.0-140.3 360.0 49.5 93.3 50.6