==== 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 BIOSYNTHETIC PROTEIN 22-JUL-09 3IEB . COMPND 2 MOLECULE: HEXULOSE-6-PHOSPHATE SYNTHASE SGBH; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; . AUTHOR B.NOCEK,N.MALTSEVA,J.OSIPIUK,J.STAM,W.ANDERSON,A.JOACHIMIAK . 1068 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43182.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 854 80.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 206 19.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 80 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 392 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.5 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 1 4 5 0 10 0 10 5 3 2 4 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 6 20 10 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 5 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 2 A T 0 0 147 0, 0.0 183,-0.4 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-117.0 58.0 50.6 17.4 2 3 A K - 0 0 99 211,-0.1 208,-0.1 1,-0.1 207,-0.0 -0.657 360.0-104.5 -63.2 124.3 54.6 52.2 17.5 3 4 A P - 0 0 7 0, 0.0 183,-0.3 0, 0.0 182,-0.2 -0.328 39.6-136.9 -54.3 133.6 55.2 55.5 15.6 4 5 A X E -a 186 0A 45 181,-2.7 183,-2.4 205,-0.0 2,-0.5 -0.398 13.2-107.9 -88.9 170.4 55.4 58.5 18.0 5 6 A I E -a 187 0A 1 181,-0.2 25,-2.1 -2,-0.1 24,-1.7 -0.866 37.4-173.9-102.9 126.8 53.9 62.0 17.7 6 7 A Q E -ab 188 30A 0 181,-2.2 183,-2.5 -2,-0.5 2,-0.5 -0.972 13.7-153.5-128.5 134.5 56.5 64.8 16.9 7 8 A I E -ab 189 31A 2 23,-2.9 25,-2.5 -2,-0.4 2,-0.7 -0.911 9.2-147.6-107.1 130.6 56.0 68.6 16.8 8 9 A A E - b 0 32A 21 181,-2.0 2,-0.7 -2,-0.5 25,-0.2 -0.901 12.9-149.1 -94.3 107.0 58.3 70.7 14.6 9 10 A L E + b 0 33A 1 23,-2.9 25,-2.4 -2,-0.7 28,-0.5 -0.685 26.4 166.2 -76.1 112.5 58.7 74.2 16.3 10 11 A D + 0 0 56 -2,-0.7 -1,-0.1 23,-0.1 23,-0.1 -0.017 22.8 140.4-122.1 23.5 59.2 76.7 13.5 11 12 A Q - 0 0 7 1,-0.1 29,-0.2 2,-0.1 3,-0.1 -0.337 53.1-135.5 -58.6 150.9 58.7 79.9 15.6 12 13 A T S S+ 0 0 77 1,-0.1 2,-0.3 28,-0.1 -1,-0.1 0.365 85.7 44.5-100.6 7.8 61.0 82.9 14.8 13 14 A N S > S- 0 0 43 1,-0.1 4,-2.1 28,-0.0 5,-0.2 -0.985 74.2-131.4-147.2 148.9 61.7 83.7 18.5 14 15 A L H > S+ 0 0 17 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.844 103.5 61.0 -62.4 -40.4 62.5 81.6 21.6 15 16 A T H > S+ 0 0 112 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.969 110.1 40.9 -51.7 -58.7 59.8 83.3 23.9 16 17 A D H > S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.931 117.1 48.0 -53.9 -51.3 57.0 82.1 21.6 17 18 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.883 109.2 53.9 -59.4 -40.6 58.5 78.6 21.0 18 19 A V H X S+ 0 0 42 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.922 108.3 50.2 -62.3 -39.0 59.1 78.2 24.8 19 20 A A H X S+ 0 0 49 -4,-2.1 4,-1.1 -5,-0.3 -1,-0.2 0.867 113.1 45.9 -69.0 -32.3 55.4 79.0 25.4 20 21 A V H >X S+ 0 0 28 -4,-2.1 4,-2.5 2,-0.2 3,-0.6 0.955 110.9 50.4 -75.0 -48.7 54.4 76.3 22.7 21 22 A A H 3X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.948 110.9 52.6 -48.0 -46.3 56.8 73.6 24.0 22 23 A S H 3< S+ 0 0 81 -4,-2.3 -1,-0.2 -5,-0.3 4,-0.2 0.803 112.0 46.2 -62.4 -31.9 55.3 74.4 27.4 23 24 A N H << S+ 0 0 103 -4,-1.1 3,-0.3 -3,-0.6 -1,-0.2 0.874 119.4 34.6 -73.4 -45.3 51.8 73.9 26.0 24 25 A V H >X S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 4,-0.6 0.562 86.5 100.2 -93.1 -7.6 52.2 70.6 24.0 25 26 A A G >< S+ 0 0 17 -4,-1.8 3,-0.8 -5,-0.3 -1,-0.2 0.842 78.4 57.1 -50.8 -40.5 54.7 68.9 26.3 26 27 A S G 34 S+ 0 0 108 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.722 118.4 28.3 -68.3 -24.0 52.0 66.7 27.9 27 28 A Y G <4 S+ 0 0 26 -3,-1.7 2,-0.4 -4,-0.1 -1,-0.2 0.151 104.7 81.4-124.4 21.8 50.7 65.1 24.6 28 29 A V << - 0 0 5 -3,-0.8 -22,-0.2 -4,-0.6 3,-0.1 -0.978 52.5-163.5-127.2 136.8 53.7 65.1 22.3 29 30 A D S S+ 0 0 53 -24,-1.7 28,-1.4 -2,-0.4 2,-0.4 0.838 77.2 34.5 -83.7 -40.6 56.5 62.6 22.3 30 31 A V E -bc 6 57A 0 -25,-2.1 -23,-2.9 26,-0.2 2,-0.5 -0.986 62.5-161.4-127.0 125.7 59.2 64.4 20.3 31 32 A I E -bc 7 58A 2 26,-2.7 28,-2.5 -2,-0.4 2,-0.5 -0.943 13.8-162.0-105.7 125.1 59.9 68.2 20.2 32 33 A E E -bc 8 59A 6 -25,-2.5 -23,-2.9 -2,-0.5 2,-1.0 -0.925 17.9-143.1-112.4 123.2 61.9 69.4 17.3 33 34 A V E -bc 9 60A 0 26,-3.7 28,-2.8 -2,-0.5 -23,-0.1 -0.778 34.2-141.9 -77.3 105.2 63.8 72.7 17.1 34 35 A G > - 0 0 5 -25,-2.4 4,-3.0 -2,-1.0 3,-0.3 -0.257 19.2-108.1 -68.1 160.7 63.1 73.5 13.4 35 36 A T H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.800 118.6 57.6 -64.4 -25.7 65.7 75.1 11.2 36 37 A I H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.943 112.4 40.4 -68.5 -44.5 63.9 78.4 11.2 37 38 A L H >>S+ 0 0 0 -28,-0.5 4,-2.7 -3,-0.3 5,-0.6 0.914 113.5 55.5 -70.9 -40.9 64.0 78.6 15.0 38 39 A A H X5S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.908 113.6 40.2 -56.5 -45.1 67.6 77.3 15.0 39 40 A F H <5S+ 0 0 2 -4,-2.4 218,-1.3 -5,-0.2 -1,-0.2 0.822 115.6 51.8 -77.1 -30.8 68.7 80.1 12.7 40 41 A A H <5S+ 0 0 16 -4,-2.1 217,-0.6 216,-0.2 218,-0.4 0.950 132.6 9.4 -61.5 -47.5 66.6 82.8 14.5 41 42 A E H ><5S- 0 0 60 -4,-2.7 3,-0.6 215,-0.2 -3,-0.2 0.591 91.8-144.8-118.2 -18.8 67.9 82.0 17.9 42 43 A G T ><< - 0 0 0 -4,-2.2 3,-1.7 -5,-0.6 4,-0.5 -0.266 61.5 -30.0 77.5-166.4 70.9 79.6 17.6 43 44 A X T 3> S+ 0 0 17 210,-1.2 4,-2.5 211,-0.8 3,-0.4 0.651 122.6 80.3 -66.3 -15.2 71.8 76.8 20.1 44 45 A K H <> S+ 0 0 141 -3,-0.6 4,-2.4 210,-0.4 -1,-0.3 0.886 90.1 56.6 -53.1 -40.1 70.2 78.9 23.0 45 46 A A H <> S+ 0 0 0 -3,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.845 107.3 46.2 -55.5 -43.3 66.8 77.5 21.7 46 47 A V H > S+ 0 0 0 -4,-0.5 4,-2.4 -3,-0.4 -2,-0.2 0.943 114.3 48.1 -72.7 -46.1 68.0 74.0 22.1 47 48 A S H X S+ 0 0 53 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.877 111.2 49.0 -52.1 -47.7 69.4 74.6 25.6 48 49 A T H X S+ 0 0 33 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.923 114.6 44.8 -72.3 -41.0 66.4 76.4 26.9 49 50 A L H X S+ 0 0 1 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.864 109.8 55.0 -67.5 -36.6 64.0 73.7 25.6 50 51 A R H < S+ 0 0 48 -4,-2.4 -1,-0.2 28,-0.2 -2,-0.2 0.890 112.1 44.0 -64.3 -38.0 66.2 70.9 26.9 51 52 A H H < S+ 0 0 146 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.896 114.1 49.6 -76.4 -37.7 66.1 72.4 30.3 52 53 A N H < S+ 0 0 62 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.815 124.1 29.6 -66.2 -29.6 62.3 73.1 30.1 53 54 A H >< + 0 0 21 -4,-2.1 3,-1.6 -5,-0.1 -1,-0.2 -0.519 65.5 165.2-134.1 64.6 61.6 69.5 29.0 54 55 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.691 76.8 51.3 -59.9 -16.4 64.2 67.2 30.4 55 56 A N T 3 S+ 0 0 136 -3,-0.1 2,-0.2 2,-0.1 -5,-0.1 0.505 90.7 89.4-103.6 -4.2 62.1 64.1 29.6 56 57 A H S < S- 0 0 36 -3,-1.6 2,-0.4 -6,-0.1 -26,-0.2 -0.520 82.6-107.3 -89.1 157.5 61.2 64.7 25.9 57 58 A I E -c 30 0A 43 -28,-1.4 -26,-2.7 -2,-0.2 2,-0.5 -0.719 41.8-154.8 -75.3 130.9 63.1 63.5 22.9 58 59 A L E -c 31 0A 4 -2,-0.4 23,-3.1 -28,-0.2 24,-2.0 -0.958 9.2-163.1-119.9 128.0 64.6 66.7 21.5 59 60 A V E -cd 32 82A 0 -28,-2.5 -26,-3.7 -2,-0.5 2,-0.6 -0.908 10.6-157.0-111.6 137.3 65.6 67.2 17.9 60 61 A C E -cd 33 83A 0 22,-2.4 24,-1.7 -2,-0.4 2,-1.4 -0.951 13.3-156.1-109.1 110.4 67.8 69.9 16.4 61 62 A D E + 0 0 11 -28,-2.8 -23,-0.1 -2,-0.6 22,-0.1 -0.572 38.1 142.0 -92.2 80.5 66.9 70.3 12.7 62 63 A X E - 0 0 8 -2,-1.4 -1,-0.2 22,-0.4 3,-0.2 0.656 48.9-143.6 -94.3 -17.2 70.1 71.7 11.0 63 64 A K E - 0 0 18 -3,-0.2 22,-0.3 21,-0.2 -2,-0.1 0.910 29.2-147.4 49.0 46.2 69.9 69.8 7.8 64 65 A T E + d 0 85A 2 20,-1.9 22,-2.3 1,-0.2 25,-0.3 -0.162 34.5 167.7 -51.0 126.4 73.6 69.7 8.0 65 66 A T - 0 0 5 1,-0.4 25,-0.6 20,-0.2 2,-0.3 0.542 67.3 -2.4-113.5 -25.9 75.3 69.8 4.7 66 67 A D S S+ 0 0 54 23,-0.1 -1,-0.4 1,-0.1 5,-0.1 -0.972 108.9 49.7-158.5 167.3 78.9 70.4 5.8 67 68 A G > + 0 0 26 -2,-0.3 4,-2.5 -3,-0.1 5,-0.2 0.866 63.8 159.5 66.5 38.4 81.0 71.0 8.9 68 69 A G H > + 0 0 3 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.835 59.6 56.1 -64.0 -43.8 79.4 68.0 10.5 69 70 A A H > S+ 0 0 50 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.951 117.0 39.6 -56.1 -46.9 81.9 67.1 13.3 70 71 A I H > S+ 0 0 88 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.936 117.9 44.9 -70.8 -50.0 81.5 70.7 14.7 71 72 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.884 112.2 51.7 -63.1 -42.8 77.8 71.2 14.2 72 73 A S H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.925 111.5 47.4 -58.6 -47.3 76.9 67.8 15.6 73 74 A R H X S+ 0 0 73 -4,-1.6 4,-2.7 -5,-0.3 5,-0.3 0.925 110.5 51.7 -65.2 -46.6 78.9 68.4 18.7 74 75 A X H X S+ 0 0 27 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.918 113.3 45.2 -51.6 -46.1 77.4 71.9 19.2 75 76 A A H X>S+ 0 0 0 -4,-2.4 5,-2.3 2,-0.2 4,-0.6 0.928 115.6 44.1 -71.8 -43.7 73.8 70.5 18.9 76 77 A F H ><5S+ 0 0 16 -4,-2.5 3,-1.4 3,-0.2 -1,-0.2 0.939 113.6 51.5 -64.9 -43.2 74.3 67.5 21.1 77 78 A E H 3<5S+ 0 0 75 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.861 105.3 56.5 -61.2 -37.6 76.2 69.6 23.7 78 79 A A H 3<5S- 0 0 16 -4,-2.0 -1,-0.3 -5,-0.3 -28,-0.2 0.669 133.4 -91.3 -69.4 -15.6 73.3 72.1 23.7 79 80 A G T <<5S+ 0 0 15 -3,-1.4 -3,-0.2 -4,-0.6 -21,-0.2 0.383 73.5 147.2 125.4 -6.1 71.0 69.2 24.6 80 81 A A < - 0 0 7 -5,-2.3 -1,-0.3 1,-0.1 -21,-0.2 -0.276 30.1-166.3 -60.3 144.3 69.7 67.6 21.4 81 82 A D S S+ 0 0 46 -23,-3.1 26,-1.8 1,-0.3 2,-0.4 0.758 78.6 23.7 -92.3 -39.1 69.0 63.9 21.3 82 83 A W E -de 59 107A 15 -24,-2.0 -22,-2.4 24,-0.2 2,-0.3 -0.963 67.5-166.0-127.3 144.7 68.6 63.7 17.5 83 84 A I E -de 60 108A 0 24,-1.9 26,-2.3 -2,-0.4 2,-0.4 -0.963 18.2-126.3-126.8 152.1 70.0 65.9 14.7 84 85 A T E - e 0 109A 0 -24,-1.7 -20,-1.9 -2,-0.3 2,-0.4 -0.779 20.2-170.8 -99.8 140.1 69.1 66.1 11.1 85 86 A V E -de 64 110A 0 24,-2.8 26,-2.9 -2,-0.4 -20,-0.2 -0.988 27.8-112.6-128.9 131.2 71.7 65.8 8.3 86 87 A S E > - e 0 111A 0 -22,-2.3 3,-2.2 -2,-0.4 26,-0.2 -0.437 14.6-131.1 -65.4 138.5 70.9 66.6 4.7 87 88 A A T 3 S+ 0 0 10 24,-2.5 -1,-0.1 1,-0.3 25,-0.1 0.712 108.9 65.7 -52.5 -25.7 71.0 63.7 2.2 88 89 A A T 3 S+ 0 0 9 23,-0.3 240,-0.7 240,-0.1 -1,-0.3 0.553 74.7 109.2 -81.8 -9.0 73.2 66.1 0.2 89 90 A A S < S- 0 0 6 -3,-2.2 -23,-0.1 -25,-0.3 -24,-0.1 -0.424 84.3-102.2 -58.8 139.6 76.0 66.0 2.7 90 91 A H >> - 0 0 52 -25,-0.6 4,-2.1 1,-0.1 3,-0.8 -0.352 33.2-111.7 -57.1 145.8 79.1 64.1 1.5 91 92 A I H 3> S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.819 118.6 59.4 -54.7 -30.7 79.2 60.7 3.0 92 93 A A H 3> S+ 0 0 24 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.869 106.1 47.4 -66.6 -35.7 82.3 61.7 5.0 93 94 A T H <> S+ 0 0 3 -3,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.908 111.6 50.8 -66.2 -42.9 80.3 64.5 6.7 94 95 A I H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.900 111.0 48.6 -62.4 -41.1 77.5 62.1 7.4 95 96 A A H X S+ 0 0 34 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.890 108.9 53.3 -67.2 -41.0 80.0 59.7 9.0 96 97 A A H X S+ 0 0 26 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.899 110.0 47.8 -59.9 -40.8 81.6 62.5 11.0 97 98 A C H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.928 112.2 49.9 -66.7 -42.5 78.1 63.4 12.4 98 99 A K H X S+ 0 0 31 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.857 106.7 54.9 -67.0 -33.3 77.4 59.7 13.2 99 100 A K H X S+ 0 0 138 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.947 110.7 45.0 -63.2 -46.7 80.8 59.4 15.0 100 101 A V H X S+ 0 0 6 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.946 112.2 53.5 -60.0 -45.7 79.9 62.3 17.3 101 102 A A H <>S+ 0 0 0 -4,-2.5 5,-3.1 1,-0.2 4,-0.3 0.892 108.1 48.7 -52.9 -49.6 76.3 60.9 17.8 102 103 A D H <5S+ 0 0 97 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.826 112.8 49.3 -65.0 -31.4 77.7 57.5 18.9 103 104 A E H <5S+ 0 0 44 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.858 117.2 40.2 -72.2 -33.2 80.1 59.3 21.3 104 105 A L T <5S- 0 0 20 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.123 112.9-106.9-108.1 19.1 77.3 61.5 22.8 105 106 A N T 5S+ 0 0 77 -3,-0.5 -3,-0.2 -4,-0.3 2,-0.2 0.881 80.4 122.7 58.9 41.2 74.5 59.0 23.1 106 107 A G < - 0 0 11 -5,-3.1 2,-0.3 -6,-0.2 -24,-0.2 -0.615 51.9-129.1-119.3-177.0 72.6 60.7 20.1 107 108 A E E -e 82 0A 67 -26,-1.8 -24,-1.9 -2,-0.2 2,-0.4 -0.972 9.2-134.9-134.9 154.7 71.2 59.7 16.7 108 109 A I E -e 83 0A 3 -2,-0.3 23,-0.5 -26,-0.2 2,-0.4 -0.833 14.3-164.5-105.9 140.4 71.4 61.1 13.2 109 110 A Q E -ef 84 131A 0 -26,-2.3 -24,-2.8 -2,-0.4 2,-0.6 -0.999 16.4-136.3-123.5 129.3 68.4 61.4 11.0 110 111 A I E -ef 85 132A 0 21,-2.1 23,-3.2 -2,-0.4 2,-0.7 -0.756 10.2-145.3 -86.5 124.6 68.9 61.9 7.2 111 112 A E E -ef 86 133A 4 -26,-2.9 -24,-2.5 -2,-0.6 2,-1.0 -0.796 20.5-134.2 -85.9 113.8 66.6 64.6 5.7 112 113 A I + 0 0 13 21,-1.9 23,-0.4 -2,-0.7 2,-0.3 -0.637 50.3 131.1 -82.5 102.8 65.8 63.3 2.3 113 114 A Y + 0 0 23 -2,-1.0 190,-0.1 21,-0.1 189,-0.1 -0.903 42.4 27.0-137.0 162.6 66.2 66.2 -0.3 114 115 A G S S- 0 0 32 188,-0.8 2,-1.6 -2,-0.3 188,-0.1 -0.313 111.7 -30.3 85.6-166.5 68.0 66.5 -3.6 115 116 A N S S+ 0 0 80 -2,-0.1 -1,-0.2 -27,-0.0 2,-0.1 -0.446 83.1 167.9 -86.3 62.3 68.8 64.0 -6.3 116 117 A W - 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0 0 99 -2,-0.4 -18,-2.8 -20,-0.2 2,-0.5 -0.526 44.6-175.5 -68.3 117.6 114.7 91.2 15.3 827 185 D T E + f 0 808D 8 -2,-0.4 -18,-0.2 -20,-0.3 3,-0.1 -0.974 29.3 180.0-128.8 119.2 112.0 89.3 17.2 828 186 D K E S- 0 0 43 -20,-2.3 -181,-2.5 -2,-0.5 2,-0.3 0.902 73.4 -13.6 -77.8 -48.7 109.8 86.5 16.0 829 187 D T E -yf 647 809D 0 -21,-1.0 -19,-2.2 -183,-0.3 2,-0.4 -0.971 48.8-133.0-147.7 160.7 107.8 86.0 19.2 830 188 D F E -yf 648 810D 4 -183,-2.1 -181,-2.6 -2,-0.3 2,-0.4 -0.982 33.1-152.9-109.7 131.3 107.7 86.8 23.0 831 189 D I E +yf 649 811D 8 -21,-2.2 -19,-0.5 -2,-0.4 -17,-0.4 -0.924 22.5 159.8-108.6 132.7 106.9 83.6 24.9 832 190 D A E -y 650 0D 17 -183,-2.3 -181,-2.3 -2,-0.4 -17,-0.0 -0.863 22.5-146.2-137.1 174.7 105.2 83.3 28.3 833 191 D G S > S- 0 0 27 -2,-0.3 3,-2.3 -183,-0.2 4,-0.1 0.320 74.2 -10.1-109.0-118.8 103.4 80.6 30.3 834 192 D R G > S+ 0 0 91 1,-0.3 3,-2.1 2,-0.2 7,-0.1 0.687 116.2 78.9 -66.0 -19.7 100.4 80.8 32.6 835 193 D A G 3 S+ 0 0 60 1,-0.3 -1,-0.3 9,-0.0 9,-0.2 0.736 93.4 53.9 -55.6 -22.0 100.6 84.6 32.7 836 194 D L G < S+ 0 0 1 -3,-2.3 -1,-0.3 8,-0.1 -2,-0.2 0.491 109.5 54.7 -92.9 -2.8 98.8 84.4 29.3 837 195 D A S <> S+ 0 0 6 -3,-2.1 4,-0.6 -4,-0.1 3,-0.4 -0.415 83.5 43.8-114.9-171.3 96.0 82.2 30.7 838 196 D G H >> S- 0 0 21 -394,-0.3 3,-1.1 1,-0.2 4,-0.5 -0.090 111.5 -30.9 67.9-168.6 93.5 82.6 33.6 839 197 D A H 34 S+ 0 0 83 1,-0.3 4,-0.3 2,-0.1 -1,-0.2 0.835 142.7 33.0 -53.6 -40.1 91.5 85.7 34.5 840 198 D E H 3> S+ 0 0 110 -3,-0.4 4,-2.5 1,-0.2 -1,-0.3 0.416 88.8 97.8-102.2 -1.6 94.2 88.2 33.3 841 199 D G H S+ 0 0 128 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.882 111.8 52.9 -62.8 -40.2 94.3 91.5 29.0 844 202 D T H X S+ 0 0 35 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.942 108.2 50.0 -62.9 -46.7 98.0 90.7 29.4 845 203 D A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.914 111.3 48.9 -55.2 -45.9 98.2 89.6 25.8 846 204 D A H X S+ 0 0 57 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.894 111.0 50.2 -63.6 -40.1 96.5 92.9 24.7 847 205 D A H X S+ 0 0 34 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.893 110.1 50.8 -67.4 -41.1 99.0 94.9 26.9 848 206 D L H X S+ 0 0 6 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.959 111.6 47.5 -57.8 -47.8 101.9 93.0 25.3 849 207 D R H X S+ 0 0 72 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.868 106.6 57.3 -64.0 -38.5 100.6 93.8 21.8 850 208 D E H X S+ 0 0 129 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.913 112.4 41.4 -58.2 -40.4 100.1 97.5 22.6 851 209 D Q H >X S+ 0 0 36 -4,-1.7 3,-1.2 -3,-0.2 4,-1.0 0.923 111.3 55.0 -74.8 -41.9 103.8 97.7 23.6 852 210 D I H >X S+ 0 0 2 -4,-2.7 4,-2.2 1,-0.3 3,-1.0 0.911 104.0 57.1 -55.2 -40.6 105.0 95.6 20.6 853 211 D D H 3< S+ 0 0 90 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.746 100.9 57.0 -66.5 -22.9 103.1 98.1 18.4 854 212 D R H << S+ 0 0 159 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.810 119.2 28.4 -72.7 -28.7 105.1 101.0 19.7 855 213 D F H << S+ 0 0 31 -3,-1.0 -31,-0.4 -4,-1.0 -2,-0.2 0.592 111.7 59.3-117.2 -15.8 108.5 99.4 18.8 856 214 D W < 0 0 25 -4,-2.2 -1,-0.2 -5,-0.2 -33,-0.0 -0.982 360.0 360.0-119.2 122.6 108.0 97.2 15.8 857 215 D P 0 0 154 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 -0.020 360.0 360.0 -28.3 360.0 106.7 98.5 12.5 858 !* 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 0.0 859 2 E T 0 0 152 0, 0.0 183,-0.1 0, 0.0 184,-0.1 0.000 360.0 360.0 360.0 58.5 113.9 67.5 74.9 860 3 E K - 0 0 98 183,-0.2 208,-0.1 211,-0.1 181,-0.0 -0.970 360.0 -84.2-153.8 135.9 111.5 69.7 76.9 861 4 E P - 0 0 10 0, 0.0 183,-0.3 0, 0.0 2,-0.2 -0.113 47.8-148.3 -50.8 134.9 108.0 70.8 75.9 862 5 E X E -g 1044 0E 48 181,-2.4 183,-2.4 205,-0.0 2,-0.5 -0.491 15.1-109.7 -97.8 171.4 108.0 73.9 73.5 863 6 E I E -g 1045 0E 1 181,-0.2 24,-2.5 -2,-0.2 25,-1.7 -0.910 35.4-173.1-106.0 125.6 105.5 76.7 73.2 864 7 E Q E -gh1046 888E 0 181,-2.6 183,-2.4 -2,-0.5 2,-0.4 -0.963 12.3-154.0-122.1 132.8 103.4 76.7 70.0 865 8 E I E -gh1047 889E 3 23,-2.3 25,-2.4 -2,-0.4 2,-0.7 -0.890 10.5-145.5-102.4 137.3 101.0 79.4 68.7 866 9 E A E - h 0 890E 19 181,-2.2 2,-0.8 -2,-0.4 25,-0.2 -0.923 10.0-151.8 -99.8 115.5 98.2 78.4 66.3 867 10 E L E + h 0 891E 0 23,-2.9 25,-2.7 -2,-0.7 28,-0.5 -0.813 27.8 161.4 -87.5 108.7 97.5 81.1 63.8 868 11 E D + 0 0 60 -2,-0.8 -1,-0.1 23,-0.1 23,-0.1 0.018 20.9 140.9-116.6 28.0 93.9 80.8 62.9 869 12 E Q - 0 0 39 1,-0.1 29,-0.2 2,-0.1 23,-0.0 -0.287 54.8-130.5 -66.9 155.4 93.3 84.3 61.4 870 13 E T S S+ 0 0 76 28,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.304 87.7 38.9 -97.9 6.0 91.1 84.6 58.3 871 14 E N S > S- 0 0 48 1,-0.1 4,-1.7 28,-0.0 3,-0.2 -0.981 78.7-123.3-149.9 154.6 93.5 86.7 56.3 872 15 E L H > S+ 0 0 14 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.844 103.3 62.7 -66.6 -35.7 97.3 86.8 55.9 873 16 E T H > S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 108.4 42.2 -57.3 -47.5 97.9 90.4 57.0 874 17 E D H > S+ 0 0 81 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.909 113.9 51.8 -66.7 -42.5 96.5 89.8 60.5 875 18 E A H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 5,-0.2 0.912 109.9 49.9 -60.3 -43.0 98.4 86.5 60.8 876 19 E V H X S+ 0 0 38 -4,-3.2 4,-2.6 2,-0.2 -1,-0.2 0.908 110.7 49.8 -62.0 -41.7 101.6 88.2 59.8 877 20 E A H X S+ 0 0 48 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.944 112.8 45.8 -66.4 -46.6 101.1 90.9 62.4 878 21 E V H X S+ 0 0 30 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.971 113.9 48.9 -60.4 -50.0 100.4 88.4 65.2 879 22 E A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.909 110.8 51.9 -54.0 -43.9 103.4 86.2 64.2 880 23 E S H < S+ 0 0 81 -4,-2.6 4,-0.4 -5,-0.2 -1,-0.2 0.947 112.6 44.8 -59.6 -49.3 105.5 89.3 64.1 881 24 E N H < S+ 0 0 119 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.867 123.0 33.4 -60.0 -40.3 104.4 90.2 67.6 882 25 E V H >X S+ 0 0 0 -4,-2.6 3,-2.3 -5,-0.2 4,-0.8 0.615 88.8 96.2 -97.7 -13.5 104.8 86.8 69.2 883 26 E A G >< S+ 0 0 15 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.839 78.3 60.4 -46.5 -45.2 107.8 85.3 67.3 884 27 E S G 34 S+ 0 0 101 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.645 116.0 29.1 -65.4 -20.3 110.2 86.3 69.9 885 28 E Y G <4 S+ 0 0 23 -3,-2.3 2,-0.4 166,-0.1 -1,-0.2 0.314 105.7 79.1-124.7 13.2 108.7 84.2 72.7 886 29 E V << - 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