==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 20-DEC-01 1KO4 . COMPND 2 MOLECULE: GLUCONATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR L.KRAFT,G.A.SPRENGER,Y.LINDQVIST . 327 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15949.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 248 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 14.1 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 . 24 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 37.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 4 1 2 1 2 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 6 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 2 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 3 A T 0 0 75 0, 0.0 2,-0.5 0, 0.0 214,-0.0 0.000 360.0 360.0 360.0 10.1 -2.6 24.8 28.1 2 4 A T - 0 0 41 2,-0.0 2,-0.8 3,-0.0 74,-0.1 -0.868 360.0-150.4 -97.0 135.2 -0.9 22.6 30.6 3 5 A N > - 0 0 48 -2,-0.5 3,-3.2 1,-0.1 74,-0.0 -0.858 5.9-165.6-109.2 94.0 -2.1 19.1 30.5 4 6 A H T 3 S+ 0 0 132 -2,-0.8 -1,-0.1 1,-0.3 -2,-0.0 0.592 86.6 61.9 -59.1 -10.1 -1.6 17.9 34.0 5 7 A D T 3 S+ 0 0 147 70,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.602 94.8 77.3 -88.3 -13.1 -2.1 14.3 32.9 6 8 A H < - 0 0 27 -3,-3.2 2,-0.4 69,-0.1 74,-0.2 -0.634 69.1-159.1 -98.0 154.6 0.9 14.7 30.7 7 9 A H E -a 80 0A 51 72,-2.1 74,-2.5 71,-0.3 2,-0.4 -0.988 15.5-154.4-146.3 144.3 4.3 14.5 32.0 8 10 A I E -ab 81 103A 0 94,-1.9 96,-2.7 -2,-0.4 2,-0.6 -0.963 9.9-161.8-118.8 128.9 7.9 15.5 31.2 9 11 A Y E -ab 82 104A 25 72,-3.6 74,-3.4 -2,-0.4 2,-0.8 -0.954 4.4-158.0-114.7 116.7 10.9 13.6 32.6 10 12 A V E -ab 83 105A 1 94,-2.6 96,-2.4 -2,-0.6 2,-0.6 -0.873 11.0-149.6 -90.2 110.2 14.2 15.4 32.5 11 13 A L E -ab 84 106A 0 72,-2.1 74,-2.3 -2,-0.8 2,-0.2 -0.804 28.8-179.3 -82.6 120.1 17.0 12.7 32.7 12 14 A X E + b 0 107A 0 94,-2.8 96,-2.2 -2,-0.6 2,-0.2 -0.743 19.6 104.0-124.8 163.4 19.8 14.5 34.5 13 15 A G - 0 0 0 73,-1.1 75,-0.1 -2,-0.2 96,-0.1 -0.789 66.0 -52.9 145.3 169.5 23.3 13.8 35.6 14 16 A V S > S- 0 0 4 94,-0.3 3,-1.4 -2,-0.2 5,-0.3 -0.256 70.2 -78.3 -72.2 160.5 26.9 14.4 34.6 15 17 A S T 3 S+ 0 0 54 1,-0.3 -1,-0.2 2,-0.1 113,-0.1 -0.349 120.5 30.5 -53.4 130.4 28.3 13.8 31.2 16 18 A G T 3 S+ 0 0 32 -3,-0.1 -1,-0.3 -2,-0.1 -2,-0.1 0.614 80.5 113.6 91.0 12.1 29.0 10.1 30.8 17 19 A S S < S- 0 0 3 -3,-1.4 -2,-0.1 -4,-0.1 -3,-0.1 0.400 92.2-110.8 -94.2 6.1 26.3 9.0 33.1 18 20 A G > + 0 0 29 -4,-0.1 4,-2.4 3,-0.1 3,-0.3 0.609 63.9 153.3 80.3 15.6 24.6 7.4 30.0 19 21 A K H > S+ 0 0 19 -5,-0.3 4,-2.9 1,-0.2 5,-0.2 0.880 70.3 45.0 -42.1 -56.0 21.7 9.8 29.8 20 22 A S H > S+ 0 0 47 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.891 111.2 51.8 -60.5 -41.0 21.2 9.5 26.1 21 23 A A H > S+ 0 0 51 -3,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.893 114.4 44.3 -66.7 -36.2 21.4 5.8 25.9 22 24 A V H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.972 112.2 49.6 -70.8 -51.5 18.9 5.5 28.7 23 25 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.2 -2,-0.2 0.913 111.7 49.2 -59.3 -42.9 16.4 8.0 27.5 24 26 A S H X S+ 0 0 52 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.919 114.3 43.3 -60.4 -49.3 16.3 6.6 24.0 25 27 A E H X S+ 0 0 63 -4,-1.5 4,-2.9 -5,-0.2 3,-0.4 0.967 115.6 48.7 -63.1 -50.2 15.8 3.0 25.0 26 28 A V H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.3 -2,-0.2 0.880 110.6 52.5 -58.9 -37.6 13.2 3.9 27.6 27 29 A A H X>S+ 0 0 7 -4,-2.7 5,-2.4 -5,-0.3 4,-0.9 0.867 109.7 46.1 -69.5 -37.0 11.4 6.0 25.1 28 30 A H H ><5S+ 0 0 59 -4,-1.9 3,-0.6 -3,-0.4 -2,-0.2 0.936 114.0 49.9 -68.6 -43.1 11.2 3.3 22.5 29 31 A Q H 3<5S+ 0 0 107 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.944 122.8 32.5 -59.2 -41.4 10.0 0.9 25.2 30 32 A L H 3<5S- 0 0 43 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.419 103.2-125.5 -95.1 -0.9 7.4 3.4 26.4 31 33 A H T <<5 + 0 0 170 -4,-0.9 -3,-0.2 -3,-0.6 49,-0.2 0.912 58.8 155.4 54.4 44.0 6.6 5.0 23.0 32 34 A A < - 0 0 19 -5,-2.4 2,-0.2 -6,-0.2 49,-0.2 -0.545 50.5 -99.5 -99.5 166.5 7.4 8.3 24.6 33 35 A A E -c 81 0A 9 47,-2.2 49,-2.5 -2,-0.2 2,-0.4 -0.588 42.3-161.2 -76.1 147.9 8.5 11.5 23.0 34 36 A F E +c 82 0A 27 -2,-0.2 2,-0.5 47,-0.2 167,-0.4 -0.958 17.9 178.8-142.5 126.4 12.3 12.1 23.3 35 37 A L E -c 83 0A 2 47,-2.8 49,-1.7 -2,-0.4 2,-0.9 -0.951 20.0-148.9-129.5 113.0 14.5 15.1 23.0 36 38 A D E > -c 84 0A 23 -2,-0.5 3,-1.2 163,-0.4 4,-0.2 -0.727 14.6-155.0 -74.7 106.4 18.2 15.0 23.4 37 39 A G G > S+ 0 0 0 47,-1.6 3,-1.6 -2,-0.9 4,-0.3 0.636 82.2 78.9 -60.4 -19.4 18.8 18.5 24.8 38 40 A D G > S+ 0 0 53 1,-0.3 3,-2.4 2,-0.2 -1,-0.2 0.935 87.2 63.5 -52.9 -42.9 22.4 18.6 23.6 39 41 A F G < S+ 0 0 7 -3,-1.2 -1,-0.3 1,-0.3 199,-0.2 0.700 95.2 58.1 -57.5 -22.7 20.9 19.5 20.2 40 42 A L G < S+ 0 0 23 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.485 74.8 118.8 -91.0 -2.6 19.4 22.7 21.5 41 43 A H S < S- 0 0 11 -3,-2.4 2,-0.1 -4,-0.3 197,-0.1 -0.417 71.2-114.1 -60.6 138.4 22.7 24.2 22.7 42 44 A P >> - 0 0 43 0, 0.0 4,-1.2 0, 0.0 3,-0.6 -0.488 26.1-108.0 -76.8 144.3 23.4 27.4 20.8 43 45 A R H >> S+ 0 0 105 1,-0.3 4,-2.4 2,-0.2 3,-0.6 0.829 118.4 58.1 -41.0 -48.7 26.4 27.5 18.4 44 46 A R H 3> S+ 0 0 140 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.963 104.3 51.5 -45.7 -59.4 28.3 29.8 20.7 45 47 A N H <> S+ 0 0 2 -3,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.773 109.6 49.5 -51.7 -33.4 28.1 27.2 23.6 46 48 A I H S+ 0 0 44 -4,-2.2 5,-2.5 1,-0.2 4,-0.8 0.909 117.8 45.2 -48.8 -49.7 33.2 27.1 23.7 49 51 A X H ><5S+ 0 0 65 -4,-2.2 3,-0.6 -5,-0.2 -2,-0.2 0.915 115.4 45.3 -64.7 -46.9 32.6 23.4 24.7 50 52 A A H 3<5S+ 0 0 55 -4,-4.2 -1,-0.2 1,-0.2 -2,-0.2 0.832 105.8 60.7 -66.9 -33.9 34.4 21.9 21.8 51 53 A S H 3<5S- 0 0 84 -4,-2.9 -1,-0.2 -5,-0.4 -2,-0.2 0.741 127.5 -98.2 -66.0 -22.3 37.4 24.3 22.2 52 54 A G T <<5S+ 0 0 60 -4,-0.8 -3,-0.2 -3,-0.6 -2,-0.1 0.454 80.9 131.3 116.7 6.6 37.8 22.8 25.7 53 55 A E < - 0 0 101 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.4 -0.653 52.2-133.2 -90.3 140.0 36.1 25.4 27.8 54 56 A P - 0 0 86 0, 0.0 -5,-0.0 0, 0.0 -6,-0.0 -0.862 31.5-120.6 -80.9 132.9 33.5 24.6 30.5 55 57 A L - 0 0 13 -2,-0.4 2,-0.2 1,-0.1 -10,-0.0 -0.179 21.6-142.5 -75.0 165.9 30.4 26.8 30.3 56 58 A N >> - 0 0 68 1,-0.0 4,-1.5 0, 0.0 3,-1.2 -0.613 36.3 -80.2-118.7-179.7 29.0 29.2 33.0 57 59 A D H 3> S+ 0 0 56 1,-0.3 4,-1.5 -2,-0.2 3,-0.2 0.859 125.8 46.2 -52.0 -47.2 25.6 30.3 34.3 58 60 A D H 34 S+ 0 0 126 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.620 106.7 58.4 -75.5 -14.4 24.9 32.8 31.5 59 61 A D H <4 S+ 0 0 4 -3,-1.2 4,-0.3 2,-0.1 -1,-0.2 0.854 111.8 42.4 -75.7 -34.7 26.0 30.4 28.7 60 62 A R H >X S+ 0 0 16 -4,-1.5 4,-3.3 -3,-0.2 3,-0.9 0.775 93.2 81.5 -85.8 -28.0 23.3 28.0 29.9 61 63 A K H 3X S+ 0 0 110 -4,-1.5 4,-3.0 1,-0.3 5,-0.2 0.902 95.4 44.3 -41.6 -57.9 20.4 30.4 30.5 62 64 A P H 3> S+ 0 0 69 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.782 116.0 50.0 -65.8 -22.3 19.4 30.6 26.8 63 65 A W H X> S+ 0 0 6 -3,-0.9 4,-2.1 -4,-0.3 3,-0.6 0.971 110.2 46.5 -80.6 -55.7 19.7 26.9 26.6 64 66 A L H 3X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.3 5,-0.2 0.928 109.8 56.8 -51.4 -43.1 17.7 26.0 29.6 65 67 A Q H 3X S+ 0 0 77 -4,-3.0 4,-2.1 -5,-0.3 -1,-0.3 0.927 106.3 50.3 -55.2 -38.6 15.2 28.5 28.3 66 68 A A H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 3,-0.6 0.811 103.4 57.9 -73.6 -36.1 5.9 18.3 24.2 75 77 A Q H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.725 92.6 75.1 -70.2 -15.8 3.5 18.0 27.0 76 78 A R H 3< S+ 0 0 86 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.936 116.6 8.7 -57.0 -43.5 0.8 19.3 24.6 77 79 A T H << S+ 0 0 108 -3,-0.6 2,-0.4 -4,-0.5 -1,-0.2 0.313 113.0 75.2-129.5 10.9 0.6 16.1 22.7 78 80 A N < - 0 0 42 -4,-1.1 -71,-0.3 1,-0.1 3,-0.2 -0.986 56.9-151.1-128.9 136.6 2.5 13.3 24.4 79 81 A K S S+ 0 0 166 -2,-0.4 -72,-2.1 1,-0.3 2,-0.4 0.932 92.7 27.9 -67.7 -41.1 1.4 11.4 27.5 80 82 A V E S-a 7 0A 37 -49,-0.2 -47,-2.2 -74,-0.2 2,-0.4 -0.985 70.9-174.9-130.1 126.0 5.1 10.9 28.4 81 83 A S E -ac 8 33A 0 -74,-2.5 -72,-3.6 -2,-0.4 2,-0.5 -0.947 7.3-160.2-124.1 134.4 8.0 13.1 27.5 82 84 A L E -ac 9 34A 0 -49,-2.5 -47,-2.8 -2,-0.4 2,-0.5 -0.965 8.0-177.8-118.2 127.0 11.8 12.5 28.0 83 85 A I E -ac 10 35A 3 -74,-3.4 -72,-2.1 -2,-0.5 2,-0.5 -0.975 16.9-149.4-126.4 117.9 14.3 15.3 27.9 84 86 A V E +ac 11 36A 8 -49,-1.7 -47,-1.6 -2,-0.5 2,-0.2 -0.748 37.9 145.8 -78.9 124.6 18.0 14.6 28.4 85 87 A C - 0 0 2 -74,-2.3 -72,-0.1 -2,-0.5 -2,-0.1 -0.764 49.0-137.1-163.8 120.5 19.5 17.7 30.1 86 88 A S - 0 0 23 -2,-0.2 -73,-1.1 -74,-0.2 -1,-0.1 0.829 27.8-179.4 -51.3 -39.7 22.4 17.7 32.6 87 89 A A + 0 0 0 -75,-0.1 6,-0.2 1,-0.1 -1,-0.1 0.817 8.4 170.3 41.7 42.7 20.6 20.2 34.8 88 90 A L + 0 0 3 -75,-0.1 45,-2.9 44,-0.1 2,-0.2 0.831 51.7 59.8 -50.4 -44.9 23.6 20.1 37.2 89 91 A K S > S- 0 0 49 43,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.551 77.6-129.7 -91.2 156.1 22.5 23.1 39.4 90 92 A K H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.866 111.4 56.4 -67.0 -35.8 19.4 23.7 41.4 91 93 A H H > S+ 0 0 75 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.897 106.0 50.1 -66.2 -36.9 19.0 27.1 39.8 92 94 A Y H > S+ 0 0 3 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.913 108.3 53.1 -65.4 -39.5 19.0 25.4 36.3 93 95 A R H >X S+ 0 0 1 -4,-1.9 4,-2.4 1,-0.2 3,-0.8 0.946 106.6 52.7 -62.3 -44.6 16.3 22.9 37.6 94 96 A D H 3X S+ 0 0 67 -4,-2.3 4,-1.5 1,-0.3 -1,-0.2 0.908 104.1 56.8 -53.9 -44.4 14.2 25.8 38.7 95 97 A L H 3< S+ 0 0 17 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.846 109.3 46.0 -59.8 -27.7 14.5 27.3 35.2 96 98 A L H << S+ 0 0 3 -4,-1.4 -2,-0.2 -3,-0.8 -1,-0.2 0.876 107.8 57.3 -81.8 -35.6 13.1 24.1 33.8 97 99 A R H >< S+ 0 0 42 -4,-2.4 3,-2.8 -5,-0.2 2,-0.2 0.749 77.2 114.7 -62.4 -28.9 10.3 23.9 36.4 98 100 A E T 3< S- 0 0 118 -4,-1.5 -3,-0.0 1,-0.3 -4,-0.0 -0.252 96.7 -7.3 -55.2 113.5 8.8 27.3 35.5 99 101 A G T 3 S+ 0 0 50 -2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.597 118.9 95.6 79.2 8.1 5.3 27.0 34.0 100 102 A N X + 0 0 1 -3,-2.8 3,-1.9 1,-0.1 -92,-0.1 -0.425 34.6 154.8-127.6 60.0 5.9 23.3 34.0 101 103 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.764 79.1 58.3 -57.5 -26.5 4.4 21.9 37.2 102 104 A N T 3 S+ 0 0 7 -3,-0.1 -94,-1.9 -5,-0.1 2,-0.4 -0.060 87.7 97.0 -92.4 29.7 4.1 18.6 35.4 103 105 A L E < +b 8 0A 2 -3,-1.9 2,-0.3 -96,-0.2 -94,-0.2 -0.950 48.7 164.9-117.0 135.8 7.8 18.4 34.8 104 106 A S E -b 9 0A 14 -96,-2.7 -94,-2.6 -2,-0.4 2,-0.4 -0.904 27.2-104.7-140.7-176.5 10.1 16.4 37.0 105 107 A F E -bd 10 142A 1 36,-2.9 38,-3.2 -2,-0.3 2,-0.6 -0.887 8.9-164.8-123.0 139.9 13.6 14.8 37.3 106 108 A I E -bd 11 143A 1 -96,-2.4 -94,-2.8 -2,-0.4 2,-0.9 -0.976 21.2-155.6-111.9 111.9 15.2 11.5 37.0 107 109 A Y E -bd 12 144A 7 36,-3.4 38,-2.6 -2,-0.6 2,-1.1 -0.823 3.7-153.2 -96.7 103.9 18.7 11.8 38.4 108 110 A L E - d 0 145A 2 -96,-2.2 -94,-0.3 -2,-0.9 2,-0.2 -0.724 30.3-160.6 -74.4 101.2 20.9 9.1 37.0 109 111 A K E + d 0 146A 88 36,-2.6 38,-2.5 -2,-1.1 2,-0.3 -0.578 31.4 130.6 -98.8 152.3 23.4 8.8 39.9 110 112 A G - 0 0 14 -2,-0.2 2,-0.1 36,-0.1 -93,-0.0 -0.883 43.2-113.0 179.8 158.4 26.9 7.5 40.4 111 113 A D > - 0 0 92 -2,-0.3 4,-2.4 1,-0.0 5,-0.3 -0.408 42.5 -83.3-100.6-177.8 30.1 8.9 42.0 112 114 A F H > S+ 0 0 54 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.903 123.4 45.7 -50.0 -51.5 33.4 9.8 40.6 113 115 A D H > S+ 0 0 109 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.939 112.4 50.5 -63.7 -45.7 35.0 6.4 40.5 114 116 A V H 4 S+ 0 0 24 2,-0.2 4,-0.2 1,-0.2 -1,-0.2 0.966 116.0 41.4 -56.0 -52.3 32.0 4.6 39.0 115 117 A I H >X S+ 0 0 2 -4,-2.4 3,-2.2 2,-0.2 4,-1.8 0.978 118.2 44.2 -63.4 -53.7 31.7 7.1 36.3 116 118 A E H >< S+ 0 0 88 -4,-2.8 3,-0.6 1,-0.3 -1,-0.2 0.941 114.6 49.9 -52.0 -51.0 35.4 7.4 35.5 117 119 A S T 3< S+ 0 0 98 -4,-3.3 -1,-0.3 -5,-0.3 -2,-0.2 0.437 107.1 58.6 -69.5 0.2 35.8 3.7 35.7 118 120 A R T <4 0 0 96 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.788 360.0 360.0 -92.8 -39.7 32.9 3.5 33.4 119 121 A L << 0 0 147 -4,-1.8 -2,-0.2 -3,-0.6 -3,-0.1 0.997 360.0 360.0 -71.9 360.0 34.6 5.5 30.6 120 ! 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 0.0 121 130 A K > 0 0 182 0, 0.0 4,-1.3 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 81.7 39.1 13.7 29.5 122 131 A T H > + 0 0 73 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.806 360.0 61.4 -44.1 -38.0 39.2 13.3 33.3 123 132 A Q H >> S+ 0 0 131 2,-0.2 4,-2.3 1,-0.2 3,-0.8 0.963 98.5 53.0 -60.5 -54.0 39.2 17.1 33.8 124 133 A X H 3> S+ 0 0 85 -3,-0.4 4,-1.9 1,-0.3 -1,-0.2 0.906 112.3 48.5 -41.5 -49.2 35.8 17.6 32.1 125 134 A L H 3X S+ 0 0 6 -4,-1.3 4,-1.5 1,-0.2 -1,-0.3 0.792 106.1 55.3 -66.3 -34.2 34.5 15.1 34.5 126 135 A V H - 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