==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PX DOMAIN 15-JUN-01 1H6H . COMPND 2 MOLECULE: NEUTROPHIL CYTOSOL FACTOR 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.KARATHANASSIS,J.BRAVO,M.PACOLD,O.PERISIC,R.L.WILLIAMS . 143 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9709.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 66.4 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 . 21 14.7 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 . 1 0.7 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 . 8 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 49 34.3 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 2 0 0 1 0 0 0 0 0 1 0 1 0 0 0 1 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 . 0 0 0 0 0 0 1 0 0 1 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 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 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 A > 0 0 106 0, 0.0 4,-1.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 12.9 -6.8 -5.3 -27.1 2 3 A V H > + 0 0 110 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.887 360.0 61.2 -61.2 -39.5 -4.0 -7.7 -28.1 3 4 A A H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.873 101.5 53.0 -55.2 -40.9 -2.3 -4.8 -30.0 4 5 A Q H > S+ 0 0 138 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.942 109.0 46.8 -62.8 -49.9 -2.0 -2.9 -26.7 5 6 A Q H X S+ 0 0 118 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.919 111.2 52.5 -58.7 -45.1 -0.3 -5.7 -24.8 6 7 A L H X S+ 0 0 105 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.840 111.9 46.2 -60.5 -34.3 2.1 -6.4 -27.7 7 8 A R H X S+ 0 0 148 -4,-1.7 4,-2.6 -5,-0.2 -1,-0.2 0.897 109.8 52.8 -74.9 -41.0 3.1 -2.7 -27.7 8 9 A A H X S+ 0 0 52 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.902 110.9 49.0 -59.3 -40.3 3.5 -2.6 -24.0 9 10 A E H X S+ 0 0 118 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.885 110.0 50.7 -66.4 -40.7 5.8 -5.5 -24.3 10 11 A S H X S+ 0 0 47 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.907 110.6 48.3 -65.0 -44.3 7.8 -3.9 -27.1 11 12 A D H >X S+ 0 0 71 -4,-2.6 3,-0.6 2,-0.2 4,-0.6 0.909 110.9 49.8 -64.3 -43.6 8.4 -0.6 -25.2 12 13 A F H >< S+ 0 0 99 -4,-2.0 3,-1.7 1,-0.2 -1,-0.2 0.930 103.6 61.2 -60.5 -45.2 9.5 -2.4 -22.0 13 14 A E H 3< S+ 0 0 131 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.800 100.1 56.1 -51.5 -32.8 12.0 -4.5 -24.1 14 15 A Q H << S+ 0 0 136 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.670 84.3 100.2 -77.2 -18.9 13.7 -1.3 -25.1 15 16 A L S << S- 0 0 23 -3,-1.7 -3,-0.0 -4,-0.6 105,-0.0 -0.365 83.6-102.2 -68.1 145.2 14.5 -0.0 -21.6 16 17 A P > - 0 0 49 0, 0.0 3,-1.6 0, 0.0 31,-0.3 -0.291 29.4-113.8 -66.0 155.2 18.0 -0.6 -20.2 17 18 A D T 3 S+ 0 0 107 1,-0.3 31,-2.6 30,-0.1 33,-0.3 0.748 111.2 64.4 -62.2 -23.4 18.4 -3.4 -17.8 18 19 A D T 3 S+ 0 0 71 29,-0.2 -1,-0.3 28,-0.1 2,-0.2 0.348 72.2 119.6 -84.8 8.6 19.2 -1.0 -14.9 19 20 A V < - 0 0 12 -3,-1.6 28,-2.3 1,-0.1 2,-0.2 -0.542 69.1-114.5 -74.6 137.0 15.8 0.7 -14.9 20 21 A A E +A 46 0A 11 -2,-0.2 26,-0.3 26,-0.2 3,-0.1 -0.509 33.0 176.1 -72.0 134.0 14.0 0.4 -11.5 21 22 A I E + 0 0 88 24,-3.0 2,-0.3 1,-0.4 25,-0.2 0.569 68.6 11.7-112.4 -15.0 10.8 -1.6 -11.6 22 23 A S E -A 45 0A 35 23,-1.4 23,-2.0 2,-0.0 -1,-0.4 -0.982 52.9-172.8-158.2 153.2 9.9 -1.5 -7.8 23 24 A A E +A 44 0A 6 -2,-0.3 2,-0.4 21,-0.2 21,-0.2 -0.909 13.2 174.5-151.3 118.9 11.0 0.4 -4.7 24 25 A N E -A 43 0A 89 19,-2.1 19,-2.9 -2,-0.3 2,-0.3 -0.994 33.1-113.0-132.0 136.7 9.7 -0.6 -1.1 25 26 A I E +A 42 0A 23 -2,-0.4 17,-0.2 17,-0.2 3,-0.1 -0.518 27.7 179.0 -75.2 127.8 10.8 0.8 2.3 26 27 A A E - 0 0 65 15,-2.9 2,-0.3 -2,-0.3 16,-0.2 0.694 62.8 -28.2 -97.8 -26.8 12.5 -1.8 4.5 27 28 A D E -A 41 0A 92 14,-1.1 14,-2.7 2,-0.0 2,-0.3 -0.969 53.5-118.9-173.9 174.6 13.2 0.4 7.6 28 29 A I E -A 40 0A 26 -2,-0.3 2,-0.4 12,-0.2 12,-0.2 -0.972 22.0-156.0-130.1 147.1 13.8 4.0 8.9 29 30 A E E -A 39 0A 78 10,-2.4 10,-2.4 -2,-0.3 2,-0.4 -0.990 11.6-134.2-127.6 134.9 16.9 5.2 10.7 30 31 A E E -A 38 0A 94 -2,-0.4 2,-0.8 8,-0.2 8,-0.2 -0.734 9.8-156.0 -88.1 129.4 17.3 8.2 13.1 31 32 A K E -A 37 0A 91 6,-2.9 6,-1.4 -2,-0.4 4,-0.0 -0.889 22.4-154.1-106.3 102.3 20.3 10.5 12.5 32 33 A R + 0 0 217 -2,-0.8 2,-0.3 4,-0.2 3,-0.1 -0.164 35.6 97.8 -73.9 166.3 20.9 12.1 15.9 33 34 A G S S- 0 0 47 1,-0.2 3,-0.1 3,-0.0 -2,-0.0 -0.916 88.7 -34.1 147.7-173.6 22.6 15.5 16.7 34 35 A F S S+ 0 0 208 -2,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.900 142.2 14.4 -39.7 -46.0 21.9 19.1 17.5 35 36 A T S S- 0 0 85 -3,-0.1 2,-0.3 -4,-0.0 -1,-0.2 -0.997 86.9-150.8-132.1 131.5 19.0 18.5 15.2 36 37 A S + 0 0 28 -2,-0.4 2,-0.3 -3,-0.1 -4,-0.2 -0.706 14.6 178.7-105.1 157.9 17.9 15.0 14.2 37 38 A H E -A 31 0A 55 -6,-1.4 -6,-2.9 -2,-0.3 2,-0.4 -0.928 24.3-114.3-145.7 168.3 16.3 13.8 11.0 38 39 A F E -A 30 0A 19 -2,-0.3 20,-0.6 -8,-0.2 2,-0.4 -0.882 16.1-154.9-115.4 146.3 15.1 10.5 9.6 39 40 A V E -AB 29 57A 14 -10,-2.4 -10,-2.4 -2,-0.4 2,-0.4 -0.943 14.0-136.4-118.5 134.6 16.4 8.4 6.6 40 41 A F E -AB 28 56A 3 16,-2.8 16,-2.2 -2,-0.4 2,-0.7 -0.778 11.0-144.8 -92.3 130.1 14.3 5.9 4.7 41 42 A V E -AB 27 55A 8 -14,-2.7 -15,-2.9 -2,-0.4 -14,-1.1 -0.883 24.8-167.2 -96.2 116.6 16.0 2.6 3.8 42 43 A I E -AB 25 54A 0 12,-2.6 12,-1.8 -2,-0.7 2,-0.6 -0.913 17.8-147.6-117.9 126.8 14.6 1.6 0.4 43 44 A E E -AB 24 53A 76 -19,-2.9 -19,-2.1 -2,-0.5 2,-0.4 -0.822 21.4-165.9 -92.8 120.2 15.0 -1.8 -1.4 44 45 A V E -AB 23 52A 0 8,-3.0 8,-2.0 -2,-0.6 2,-0.4 -0.865 8.6-166.0-109.3 138.3 15.1 -1.4 -5.2 45 46 A K E -AB 22 51A 93 -23,-2.0 -24,-3.0 -2,-0.4 -23,-1.4 -0.971 12.8-153.0-120.6 139.9 14.7 -4.1 -7.9 46 47 A T E > -A 20 0A 9 4,-1.8 3,-1.8 -2,-0.4 -26,-0.2 -0.648 30.3-106.0-110.4 167.4 15.6 -3.5 -11.6 47 48 A K T 3 S+ 0 0 47 -28,-2.3 -29,-0.2 1,-0.3 -30,-0.1 0.863 119.0 55.7 -56.1 -39.1 14.5 -4.9 -14.9 48 49 A G T 3 S- 0 0 48 -31,-2.6 -1,-0.3 -29,-0.2 -30,-0.1 0.451 123.9 -99.1 -77.2 -1.1 17.7 -6.9 -15.2 49 50 A G S < S+ 0 0 65 -3,-1.8 -2,-0.1 1,-0.3 2,-0.1 0.506 72.3 142.7 99.4 3.1 17.2 -8.7 -11.8 50 51 A S - 0 0 69 -33,-0.3 -4,-1.8 2,-0.0 2,-0.4 -0.449 28.2-166.8 -77.0 153.0 19.4 -6.6 -9.5 51 52 A K E +B 45 0A 131 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.977 22.0 141.6-142.2 125.7 18.3 -6.0 -5.9 52 53 A Y E -B 44 0A 44 -8,-2.0 -8,-3.0 -2,-0.4 2,-0.3 -0.959 41.4-103.9-156.3 171.1 19.9 -3.4 -3.6 53 54 A L E -B 43 0A 25 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.792 24.2-177.5-106.6 147.2 19.4 -0.7 -0.9 54 55 A I E -B 42 0A 0 -12,-1.8 -12,-2.6 -2,-0.3 2,-0.5 -0.928 19.1-137.9-131.7 159.9 19.5 3.1 -1.2 55 56 A Y E +B 41 0A 44 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.973 27.9 168.0-126.6 118.5 19.1 5.6 1.7 56 57 A R E -B 40 0A 18 -16,-2.2 -16,-2.8 -2,-0.5 2,-0.2 -0.994 22.0-148.7-135.1 136.9 17.0 8.8 1.2 57 58 A R E >> -B 39 0A 86 -2,-0.4 3,-1.4 -18,-0.2 4,-1.3 -0.593 36.0-104.1 -96.4 160.4 15.6 11.5 3.5 58 59 A Y H 3> S+ 0 0 25 -20,-0.6 4,-2.4 1,-0.3 3,-0.4 0.881 116.7 59.2 -53.3 -41.8 12.3 13.3 2.8 59 60 A R H 3> S+ 0 0 171 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.789 102.1 55.0 -64.1 -21.3 13.9 16.6 1.6 60 61 A Q H <> S+ 0 0 85 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.886 108.6 49.0 -72.6 -38.8 15.7 14.7 -1.2 61 62 A F H X S+ 0 0 1 -4,-1.3 4,-2.5 -3,-0.4 -2,-0.2 0.906 111.1 49.7 -62.5 -44.4 12.2 13.3 -2.3 62 63 A H H X S+ 0 0 59 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.906 108.6 51.7 -66.2 -39.8 10.7 16.9 -2.2 63 64 A A H X S+ 0 0 48 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.869 111.0 49.0 -63.9 -36.9 13.6 18.3 -4.3 64 65 A L H X S+ 0 0 7 -4,-1.7 4,-2.1 1,-0.2 3,-0.4 0.948 110.3 49.7 -67.6 -46.3 13.1 15.6 -6.9 65 66 A Q H X S+ 0 0 8 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.865 105.3 58.0 -62.0 -34.9 9.3 16.2 -7.1 66 67 A S H X S+ 0 0 37 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.895 107.5 47.8 -61.4 -38.5 9.9 19.9 -7.5 67 68 A K H X S+ 0 0 80 -4,-1.3 4,-1.6 -3,-0.4 -2,-0.2 0.923 110.9 50.3 -66.5 -45.5 11.9 19.2 -10.6 68 69 A L H X S+ 0 0 0 -4,-2.1 4,-3.2 1,-0.2 5,-0.5 0.893 108.7 51.9 -62.9 -39.4 9.3 16.8 -12.1 69 70 A E H X S+ 0 0 101 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.883 109.2 50.1 -64.9 -36.8 6.5 19.4 -11.6 70 71 A E H < S+ 0 0 152 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.815 121.0 35.6 -69.7 -29.5 8.5 22.1 -13.4 71 72 A R H < S+ 0 0 92 -4,-1.6 -2,-0.2 -5,-0.1 10,-0.2 0.807 137.1 12.4 -94.0 -33.5 9.2 19.7 -16.3 72 73 A F H < S+ 0 0 15 -4,-3.2 11,-1.8 -5,-0.2 -3,-0.2 0.387 102.5 97.1-128.5 0.9 6.0 17.6 -16.6 73 74 A G S >< S- 0 0 4 -4,-1.5 3,-1.4 -5,-0.5 5,-0.2 -0.152 86.7 -86.5 -87.7-175.5 3.3 19.3 -14.4 74 75 A P T 3 S+ 0 0 134 0, 0.0 5,-0.1 0, 0.0 -4,-0.1 0.862 126.7 45.7 -56.5 -46.7 0.4 21.8 -15.1 75 76 A D T 3 S+ 0 0 152 -6,-0.2 2,-1.0 2,-0.1 -5,-0.0 0.248 86.3 116.6 -85.1 13.3 2.5 25.0 -14.8 76 77 A S < - 0 0 10 -3,-1.4 2,-3.1 -7,-0.1 3,-0.3 -0.734 60.5-150.4 -86.6 102.3 5.2 23.4 -17.0 77 78 A K S S+ 0 0 201 -2,-1.0 -1,-0.1 1,-0.2 -2,-0.1 -0.358 80.0 84.1 -71.9 67.0 5.4 25.4 -20.2 78 79 A S > + 0 0 55 -2,-3.1 3,-2.3 -5,-0.2 4,-0.3 -0.052 56.7 177.4-158.3 33.3 6.4 22.4 -22.2 79 80 A S G > + 0 0 103 -3,-0.3 3,-1.5 1,-0.3 -2,-0.1 0.515 67.3 71.6 -12.7 -46.5 3.0 20.9 -23.0 80 81 A A G 3 S+ 0 0 90 1,-0.3 -1,-0.3 3,-0.0 -8,-0.0 0.864 103.8 39.3 -50.9 -42.5 4.3 18.0 -25.1 81 82 A L G < S+ 0 0 61 -3,-2.3 -1,-0.3 -10,-0.2 -2,-0.2 0.401 87.4 129.8 -91.9 3.7 5.8 16.1 -22.2 82 83 A A < + 0 0 49 -3,-1.5 2,-0.3 -4,-0.3 -9,-0.2 -0.242 25.8 150.7 -60.3 143.7 2.9 16.8 -19.7 83 84 A C - 0 0 35 -11,-1.8 2,-0.9 36,-0.0 -2,-0.0 -0.954 53.1 -75.6-160.8 174.0 1.4 13.9 -17.8 84 85 A T - 0 0 129 -2,-0.3 -11,-0.1 -11,-0.1 -2,-0.0 -0.712 48.0-163.5 -85.9 106.0 -0.4 13.1 -14.5 85 86 A L - 0 0 28 -2,-0.9 2,-0.1 -13,-0.1 30,-0.1 -0.564 22.6-111.7 -86.3 148.0 2.2 13.0 -11.8 86 87 A P - 0 0 23 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.485 35.6-110.6 -75.4 154.7 1.5 11.3 -8.4 87 88 A T - 0 0 128 -2,-0.1 3,-0.1 1,-0.0 24,-0.0 -0.701 25.8-133.3 -88.4 134.5 1.3 13.7 -5.5 88 89 A L - 0 0 25 -2,-0.4 20,-0.1 1,-0.1 19,-0.0 -0.665 34.1 -95.9 -84.6 138.9 4.1 13.5 -2.9 89 90 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 15,-0.0 -0.286 57.0-106.2 -50.9 138.6 3.0 13.4 0.8 90 91 A A - 0 0 75 1,-0.1 -28,-0.0 -3,-0.1 -3,-0.0 -0.128 29.6 -89.7 -75.6 162.8 3.2 17.1 2.0 91 92 A K - 0 0 117 1,-0.0 2,-0.4 -29,-0.0 -1,-0.1 -0.317 31.2-154.5 -63.8 151.3 5.7 18.9 4.3 92 93 A V - 0 0 62 1,-0.1 -1,-0.0 3,-0.0 3,-0.0 -0.956 3.9-165.1-131.3 106.4 4.9 18.9 8.0 93 94 A Y + 0 0 208 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.890 67.3 14.7 -63.3 -44.0 6.5 22.0 9.7 94 95 A V S S+ 0 0 125 2,-0.0 2,-0.3 3,-0.0 -1,-0.1 -0.936 82.1 78.1-134.0 157.9 6.2 20.9 13.3 95 96 A G S S- 0 0 54 -2,-0.3 2,-0.8 -3,-0.0 3,-0.1 -0.827 82.9 -30.7 139.1-178.6 5.6 17.8 15.3 96 97 A V >> - 0 0 83 -2,-0.3 4,-2.1 1,-0.2 3,-0.7 -0.625 52.5-152.2 -75.3 109.4 7.2 14.5 16.6 97 98 A K H 3> S+ 0 0 100 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.818 90.2 51.1 -53.5 -40.6 9.8 13.6 13.9 98 99 A Q H 3> S+ 0 0 95 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.855 112.0 46.9 -67.7 -34.4 9.7 9.9 14.4 99 100 A E H <> S+ 0 0 124 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.862 110.1 53.2 -74.3 -36.0 5.9 9.7 14.2 100 101 A I H X S+ 0 0 25 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.943 110.7 48.0 -62.6 -45.6 5.9 11.8 11.1 101 102 A A H X S+ 0 0 4 -4,-2.3 4,-0.7 1,-0.2 -2,-0.2 0.915 110.3 50.5 -60.7 -46.7 8.5 9.4 9.5 102 103 A E H >< S+ 0 0 99 -4,-2.0 3,-0.9 1,-0.2 -1,-0.2 0.898 109.1 51.6 -59.4 -41.5 6.5 6.3 10.4 103 104 A M H 3X S+ 0 0 106 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.849 105.8 57.6 -64.1 -33.4 3.3 7.8 8.9 104 105 A R H 3X S+ 0 0 26 -4,-1.6 4,-3.1 1,-0.2 5,-0.3 0.665 84.5 83.0 -73.6 -15.4 5.2 8.5 5.7 105 106 A I H S+ 0 0 88 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.875 119.8 53.2 -65.7 -32.8 3.0 3.7 3.4 107 108 A A H X S+ 0 0 37 -4,-0.8 4,-2.0 2,-0.2 -2,-0.2 0.894 111.9 43.6 -66.9 -40.4 2.5 7.1 1.8 108 109 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 5,-0.2 0.812 109.3 57.7 -75.4 -29.9 6.0 7.1 0.2 109 110 A N H X S+ 0 0 43 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.936 109.4 45.7 -62.9 -43.7 5.6 3.5 -0.9 110 111 A A H X S+ 0 0 56 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.920 111.7 51.7 -63.7 -46.1 2.4 4.6 -2.8 111 112 A Y H X S+ 0 0 6 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.923 111.8 45.9 -58.6 -45.4 4.2 7.6 -4.3 112 113 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.901 110.5 53.2 -67.0 -38.8 7.2 5.5 -5.5 113 114 A K H < S+ 0 0 163 -4,-2.2 4,-0.3 -5,-0.2 -1,-0.2 0.935 112.7 44.8 -58.6 -46.1 4.9 2.8 -7.0 114 115 A S H >< S+ 0 0 53 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.879 110.3 54.2 -67.3 -39.3 3.0 5.4 -9.0 115 116 A L H >< S+ 0 0 1 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.899 104.6 53.4 -62.1 -40.4 6.2 7.2 -10.2 116 117 A L T 3< S+ 0 0 22 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.526 103.2 59.0 -76.3 -3.7 7.7 4.0 -11.6 117 118 A S T < S+ 0 0 95 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.252 84.7 111.6-103.1 7.0 4.5 3.4 -13.7 118 119 A L S < S- 0 0 25 -3,-1.5 5,-0.1 1,-0.2 -33,-0.1 -0.209 79.9 -68.3 -77.3 169.4 4.8 6.8 -15.5 119 120 A P >> - 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