++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 15:11:52 on 14 Sep 2019 + ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Please cite: I. Uson & G.M. Sheldrick (2018), "An introduction to experimental phasing of macromolecules illustrated by SHELX; new autotracing features" Acta Cryst. D74, 106-116 (Open Access) if SHELXE proves useful. Command line parameters: ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.phi -a -n -t20 Cell and symmetry only from ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.ins Phases from ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.phi Native data from ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.hkl Listing output to ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.lst Phases output to ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.phs Poly-Ala trace output to ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.pdb Summary of parameters to be employed: -a 30 global autotracing cycles, stop 3 cycles after CC>30 -b 5.0 extra B for revised heavy atom sites -c 0.400 fraction of pixels in crossover region -d 0.000 high resolution limit to be applied to input data -D unset do not fuse disulfides for NCS -e unset fill in missing data up to maximum resolution + 0.2 Ang. -f unset read intensity not F from native .hkl file -F 0.800 fractional weight for phases from previous global cycle -g 1.100 solvent gamma flipping factor -G 0.700 FOM threshold for initial tripeptides and chain building -i unset no structure inversion -k 4.5 minimum height/sigma for revised heavy atom sites -l 2 space for 2000000 reflections -L 6 minimum number of residues/chain (if more than 3 chains) -m 10 cycles of density modification -p unset no phosphate search -q unset no alpha-helix search -r 3.00 map resolution (multiplies maximum indices) -s 0.450 solvent fraction -S 2.42 radius of sphere of influence -t 10.00 time for initial searches (-t6 or more if difficult) -u 500 MB allocatable memory for fragment optimization -v unset density sharpening factor dependent on resolution -w 0.200 weight for experimental phases after cycle 1 -x unset no phase and trace diagnostics -z unset do not optimize heavy atoms Space group: P 65 Allowed origin shift code: 8 94163 Reflections read from file ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.phi 94163 Reflections read from file ./1vp4-1.8-parrot-hancs/1vp4-1.8-parrot-hancs.hkl 94163 Unique data, highest resolution = 1.820 Angstroms Anisotropic scaling: intensities multiplied by 0.000042h^2 +0.000042k^2 -0.000313l^2 +0.000000kl +0.000000hl +0.000042hk 32 Reflections with d > 2.020 and 0 in range 2.020 > d > 1.820 added Density sharpening factor set to 1.02 Fourier grid = 512 x 512 x 18 0.000 <= z <= 0.167 92 Point spherical net set up with radius 2.42A 32 Extra Fourier layers will be generated <|E^2-1|> = 0.645 ** -f missing ?? ** = 0.300, Contrast = 0.419, Connect. = 0.762 for dens.mod. cycle 1 = 0.300, Contrast = 0.542, Connect. = 0.788 for dens.mod. cycle 2 = 0.300, Contrast = 0.724, Connect. = 0.819 for dens.mod. cycle 3 = 0.300, Contrast = 0.772, Connect. = 0.826 for dens.mod. cycle 4 = 0.300, Contrast = 0.798, Connect. = 0.830 for dens.mod. cycle 5 = 0.300, Contrast = 0.811, Connect. = 0.833 for dens.mod. cycle 6 = 0.300, Contrast = 0.818, Connect. = 0.835 for dens.mod. cycle 7 = 0.300, Contrast = 0.823, Connect. = 0.836 for dens.mod. cycle 8 = 0.300, Contrast = 0.826, Connect. = 0.837 for dens.mod. cycle 9 = 0.300, Contrast = 0.827, Connect. = 0.837 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 3797 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 961 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 25 43.229 2.220 0.901 0.928 0.958 0.875 CB 1.528 B: 27 32.355 2.308 0.883 0.415 0.962 0.615 CB 1.659 C: 28 62.223 2.262 1.080 0.938 1.000 0.926 CB 1.770 D: 16 33.722 2.151 1.014 0.886 1.000 0.733 CB 1.451 E: 16 50.965 2.381 1.239 0.925 1.000 0.933 CB 1.732 F: 14 33.866 2.200 1.099 0.922 1.000 0.846 CB 1.431 15 residues pruned to eliminate duplicates G: 17 28.731 2.078 0.558 0.889 1.000 0.875 CB 1.598 H: 17 50.879 2.337 1.173 0.911 1.000 0.812 CA 1.775 17 residues pruned to eliminate duplicates I: 27 64.062 2.390 1.131 0.930 0.962 0.731 CB 1.794 27 residues pruned to eliminate duplicates J: 17 41.183 2.320 1.330 0.873 0.875 0.750 CB 1.586 17 residues pruned to eliminate duplicates K: 91 87.342 2.313 1.045 0.712 0.967 0.800 CB 1.661 L: 16 57.771 2.413 1.370 0.922 1.000 0.667 CB 1.834 16 residues pruned to eliminate duplicates M: 39 25.628 1.910 0.712 0.607 0.947 0.658 CB 1.213 N: 24 50.595 2.359 1.097 0.938 0.957 0.826 CB 1.550 25 residues pruned to eliminate duplicates O: 24 44.651 2.328 0.833 0.935 0.957 0.870 CB 1.589 24 residues pruned to eliminate duplicates P: 16 40.151 2.315 0.902 0.876 1.000 0.800 CB 1.711 16 residues pruned to eliminate duplicates Q: 17 45.846 2.291 1.209 0.914 0.938 0.750 CB 1.708 17 residues pruned to eliminate duplicates R: 30 60.557 2.193 1.050 0.931 1.000 0.897 CB 1.748 32 residues pruned to eliminate duplicates S: 24 44.412 2.230 1.079 0.921 0.957 0.522 CB 1.470 24 residues pruned to eliminate duplicates T: 15 48.522 2.487 1.167 0.931 0.929 0.929 CB 1.812 15 residues pruned to eliminate duplicates U: 16 36.850 2.173 0.803 0.930 1.000 0.867 CB 1.699 17 residues pruned to eliminate duplicates V: 28 53.863 2.214 0.923 0.926 0.963 0.852 CA 1.773 28 residues pruned to eliminate duplicates W: 17 41.757 2.282 0.783 0.942 1.000 0.938 CB 1.779 X: 52 55.298 2.317 0.954 0.582 0.980 0.804 CB 1.613 48 residues pruned to eliminate duplicates Y: 16 38.216 2.173 0.843 0.940 1.000 1.000 CB 1.710 15 residues pruned to eliminate duplicates Z: 27 63.123 2.361 1.127 0.934 0.962 0.615 CB 1.788 28 residues pruned to eliminate duplicates Z: 13 28.751 2.361 0.495 0.894 1.000 0.917 CB 1.686 Z: 15 35.405 2.363 0.913 0.881 0.857 0.857 CB 1.768 15 residues pruned to eliminate duplicates Z: 15 31.049 2.316 0.489 0.924 1.000 1.000 CB 1.689 Z: 18 44.045 2.223 1.167 0.919 1.000 0.824 CB 1.563 Z: 22 33.236 2.198 1.016 0.835 0.762 0.190 CB 1.610 23 residues pruned to eliminate duplicates Z: 27 43.015 2.333 1.109 0.640 0.923 0.615 CB 1.629 18 residues pruned to eliminate duplicates Z: 52 57.134 2.354 0.908 0.630 0.961 0.725 CB 1.641 54 residues pruned to eliminate duplicates Z: 29 50.588 2.317 0.702 0.924 1.000 0.821 CB 1.703 29 residues pruned to eliminate duplicates Z: 16 24.034 2.229 0.414 0.881 0.867 0.600 CA 1.644 16 residues pruned to eliminate duplicates Z: 27 34.444 2.330 0.850 0.651 0.923 0.577 CB 1.475 16 residues pruned to eliminate duplicates Z: 14 26.165 2.218 0.655 0.898 1.000 0.846 CB 1.415 14 residues pruned to eliminate duplicates Z: 9 17.281 2.064 1.220 0.651 0.750 0.750 CB 1.545 Z: 18 42.345 2.137 1.262 0.910 0.941 0.824 CA 1.601 18 residues pruned to eliminate duplicates Z: 24 48.552 2.328 0.793 0.918 1.000 0.870 CB 1.711 24 residues pruned to eliminate duplicates Z: 22 48.980 2.380 1.054 0.841 0.952 0.810 CA 1.712 Z: 15 38.577 2.355 0.984 0.912 0.929 0.929 CB 1.683 15 residues pruned to eliminate duplicates Z: 14 26.551 2.291 0.774 0.836 0.923 0.846 CB 1.469 14 residues pruned to eliminate duplicates Z: 27 49.951 2.325 0.944 0.889 0.923 0.885 CA 1.690 27 residues pruned to eliminate duplicates Z: 29 61.985 2.275 1.066 0.932 0.964 0.857 CB 1.805 29 residues pruned to eliminate duplicates Z: 28 20.626 2.096 0.662 0.335 0.926 0.556 CB 1.474 Z: 100 87.141 2.361 0.996 0.696 0.929 0.697 CB 1.672 69 residues pruned to eliminate duplicates Z: 17 45.701 2.252 1.075 0.926 1.000 0.875 CA 1.715 17 residues pruned to eliminate duplicates Z: 30 48.501 2.214 0.699 0.894 0.966 0.862 CA 1.779 30 residues pruned to eliminate duplicates Z: 23 48.427 2.349 1.011 0.935 0.955 0.773 CB 1.596 23 residues pruned to eliminate duplicates Z: 15 44.633 2.437 1.121 0.930 0.929 0.857 CB 1.737 15 residues pruned to eliminate duplicates Z: 18 41.948 2.219 0.827 0.923 1.000 0.882 CA 1.764 18 residues pruned to eliminate duplicates Z: 18 42.954 2.179 1.133 0.946 1.000 0.824 CB 1.550 16 residues pruned to eliminate duplicates Z: 17 30.167 2.174 0.910 0.838 0.875 0.812 CB 1.551 17 residues pruned to eliminate duplicates Z: 19 40.603 2.064 1.309 0.878 0.944 0.611 CB 1.543 19 residues pruned to eliminate duplicates Z: 27 40.586 2.192 0.772 0.876 0.962 0.885 CB 1.550 27 residues pruned to eliminate duplicates Z: 28 49.088 2.182 0.726 0.927 1.000 0.852 CA 1.758 28 residues pruned to eliminate duplicates Z: 27 60.533 2.367 1.070 0.926 0.962 0.769 CB 1.768 27 residues pruned to eliminate duplicates Z: 18 15.999 2.119 0.805 0.485 0.824 0.588 CB 1.251 Z: 14 35.716 2.279 1.430 0.878 0.923 0.692 CB 1.407 Z: 16 38.936 2.352 0.782 0.932 1.000 0.867 CB 1.675 16 residues pruned to eliminate duplicates Z: 24 32.649 2.071 0.617 0.894 1.000 0.957 CB 1.458 Z: 19 35.711 2.254 0.802 0.776 0.944 0.833 CB 1.720 19 residues pruned to eliminate duplicates Z: 16 37.150 2.235 1.033 0.931 0.933 0.667 CB 1.581 17 residues pruned to eliminate duplicates Z: 17 47.934 2.379 1.072 0.904 1.000 0.812 CB 1.732 17 residues pruned to eliminate duplicates Z: 23 37.177 2.314 0.708 0.865 0.909 0.818 CB 1.616 17 residues pruned to eliminate duplicates Z: 59 43.024 2.127 0.943 0.542 0.966 0.621 CB 1.358 15 residues pruned to eliminate duplicates Z: 8 9.320 1.815 0.949 0.434 0.857 0.857 CB 1.244 Z: 31 56.633 2.303 1.035 0.919 0.933 0.667 CB 1.666 31 residues pruned to eliminate duplicates Z: 15 29.279 2.124 0.861 0.895 0.929 0.786 CB 1.528 15 residues pruned to eliminate duplicates Z: 17 34.727 2.301 0.600 0.915 0.938 0.812 CB 1.779 16 residues pruned to eliminate duplicates Z: 22 30.846 2.109 0.686 0.927 0.952 0.762 CB 1.394 22 residues pruned to eliminate duplicates Z: 47 32.458 2.131 0.600 0.599 0.957 0.652 CB 1.335 47 residues pruned to eliminate duplicates Z: 23 45.259 2.381 0.781 0.845 0.955 0.727 CA 1.773 23 residues pruned to eliminate duplicates Z: 17 36.386 2.205 0.831 0.903 1.000 0.875 CB 1.605 17 residues pruned to eliminate duplicates Z: 15 35.562 2.341 0.973 0.919 0.857 0.786 CB 1.691 15 residues pruned to eliminate duplicates Z: 16 40.645 2.379 0.819 0.935 1.000 0.933 CA 1.689 16 residues pruned to eliminate duplicates Z: 30 54.176 2.342 0.902 0.889 0.966 0.862 CB 1.684 30 residues pruned to eliminate duplicates Z: 19 29.381 2.059 1.043 0.768 0.889 0.722 CB 1.460 19 residues pruned to eliminate duplicates Z: 31 50.336 2.231 0.886 0.899 0.967 0.900 CB 1.615 31 residues pruned to eliminate duplicates Z: 139 92.924 2.333 1.043 0.668 0.920 0.710 CB 1.544 90 residues pruned to eliminate duplicates Z: 41 51.973 2.349 1.132 0.682 0.900 0.775 CB 1.543 41 residues pruned to eliminate duplicates Z: 16 39.149 2.334 0.974 0.877 0.933 0.800 CB 1.708 16 residues pruned to eliminate duplicates Z: 18 40.838 2.202 1.007 0.907 0.941 0.824 CA 1.692 18 residues pruned to eliminate duplicates Z: 17 37.105 2.276 0.938 0.920 0.875 0.812 CB 1.693 17 residues pruned to eliminate duplicates Z: 30 68.965 2.369 1.281 0.923 0.966 0.759 CB 1.725 40 residues pruned to eliminate duplicates Z: 14 22.533 2.203 0.598 0.815 0.846 0.692 CB 1.596 14 residues pruned to eliminate duplicates Z: 16 38.106 2.155 0.912 0.942 1.000 0.667 CB 1.656 15 residues pruned to eliminate duplicates Z: 15 31.607 2.230 0.609 0.925 1.000 0.857 CB 1.651 15 residues pruned to eliminate duplicates Z: 23 52.605 2.326 1.125 0.855 1.000 0.773 CA 1.675 24 residues pruned to eliminate duplicates Z: 29 56.920 2.239 0.886 0.926 1.000 0.821 CB 1.785 29 residues pruned to eliminate duplicates Z: 30 53.655 2.255 0.848 0.902 0.966 0.828 CB 1.767 30 residues pruned to eliminate duplicates Z: 14 31.398 2.243 0.946 0.914 1.000 0.846 CB 1.411 14 residues pruned to eliminate duplicates Z: 16 47.742 2.410 1.207 0.898 0.933 0.800 CA 1.777 16 residues pruned to eliminate duplicates Z: 13 28.870 2.447 0.706 0.866 0.833 0.667 CA 1.754 13 residues pruned to eliminate duplicates Z: 7 12.564 2.220 0.954 0.547 0.833 0.500 CB 1.355 7 residues pruned to eliminate duplicates Z: 16 39.493 2.223 1.121 0.897 0.933 0.867 CB 1.659 16 residues pruned to eliminate duplicates Z: 25 47.913 2.238 1.246 0.909 0.917 0.667 CB 1.506 25 residues pruned to eliminate duplicates Z: 16 45.883 2.306 1.133 0.947 1.000 0.733 CB 1.665 16 residues pruned to eliminate duplicates Z: 92 88.220 2.308 1.058 0.731 0.956 0.769 CB 1.655 92 residues pruned to eliminate duplicates Z: 15 35.958 2.354 0.744 0.879 0.929 0.929 CB 1.829 15 residues pruned to eliminate duplicates Z: 25 40.541 2.246 0.783 0.899 0.917 0.833 CB 1.612 25 residues pruned to eliminate duplicates Z: 18 31.941 2.133 1.018 0.822 0.882 0.706 CB 1.543 18 residues pruned to eliminate duplicates Z: 17 33.772 2.239 0.587 0.895 1.000 0.875 CA 1.703 17 residues pruned to eliminate duplicates Z: 17 40.961 2.265 1.011 0.921 0.938 0.625 CB 1.688 17 residues pruned to eliminate duplicates Z: 22 35.091 2.139 0.990 0.940 0.905 0.619 CB 1.380 23 residues pruned to eliminate duplicates Z: 24 49.670 2.334 1.082 0.933 0.957 0.696 CB 1.555 25 residues pruned to eliminate duplicates Z: 6 11.449 2.096 0.841 0.697 0.800 0.800 CA 1.386 6 residues pruned to eliminate duplicates Z: 16 23.745 2.197 0.365 0.929 1.000 0.933 CB 1.431 16 residues pruned to eliminate duplicates Z: 29 54.919 2.230 0.876 0.922 1.000 0.929 CA 1.744 29 residues pruned to eliminate duplicates Z: 14 33.359 2.235 0.995 0.900 1.000 0.692 CB 1.482 14 residues pruned to eliminate duplicates Z: 49 40.518 2.210 0.845 0.538 0.938 0.667 CB 1.474 28 residues pruned to eliminate duplicates Z: 37 42.462 2.199 1.075 0.659 1.000 0.639 CB 1.338 37 residues pruned to eliminate duplicates Z: 14 34.293 2.197 1.316 0.927 1.000 0.615 CB 1.310 14 residues pruned to eliminate duplicates Z: 76 65.608 2.318 0.995 0.610 0.907 0.680 CB 1.628 74 residues pruned to eliminate duplicates Z: 22 33.907 2.129 0.886 0.927 0.952 0.857 CB 1.356 22 residues pruned to eliminate duplicates Z: 17 42.193 2.365 0.887 0.928 1.000 0.938 CA 1.655 17 residues pruned to eliminate duplicates Z: 16 36.155 2.091 1.416 0.876 0.933 0.600 CA 1.438 16 residues pruned to eliminate duplicates Z: 28 61.003 2.301 0.980 0.944 1.000 0.889 CB 1.785 28 residues pruned to eliminate duplicates Z: 30 54.193 2.231 0.852 0.881 1.000 0.793 CA 1.764 30 residues pruned to eliminate duplicates Z: 11 11.130 1.978 0.656 0.680 0.800 0.500 CB 1.139 11 residues pruned to eliminate duplicates Z: 16 10.687 2.069 0.389 0.385 0.733 0.533 CB 1.478 16 residues pruned to eliminate duplicates Z: 15 20.230 2.083 0.591 0.813 0.929 0.643 CB 1.337 15 residues pruned to eliminate duplicates Z: 22 60.050 2.343 1.400 0.945 1.000 0.714 CB 1.612 22 residues pruned to eliminate duplicates Z: 22 47.523 2.420 0.818 0.838 1.000 0.476 CB 1.761 22 residues pruned to eliminate duplicates Z: 50 36.829 2.175 0.843 0.503 0.939 0.673 CB 1.394 50 residues pruned to eliminate duplicates Z: 18 38.030 2.268 0.683 0.927 1.000 1.000 CA 1.694 18 residues pruned to eliminate duplicates Z: 6 9.198 2.038 0.592 0.825 0.800 0.800 CB 1.196 Z: 29 59.638 2.262 0.915 0.938 1.000 0.821 CB 1.810 29 residues pruned to eliminate duplicates Z: 25 57.734 2.256 1.388 0.942 1.000 0.500 CB 1.517 26 residues pruned to eliminate duplicates Z: 24 51.452 2.332 1.003 0.943 1.000 0.870 CB 1.592 24 residues pruned to eliminate duplicates Z: 15 26.647 2.100 0.743 0.913 1.000 0.857 CB 1.378 15 residues pruned to eliminate duplicates Z: 17 16.961 2.093 0.597 0.495 0.938 0.500 CB 1.360 18 residues pruned to eliminate duplicates Z: 47 43.907 2.197 0.973 0.635 0.957 0.609 CB 1.375 51 residues pruned to eliminate duplicates Z: 13 34.520 2.309 0.919 0.891 1.000 0.750 CB 1.616 13 residues pruned to eliminate duplicates Z: 21 43.079 2.226 0.890 0.871 0.950 0.800 CA 1.758 21 residues pruned to eliminate duplicates Z: 8 23.390 2.204 0.918 0.824 1.000 0.857 CB 1.580 7 residues pruned to eliminate duplicates Z: 23 34.209 2.024 0.856 0.917 1.000 0.909 CB 1.369 23 residues pruned to eliminate duplicates Z: 14 34.737 2.236 1.068 0.846 1.000 0.692 CB 1.548 15 residues pruned to eliminate duplicates Z: 16 32.803 2.360 0.697 0.906 0.933 0.933 CA 1.612 16 residues pruned to eliminate duplicates Z: 32 56.058 2.257 0.906 0.897 1.000 0.774 CB 1.675 30 residues pruned to eliminate duplicates Z: 29 40.652 2.359 0.713 0.784 0.929 0.821 CB 1.595 29 residues pruned to eliminate duplicates Z: 30 24.100 2.172 0.796 0.386 0.862 0.621 CB 1.503 30 residues pruned to eliminate duplicates Z: 28 57.862 2.284 1.041 0.906 0.963 0.815 CB 1.765 28 residues pruned to eliminate duplicates Z: 25 47.892 2.261 0.993 0.914 0.958 0.958 CB 1.601 25 residues pruned to eliminate duplicates Z: 27 66.667 2.376 1.248 0.942 0.962 0.808 CB 1.765 27 residues pruned to eliminate duplicates Z: 56 45.451 2.242 0.891 0.503 0.927 0.545 CB 1.554 55 residues pruned to eliminate duplicates Z: 32 58.693 2.240 0.929 0.925 1.000 0.871 CA 1.712 32 residues pruned to eliminate duplicates Z: 15 34.177 2.361 0.551 0.907 1.000 0.929 CA 1.773 15 residues pruned to eliminate duplicates Z: 24 43.908 2.339 0.798 0.938 0.957 0.870 CB 1.583 24 residues pruned to eliminate duplicates Z: 10 27.205 2.272 1.000 0.916 1.000 0.889 CB 1.409 Z: 23 37.834 2.297 0.704 0.861 0.909 0.682 CA 1.665 23 residues pruned to eliminate duplicates Z: 87 88.551 2.339 1.041 0.746 0.953 0.756 CB 1.683 87 residues pruned to eliminate duplicates Z: 21 35.608 2.160 0.960 0.931 0.950 0.750 CB 1.383 21 residues pruned to eliminate duplicates Z: 15 37.939 2.349 0.837 0.925 1.000 0.929 CA 1.649 15 residues pruned to eliminate duplicates Z: 18 27.709 2.044 0.796 0.860 1.000 0.824 CB 1.346 18 residues pruned to eliminate duplicates Z: 17 38.970 2.247 0.931 0.929 1.000 0.938 CB 1.571 17 residues pruned to eliminate duplicates Z: 30 54.345 2.187 0.850 0.908 1.000 0.828 CB 1.771 30 residues pruned to eliminate duplicates Z: 16 25.329 2.187 0.583 0.844 0.933 0.800 CA 1.506 16 residues pruned to eliminate duplicates Z: 9 21.455 2.272 0.721 0.895 1.000 0.875 CB 1.391 9 residues pruned to eliminate duplicates Z: 12 23.498 2.194 0.937 0.851 0.909 0.727 CB 1.357 Z: 135 88.947 2.261 1.026 0.649 0.940 0.687 CB 1.553 135 residues pruned to eliminate duplicates Z: 65 56.830 2.337 0.911 0.570 0.891 0.625 CB 1.669 57 residues pruned to eliminate duplicates Z: 17 26.652 2.278 0.459 0.862 0.938 0.812 CB 1.570 17 residues pruned to eliminate duplicates Z: 31 53.679 2.153 0.909 0.879 1.000 0.767 CA 1.730 31 residues pruned to eliminate duplicates Z: 16 42.537 2.321 0.996 0.893 1.000 0.800 CB 1.702 16 residues pruned to eliminate duplicates Z: 14 21.411 2.190 0.521 0.821 0.923 0.615 CB 1.462 14 residues pruned to eliminate duplicates Z: 25 50.137 2.242 1.239 0.947 0.958 0.625 CB 1.470 25 residues pruned to eliminate duplicates Z: 11 25.109 2.280 0.617 0.905 1.000 0.900 CB 1.533 12 residues pruned to eliminate duplicates Z: 9 14.342 1.899 0.425 0.867 1.000 0.750 N 1.371 9 residues pruned to eliminate duplicates Z: 15 37.449 2.203 1.273 0.904 1.000 0.714 CB 1.423 14 residues pruned to eliminate duplicates Z: 17 39.624 2.322 0.938 0.920 1.000 0.812 CB 1.550 17 residues pruned to eliminate duplicates Z: 23 31.494 2.112 0.854 0.900 0.955 0.682 CB 1.283 23 residues pruned to eliminate duplicates Z: 17 30.666 2.229 0.995 0.864 0.938 0.875 CB 1.348 17 residues pruned to eliminate duplicates Z: 14 8.107 2.007 0.517 0.326 0.692 0.308 CB 1.292 Z: 71 48.266 2.195 0.785 0.618 0.914 0.729 CB 1.440 71 residues pruned to eliminate duplicates Z: 31 49.246 2.284 0.727 0.874 0.967 0.867 CB 1.717 31 residues pruned to eliminate duplicates Z: 38 43.920 2.248 1.098 0.598 0.973 0.676 CB 1.433 38 residues pruned to eliminate duplicates Z: 6 12.081 2.020 0.336 0.760 1.000 0.800 CA 1.589 6 residues pruned to eliminate duplicates Z: 17 36.911 2.257 0.825 0.877 1.000 0.938 CB 1.627 17 residues pruned to eliminate duplicates Z: 27 64.051 2.356 1.194 0.940 0.962 0.846 CB 1.755 27 residues pruned to eliminate duplicates Z: 51 41.314 2.203 1.007 0.600 0.920 0.700 CB 1.306 51 residues pruned to eliminate duplicates Z: 30 46.774 2.200 0.644 0.907 0.966 0.897 CB 1.767 30 residues pruned to eliminate duplicates Z: 14 19.334 2.189 0.369 0.863 0.923 0.769 CB 1.422 14 residues pruned to eliminate duplicates Z: 16 50.558 2.342 1.313 0.898 1.000 0.733 CB 1.723 16 residues pruned to eliminate duplicates Z: 41 33.743 2.205 0.754 0.584 0.875 0.500 CB 1.454 33 residues pruned to eliminate duplicates Z: 26 46.001 2.379 1.173 0.672 0.920 0.680 CB 1.651 26 residues pruned to eliminate duplicates Z: 29 44.717 2.190 1.082 0.763 0.893 0.571 CB 1.644 29 residues pruned to eliminate duplicates Z: 15 25.970 2.237 0.692 0.844 0.857 0.714 CA 1.592 15 residues pruned to eliminate duplicates Z: 16 38.636 2.326 0.802 0.891 1.000 0.867 CB 1.712 16 residues pruned to eliminate duplicates Z: 23 21.692 2.118 0.684 0.428 0.909 0.455 CB 1.538 23 residues pruned to eliminate duplicates Z: 15 39.170 2.415 0.792 0.918 1.000 0.857 CB 1.707 15 residues pruned to eliminate duplicates Z: 15 18.934 1.801 0.955 0.839 0.857 0.500 CB 1.253 10 residues pruned to eliminate duplicates Z: 23 41.413 2.285 0.955 0.841 0.864 0.727 CA 1.707 23 residues pruned to eliminate duplicates Z: 21 41.618 2.254 0.927 0.840 0.950 0.750 CA 1.683 21 residues pruned to eliminate duplicates Z: 41 39.535 2.196 0.989 0.544 0.925 0.425 CB 1.482 41 residues pruned to eliminate duplicates Z: 25 49.754 2.257 1.314 0.916 0.917 0.667 CB 1.498 25 residues pruned to eliminate duplicates Z: 30 30.848 1.900 0.922 0.657 0.966 0.517 CB 1.404 Z: 7 12.550 1.841 0.526 0.834 1.000 1.000 CA 1.368 7 residues pruned to eliminate duplicates Z: 30 59.569 2.234 1.193 0.880 0.931 0.621 CB 1.758 30 residues pruned to eliminate duplicates Z: 14 37.546 2.244 0.920 0.896 1.000 0.846 CB 1.732 14 residues pruned to eliminate duplicates Z: 14 29.000 2.305 0.735 0.832 0.923 0.769 CA 1.636 14 residues pruned to eliminate duplicates Z: 18 51.044 2.307 1.221 0.908 0.941 0.765 CB 1.824 18 residues pruned to eliminate duplicates Z: 18 33.939 2.245 0.579 0.922 0.941 0.882 CB 1.735 18 residues pruned to eliminate duplicates Z: 44 44.409 2.324 1.049 0.620 0.860 0.651 CB 1.475 44 residues pruned to eliminate duplicates Z: 17 35.895 2.245 0.779 0.918 0.938 0.875 CB 1.690 17 residues pruned to eliminate duplicates Z: 6 16.041 1.966 0.761 0.815 1.000 0.800 CA 1.576 Z: 31 53.910 2.164 0.915 0.874 1.000 0.700 CB 1.729 31 residues pruned to eliminate duplicates Z: 24 41.015 2.316 0.661 0.935 1.000 0.957 CB 1.550 24 residues pruned to eliminate duplicates Z: 40 42.599 2.293 0.944 0.577 0.872 0.564 CB 1.630 40 residues pruned to eliminate duplicates Z: 16 41.424 2.327 0.950 0.913 1.000 0.733 CB 1.668 16 residues pruned to eliminate duplicates Z: 17 36.607 2.185 0.959 0.868 0.938 0.750 CB 1.666 17 residues pruned to eliminate duplicates Z: 7 5.044 1.788 0.317 0.730 0.833 0.833 CB 0.853 7 residues pruned to eliminate duplicates Z: 30 58.928 2.207 1.077 0.898 0.966 0.690 CB 1.768 29 residues pruned to eliminate duplicates Z: 6 8.644 2.163 0.265 0.736 0.800 0.600 CA 1.429 6 residues pruned to eliminate duplicates Z: 30 47.495 2.207 0.626 0.894 1.000 0.897 CA 1.763 30 residues pruned to eliminate duplicates Z: 12 23.888 2.125 0.959 0.856 0.909 0.545 CB 1.404 12 residues pruned to eliminate duplicates Z: 48 76.568 2.329 1.113 0.821 0.957 0.787 CB 1.794 48 residues pruned to eliminate duplicates Z: 27 66.531 2.375 1.255 0.936 0.962 0.769 CB 1.765 27 residues pruned to eliminate duplicates Z: 14 25.764 2.072 0.694 0.875 1.000 0.846 CA 1.481 14 residues pruned to eliminate duplicates Z: 17 37.471 2.342 0.771 0.920 1.000 0.500 CB 1.591 17 residues pruned to eliminate duplicates Z: 15 37.887 2.228 0.944 0.876 1.000 0.714 CB 1.699 15 residues pruned to eliminate duplicates Z: 8 12.948 2.132 0.406 0.760 0.857 0.857 CB 1.510 8 residues pruned to eliminate duplicates Z: 33 17.278 2.011 0.693 0.373 0.844 0.500 CB 1.217 33 residues pruned to eliminate duplicates Z: 11 18.583 1.917 0.736 0.852 1.000 0.500 CB 1.307 11 residues pruned to eliminate duplicates Z: 13 20.549 1.903 0.880 0.909 0.917 0.750 CB 1.283 15 residues pruned to eliminate duplicates Z: 30 45.153 2.181 0.636 0.893 1.000 0.828 CA 1.687 30 residues pruned to eliminate duplicates Z: 13 34.117 2.266 1.158 0.930 1.000 0.833 CB 1.408 13 residues pruned to eliminate duplicates Z: 7 14.727 2.040 0.687 0.879 1.000 1.000 CB 1.267 7 residues pruned to eliminate duplicates Z: 14 19.447 1.972 0.653 0.830 0.923 0.692 CB 1.348 12 residues pruned to eliminate duplicates Z: 23 43.540 2.296 0.942 0.887 0.955 0.864 CA 1.572 23 residues pruned to eliminate duplicates Z: 17 38.444 2.283 0.734 0.927 1.000 0.875 CB 1.700 17 residues pruned to eliminate duplicates Z: 86 84.569 2.400 1.010 0.738 0.918 0.776 CB 1.673 86 residues pruned to eliminate duplicates Z: 23 47.774 2.299 0.979 0.855 0.909 0.818 CA 1.817 23 residues pruned to eliminate duplicates Z: 22 32.057 2.121 1.000 0.934 0.905 0.524 CB 1.271 22 residues pruned to eliminate duplicates Z: 30 53.751 2.355 0.857 0.907 0.931 0.862 CB 1.742 30 residues pruned to eliminate duplicates Z: 57 34.749 2.130 0.854 0.543 0.893 0.643 CB 1.263 56 residues pruned to eliminate duplicates Z: 17 33.965 2.271 0.502 0.922 1.000 0.938 CB 1.751 17 residues pruned to eliminate duplicates Z: 38 37.054 2.201 0.771 0.620 0.973 0.757 CB 1.434 38 residues pruned to eliminate duplicates Z: 11 17.263 2.169 0.642 0.652 0.900 0.500 CB 1.479 11 residues pruned to eliminate duplicates Z: 8 11.836 1.917 0.301 0.828 1.000 1.000 CA 1.350 8 residues pruned to eliminate duplicates Z: 17 29.511 2.147 0.921 0.903 0.938 0.812 CB 1.360 17 residues pruned to eliminate duplicates Z: 16 27.197 2.192 0.509 0.930 1.000 0.933 CB 1.485 16 residues pruned to eliminate duplicates Z: 17 28.699 2.128 1.004 0.890 1.000 0.688 CB 1.211 17 residues pruned to eliminate duplicates Z: 16 24.377 2.136 0.477 0.928 1.000 0.933 CB 1.396 16 residues pruned to eliminate duplicates Z: 17 48.934 2.251 1.310 0.919 1.000 0.812 CB 1.658 17 residues pruned to eliminate duplicates Z: 16 26.126 2.163 0.964 0.902 0.933 0.867 CB 1.213 16 residues pruned to eliminate duplicates Z: 15 21.539 1.909 0.642 0.939 0.929 0.714 CB 1.375 15 residues pruned to eliminate duplicates Z: 29 47.837 2.234 0.636 0.894 1.000 0.893 CB 1.775 29 residues pruned to eliminate duplicates Z: 34 50.942 2.389 0.777 0.686 1.000 0.727 CB 1.762 30 residues pruned to eliminate duplicates Z: 25 22.581 2.152 0.717 0.590 0.875 0.792 CB 1.307 25 residues pruned to eliminate duplicates Z: 14 37.730 2.464 0.757 0.923 1.000 0.923 CB 1.698 14 residues pruned to eliminate duplicates Z: 11 25.830 2.296 0.537 0.912 1.000 1.000 CB 1.639 13 residues pruned to eliminate duplicates Z: 22 36.336 2.090 1.254 0.937 0.952 0.381 CB 1.229 22 residues pruned to eliminate duplicates Z: 17 37.074 2.167 0.983 0.898 1.000 0.688 CB 1.542 17 residues pruned to eliminate duplicates Z: 9 14.548 2.115 0.753 0.825 0.750 0.625 CB 1.396 9 residues pruned to eliminate duplicates Z: 49 37.938 2.219 0.908 0.554 0.917 0.667 CB 1.339 49 residues pruned to eliminate duplicates Z: 14 19.288 1.889 1.128 0.892 0.923 0.769 CB 1.035 14 residues pruned to eliminate duplicates Z: 8 11.410 1.866 0.782 0.859 0.857 0.714 CB 1.113 7 residues pruned to eliminate duplicates Z: 51 34.901 2.173 0.818 0.496 0.920 0.640 CB 1.363 51 residues pruned to eliminate duplicates Z: 16 28.906 2.128 1.016 0.933 1.000 0.667 CB 1.214 16 residues pruned to eliminate duplicates Z: 16 42.535 2.184 1.104 0.923 1.000 0.867 CB 1.679 17 residues pruned to eliminate duplicates Z: 19 42.734 2.119 1.124 0.896 1.000 0.667 CB 1.604 19 residues pruned to eliminate duplicates Z: 27 32.546 2.039 1.008 0.587 0.962 0.462 CB 1.491 15 residues pruned to eliminate duplicates Z: 23 43.938 2.295 0.954 0.834 0.909 0.500 CB 1.722 23 residues pruned to eliminate duplicates Z: 25 40.765 2.397 0.907 0.639 0.958 0.625 CB 1.667 25 residues pruned to eliminate duplicates Z: 25 58.629 2.267 1.404 0.932 1.000 0.792 CB 1.534 28 residues pruned to eliminate duplicates Z: 36 55.436 2.430 1.034 0.667 0.914 0.657 CB 1.777 35 residues pruned to eliminate duplicates Z: 27 35.592 2.147 0.910 0.823 0.846 0.654 CB 1.521 27 residues pruned to eliminate duplicates Z: 16 49.031 2.371 1.080 0.921 1.000 0.867 CA 1.807 16 residues pruned to eliminate duplicates Z: 15 29.288 2.236 0.723 0.848 0.929 0.786 CB 1.624 15 residues pruned to eliminate duplicates Z: 15 19.779 1.937 0.614 0.788 1.000 0.929 CB 1.312 15 residues pruned to eliminate duplicates Z: 7 15.698 1.970 0.953 0.847 1.000 1.000 CB 1.237 7 residues pruned to eliminate duplicates Z: 6 11.730 1.773 0.762 0.784 1.000 0.800 CB 1.308 Z: 6 12.839 2.129 1.041 0.673 0.800 0.600 CA 1.408 6 residues pruned to eliminate duplicates Z: 17 23.298 2.047 0.810 0.914 1.000 0.875 CB 1.112 17 residues pruned to eliminate duplicates Z: 27 36.214 2.188 1.114 0.673 0.962 0.615 CB 1.361 27 residues pruned to eliminate duplicates Z: 10 8.250 2.014 0.672 0.403 0.778 0.556 CB 1.163 12 residues pruned to eliminate duplicates Z: 30 50.619 2.172 0.747 0.924 1.000 0.897 CB 1.740 30 residues pruned to eliminate duplicates Z: 28 58.397 2.363 1.048 0.913 0.963 0.852 CB 1.707 28 residues pruned to eliminate duplicates Z: 6 2.144 1.512 -0.294 0.466 0.800 0.600 C 1.163 Z: 16 15.796 1.752 0.345 0.909 1.000 0.933 CB 1.229 Z: 11 14.047 2.072 0.958 0.336 0.900 0.600 CB 1.454 Z: 16 28.015 2.166 1.053 0.905 0.933 0.867 CB 1.240 16 residues pruned to eliminate duplicates Z: 9 24.729 2.468 0.386 0.898 1.000 1.000 CB 1.828 9 residues pruned to eliminate duplicates Z: 14 28.500 2.218 0.796 0.931 1.000 0.923 CB 1.387 14 residues pruned to eliminate duplicates Z: 32 60.204 2.287 1.094 0.918 0.935 0.806 CB 1.702 32 residues pruned to eliminate duplicates Z: 14 22.273 1.938 0.585 0.948 1.000 1.000 CB 1.389 14 residues pruned to eliminate duplicates Z: 15 8.516 2.056 0.502 0.261 0.714 0.429 CB 1.356 15 residues pruned to eliminate duplicates Z: 17 35.426 2.174 1.188 0.884 1.000 0.875 CB 1.345 17 residues pruned to eliminate duplicates Z: 7 6.774 1.898 0.279 0.816 0.833 0.667 CB 1.039 7 residues pruned to eliminate duplicates Z: 29 56.290 2.234 1.023 0.928 0.964 0.786 CB 1.709 29 residues pruned to eliminate duplicates Z: 57 44.012 2.126 1.006 0.593 0.929 0.500 CB 1.359 47 residues pruned to eliminate duplicates Z: 25 51.451 2.261 1.208 0.918 0.958 0.875 CB 1.548 25 residues pruned to eliminate duplicates Z: 15 31.742 2.164 1.285 0.933 1.000 0.429 CB 1.198 15 residues pruned to eliminate duplicates Z: 16 41.678 2.321 0.950 0.929 1.000 0.667 CB 1.664 16 residues pruned to eliminate duplicates Z: 21 21.388 1.976 0.835 0.577 0.950 0.650 CB 1.289 13 residues pruned to eliminate duplicates Z: 48 36.095 2.138 0.735 0.619 0.957 0.723 CB 1.325 48 residues pruned to eliminate duplicates Z: 88 84.593 2.398 0.972 0.732 0.931 0.793 CB 1.672 88 residues pruned to eliminate duplicates Z: 16 36.448 2.337 0.735 0.908 1.000 0.933 CB 1.649 16 residues pruned to eliminate duplicates Z: 25 50.581 2.300 0.840 0.927 1.000 0.958 CB 1.710 25 residues pruned to eliminate duplicates Z: 76 63.982 2.304 0.952 0.621 0.947 0.627 CB 1.547 76 residues pruned to eliminate duplicates Z: 8 11.000 1.668 0.598 0.792 1.000 0.714 CA 1.208 8 residues pruned to eliminate duplicates Z: 16 40.330 2.339 0.965 0.910 1.000 0.800 CB 1.607 16 residues pruned to eliminate duplicates Z: 162 110.757 2.392 1.071 0.659 0.932 0.689 CB 1.632 162 residues pruned to eliminate duplicates Z: 17 41.328 2.225 1.005 0.876 1.000 0.750 CB 1.683 17 residues pruned to eliminate duplicates Z: 17 34.365 2.089 1.058 0.886 0.938 0.812 CB 1.537 17 residues pruned to eliminate duplicates Z: 17 36.417 2.279 0.922 0.846 0.938 0.750 CB 1.647 17 residues pruned to eliminate duplicates Z: 13 19.742 1.952 0.848 0.836 0.917 0.333 CB 1.290 13 residues pruned to eliminate duplicates Z: 15 22.713 2.186 0.709 0.838 0.786 0.643 CB 1.546 15 residues pruned to eliminate duplicates Z: 31 24.923 1.899 0.729 0.635 1.000 0.533 CB 1.220 31 residues pruned to eliminate duplicates Z: 10 9.663 2.034 0.667 0.411 0.778 0.667 CB 1.340 5 residues pruned to eliminate duplicates Z: 7 6.984 1.809 0.369 0.797 0.667 0.667 CA 1.332 7 residues pruned to eliminate duplicates Z: 30 64.887 2.202 1.235 0.890 1.000 0.414 CB 1.761 30 residues pruned to eliminate duplicates Z: 13 29.485 2.258 0.855 0.872 1.000 0.583 CB 1.481 13 residues pruned to eliminate duplicates Z: 16 30.199 2.157 1.335 0.923 0.933 0.533 CB 1.166 16 residues pruned to eliminate duplicates Z: 30 51.861 2.221 0.910 0.895 0.931 0.793 CB 1.748 30 residues pruned to eliminate duplicates Z: 22 37.416 2.214 0.852 0.840 0.952 0.905 CB 1.560 22 residues pruned to eliminate duplicates Z: 17 8.687 1.991 0.462 0.276 0.750 0.625 CB 1.282 17 residues pruned to eliminate duplicates Z: 54 35.658 2.104 0.755 0.582 0.943 0.642 CB 1.299 54 residues pruned to eliminate duplicates Z: 6 11.686 1.968 0.373 0.713 1.000 1.000 N 1.595 Z: 31 58.503 2.163 1.107 0.890 1.000 0.633 CB 1.686 31 residues pruned to eliminate duplicates Z: 16 21.906 2.100 0.612 0.908 1.000 0.933 CB 1.187 16 residues pruned to eliminate duplicates Z: 17 33.794 2.174 1.028 0.856 0.938 0.625 CB 1.508 17 residues pruned to eliminate duplicates Z: 14 18.113 2.124 0.447 0.794 0.846 0.769 CB 1.493 14 residues pruned to eliminate duplicates Z: 16 31.524 2.285 0.511 0.885 1.000 0.867 CB 1.702 16 residues pruned to eliminate duplicates Z: 17 37.949 2.356 0.910 0.855 0.938 0.750 CB 1.659 17 residues pruned to eliminate duplicates Z: 23 36.205 2.105 1.220 0.900 0.909 0.682 CB 1.298 22 residues pruned to eliminate duplicates Z: 74 81.850 2.346 0.974 0.783 0.959 0.740 CB 1.682 74 residues pruned to eliminate duplicates Z: 15 28.876 2.125 1.199 0.897 0.929 0.714 CB 1.273 15 residues pruned to eliminate duplicates Z: 30 63.941 2.319 1.245 0.909 0.966 0.655 CB 1.677 30 residues pruned to eliminate duplicates Z: 19 35.855 2.223 0.844 0.829 1.000 0.778 CA 1.551 19 residues pruned to eliminate duplicates Z: 16 22.945 2.169 0.937 0.562 0.933 0.667 CB 1.422 16 residues pruned to eliminate duplicates Z: 18 50.856 2.270 1.177 0.909 1.000 0.824 CB 1.771 18 residues pruned to eliminate duplicates Z: 15 38.275 2.235 1.186 0.880 0.929 0.429 CB 1.633 15 residues pruned to eliminate duplicates Z: 13 9.789 1.711 0.924 0.332 0.833 0.417 CB 1.238 13 residues pruned to eliminate duplicates Z: 8 11.956 1.857 0.897 0.858 0.857 0.571 CB 1.102 8 residues pruned to eliminate duplicates Z: 16 28.822 2.189 1.087 0.873 0.933 0.733 CB 1.271 16 residues pruned to eliminate duplicates Z: 58 35.042 2.124 0.815 0.519 0.877 0.614 CB 1.347 58 residues pruned to eliminate duplicates Z: 75 50.449 2.169 0.791 0.616 0.959 0.635 CB 1.410 74 residues pruned to eliminate duplicates Z: 15 16.663 2.066 0.454 0.813 0.857 0.643 CB 1.317 15 residues pruned to eliminate duplicates Z: 13 23.553 1.980 0.667 0.941 1.000 0.917 CB 1.429 13 residues pruned to eliminate duplicates Z: 16 30.409 2.098 1.308 0.905 1.000 0.667 CB 1.154 16 residues pruned to eliminate duplicates Z: 30 61.279 2.233 1.175 0.884 0.966 0.690 CB 1.753 30 residues pruned to eliminate duplicates Z: 13 22.333 2.279 0.499 0.860 0.917 0.667 CB 1.514 13 residues pruned to eliminate duplicates Z: 24 20.265 2.023 0.927 0.468 0.826 0.609 CB 1.356 24 residues pruned to eliminate duplicates Z: 23 58.597 2.369 1.440 0.949 0.955 0.636 CB 1.563 24 residues pruned to eliminate duplicates Z: 8 23.303 2.318 1.035 0.563 1.000 0.714 CB 1.756 8 residues pruned to eliminate duplicates Z: 14 25.900 2.259 0.574 0.861 0.923 0.923 CA 1.608 14 residues pruned to eliminate duplicates Z: 101 85.597 2.376 1.068 0.691 0.900 0.720 CB 1.626 101 residues pruned to eliminate duplicates Z: 16 31.217 2.163 0.765 0.903 1.000 0.733 CB 1.505 16 residues pruned to eliminate duplicates Z: 33 29.190 2.160 0.699 0.367 1.000 0.500 CB 1.622 33 residues pruned to eliminate duplicates Z: 89 87.997 2.390 1.009 0.742 0.932 0.705 CB 1.688 89 residues pruned to eliminate duplicates Z: 15 34.096 2.283 0.758 0.915 1.000 0.929 CB 1.604 15 residues pruned to eliminate duplicates Z: 33 37.209 2.214 0.793 0.610 0.938 0.688 CB 1.592 33 residues pruned to eliminate duplicates Z: 72 49.873 2.154 0.863 0.606 0.958 0.690 CB 1.392 72 residues pruned to eliminate duplicates Z: 32 56.942 2.252 1.052 0.866 0.968 0.516 CB 1.674 32 residues pruned to eliminate duplicates Z: 30 15.848 1.984 0.593 0.415 0.862 0.448 CB 1.180 37 residues pruned to eliminate duplicates Z: 8 14.320 2.261 0.836 0.475 1.000 0.714 CB 1.337 8 residues pruned to eliminate duplicates Z: 15 40.127 2.224 1.054 0.866 1.000 0.571 CB 1.719 15 residues pruned to eliminate duplicates Z: 13 18.160 2.198 0.623 0.558 0.917 0.750 CB 1.515 13 residues pruned to eliminate duplicates Z: 13 23.800 2.347 0.471 0.825 0.917 0.833 CB 1.639 13 residues pruned to eliminate duplicates Z: 16 40.270 2.157 1.116 0.910 1.000 0.733 CB 1.616 16 residues pruned to eliminate duplicates Z: 11 10.952 1.834 0.951 0.379 0.900 0.400 CB 1.223 11 residues pruned to eliminate duplicates Z: 9 17.494 1.983 1.268 0.627 1.000 0.625 CB 1.220 14 residues pruned to eliminate duplicates Z: 11 11.290 1.972 0.275 0.547 1.000 0.600 CB 1.357 Z: 8 8.156 1.624 0.517 0.545 0.857 0.286 CA 1.398 8 residues pruned to eliminate duplicates Z: 6 9.660 2.076 0.530 0.581 1.000 0.600 CB 1.259 Z: 36 48.750 2.370 0.966 0.622 0.914 0.629 CB 1.725 60 residues pruned to eliminate duplicates Z: 28 60.402 2.267 1.171 0.928 0.963 0.556 CB 1.718 28 residues pruned to eliminate duplicates Z: 16 16.165 1.748 0.444 0.906 1.000 0.733 CB 1.176 16 residues pruned to eliminate duplicates Z: 15 13.876 2.130 0.890 0.307 0.857 0.357 CB 1.331 15 residues pruned to eliminate duplicates Z: 13 24.832 1.971 0.762 0.936 1.000 0.917 CB 1.437 13 residues pruned to eliminate duplicates Z: 16 30.604 2.228 0.856 0.915 0.933 0.867 CB 1.446 16 residues pruned to eliminate duplicates Z: 32 45.837 2.207 0.972 0.690 1.000 0.774 CB 1.589 32 residues pruned to eliminate duplicates Z: 14 20.453 2.160 0.434 0.829 0.923 0.769 CB 1.493 14 residues pruned to eliminate duplicates Z: 6 5.573 1.633 -0.012 0.701 1.000 0.600 CB 1.287 6 residues pruned to eliminate duplicates Z: 69 52.597 2.336 0.819 0.564 0.912 0.588 CB 1.547 69 residues pruned to eliminate duplicates Z: 18 19.999 2.225 0.699 0.443 0.941 0.588 CB 1.446 18 residues pruned to eliminate duplicates Z: 45 38.813 2.156 0.846 0.599 0.955 0.614 CB 1.402 25 residues pruned to eliminate duplicates Z: 8 14.239 2.110 0.674 0.697 0.857 0.714 CB 1.486 10 residues pruned to eliminate duplicates Z: 10 12.099 2.072 0.471 0.397 1.000 0.556 CB 1.475 Z: 15 10.030 1.763 0.680 0.311 0.857 0.286 CB 1.301 15 residues pruned to eliminate duplicates Z: 6 14.091 1.837 1.039 0.652 1.000 0.600 CB 1.460 6 residues pruned to eliminate duplicates Z: 14 25.807 1.940 0.816 0.939 1.000 0.846 CB 1.411 14 residues pruned to eliminate duplicates Z: 14 25.220 1.931 0.932 0.931 1.000 0.692 CB 1.311 14 residues pruned to eliminate duplicates Z: 16 45.557 2.316 1.202 0.858 1.000 0.733 CB 1.699 16 residues pruned to eliminate duplicates Z: 7 7.934 1.723 0.666 0.661 0.833 0.500 CA 1.167 7 residues pruned to eliminate duplicates Z: 42 34.711 2.108 0.987 0.536 0.878 0.537 CB 1.423 42 residues pruned to eliminate duplicates Z: 6 14.779 1.818 0.871 0.834 1.000 0.600 CB 1.457 6 residues pruned to eliminate duplicates Z: 29 18.773 1.882 0.509 0.610 0.893 0.679 CB 1.260 29 residues pruned to eliminate duplicates Z: 7 11.999 1.817 0.842 0.785 1.000 0.667 CA 1.139 7 residues pruned to eliminate duplicates Z: 41 35.006 2.194 0.817 0.546 0.875 0.650 CB 1.517 41 residues pruned to eliminate duplicates Z: 47 37.208 2.135 0.913 0.612 0.935 0.652 CB 1.292 50 residues pruned to eliminate duplicates Z: 25 12.752 1.876 0.454 0.378 0.833 0.542 CB 1.305 25 residues pruned to eliminate duplicates Z: 29 45.875 2.270 1.087 0.728 1.000 0.821 CB 1.490 29 residues pruned to eliminate duplicates Z: 25 29.751 2.084 0.730 0.759 0.958 0.833 CB 1.396 25 residues pruned to eliminate duplicates Z: 14 24.473 1.907 1.037 0.930 1.000 0.538 CB 1.222 14 residues pruned to eliminate duplicates Z: 45 24.215 1.899 0.903 0.554 0.886 0.341 CB 1.081 28 residues pruned to eliminate duplicates Z: 99 87.397 2.369 0.975 0.712 0.929 0.684 CB 1.677 99 residues pruned to eliminate duplicates Z: 15 15.363 1.808 0.276 0.915 1.000 0.929 CB 1.258 15 residues pruned to eliminate duplicates Z: 23 37.680 2.272 0.834 0.904 0.909 0.682 CB 1.510 23 residues pruned to eliminate duplicates Z: 12 25.131 2.183 0.722 0.921 0.909 0.909 CB 1.560 17 residues pruned to eliminate duplicates Z: 16 30.348 2.163 1.165 0.871 0.933 0.533 CB 1.307 16 residues pruned to eliminate duplicates Z: 154 86.924 2.292 0.946 0.635 0.915 0.693 CB 1.517 154 residues pruned to eliminate duplicates Z: 16 50.881 2.383 1.418 0.903 0.933 0.867 CB 1.742 16 residues pruned to eliminate duplicates Z: 22 31.215 2.086 0.921 0.921 0.952 0.381 CB 1.256 22 residues pruned to eliminate duplicates Z: 9 9.346 1.798 0.764 0.347 0.875 0.625 CB 1.406 9 residues pruned to eliminate duplicates Z: 11 10.883 1.638 1.131 0.505 0.800 0.600 CA 1.227 11 residues pruned to eliminate duplicates Z: 14 17.884 1.886 0.659 0.913 0.923 0.692 CB 1.216 14 residues pruned to eliminate duplicates Z: 7 3.202 1.947 0.269 0.414 0.667 0.500 CB 0.868 Z: 7 11.308 1.927 0.316 0.837 1.000 0.833 CA 1.361 7 residues pruned to eliminate duplicates Z: 7 6.840 1.854 0.552 0.814 0.667 0.667 CB 1.108 7 residues pruned to eliminate duplicates Z: 19 23.895 2.138 0.856 0.616 0.944 0.500 CB 1.347 18 residues pruned to eliminate duplicates Z: 15 16.753 2.024 0.613 0.764 0.929 0.643 CB 1.169 15 residues pruned to eliminate duplicates Z: 25 19.600 2.153 0.766 0.364 0.792 0.667 CB 1.539 25 residues pruned to eliminate duplicates Z: 16 23.596 2.095 0.964 0.863 0.933 0.733 CB 1.164 16 residues pruned to eliminate duplicates Z: 28 24.510 2.212 0.731 0.405 0.889 0.519 CB 1.531 28 residues pruned to eliminate duplicates Z: 16 41.126 2.308 1.079 0.923 1.000 0.600 CB 1.555 16 residues pruned to eliminate duplicates Z: 7 3.903 1.719 0.123 0.290 0.833 0.167 O 1.254 7 residues pruned to eliminate duplicates Z: 15 34.192 2.225 1.246 0.919 0.857 0.286 CB 1.504 15 residues pruned to eliminate duplicates Z: 16 17.021 2.108 0.974 0.389 0.867 0.467 CB 1.371 16 residues pruned to eliminate duplicates Z: 27 45.422 2.225 0.821 0.820 0.962 0.692 CA 1.733 27 residues pruned to eliminate duplicates Z: 8 4.247 1.874 0.010 0.435 0.857 0.571 CB 1.059 8 residues pruned to eliminate duplicates Z: 16 52.878 2.369 1.339 0.907 1.000 0.733 CB 1.751 16 residues pruned to eliminate duplicates Z: 10 15.082 2.147 0.378 0.636 1.000 0.444 CB 1.497 10 residues pruned to eliminate duplicates Z: 22 34.395 2.138 0.926 0.917 0.952 0.762 CB 1.351 22 residues pruned to eliminate duplicates Z: 8 8.345 1.666 0.329 0.904 1.000 1.000 CB 1.015 Z: 8 12.751 2.115 0.450 0.617 1.000 0.857 CB 1.406 8 residues pruned to eliminate duplicates Z: 6 12.038 1.972 0.719 0.799 0.800 0.600 CA 1.528 6 residues pruned to eliminate duplicates Z: 30 54.296 2.191 0.872 0.883 1.000 0.759 CB 1.778 30 residues pruned to eliminate duplicates Z: 56 34.724 2.128 0.925 0.559 0.927 0.600 CB 1.163 56 residues pruned to eliminate duplicates Z: 16 30.473 2.180 1.237 0.887 0.933 0.667 CB 1.246 16 residues pruned to eliminate duplicates Z: 19 35.262 2.062 1.138 0.882 0.944 0.611 CB 1.445 19 residues pruned to eliminate duplicates Z: 25 26.046 2.256 0.885 0.369 0.917 0.708 CB 1.570 25 residues pruned to eliminate duplicates Z: 7 5.744 1.586 0.156 0.890 1.000 0.833 CB 0.920 7 residues pruned to eliminate duplicates Z: 49 35.098 2.185 0.802 0.511 0.917 0.646 CB 1.389 49 residues pruned to eliminate duplicates Z: 10 11.666 1.846 0.522 0.538 0.889 0.444 CB 1.500 10 residues pruned to eliminate duplicates Z: 44 35.087 2.201 1.010 0.545 0.884 0.558 CB 1.310 44 residues pruned to eliminate duplicates Z: 16 39.668 2.305 1.159 0.889 0.933 0.333 CB 1.588 16 residues pruned to eliminate duplicates Z: 15 24.804 2.255 0.600 0.919 0.929 0.857 CB 1.394 15 residues pruned to eliminate duplicates Z: 15 23.534 2.124 0.760 0.921 0.929 0.857 CB 1.275 15 residues pruned to eliminate duplicates Z: 15 15.093 2.022 0.323 0.860 0.857 0.857 CB 1.293 15 residues pruned to eliminate duplicates Z: 47 24.701 1.918 0.641 0.552 1.000 0.609 CB 1.100 47 residues pruned to eliminate duplicates Z: 48 40.507 2.212 0.953 0.585 0.957 0.745 CB 1.316 48 residues pruned to eliminate duplicates Z: 38 34.059 2.130 0.958 0.634 0.919 0.784 CB 1.288 38 residues pruned to eliminate duplicates Z: 20 32.002 2.255 0.992 0.655 0.895 0.737 CB 1.582 20 residues pruned to eliminate duplicates Z: 12 25.856 2.223 1.037 0.811 0.909 0.545 CB 1.444 12 residues pruned to eliminate duplicates Z: 17 24.066 2.107 0.706 0.913 1.000 0.875 CB 1.184 17 residues pruned to eliminate duplicates Z: 13 20.242 1.897 0.750 0.926 1.000 0.833 CB 1.235 13 residues pruned to eliminate duplicates Z: 13 19.091 2.159 0.592 0.826 0.833 0.667 CB 1.452 13 residues pruned to eliminate duplicates Z: 6 8.300 1.790 0.573 0.756 0.800 0.400 CB 1.312 6 residues pruned to eliminate duplicates Z: 24 44.042 2.313 0.711 0.934 1.000 0.913 CB 1.618 24 residues pruned to eliminate duplicates Z: 11 25.193 2.219 0.740 0.874 1.000 0.800 CB 1.502 11 residues pruned to eliminate duplicates Z: 16 44.214 2.381 1.002 0.912 1.000 0.800 CB 1.697 16 residues pruned to eliminate duplicates Z: 90 86.969 2.382 1.127 0.716 0.933 0.742 CB 1.605 90 residues pruned to eliminate duplicates Z: 15 36.545 2.206 1.188 0.923 0.929 0.571 CB 1.532 15 residues pruned to eliminate duplicates Z: 31 37.417 2.198 1.174 0.629 0.933 0.533 CB 1.357 31 residues pruned to eliminate duplicates Z: 26 38.766 2.249 1.040 0.610 0.920 0.640 CB 1.655 26 residues pruned to eliminate duplicates Z: 9 4.186 1.664 0.250 0.392 0.625 0.375 CB 1.276 9 residues pruned to eliminate duplicates Z: 8 5.704 1.466 0.687 0.704 0.714 0.571 CA 1.014 8 residues pruned to eliminate duplicates Z: 7 7.026 1.752 0.514 0.532 1.000 0.500 CB 1.047 Z: 15 25.709 1.890 0.901 0.933 1.000 0.643 CB 1.335 15 residues pruned to eliminate duplicates Z: 17 39.763 2.381 0.808 0.880 1.000 0.750 CB 1.673 17 residues pruned to eliminate duplicates Z: 10 21.231 2.282 0.505 0.895 1.000 1.000 CB 1.477 10 residues pruned to eliminate duplicates Z: 17 33.011 2.261 0.631 0.904 0.938 0.938 CB 1.700 17 residues pruned to eliminate duplicates Z: 6 7.715 1.972 0.465 0.736 0.600 0.600 N 1.610 6 residues pruned to eliminate duplicates Z: 13 24.273 1.950 0.784 0.944 1.000 0.917 CB 1.394 13 residues pruned to eliminate duplicates Z: 38 42.501 2.204 1.167 0.647 0.946 0.676 CB 1.348 38 residues pruned to eliminate duplicates Z: 19 26.257 2.273 0.847 0.580 0.944 0.611 CB 1.445 19 residues pruned to eliminate duplicates Z: 11 11.137 1.883 0.435 0.546 1.000 0.400 CB 1.246 10 residues pruned to eliminate duplicates Z: 7 7.894 1.529 0.687 0.678 1.000 0.667 CB 1.060 7 residues pruned to eliminate duplicates Z: 17 37.508 2.217 0.729 0.917 1.000 0.875 CA 1.726 17 residues pruned to eliminate duplicates Z: 12 6.619 1.830 0.319 0.728 0.636 0.545 CB 1.057 12 residues pruned to eliminate duplicates Z: 36 35.408 2.153 0.883 0.583 0.943 0.771 CB 1.447 36 residues pruned to eliminate duplicates Z: 40 34.435 2.130 0.837 0.535 0.897 0.590 CB 1.517 40 residues pruned to eliminate duplicates Z: 13 23.247 1.992 0.598 0.932 1.000 1.000 CB 1.473 13 residues pruned to eliminate duplicates Z: 15 23.594 1.812 0.726 0.889 1.000 0.857 CB 1.452 15 residues pruned to eliminate duplicates Z: 50 33.059 2.157 0.681 0.498 0.939 0.633 CB 1.391 50 residues pruned to eliminate duplicates Z: 6 7.015 1.808 0.356 0.830 0.800 0.800 CB 1.203 6 residues pruned to eliminate duplicates Z: 14 23.148 1.896 0.951 0.939 1.000 0.538 CB 1.206 14 residues pruned to eliminate duplicates Z: 39 24.370 1.806 0.558 0.640 0.974 0.789 CB 1.266 39 residues pruned to eliminate duplicates Z: 7 19.270 2.187 1.153 0.592 1.000 0.500 CB 1.530 7 residues pruned to eliminate duplicates Z: 30 64.605 2.307 1.290 0.926 0.966 0.552 CB 1.650 30 residues pruned to eliminate duplicates Z: 74 81.323 2.331 1.032 0.766 0.945 0.767 CB 1.680 74 residues pruned to eliminate duplicates Z: 45 33.043 2.116 0.764 0.527 0.909 0.750 CB 1.428 45 residues pruned to eliminate duplicates Z: 27 47.772 2.263 0.899 0.908 0.962 0.538 CB 1.610 27 residues pruned to eliminate duplicates Z: 40 20.946 1.874 0.679 0.554 0.897 0.564 CB 1.126 40 residues pruned to eliminate duplicates Z: 15 14.193 2.006 0.374 0.818 0.786 0.429 CB 1.329 15 residues pruned to eliminate duplicates Z: 10 11.994 2.008 0.695 0.565 1.000 0.667 CB 1.102 10 residues pruned to eliminate duplicates Z: 14 19.540 1.864 0.738 0.936 1.000 0.923 CB 1.165 14 residues pruned to eliminate duplicates Z: 16 41.735 2.277 1.152 0.927 0.933 0.733 CB 1.651 16 residues pruned to eliminate duplicates Z: 13 13.916 2.130 0.802 0.402 0.833 0.417 CB 1.393 13 residues pruned to eliminate duplicates Z: 16 21.974 2.092 0.538 0.920 1.000 0.933 CB 1.242 16 residues pruned to eliminate duplicates Z: 31 18.472 1.779 0.546 0.669 0.933 0.667 CB 1.124 31 residues pruned to eliminate duplicates Z: 29 53.187 2.282 0.734 0.932 1.000 0.964 CB 1.774 29 residues pruned to eliminate duplicates Z: 13 16.075 1.977 0.536 0.769 0.833 0.500 CB 1.446 13 residues pruned to eliminate duplicates Z: 44 37.700 2.177 0.982 0.578 0.953 0.698 CB 1.296 44 residues pruned to eliminate duplicates Z: 14 25.324 2.340 0.395 0.857 0.923 0.615 CB 1.717 14 residues pruned to eliminate duplicates Z: 12 11.870 1.892 0.590 0.446 1.000 0.636 CB 1.258 12 residues pruned to eliminate duplicates Z: 6 9.754 1.865 0.645 0.798 1.000 1.000 CB 1.096 6 residues pruned to eliminate duplicates Z: 35 40.060 2.286 1.032 0.597 0.882 0.618 CB 1.527 35 residues pruned to eliminate duplicates Z: 11 16.711 2.235 0.536 0.582 1.000 0.700 CB 1.423 11 residues pruned to eliminate duplicates Z: 48 68.896 2.456 1.308 0.689 0.936 0.660 CB 1.593 48 residues pruned to eliminate duplicates Z: 12 10.724 1.898 0.499 0.577 0.909 0.636 CB 1.161 12 residues pruned to eliminate duplicates Z: 7 14.400 2.212 0.978 0.637 0.833 0.833 CB 1.418 7 residues pruned to eliminate duplicates Z: 6 3.178 1.749 0.435 0.784 0.800 0.800 CB 0.551 6 residues pruned to eliminate duplicates Z: 86 89.386 2.396 1.155 0.725 0.941 0.682 CB 1.629 86 residues pruned to eliminate duplicates Z: 8 12.084 1.776 0.695 0.771 1.000 0.714 CB 1.194 8 residues pruned to eliminate duplicates Z: 32 33.484 2.120 1.134 0.638 0.903 0.645 CB 1.293 32 residues pruned to eliminate duplicates Z: 13 9.388 1.808 0.569 0.346 0.917 0.667 CB 1.232 13 residues pruned to eliminate duplicates Z: 32 32.514 2.159 0.982 0.579 0.871 0.516 CB 1.452 32 residues pruned to eliminate duplicates Z: 30 67.365 2.297 1.288 0.906 1.000 0.517 CB 1.693 30 residues pruned to eliminate duplicates Z: 16 40.149 2.224 1.248 0.891 0.933 0.533 CB 1.596 16 residues pruned to eliminate duplicates 7 1.722 1.598 -0.388 0.483 0.833 0.667 CB 0.877 ? Z: 14 12.589 2.109 0.921 0.381 0.769 0.462 CB 1.272 14 residues pruned to eliminate duplicates Z: 7 3.755 1.813 -0.077 0.461 1.000 0.333 CB 0.953 Z: 24 33.170 2.088 0.881 0.696 1.000 0.609 CB 1.472 26 residues pruned to eliminate duplicates Z: 55 29.301 2.004 0.654 0.565 0.907 0.630 CB 1.245 54 residues pruned to eliminate duplicates Z: 48 48.379 2.374 0.903 0.521 0.915 0.638 CB 1.671 48 residues pruned to eliminate duplicates Z: 15 24.336 1.896 0.784 0.919 1.000 0.786 CB 1.356 15 residues pruned to eliminate duplicates Z: 15 22.727 1.887 0.906 0.918 1.000 0.786 CB 1.191 15 residues pruned to eliminate duplicates Z: 18 19.953 2.111 0.620 0.626 0.882 0.647 CB 1.424 18 residues pruned to eliminate duplicates Z: 16 22.149 1.806 0.852 0.912 1.000 0.733 CB 1.211 16 residues pruned to eliminate duplicates Z: 6 11.741 1.990 0.714 0.661 1.000 0.600 CB 1.326 5 residues pruned to eliminate duplicates Z: 17 39.806 2.121 1.235 0.931 0.938 0.875 CA 1.566 17 residues pruned to eliminate duplicates Z: 6 6.232 1.677 0.293 0.766 1.000 0.600 CA 1.016 6 residues pruned to eliminate duplicates Z: 38 28.563 2.131 0.853 0.537 0.838 0.514 CB 1.368 38 residues pruned to eliminate duplicates Z: 14 30.424 2.190 1.045 0.900 1.000 0.308 CB 1.345 14 residues pruned to eliminate duplicates Z: 12 12.795 1.942 0.512 0.661 0.909 0.545 CB 1.246 12 residues pruned to eliminate duplicates Z: 39 32.328 2.127 0.768 0.602 0.974 0.632 CB 1.299 39 residues pruned to eliminate duplicates Z: 36 41.440 2.184 1.120 0.644 0.971 0.629 CB 1.362 36 residues pruned to eliminate duplicates Z: 65 47.964 2.159 0.956 0.560 0.953 0.625 CB 1.405 65 residues pruned to eliminate duplicates Z: 27 30.997 2.067 0.966 0.598 0.923 0.654 CB 1.475 27 residues pruned to eliminate duplicates Z: 24 23.806 2.061 0.798 0.496 1.000 0.783 CB 1.345 24 residues pruned to eliminate duplicates Z: 14 18.627 2.040 0.624 0.775 0.923 0.615 CB 1.325 14 residues pruned to eliminate duplicates Z: 30 53.578 2.191 0.926 0.883 1.000 0.724 CB 1.705 30 residues pruned to eliminate duplicates Z: 31 50.730 2.232 0.947 0.824 0.933 0.733 CB 1.724 31 residues pruned to eliminate duplicates Z: 39 36.319 2.116 0.737 0.652 0.947 0.789 CB 1.469 39 residues pruned to eliminate duplicates Z: 14 22.685 1.900 0.853 0.907 1.000 0.615 CB 1.269 14 residues pruned to eliminate duplicates Z: 7 15.503 1.928 0.903 0.758 1.000 0.500 CB 1.371 7 residues pruned to eliminate duplicates Z: 14 30.929 2.253 0.889 0.847 0.923 0.462 CB 1.622 14 residues pruned to eliminate duplicates Z: 14 13.934 1.850 0.713 0.510 0.923 0.615 CB 1.308 14 residues pruned to eliminate duplicates Z: 22 23.844 2.039 0.856 0.696 0.857 0.714 CB 1.341 22 residues pruned to eliminate duplicates Z: 6 8.533 1.798 0.535 0.829 1.000 0.600 CB 1.040 6 residues pruned to eliminate duplicates Z: 19 21.068 2.142 0.598 0.632 0.944 0.667 CB 1.357 19 residues pruned to eliminate duplicates Z: 38 23.466 1.880 0.896 0.523 0.865 0.622 CB 1.223 38 residues pruned to eliminate duplicates Z: 11 6.764 1.675 0.149 0.372 0.900 0.500 CB 1.417 11 residues pruned to eliminate duplicates Z: 10 16.967 2.081 0.541 0.669 1.000 0.778 CB 1.509 10 residues pruned to eliminate duplicates Z: 14 21.540 1.883 0.793 0.945 1.000 1.000 CB 1.225 14 residues pruned to eliminate duplicates Z: 22 42.908 2.291 1.003 0.813 0.905 0.143 CB 1.718 22 residues pruned to eliminate duplicates Z: 12 8.741 1.687 0.454 0.465 0.909 0.455 CB 1.226 11 residues pruned to eliminate duplicates Z: 14 39.928 2.301 0.997 0.897 1.000 0.846 CA 1.726 14 residues pruned to eliminate duplicates Z: 9 9.763 2.056 0.559 0.647 0.750 0.250 CB 1.252 9 residues pruned to eliminate duplicates Z: 17 44.559 2.283 1.313 0.929 0.938 0.750 CB 1.574 17 residues pruned to eliminate duplicates Z: 54 38.294 2.163 0.942 0.554 0.887 0.679 CB 1.340 52 residues pruned to eliminate duplicates Z: 16 38.157 2.247 1.009 0.908 1.000 0.867 CB 1.550 16 residues pruned to eliminate duplicates Z: 14 34.179 2.071 1.352 0.904 1.000 0.615 CB 1.386 14 residues pruned to eliminate duplicates Z: 18 17.676 1.898 0.696 0.645 0.882 0.588 CB 1.317 18 residues pruned to eliminate duplicates Z: 8 18.261 2.340 0.831 0.495 1.000 0.571 CB 1.619 8 residues pruned to eliminate duplicates Z: 14 20.678 1.876 0.462 0.931 1.000 1.000 CB 1.461 14 residues pruned to eliminate duplicates Z: 30 24.320 1.918 0.757 0.627 0.966 0.483 CB 1.232 30 residues pruned to eliminate duplicates Z: 25 28.997 2.160 0.913 0.585 0.917 0.542 CB 1.440 25 residues pruned to eliminate duplicates Z: 11 15.138 2.321 0.566 0.386 0.800 0.500 CB 1.858 11 residues pruned to eliminate duplicates Z: 7 5.240 1.580 0.098 0.901 1.000 0.833 CB 0.881 7 residues pruned to eliminate duplicates Z: 16 15.286 2.154 1.067 0.329 0.733 0.400 CB 1.458 16 residues pruned to eliminate duplicates Z: 93 87.166 2.376 1.051 0.710 0.935 0.696 CB 1.649 93 residues pruned to eliminate duplicates Z: 14 15.652 1.946 0.765 0.424 0.923 0.462 CB 1.483 14 residues pruned to eliminate duplicates Z: 8 6.089 1.953 0.446 0.223 0.857 0.714 CA 1.316 Z: 11 8.364 1.503 0.814 0.607 0.900 0.700 CB 0.973 Z: 16 31.239 2.174 0.940 0.779 0.933 0.733 CB 1.601 17 residues pruned to eliminate duplicates Z: 9 9.298 1.671 0.334 0.865 1.000 0.375 CB 1.081 8 residues pruned to eliminate duplicates Z: 8 17.010 1.962 0.883 0.583 1.000 0.857 CB 1.606 8 residues pruned to eliminate duplicates Z: 18 25.943 2.228 0.622 0.629 1.000 0.647 CB 1.542 17 residues pruned to eliminate duplicates Z: 8 2.581 1.489 0.538 0.269 0.714 0.286 CB 0.776 8 residues pruned to eliminate duplicates Z: 6 6.191 1.695 0.407 0.829 1.000 0.800 CB 0.874 6 residues pruned to eliminate duplicates Z: 90 85.574 2.316 1.038 0.721 0.933 0.798 CB 1.687 90 residues pruned to eliminate duplicates Z: 8 8.078 1.675 0.446 0.742 1.000 0.571 CB 1.015 8 residues pruned to eliminate duplicates Z: 15 20.865 1.839 0.801 0.907 1.000 0.786 CB 1.197 15 residues pruned to eliminate duplicates Z: 14 22.278 1.853 0.981 0.923 1.000 0.615 CB 1.183 14 residues pruned to eliminate duplicates Z: 14 22.606 1.862 1.035 0.915 1.000 0.923 CB 1.169 14 residues pruned to eliminate duplicates Z: 66 86.737 2.402 1.053 0.790 0.954 0.738 CB 1.773 66 residues pruned to eliminate duplicates Z: 47 43.416 2.199 0.922 0.647 0.913 0.739 CB 1.447 47 residues pruned to eliminate duplicates Z: 36 37.474 2.172 0.815 0.641 0.971 0.743 CB 1.450 36 residues pruned to eliminate duplicates Z: 28 54.295 2.249 0.915 0.930 1.000 0.963 CB 1.697 28 residues pruned to eliminate duplicates Z: 10 11.183 2.155 0.497 0.465 1.000 0.667 CB 1.198 10 residues pruned to eliminate duplicates Z: 24 34.931 2.234 0.866 0.759 0.913 0.783 CB 1.520 24 residues pruned to eliminate duplicates Z: 6 6.229 1.621 0.281 0.718 1.000 0.800 CB 1.102 6 residues pruned to eliminate duplicates Z: 51 37.972 2.147 0.882 0.534 0.980 0.700 CB 1.312 50 residues pruned to eliminate duplicates Z: 22 39.214 2.113 1.148 0.900 0.952 0.571 CB 1.414 24 residues pruned to eliminate duplicates Z: 25 52.557 2.270 1.308 0.920 0.917 0.708 CB 1.573 25 residues pruned to eliminate duplicates Z: 19 18.298 1.769 0.789 0.735 0.833 0.611 CB 1.324 19 residues pruned to eliminate duplicates Z: 8 8.955 1.921 0.656 0.490 0.857 0.571 CB 1.254 8 residues pruned to eliminate duplicates Z: 8 2.920 1.724 -0.080 0.490 0.857 0.429 CB 0.819 8 residues pruned to eliminate duplicates Z: 19 24.831 2.191 0.673 0.646 0.944 0.778 CB 1.475 19 residues pruned to eliminate duplicates Z: 12 15.452 2.169 0.403 0.825 0.818 0.545 CB 1.413 12 residues pruned to eliminate duplicates Z: 9 8.644 1.769 0.468 0.509 0.875 0.750 CB 1.332 9 residues pruned to eliminate duplicates Z: 28 46.197 2.238 0.822 0.826 0.926 0.815 CB 1.776 28 residues pruned to eliminate duplicates Z: 32 40.374 2.243 0.884 0.652 0.968 0.613 CB 1.539 32 residues pruned to eliminate duplicates Z: 11 7.856 1.646 0.322 0.537 1.000 0.600 CB 1.102 11 residues pruned to eliminate duplicates Z: 16 23.381 1.805 0.986 0.926 1.000 0.267 CB 1.181 16 residues pruned to eliminate duplicates Z: 8 3.507 1.689 0.058 0.541 0.857 0.571 CB 0.832 Z: 18 36.812 2.142 0.829 0.919 1.000 0.882 CB 1.606 18 residues pruned to eliminate duplicates Z: 13 6.790 1.477 0.774 0.248 0.833 0.250 CB 1.200 13 residues pruned to eliminate duplicates Z: 8 6.485 1.673 0.546 0.515 0.857 0.571 CA 1.090 8 residues pruned to eliminate duplicates Z: 15 18.714 2.041 0.760 0.550 0.929 0.714 CB 1.428 15 residues pruned to eliminate duplicates Z: 6 5.365 1.728 0.457 0.681 1.000 0.400 CB 0.807 6 residues pruned to eliminate duplicates Z: 12 17.278 2.059 0.690 0.692 0.909 0.636 CB 1.381 12 residues pruned to eliminate duplicates Z: 98 88.925 2.312 1.186 0.678 0.948 0.639 CB 1.599 98 residues pruned to eliminate duplicates Z: 64 53.067 2.266 0.898 0.539 0.937 0.571 CB 1.597 64 residues pruned to eliminate duplicates Z: 86 85.178 2.376 1.110 0.711 0.941 0.741 CB 1.617 86 residues pruned to eliminate duplicates Z: 6 3.934 1.859 -0.069 0.640 0.800 0.600 CA 1.114 6 residues pruned to eliminate duplicates Z: 27 50.670 2.383 0.972 0.820 0.962 0.808 CB 1.667 27 residues pruned to eliminate duplicates Z: 6 3.108 1.665 -0.109 0.624 1.000 0.600 CB 0.834 Z: 14 15.980 1.925 0.987 0.637 0.846 0.538 CB 1.205 14 residues pruned to eliminate duplicates Z: 8 8.094 1.521 0.792 0.695 0.857 0.429 CB 1.096 8 residues pruned to eliminate duplicates Z: 11 4.524 2.014 0.406 0.206 0.900 0.400 CB 0.795 11 residues pruned to eliminate duplicates Z: 39 29.091 2.207 0.842 0.514 0.816 0.553 CB 1.403 39 residues pruned to eliminate duplicates Z: 79 43.236 2.094 0.812 0.525 0.923 0.577 CB 1.363 140 residues pruned to eliminate duplicates Z: 9 2.463 1.505 -0.156 0.372 0.750 0.375 C 1.049 6 1.305 1.570 -0.253 0.297 0.800 0.400 CB 0.782 ? Z: 24 23.487 2.151 0.627 0.613 0.913 0.783 CB 1.377 24 residues pruned to eliminate duplicates Z: 14 26.127 2.156 0.835 0.869 0.923 0.615 CB 1.450 14 residues pruned to eliminate duplicates 6 1.921 1.597 -0.073 0.421 0.600 0.400 N 1.050 ? Z: 23 28.201 2.185 0.774 0.523 0.955 0.500 CB 1.589 23 residues pruned to eliminate duplicates Z: 22 58.248 2.325 1.585 0.911 0.952 0.476 CB 1.573 22 residues pruned to eliminate duplicates Z: 15 8.821 1.751 0.574 0.407 0.786 0.429 CB 1.200 15 residues pruned to eliminate duplicates Z: 7 6.421 1.706 0.462 0.745 0.833 0.333 CB 1.013 7 residues pruned to eliminate duplicates Z: 7 5.628 1.556 0.248 0.897 1.000 1.000 CB 0.847 7 residues pruned to eliminate duplicates Z: 23 47.537 2.305 1.291 0.930 0.909 0.455 CB 1.476 23 residues pruned to eliminate duplicates Z: 6 2.874 1.275 0.546 0.682 0.800 0.400 C 0.689 6 residues pruned to eliminate duplicates Z: 24 30.936 1.992 0.884 0.862 0.957 0.739 CB 1.320 22 residues pruned to eliminate duplicates Z: 24 16.176 1.940 0.821 0.314 0.913 0.652 CB 1.284 24 residues pruned to eliminate duplicates Z: 25 13.032 2.055 0.533 0.422 0.833 0.667 CB 1.099 25 residues pruned to eliminate duplicates Z: 24 30.670 2.007 0.968 0.866 0.913 0.522 CB 1.298 24 residues pruned to eliminate duplicates Z: 31 22.059 2.045 0.666 0.482 0.867 0.667 CB 1.388 31 residues pruned to eliminate duplicates Z: 18 20.508 1.956 0.931 0.607 0.941 0.588 CB 1.264 18 residues pruned to eliminate duplicates Z: 6 10.062 1.883 0.560 0.826 1.000 0.800 N 1.155 6 residues pruned to eliminate duplicates Z: 80 63.596 2.311 0.905 0.597 0.937 0.684 CB 1.581 80 residues pruned to eliminate duplicates Z: 12 13.713 1.903 0.628 0.584 1.000 0.727 CB 1.231 12 residues pruned to eliminate duplicates Z: 59 75.786 2.384 1.020 0.768 0.948 0.724 CB 1.719 59 residues pruned to eliminate duplicates Z: 14 23.213 1.899 0.920 0.945 1.000 0.769 CB 1.222 14 residues pruned to eliminate duplicates Z: 8 12.708 1.873 0.845 0.887 1.000 0.857 CB 1.002 8 residues pruned to eliminate duplicates Z: 15 12.245 2.006 0.658 0.570 0.857 0.643 CB 1.073 15 residues pruned to eliminate duplicates Z: 57 35.648 2.018 0.831 0.575 0.964 0.643 CB 1.244 Z: 6 3.021 1.557 0.086 0.295 0.800 0.400 N 1.255 Z: 7 11.775 1.927 0.748 0.708 1.000 0.333 CB 1.181 7 residues pruned to eliminate duplicates Z: 10 7.699 1.953 0.203 0.561 0.778 0.556 CB 1.323 10 residues pruned to eliminate duplicates 6 1.211 1.356 0.388 0.332 0.400 0.200 CB 0.865 ? Z: 14 22.700 1.895 1.086 0.807 0.923 0.846 CB 1.320 14 residues pruned to eliminate duplicates Z: 28 31.523 2.033 0.796 0.789 0.963 0.778 CB 1.338 25 residues pruned to eliminate duplicates Z: 8 4.477 1.480 1.048 0.414 0.714 0.571 CA 0.855 Z: 36 67.602 2.232 1.147 0.820 1.000 0.743 CB 1.806 36 residues pruned to eliminate duplicates Z: 6 3.462 1.269 0.351 0.638 0.800 0.600 C 0.992 Z: 11 9.049 1.485 0.514 0.864 1.000 0.900 CB 0.933 11 residues pruned to eliminate duplicates Z: 30 34.273 2.209 0.734 0.645 0.897 0.586 CB 1.618 30 residues pruned to eliminate duplicates Z: 21 26.735 1.994 0.989 0.785 0.950 0.300 CB 1.235 21 residues pruned to eliminate duplicates Z: 10 3.511 1.405 0.643 0.334 0.667 0.333 N 0.911 Z: 32 24.226 1.893 0.745 0.557 0.903 0.516 CB 1.380 32 residues pruned to eliminate duplicates Z: 18 43.342 2.166 1.140 0.930 1.000 0.765 CB 1.586 18 residues pruned to eliminate duplicates Z: 12 16.960 2.141 0.555 0.716 0.909 0.818 CB 1.389 12 residues pruned to eliminate duplicates Z: 34 38.150 2.286 0.716 0.476 1.000 0.727 CB 1.735 34 residues pruned to eliminate duplicates 7 1.850 1.571 0.693 0.507 0.667 0.500 CB 0.423 ? Z: 21 20.829 2.003 0.639 0.562 0.900 0.600 CB 1.484 21 residues pruned to eliminate duplicates Z: 7 8.002 1.871 1.021 0.752 0.667 0.500 CA 1.035 7 residues pruned to eliminate duplicates Z: 8 3.191 1.252 0.380 0.345 0.857 0.714 CB 0.965 Z: 6 12.575 2.017 0.719 0.740 1.000 0.800 CB 1.308 6 residues pruned to eliminate duplicates Z: 17 13.762 2.037 0.698 0.526 0.875 0.688 CB 1.107 17 residues pruned to eliminate duplicates Z: 29 13.095 1.521 0.637 0.641 0.893 0.571 CB 0.975 29 residues pruned to eliminate duplicates Z: 13 25.031 1.972 0.826 0.919 1.000 0.917 CB 1.415 13 residues pruned to eliminate duplicates Z: 26 24.746 2.201 0.825 0.466 0.880 0.600 CB 1.449 26 residues pruned to eliminate duplicates Z: 14 24.476 1.849 1.134 0.923 1.000 0.692 CB 1.209 14 residues pruned to eliminate duplicates Z: 6 6.809 1.894 0.445 0.725 1.000 0.800 CB 0.909 Z: 36 55.083 2.400 0.974 0.705 0.914 0.486 CB 1.785 36 residues pruned to eliminate duplicates Z: 18 20.618 1.833 0.672 0.802 0.882 0.824 CB 1.420 18 residues pruned to eliminate duplicates Z: 44 30.094 2.199 0.712 0.471 0.930 0.651 CB 1.349 44 residues pruned to eliminate duplicates Z: 6 3.979 1.830 0.225 0.505 1.000 0.600 CB 0.790 6 residues pruned to eliminate duplicates Z: 7 6.544 1.590 0.463 0.569 1.000 0.500 N 1.075 Z: 88 80.818 2.358 1.038 0.693 0.908 0.667 CB 1.665 88 residues pruned to eliminate duplicates Z: 13 35.850 2.329 1.102 0.873 1.000 0.667 CB 1.540 13 residues pruned to eliminate duplicates Z: 109 81.635 2.254 1.044 0.684 0.935 0.657 CB 1.540 109 residues pruned to eliminate duplicates Z: 12 14.321 2.107 1.050 0.359 0.727 0.364 CA 1.600 12 residues pruned to eliminate duplicates Z: 39 26.351 2.105 0.591 0.581 0.947 0.684 CB 1.246 39 residues pruned to eliminate duplicates Z: 22 37.596 2.074 1.125 0.922 0.952 0.667 CB 1.375 26 residues pruned to eliminate duplicates Z: 33 38.065 2.228 1.029 0.575 0.938 0.656 CB 1.478 33 residues pruned to eliminate duplicates Z: 24 30.632 2.144 0.963 0.651 0.957 0.565 CB 1.379 25 residues pruned to eliminate duplicates Z: 9 6.818 1.572 0.263 0.897 1.000 0.875 CB 0.869 9 residues pruned to eliminate duplicates Z: 17 29.598 2.221 1.128 0.673 1.000 0.812 CB 1.334 17 residues pruned to eliminate duplicates Z: 14 22.804 1.927 0.905 0.764 0.923 0.615 CB 1.477 14 residues pruned to eliminate duplicates Z: 18 20.879 2.085 0.865 0.663 0.882 0.647 CB 1.269 18 residues pruned to eliminate duplicates Z: 9 4.470 1.263 0.540 0.420 0.875 0.750 O 1.010 Z: 6 5.275 1.304 0.447 0.676 1.000 0.800 CA 1.063 6 residues pruned to eliminate duplicates Z: 12 14.475 1.963 0.461 0.698 1.000 0.545 CB 1.270 12 residues pruned to eliminate duplicates Z: 6 15.253 2.033 1.302 0.694 1.000 0.600 CB 1.221 6 residues pruned to eliminate duplicates Z: 21 33.375 2.081 1.192 0.876 0.900 0.400 CB 1.321 21 residues pruned to eliminate duplicates Z: 7 10.835 2.019 0.889 0.488 0.833 0.667 CB 1.408 7 residues pruned to eliminate duplicates Z: 29 50.656 2.298 0.997 0.871 0.893 0.571 CB 1.704 29 residues pruned to eliminate duplicates Z: 16 8.595 1.706 0.651 0.350 0.800 0.667 CB 1.159 16 residues pruned to eliminate duplicates Z: 26 30.999 2.282 0.885 0.459 0.960 0.760 CB 1.565 26 residues pruned to eliminate duplicates Z: 11 20.807 2.149 0.591 0.908 1.000 1.000 CB 1.367 11 residues pruned to eliminate duplicates Z: 34 30.933 2.032 0.794 0.620 0.879 0.545 CB 1.500 34 residues pruned to eliminate duplicates Z: 8 15.993 2.340 0.783 0.505 1.000 0.857 CB 1.442 8 residues pruned to eliminate duplicates Z: 6 9.799 1.800 0.915 0.865 1.000 0.600 CB 0.931 6 residues pruned to eliminate duplicates Z: 12 17.098 2.010 0.624 0.700 1.000 0.455 CB 1.316 12 residues pruned to eliminate duplicates Z: 20 24.315 2.247 0.783 0.549 0.947 0.789 CB 1.400 20 residues pruned to eliminate duplicates Z: 9 17.651 2.164 0.792 0.766 0.875 0.625 CA 1.452 9 residues pruned to eliminate duplicates Z: 29 22.369 1.880 0.997 0.651 0.929 0.429 CB 1.054 29 residues pruned to eliminate duplicates Z: 9 7.920 1.910 0.379 0.380 1.000 0.750 CA 1.207 9 residues pruned to eliminate duplicates Z: 14 22.150 1.824 1.051 0.921 1.000 0.538 CB 1.156 14 residues pruned to eliminate duplicates Z: 13 10.740 1.975 0.355 0.630 0.917 0.750 CB 1.118 13 residues pruned to eliminate duplicates Z: 74 90.457 2.368 1.146 0.775 0.973 0.781 CB 1.680 74 residues pruned to eliminate duplicates Z: 17 18.159 2.142 0.674 0.366 0.875 0.438 CB 1.671 17 residues pruned to eliminate duplicates Z: 56 63.138 2.298 0.962 0.694 0.927 0.727 CB 1.705 56 residues pruned to eliminate duplicates Z: 18 30.353 2.269 1.099 0.588 0.941 0.706 CB 1.509 18 residues pruned to eliminate duplicates Z: 9 10.909 1.985 0.587 0.510 0.875 0.500 CA 1.385 9 residues pruned to eliminate duplicates Z: 49 36.719 2.124 0.683 0.590 0.938 0.688 CB 1.451 49 residues pruned to eliminate duplicates Z: 25 26.936 2.171 0.900 0.561 0.917 0.625 CB 1.371 25 residues pruned to eliminate duplicates Z: 18 24.633 2.146 0.798 0.645 0.941 0.529 CB 1.437 18 residues pruned to eliminate duplicates Z: 15 18.808 2.014 0.873 0.530 0.929 0.714 CB 1.394 15 residues pruned to eliminate duplicates 787 residues left after pruning, divided into chains as follows: A: 30 B: 104 C: 221 D: 9 E: 20 F: 56 G: 19 H: 245 I: 83 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 43.51 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.543, Connect. = 0.792 for dens.mod. cycle 1 = 0.300, Contrast = 0.623, Connect. = 0.813 for dens.mod. cycle 2 = 0.300, Contrast = 0.765, Connect. = 0.833 for dens.mod. cycle 3 = 0.300, Contrast = 0.783, Connect. = 0.835 for dens.mod. cycle 4 = 0.300, Contrast = 0.802, Connect. = 0.836 for dens.mod. cycle 5 = 0.300, Contrast = 0.809, Connect. = 0.837 for dens.mod. cycle 6 = 0.300, Contrast = 0.816, Connect. = 0.838 for dens.mod. cycle 7 = 0.300, Contrast = 0.818, Connect. = 0.839 for dens.mod. cycle 8 = 0.300, Contrast = 0.821, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.822, Connect. = 0.840 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 3968 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 962 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 14 25.128 2.263 0.652 0.821 1.000 0.769 CB 1.412 B: 18 41.878 2.254 0.990 0.893 0.941 0.824 CB 1.728 C: 14 25.690 2.269 0.541 0.911 1.000 0.769 CB 1.445 14 residues pruned to eliminate duplicates D: 24 52.666 2.403 1.071 0.951 0.957 0.739 CB 1.590 E: 108 64.574 2.283 0.802 0.602 0.925 0.561 CB 1.488 F: 24 50.865 2.396 1.093 0.939 0.957 0.870 CB 1.536 24 residues pruned to eliminate duplicates G: 16 26.651 2.261 0.655 0.587 0.933 0.800 CB 1.814 H: 30 64.326 2.378 1.036 0.926 1.000 0.793 CB 1.730 I: 14 27.619 2.402 0.593 0.866 0.846 0.769 CB 1.732 J: 19 41.082 2.243 1.067 0.877 0.889 0.778 CB 1.707 18 residues pruned to eliminate duplicates K: 16 39.329 2.345 0.810 0.934 1.000 0.867 CB 1.667 L: 14 29.404 2.386 0.715 0.895 0.846 0.769 CB 1.689 M: 17 48.375 2.324 1.012 0.916 1.000 0.812 CA 1.827 N: 32 55.462 2.352 0.913 0.916 0.935 0.613 CB 1.672 32 residues pruned to eliminate duplicates O: 25 51.048 2.352 1.005 0.920 0.958 0.708 CB 1.624 24 residues pruned to eliminate duplicates P: 29 27.776 2.334 0.683 0.408 0.929 0.643 CB 1.584 Q: 16 47.437 2.421 0.890 0.919 1.000 0.867 CA 1.887 16 residues pruned to eliminate duplicates R: 16 44.795 2.381 0.893 0.941 1.000 0.867 CB 1.781 16 residues pruned to eliminate duplicates S: 14 45.670 2.499 0.935 0.909 1.000 0.769 CB 1.860 14 residues pruned to eliminate duplicates T: 25 56.850 2.357 1.207 0.920 0.958 0.667 CB 1.640 25 residues pruned to eliminate duplicates U: 16 41.237 2.459 0.613 0.919 1.000 0.933 CA 1.892 16 residues pruned to eliminate duplicates V: 31 65.015 2.384 1.009 0.920 0.967 0.800 CB 1.805 31 residues pruned to eliminate duplicates W: 24 42.055 2.282 0.840 0.835 0.957 0.826 CB 1.635 X: 11 20.289 2.246 0.391 0.789 0.900 0.800 CB 1.769 Y: 6 18.071 2.434 0.905 0.645 1.000 0.800 CB 1.522 Z: 14 26.176 2.265 0.720 0.905 1.000 0.923 CB 1.326 14 residues pruned to eliminate duplicates Z: 23 46.442 2.382 0.776 0.851 0.955 0.773 CA 1.815 24 residues pruned to eliminate duplicates Z: 18 37.930 2.353 0.638 0.883 1.000 0.824 CB 1.726 19 residues pruned to eliminate duplicates Z: 23 47.959 2.395 0.940 0.836 0.909 0.727 CA 1.812 23 residues pruned to eliminate duplicates Z: 24 53.202 2.413 1.145 0.943 0.957 0.522 CB 1.552 24 residues pruned to eliminate duplicates Z: 16 34.705 2.332 0.521 0.925 1.000 1.000 CA 1.773 16 residues pruned to eliminate duplicates Z: 16 33.889 2.313 0.831 0.858 0.933 0.800 CB 1.630 14 residues pruned to eliminate duplicates Z: 32 58.150 2.351 0.842 0.874 0.968 0.774 CB 1.813 32 residues pruned to eliminate duplicates Z: 31 48.561 2.266 0.575 0.892 1.000 0.833 CB 1.785 Z: 52 54.096 2.387 0.811 0.517 0.961 0.784 CB 1.795 43 residues pruned to eliminate duplicates Z: 24 44.403 2.386 0.738 0.938 0.957 0.913 CB 1.624 24 residues pruned to eliminate duplicates Z: 17 30.612 2.220 0.934 0.840 0.875 0.750 CB 1.520 17 residues pruned to eliminate duplicates Z: 15 31.740 2.291 0.528 0.913 1.000 0.857 CB 1.715 11 residues pruned to eliminate duplicates Z: 15 42.861 2.508 0.864 0.922 1.000 0.857 CB 1.723 15 residues pruned to eliminate duplicates Z: 24 52.987 2.412 1.101 0.948 0.957 0.739 CB 1.574 24 residues pruned to eliminate duplicates Z: 32 58.413 2.346 0.886 0.889 0.968 0.774 CB 1.764 32 residues pruned to eliminate duplicates Z: 31 46.646 2.259 0.643 0.867 0.967 0.800 CB 1.736 32 residues pruned to eliminate duplicates Z: 91 90.276 2.408 0.973 0.718 0.944 0.722 CB 1.741 78 residues pruned to eliminate duplicates Z: 12 39.215 2.384 1.187 0.940 1.000 1.000 CB 1.575 Z: 31 65.104 2.358 1.178 0.932 0.933 0.667 CB 1.732 31 residues pruned to eliminate duplicates Z: 15 48.446 2.480 1.116 0.931 1.000 0.786 CB 1.724 15 residues pruned to eliminate duplicates Z: 17 42.462 2.445 0.941 0.910 0.938 0.875 CB 1.692 17 residues pruned to eliminate duplicates Z: 30 59.597 2.327 0.834 0.896 1.000 0.759 CB 1.857 32 residues pruned to eliminate duplicates Z: 32 67.866 2.318 1.246 0.910 0.935 0.677 CB 1.775 31 residues pruned to eliminate duplicates Z: 15 28.577 2.191 0.326 0.934 1.000 0.929 CA 1.833 15 residues pruned to eliminate duplicates Z: 17 43.020 2.342 0.695 0.936 1.000 0.938 CA 1.885 17 residues pruned to eliminate duplicates Z: 15 50.023 2.475 1.025 0.926 1.000 0.786 CB 1.871 15 residues pruned to eliminate duplicates Z: 90 88.511 2.414 0.920 0.725 0.944 0.730 CB 1.752 90 residues pruned to eliminate duplicates Z: 12 25.826 2.518 0.436 0.898 0.818 0.636 CB 1.883 12 residues pruned to eliminate duplicates Z: 135 93.733 2.360 0.879 0.670 0.955 0.724 CB 1.634 89 residues pruned to eliminate duplicates Z: 14 33.243 2.364 0.739 0.871 1.000 0.692 CB 1.635 14 residues pruned to eliminate duplicates Z: 17 41.762 2.327 0.946 0.903 0.938 0.688 CB 1.753 17 residues pruned to eliminate duplicates Z: 25 53.950 2.348 1.196 0.916 0.958 0.625 CB 1.573 25 residues pruned to eliminate duplicates Z: 21 41.766 2.445 0.721 0.837 0.900 0.750 CA 1.844 21 residues pruned to eliminate duplicates Z: 30 68.285 2.402 1.046 0.921 1.000 0.655 CB 1.816 30 residues pruned to eliminate duplicates Z: 23 47.004 2.383 0.927 0.840 0.955 0.909 CB 1.705 22 residues pruned to eliminate duplicates Z: 17 35.330 2.392 0.787 0.923 0.938 0.812 CB 1.549 17 residues pruned to eliminate duplicates Z: 23 47.820 2.284 0.987 0.852 0.955 0.773 CB 1.741 17 residues pruned to eliminate duplicates Z: 17 41.190 2.339 0.760 0.907 1.000 0.938 CA 1.778 17 residues pruned to eliminate duplicates Z: 17 43.023 2.286 1.279 0.930 0.938 0.812 CB 1.540 17 residues pruned to eliminate duplicates Z: 27 42.802 2.418 1.037 0.643 0.885 0.577 CB 1.686 27 residues pruned to eliminate duplicates Z: 20 52.682 2.486 0.901 0.879 1.000 0.579 CB 1.854 20 residues pruned to eliminate duplicates Z: 25 54.658 2.371 1.113 0.922 0.958 0.583 CB 1.635 25 residues pruned to eliminate duplicates Z: 31 50.914 2.275 0.624 0.877 1.000 0.933 CB 1.826 31 residues pruned to eliminate duplicates Z: 49 34.858 2.267 0.628 0.528 0.875 0.646 CB 1.516 Z: 17 35.223 2.207 0.970 0.896 1.000 0.812 CB 1.451 Z: 16 50.922 2.443 1.033 0.918 1.000 0.800 CB 1.867 17 residues pruned to eliminate duplicates Z: 16 45.470 2.404 0.910 0.924 1.000 0.933 CB 1.795 16 residues pruned to eliminate duplicates Z: 40 34.484 2.215 0.640 0.594 0.974 0.769 CB 1.425 40 residues pruned to eliminate duplicates Z: 17 40.363 2.299 0.741 0.909 1.000 0.812 CA 1.789 17 residues pruned to eliminate duplicates Z: 22 38.117 2.161 0.806 0.889 1.000 0.857 CB 1.535 Z: 50 39.033 2.197 0.618 0.584 0.959 0.714 CB 1.509 46 residues pruned to eliminate duplicates Z: 23 42.096 2.391 0.695 0.819 0.955 0.682 CB 1.759 23 residues pruned to eliminate duplicates Z: 15 33.363 2.200 1.390 0.802 0.929 0.714 CB 1.403 14 residues pruned to eliminate duplicates Z: 17 40.710 2.276 0.965 0.885 1.000 0.812 CB 1.643 17 residues pruned to eliminate duplicates Z: 23 39.646 2.405 0.654 0.809 0.909 0.682 CB 1.786 23 residues pruned to eliminate duplicates Z: 15 40.981 2.447 0.709 0.905 1.000 0.857 CB 1.864 15 residues pruned to eliminate duplicates Z: 22 19.035 2.085 0.364 0.528 0.857 0.714 CB 1.657 22 residues pruned to eliminate duplicates Z: 31 40.913 2.384 0.961 0.638 0.933 0.667 CB 1.504 29 residues pruned to eliminate duplicates Z: 18 46.589 2.278 0.925 0.894 1.000 0.588 CB 1.848 19 residues pruned to eliminate duplicates Z: 21 26.992 2.121 0.441 0.867 0.950 0.850 CB 1.522 21 residues pruned to eliminate duplicates Z: 16 22.712 2.223 0.307 0.930 1.000 1.000 CB 1.411 16 residues pruned to eliminate duplicates Z: 13 28.477 2.476 0.505 0.874 0.917 0.583 CB 1.751 13 residues pruned to eliminate duplicates Z: 16 43.131 2.453 0.947 0.901 0.933 0.800 CB 1.783 16 residues pruned to eliminate duplicates Z: 17 31.996 2.264 0.559 0.873 1.000 0.812 CB 1.650 17 residues pruned to eliminate duplicates Z: 17 46.033 2.316 1.133 0.873 0.938 0.875 CB 1.811 17 residues pruned to eliminate duplicates Z: 27 42.484 2.224 0.760 0.871 0.962 0.885 CB 1.614 27 residues pruned to eliminate duplicates Z: 16 41.984 2.483 0.657 0.929 1.000 0.867 CB 1.843 16 residues pruned to eliminate duplicates Z: 15 53.639 2.524 1.073 0.927 1.000 0.929 CA 1.921 18 residues pruned to eliminate duplicates Z: 24 52.694 2.514 1.014 0.706 1.000 0.739 CB 1.799 24 residues pruned to eliminate duplicates Z: 15 34.306 2.477 0.736 0.892 0.929 0.643 CB 1.649 15 residues pruned to eliminate duplicates Z: 65 45.986 2.210 0.633 0.631 0.922 0.750 CB 1.528 65 residues pruned to eliminate duplicates Z: 83 46.766 2.155 0.803 0.588 0.866 0.585 CB 1.411 17 residues pruned to eliminate duplicates Z: 30 64.720 2.351 0.965 0.902 1.000 0.724 CB 1.856 30 residues pruned to eliminate duplicates Z: 49 51.573 2.381 0.912 0.544 0.938 0.688 CB 1.670 51 residues pruned to eliminate duplicates Z: 17 14.251 1.974 0.534 0.336 0.875 0.438 CB 1.608 17 residues pruned to eliminate duplicates Z: 17 41.289 2.289 0.888 0.920 1.000 0.938 CB 1.683 17 residues pruned to eliminate duplicates Z: 31 55.384 2.348 0.871 0.857 0.933 0.800 CA 1.817 31 residues pruned to eliminate duplicates Z: 22 35.326 2.009 0.880 0.812 0.952 0.667 CB 1.632 22 residues pruned to eliminate duplicates Z: 13 31.207 2.459 0.570 0.871 1.000 0.833 CB 1.702 13 residues pruned to eliminate duplicates Z: 16 40.857 2.515 0.573 0.933 1.000 1.000 CB 1.861 16 residues pruned to eliminate duplicates Z: 180 110.625 2.439 0.947 0.632 0.905 0.654 CB 1.698 137 residues pruned to eliminate duplicates Z: 20 42.150 2.428 0.770 0.871 0.947 0.789 CB 1.733 20 residues pruned to eliminate duplicates Z: 15 34.746 2.388 0.567 0.923 1.000 0.929 CB 1.744 15 residues pruned to eliminate duplicates Z: 15 25.302 2.261 0.507 0.802 0.929 0.643 CB 1.642 15 residues pruned to eliminate duplicates Z: 77 69.319 2.422 0.839 0.635 0.947 0.697 CB 1.661 77 residues pruned to eliminate duplicates Z: 30 55.069 2.319 0.798 0.895 0.966 0.828 CB 1.821 30 residues pruned to eliminate duplicates Z: 28 46.382 2.246 0.922 0.887 0.926 0.704 CB 1.610 28 residues pruned to eliminate duplicates Z: 137 90.080 2.351 0.859 0.662 0.941 0.691 CB 1.616 137 residues pruned to eliminate duplicates Z: 8 14.571 2.183 0.337 0.909 1.000 0.857 CB 1.340 8 residues pruned to eliminate duplicates Z: 23 54.412 2.362 1.061 0.849 1.000 0.773 CA 1.766 24 residues pruned to eliminate duplicates Z: 48 38.932 2.215 0.690 0.604 0.915 0.745 CB 1.502 48 residues pruned to eliminate duplicates Z: 24 42.287 2.128 0.948 0.901 1.000 0.870 CB 1.518 26 residues pruned to eliminate duplicates Z: 13 23.985 2.318 0.558 0.870 0.917 0.750 CB 1.526 13 residues pruned to eliminate duplicates Z: 22 35.291 2.182 0.943 0.858 0.857 0.810 CB 1.561 22 residues pruned to eliminate duplicates Z: 17 28.115 2.162 0.479 0.868 1.000 0.625 CB 1.606 17 residues pruned to eliminate duplicates Z: 8 21.796 2.295 0.576 0.883 1.000 0.857 CA 1.647 8 residues pruned to eliminate duplicates Z: 14 29.571 2.154 0.791 0.890 0.923 0.692 CB 1.657 13 residues pruned to eliminate duplicates Z: 16 43.631 2.238 0.986 0.935 1.000 0.667 CB 1.766 15 residues pruned to eliminate duplicates Z: 20 12.967 2.029 0.346 0.451 0.842 0.526 CB 1.360 7 residues pruned to eliminate duplicates Z: 14 34.359 2.282 1.005 0.914 1.000 0.769 CB 1.473 14 residues pruned to eliminate duplicates Z: 16 43.127 2.339 0.780 0.948 1.000 0.867 CB 1.847 16 residues pruned to eliminate duplicates Z: 18 27.588 2.162 0.538 0.812 0.941 0.765 CB 1.630 18 residues pruned to eliminate duplicates Z: 21 44.766 2.412 0.821 0.881 0.950 0.800 CB 1.738 21 residues pruned to eliminate duplicates Z: 14 16.330 2.225 0.687 0.507 0.846 0.615 CB 1.416 14 residues pruned to eliminate duplicates Z: 33 37.124 2.278 0.831 0.549 0.875 0.656 CB 1.713 33 residues pruned to eliminate duplicates Z: 17 30.815 2.224 0.660 0.854 1.000 0.938 CB 1.541 17 residues pruned to eliminate duplicates Z: 33 36.499 2.219 0.820 0.567 0.938 0.594 CB 1.598 33 residues pruned to eliminate duplicates Z: 31 50.309 2.275 0.601 0.897 1.000 0.867 CB 1.806 31 residues pruned to eliminate duplicates Z: 30 66.528 2.404 1.099 0.907 0.966 0.724 CB 1.802 30 residues pruned to eliminate duplicates Z: 17 21.495 2.167 0.650 0.562 0.938 0.625 CB 1.509 17 residues pruned to eliminate duplicates Z: 25 48.970 2.299 1.174 0.934 0.917 0.417 CB 1.521 25 residues pruned to eliminate duplicates Z: 32 66.282 2.358 1.091 0.922 0.968 0.742 CB 1.754 32 residues pruned to eliminate duplicates Z: 32 42.214 2.336 0.900 0.609 0.903 0.613 CB 1.705 31 residues pruned to eliminate duplicates Z: 43 39.496 2.270 0.839 0.555 0.881 0.595 CB 1.570 23 residues pruned to eliminate duplicates Z: 51 44.833 2.297 0.936 0.576 0.920 0.560 CB 1.441 51 residues pruned to eliminate duplicates Z: 14 22.146 1.948 0.960 0.859 0.923 0.462 CB 1.283 Z: 14 41.300 2.485 0.967 0.930 0.923 0.692 CB 1.775 14 residues pruned to eliminate duplicates Z: 24 28.700 2.411 0.618 0.436 1.000 0.609 CB 1.638 24 residues pruned to eliminate duplicates Z: 42 48.599 2.441 0.854 0.664 0.927 0.732 CB 1.554 44 residues pruned to eliminate duplicates Z: 6 12.109 2.151 0.898 0.821 1.000 0.600 CB 1.005 7 residues pruned to eliminate duplicates Z: 13 32.337 2.416 0.750 0.847 1.000 0.667 CB 1.640 13 residues pruned to eliminate duplicates Z: 32 54.269 2.309 0.718 0.920 1.000 0.903 CB 1.730 32 residues pruned to eliminate duplicates Z: 16 32.055 2.270 0.483 0.910 1.000 0.733 CA 1.745 16 residues pruned to eliminate duplicates Z: 31 53.744 2.275 0.756 0.868 1.000 0.833 CB 1.796 31 residues pruned to eliminate duplicates Z: 14 20.317 2.234 0.586 0.867 0.923 0.769 CB 1.260 14 residues pruned to eliminate duplicates Z: 15 32.374 2.268 0.632 0.915 1.000 0.786 CB 1.652 15 residues pruned to eliminate duplicates Z: 30 64.839 2.336 1.180 0.920 0.966 0.552 CB 1.724 30 residues pruned to eliminate duplicates Z: 6 17.048 2.152 0.807 0.849 1.000 0.600 CA 1.453 6 residues pruned to eliminate duplicates Z: 32 48.862 2.346 1.100 0.698 1.000 0.645 CB 1.487 32 residues pruned to eliminate duplicates Z: 19 36.056 2.261 0.619 0.870 0.944 0.778 CB 1.795 19 residues pruned to eliminate duplicates Z: 84 87.221 2.475 0.961 0.716 0.916 0.687 CB 1.772 84 residues pruned to eliminate duplicates Z: 23 43.395 2.148 1.122 0.888 0.955 0.682 CB 1.532 24 residues pruned to eliminate duplicates Z: 92 60.888 2.333 0.833 0.577 0.934 0.615 CB 1.483 92 residues pruned to eliminate duplicates Z: 23 47.107 2.348 1.008 0.819 0.955 0.682 CB 1.691 23 residues pruned to eliminate duplicates Z: 14 27.614 2.350 0.903 0.565 0.923 0.615 CA 1.743 14 residues pruned to eliminate duplicates Z: 29 57.056 2.389 0.887 0.916 1.000 0.857 CB 1.690 29 residues pruned to eliminate duplicates Z: 16 29.570 2.294 0.641 0.923 0.933 0.800 CB 1.527 16 residues pruned to eliminate duplicates Z: 30 52.123 2.329 0.685 0.888 0.966 0.828 CB 1.840 30 residues pruned to eliminate duplicates Z: 35 34.256 2.214 0.834 0.575 0.882 0.588 CB 1.525 32 residues pruned to eliminate duplicates Z: 23 33.552 2.113 0.712 0.921 0.955 0.818 CB 1.457 22 residues pruned to eliminate duplicates Z: 16 27.396 2.212 0.728 0.920 1.000 0.933 CB 1.304 16 residues pruned to eliminate duplicates Z: 31 50.174 2.273 0.604 0.885 1.000 0.833 CB 1.814 31 residues pruned to eliminate duplicates Z: 17 31.261 2.387 0.879 0.785 0.938 0.688 CB 1.447 17 residues pruned to eliminate duplicates Z: 23 29.554 2.103 0.565 0.911 0.955 0.864 CB 1.421 23 residues pruned to eliminate duplicates Z: 22 36.441 2.135 0.858 0.806 0.952 0.857 CB 1.612 22 residues pruned to eliminate duplicates Z: 15 41.946 2.494 0.811 0.928 1.000 0.929 CB 1.738 15 residues pruned to eliminate duplicates Z: 16 41.896 2.363 0.853 0.913 1.000 0.800 CB 1.748 16 residues pruned to eliminate duplicates Z: 54 34.923 2.179 0.736 0.514 0.887 0.698 CB 1.410 54 residues pruned to eliminate duplicates Z: 30 53.186 2.311 0.721 0.885 1.000 0.690 CB 1.793 30 residues pruned to eliminate duplicates Z: 14 38.004 2.476 0.650 0.897 1.000 0.923 CA 1.848 14 residues pruned to eliminate duplicates Z: 16 26.319 1.951 0.895 0.879 0.933 0.600 CB 1.428 16 residues pruned to eliminate duplicates Z: 23 35.102 2.362 0.544 0.829 0.864 0.727 CB 1.788 23 residues pruned to eliminate duplicates Z: 30 47.089 2.411 0.994 0.766 0.897 0.621 CB 1.602 30 residues pruned to eliminate duplicates Z: 37 39.451 2.302 0.596 0.646 1.000 0.750 CB 1.561 37 residues pruned to eliminate duplicates Z: 23 46.009 2.279 0.914 0.863 0.909 0.682 CA 1.814 23 residues pruned to eliminate duplicates Z: 6 12.010 2.207 0.532 0.730 0.800 0.400 CA 1.615 6 residues pruned to eliminate duplicates Z: 136 105.997 2.464 1.047 0.649 0.941 0.659 CB 1.672 136 residues pruned to eliminate duplicates Z: 48 37.379 2.209 0.796 0.608 0.957 0.553 CB 1.295 48 residues pruned to eliminate duplicates Z: 90 88.252 2.463 0.990 0.703 0.955 0.708 CB 1.661 90 residues pruned to eliminate duplicates Z: 14 34.112 2.313 0.583 0.932 1.000 0.769 CB 1.804 14 residues pruned to eliminate duplicates Z: 33 37.191 2.276 0.951 0.605 0.875 0.656 CB 1.532 33 residues pruned to eliminate duplicates Z: 6 13.824 2.119 0.253 0.838 1.000 1.000 CB 1.740 6 residues pruned to eliminate duplicates Z: 18 49.619 2.324 1.162 0.918 0.941 0.647 CB 1.795 18 residues pruned to eliminate duplicates Z: 15 39.287 2.424 0.955 0.937 0.929 0.714 CB 1.661 15 residues pruned to eliminate duplicates Z: 31 62.972 2.356 0.923 0.898 1.000 0.833 CB 1.815 31 residues pruned to eliminate duplicates Z: 27 38.692 2.144 0.877 0.783 0.923 0.692 CB 1.592 27 residues pruned to eliminate duplicates Z: 22 49.359 2.385 0.869 0.841 1.000 0.714 CA 1.802 22 residues pruned to eliminate duplicates Z: 49 37.816 2.262 0.625 0.525 0.938 0.688 CB 1.545 49 residues pruned to eliminate duplicates Z: 31 58.187 2.302 0.807 0.908 1.000 0.800 CB 1.814 31 residues pruned to eliminate duplicates Z: 75 68.184 2.453 0.825 0.624 0.919 0.716 CB 1.715 75 residues pruned to eliminate duplicates Z: 15 27.615 2.281 0.728 0.922 0.929 0.786 CB 1.418 15 residues pruned to eliminate duplicates Z: 26 40.567 2.225 0.850 0.840 0.880 0.600 CB 1.671 26 residues pruned to eliminate duplicates Z: 13 37.249 2.374 0.925 0.893 1.000 0.917 CB 1.689 14 residues pruned to eliminate duplicates Z: 17 28.398 2.135 0.595 0.911 1.000 0.750 CB 1.478 17 residues pruned to eliminate duplicates Z: 24 41.052 2.371 0.466 0.916 1.000 0.913 CB 1.739 24 residues pruned to eliminate duplicates Z: 30 65.303 2.343 1.015 0.913 1.000 0.655 CB 1.817 30 residues pruned to eliminate duplicates Z: 22 38.967 2.503 0.630 0.843 0.905 0.667 CB 1.715 22 residues pruned to eliminate duplicates Z: 6 10.668 2.097 0.545 0.679 0.800 0.800 CA 1.560 6 residues pruned to eliminate duplicates Z: 29 57.036 2.369 0.870 0.931 1.000 0.893 CB 1.700 29 residues pruned to eliminate duplicates Z: 23 39.723 2.167 0.952 0.892 1.000 0.591 CB 1.438 23 residues pruned to eliminate duplicates Z: 23 50.619 2.415 0.855 0.861 0.955 0.773 CA 1.854 23 residues pruned to eliminate duplicates Z: 13 28.501 2.174 0.849 0.886 0.917 0.750 CA 1.611 13 residues pruned to eliminate duplicates Z: 26 48.825 2.245 1.244 0.924 0.960 0.440 CB 1.419 26 residues pruned to eliminate duplicates Z: 14 19.996 2.213 0.540 0.824 0.923 0.615 CB 1.333 14 residues pruned to eliminate duplicates Z: 22 38.189 2.143 0.945 0.913 0.952 0.810 CB 1.486 22 residues pruned to eliminate duplicates Z: 14 21.921 2.050 0.602 0.845 0.923 0.846 CB 1.491 14 residues pruned to eliminate duplicates Z: 30 57.295 2.331 0.779 0.881 1.000 0.828 CB 1.858 30 residues pruned to eliminate duplicates Z: 14 18.628 1.931 0.947 0.834 0.846 0.692 CB 1.217 Z: 44 41.530 2.235 1.006 0.546 0.930 0.558 CB 1.452 38 residues pruned to eliminate duplicates Z: 12 28.626 2.207 0.714 0.894 1.000 0.727 CB 1.637 14 residues pruned to eliminate duplicates Z: 6 12.051 1.998 0.337 0.876 1.000 0.600 CB 1.466 6 residues pruned to eliminate duplicates Z: 31 65.792 2.363 1.064 0.922 1.000 0.733 CB 1.731 31 residues pruned to eliminate duplicates Z: 98 73.363 2.327 0.764 0.648 0.928 0.680 CB 1.704 98 residues pruned to eliminate duplicates Z: 11 20.858 2.248 0.588 0.679 1.000 0.800 CB 1.567 11 residues pruned to eliminate duplicates Z: 11 24.892 2.320 0.771 0.880 0.900 0.800 CB 1.542 11 residues pruned to eliminate duplicates Z: 23 56.704 2.403 1.098 0.841 0.955 0.773 CA 1.874 23 residues pruned to eliminate duplicates Z: 6 5.289 1.651 0.669 0.386 0.800 0.400 CB 1.210 6 residues pruned to eliminate duplicates Z: 17 37.225 2.314 0.599 0.935 1.000 1.000 CB 1.753 17 residues pruned to eliminate duplicates Z: 7 10.152 2.044 0.283 0.736 1.000 0.667 CA 1.279 7 residues pruned to eliminate duplicates Z: 12 16.186 2.223 0.327 0.702 0.909 0.818 CB 1.514 12 residues pruned to eliminate duplicates Z: 24 37.779 2.108 1.192 0.893 0.913 0.522 CB 1.340 24 residues pruned to eliminate duplicates Z: 52 65.498 2.436 0.852 0.690 0.961 0.569 CB 1.778 69 residues pruned to eliminate duplicates Z: 8 14.818 1.803 0.812 0.868 1.000 1.000 CA 1.254 8 residues pruned to eliminate duplicates Z: 15 33.508 2.304 0.928 0.937 1.000 0.786 CB 1.403 15 residues pruned to eliminate duplicates Z: 15 19.951 2.181 0.367 0.839 0.929 0.786 CB 1.439 15 residues pruned to eliminate duplicates Z: 30 49.317 2.344 0.731 0.866 0.966 0.690 CB 1.712 30 residues pruned to eliminate duplicates Z: 16 28.000 2.234 0.680 0.935 1.000 0.867 CB 1.342 16 residues pruned to eliminate duplicates Z: 13 20.188 2.254 0.618 0.553 1.000 0.750 CB 1.518 13 residues pruned to eliminate duplicates Z: 17 36.673 2.343 0.673 0.869 0.938 0.812 CA 1.822 17 residues pruned to eliminate duplicates Z: 23 37.760 2.147 0.943 0.905 0.955 0.773 CB 1.439 23 residues pruned to eliminate duplicates Z: 25 39.529 2.329 0.548 0.898 0.958 0.833 CB 1.671 25 residues pruned to eliminate duplicates Z: 25 26.308 2.241 0.758 0.418 1.000 0.708 CB 1.484 25 residues pruned to eliminate duplicates Z: 50 44.845 2.419 0.751 0.527 0.898 0.694 CB 1.640 50 residues pruned to eliminate duplicates Z: 18 33.571 2.297 0.613 0.844 0.941 0.882 CB 1.738 18 residues pruned to eliminate duplicates Z: 22 33.124 2.161 0.608 0.907 0.952 0.762 CB 1.553 22 residues pruned to eliminate duplicates Z: 16 43.778 2.366 0.921 0.928 1.000 0.733 CB 1.741 16 residues pruned to eliminate duplicates Z: 10 19.822 2.276 0.170 0.921 1.000 1.000 CB 1.744 10 residues pruned to eliminate duplicates Z: 36 55.110 2.544 0.744 0.641 0.971 0.629 CA 1.893 36 residues pruned to eliminate duplicates Z: 14 21.488 2.294 0.429 0.637 1.000 0.846 CB 1.599 14 residues pruned to eliminate duplicates Z: 16 26.161 2.182 0.505 0.923 1.000 0.933 CB 1.445 16 residues pruned to eliminate duplicates Z: 34 60.840 2.520 0.979 0.662 0.970 0.727 CB 1.886 34 residues pruned to eliminate duplicates Z: 20 43.098 2.492 0.697 0.889 0.895 0.842 CB 1.881 20 residues pruned to eliminate duplicates Z: 14 34.910 2.278 1.150 0.926 1.000 0.692 CB 1.387 14 residues pruned to eliminate duplicates Z: 13 24.610 2.450 0.341 0.852 0.917 0.833 CB 1.744 13 residues pruned to eliminate duplicates Z: 18 22.303 2.017 0.427 0.839 1.000 0.824 CB 1.403 18 residues pruned to eliminate duplicates Z: 15 20.067 1.896 0.485 0.936 1.000 0.929 CB 1.326 Z: 29 50.868 2.268 0.697 0.903 1.000 0.857 CA 1.780 29 residues pruned to eliminate duplicates Z: 47 51.602 2.399 0.844 0.558 0.978 0.630 CB 1.662 47 residues pruned to eliminate duplicates Z: 18 38.937 2.239 1.036 0.861 0.941 0.353 CB 1.618 18 residues pruned to eliminate duplicates Z: 36 56.092 2.515 0.984 0.641 0.914 0.657 CB 1.821 36 residues pruned to eliminate duplicates Z: 26 31.944 2.196 0.923 0.604 0.960 0.560 CB 1.428 16 residues pruned to eliminate duplicates Z: 28 50.491 2.241 0.702 0.944 1.000 0.815 CB 1.764 28 residues pruned to eliminate duplicates Z: 14 22.542 1.998 0.799 0.871 0.923 0.615 CB 1.375 14 residues pruned to eliminate duplicates Z: 24 54.185 2.408 1.237 0.946 0.957 0.783 CB 1.516 25 residues pruned to eliminate duplicates Z: 6 5.348 1.810 0.217 0.578 0.800 0.400 CB 1.259 Z: 16 35.552 2.234 1.080 0.927 1.000 0.867 CB 1.384 16 residues pruned to eliminate duplicates Z: 8 10.233 1.950 0.303 0.788 1.000 0.714 CB 1.182 8 residues pruned to eliminate duplicates Z: 6 9.897 1.869 0.248 0.820 1.000 0.800 CB 1.437 6 residues pruned to eliminate duplicates Z: 27 27.934 2.218 0.798 0.612 0.846 0.654 CB 1.459 27 residues pruned to eliminate duplicates Z: 18 40.821 2.304 0.806 0.926 0.941 0.882 CB 1.772 18 residues pruned to eliminate duplicates Z: 12 25.660 2.115 0.898 0.866 0.909 0.636 CB 1.553 12 residues pruned to eliminate duplicates Z: 10 29.466 2.399 0.821 0.912 1.000 0.889 CB 1.592 12 residues pruned to eliminate duplicates Z: 16 39.948 2.362 0.889 0.919 0.933 0.667 CB 1.745 16 residues pruned to eliminate duplicates Z: 32 58.207 2.242 0.921 0.898 1.000 0.484 CB 1.737 32 residues pruned to eliminate duplicates Z: 10 23.408 2.354 0.569 0.908 1.000 0.889 CB 1.500 10 residues pruned to eliminate duplicates Z: 17 41.207 2.291 0.861 0.912 1.000 0.812 CB 1.712 17 residues pruned to eliminate duplicates Z: 12 20.030 2.183 0.514 0.913 1.000 0.727 CB 1.294 12 residues pruned to eliminate duplicates Z: 37 35.421 2.250 0.553 0.632 1.000 0.667 CB 1.493 37 residues pruned to eliminate duplicates Z: 36 39.411 2.306 0.822 0.644 0.943 0.686 CB 1.470 36 residues pruned to eliminate duplicates Z: 51 47.697 2.384 0.801 0.531 0.920 0.640 CB 1.657 51 residues pruned to eliminate duplicates Z: 17 26.839 2.131 0.770 0.849 0.875 0.625 CB 1.507 17 residues pruned to eliminate duplicates Z: 24 45.171 2.318 0.952 0.824 0.913 0.565 CB 1.722 24 residues pruned to eliminate duplicates Z: 16 25.225 2.223 0.537 0.931 0.933 0.867 CB 1.427 16 residues pruned to eliminate duplicates Z: 86 90.715 2.461 1.044 0.723 0.941 0.753 CB 1.699 86 residues pruned to eliminate duplicates Z: 12 29.543 2.223 0.721 0.899 1.000 0.818 CB 1.665 12 residues pruned to eliminate duplicates Z: 13 36.565 2.330 1.058 0.864 1.000 0.583 CB 1.613 13 residues pruned to eliminate duplicates Z: 101 93.319 2.446 1.038 0.687 0.940 0.650 CB 1.677 101 residues pruned to eliminate duplicates Z: 10 14.050 1.944 0.137 0.771 1.000 0.444 CB 1.666 10 residues pruned to eliminate duplicates Z: 6 12.294 2.026 1.079 0.756 0.800 0.600 CB 1.299 6 residues pruned to eliminate duplicates Z: 6 12.614 1.929 0.389 0.849 1.000 1.000 CA 1.560 Z: 27 57.329 2.344 1.095 0.904 0.923 0.731 CB 1.767 27 residues pruned to eliminate duplicates Z: 6 14.219 2.291 0.375 0.866 1.000 0.800 CB 1.477 6 residues pruned to eliminate duplicates Z: 18 37.801 2.071 1.050 0.903 0.941 0.765 CB 1.636 18 residues pruned to eliminate duplicates Z: 6 12.482 2.187 0.457 0.758 1.000 0.800 CB 1.393 6 residues pruned to eliminate duplicates Z: 24 12.127 2.043 0.322 0.439 0.913 0.565 CB 1.092 30 residues pruned to eliminate duplicates Z: 14 32.650 2.381 0.621 0.903 1.000 0.846 CB 1.673 14 residues pruned to eliminate duplicates Z: 178 107.998 2.455 0.854 0.639 0.910 0.650 CB 1.722 178 residues pruned to eliminate duplicates Z: 17 37.746 2.330 0.683 0.900 1.000 0.750 CB 1.718 17 residues pruned to eliminate duplicates Z: 17 45.041 2.384 1.009 0.911 0.938 0.875 CB 1.777 17 residues pruned to eliminate duplicates Z: 34 51.435 2.499 0.770 0.650 0.939 0.636 CB 1.873 34 residues pruned to eliminate duplicates Z: 16 44.446 2.369 1.150 0.905 0.933 0.733 CB 1.718 16 residues pruned to eliminate duplicates Z: 92 88.815 2.391 0.967 0.711 0.945 0.681 CB 1.730 92 residues pruned to eliminate duplicates Z: 76 64.365 2.397 0.823 0.628 0.933 0.653 CB 1.616 75 residues pruned to eliminate duplicates Z: 33 38.253 2.230 0.974 0.620 0.906 0.406 CB 1.514 33 residues pruned to eliminate duplicates Z: 40 39.860 2.291 0.901 0.510 0.821 0.590 CB 1.768 40 residues pruned to eliminate duplicates Z: 13 24.011 2.020 0.596 0.888 1.000 0.583 CB 1.548 13 residues pruned to eliminate duplicates Z: 16 43.864 2.367 1.109 0.916 1.000 0.733 CB 1.601 16 residues pruned to eliminate duplicates Z: 13 19.929 2.265 0.280 0.844 0.917 0.750 CB 1.610 13 residues pruned to eliminate duplicates Z: 177 105.819 2.459 0.872 0.626 0.909 0.676 CB 1.692 177 residues pruned to eliminate duplicates Z: 90 92.429 2.398 0.937 0.731 0.978 0.764 CB 1.752 90 residues pruned to eliminate duplicates Z: 31 54.533 2.270 0.881 0.886 0.967 0.733 CB 1.741 31 residues pruned to eliminate duplicates Z: 7 10.421 1.643 0.504 0.823 1.000 0.667 O 1.302 7 residues pruned to eliminate duplicates Z: 91 87.295 2.393 0.855 0.727 0.956 0.711 CB 1.768 91 residues pruned to eliminate duplicates Z: 7 14.394 1.914 0.693 0.771 1.000 0.667 CB 1.427 7 residues pruned to eliminate duplicates Z: 12 18.915 2.289 0.222 0.873 0.909 0.909 CB 1.633 12 residues pruned to eliminate duplicates Z: 24 35.021 2.094 0.900 0.879 0.957 0.739 CB 1.392 24 residues pruned to eliminate duplicates Z: 12 15.897 2.215 0.449 0.662 0.909 0.818 CB 1.415 12 residues pruned to eliminate duplicates Z: 29 34.216 2.240 0.687 0.692 0.964 0.750 CB 1.489 29 residues pruned to eliminate duplicates Z: 24 35.585 2.117 0.750 0.909 1.000 0.652 CB 1.422 24 residues pruned to eliminate duplicates Z: 6 10.763 2.093 0.362 0.871 1.000 0.600 CB 1.232 6 residues pruned to eliminate duplicates Z: 6 8.863 2.312 0.285 0.573 0.800 0.800 CB 1.554 Z: 13 24.406 2.044 0.920 0.858 1.000 0.583 CB 1.323 12 residues pruned to eliminate duplicates Z: 15 36.279 2.277 0.832 0.927 1.000 0.929 CB 1.629 15 residues pruned to eliminate duplicates Z: 22 42.866 2.166 1.221 0.911 0.952 0.762 CB 1.447 23 residues pruned to eliminate duplicates Z: 73 54.646 2.235 0.707 0.655 0.972 0.708 CB 1.503 72 residues pruned to eliminate duplicates Z: 30 26.266 1.975 0.597 0.650 0.966 0.690 CB 1.392 29 residues pruned to eliminate duplicates Z: 11 25.558 2.269 0.719 0.842 1.000 0.700 CB 1.544 11 residues pruned to eliminate duplicates Z: 16 43.248 2.373 0.853 0.911 1.000 0.933 CA 1.800 16 residues pruned to eliminate duplicates Z: 31 53.663 2.246 0.709 0.908 1.000 0.933 CB 1.812 31 residues pruned to eliminate duplicates Z: 15 23.435 1.871 0.657 0.907 1.000 0.929 CB 1.436 15 residues pruned to eliminate duplicates Z: 23 41.316 2.165 0.965 0.929 1.000 0.591 CB 1.449 23 residues pruned to eliminate duplicates Z: 64 56.808 2.329 0.874 0.615 0.905 0.683 CB 1.625 55 residues pruned to eliminate duplicates Z: 14 23.362 1.963 0.570 0.939 1.000 0.846 CB 1.461 14 residues pruned to eliminate duplicates Z: 9 13.143 2.035 0.480 0.851 0.750 0.750 CB 1.522 9 residues pruned to eliminate duplicates Z: 15 21.399 1.925 0.434 0.939 1.000 0.857 CB 1.439 15 residues pruned to eliminate duplicates Z: 51 51.790 2.413 0.842 0.540 0.920 0.700 CB 1.722 51 residues pruned to eliminate duplicates Z: 72 44.126 2.182 0.769 0.565 0.915 0.521 CB 1.392 72 residues pruned to eliminate duplicates Z: 13 18.660 2.342 0.529 0.437 0.917 0.667 CA 1.750 13 residues pruned to eliminate duplicates Z: 8 12.755 1.946 0.331 0.831 1.000 0.714 N 1.398 8 residues pruned to eliminate duplicates Z: 14 16.221 2.208 0.232 0.851 0.846 0.769 CB 1.447 14 residues pruned to eliminate duplicates Z: 29 57.543 2.354 0.741 0.938 1.000 0.821 CB 1.845 29 residues pruned to eliminate duplicates Z: 31 65.634 2.378 1.182 0.929 0.933 0.567 CB 1.732 31 residues pruned to eliminate duplicates Z: 25 16.643 2.148 0.451 0.490 0.917 0.583 CB 1.201 25 residues pruned to eliminate duplicates Z: 30 58.323 2.304 1.057 0.894 0.931 0.586 CB 1.761 30 residues pruned to eliminate duplicates Z: 32 61.851 2.348 0.908 0.916 0.968 0.935 CB 1.809 32 residues pruned to eliminate duplicates Z: 9 9.864 2.022 0.585 0.679 0.750 0.625 CB 1.231 9 residues pruned to eliminate duplicates Z: 65 34.808 2.125 0.559 0.482 0.953 0.594 CB 1.403 65 residues pruned to eliminate duplicates Z: 27 28.270 2.224 0.685 0.616 0.923 0.577 CB 1.436 25 residues pruned to eliminate duplicates Z: 10 14.840 2.163 0.255 0.626 1.000 0.556 CB 1.618 10 residues pruned to eliminate duplicates Z: 32 50.188 2.218 0.712 0.883 0.968 0.871 CB 1.774 32 residues pruned to eliminate duplicates Z: 40 37.405 2.206 0.960 0.585 0.949 0.538 CB 1.347 40 residues pruned to eliminate duplicates Z: 28 66.126 2.333 1.184 0.925 0.963 0.667 CB 1.821 28 residues pruned to eliminate duplicates Z: 6 9.114 2.188 0.055 0.837 1.000 0.800 CB 1.321 6 residues pruned to eliminate duplicates Z: 26 48.136 2.269 1.274 0.872 0.960 0.440 CB 1.416 26 residues pruned to eliminate duplicates Z: 152 94.983 2.450 0.886 0.597 0.907 0.682 CB 1.680 152 residues pruned to eliminate duplicates Z: 20 24.098 2.178 0.673 0.673 0.895 0.579 CB 1.446 18 residues pruned to eliminate duplicates Z: 23 57.968 2.473 1.265 0.931 0.955 0.818 CB 1.615 23 residues pruned to eliminate duplicates Z: 19 23.739 2.125 0.770 0.678 0.944 0.611 CB 1.337 16 residues pruned to eliminate duplicates Z: 14 17.925 2.181 0.393 0.849 0.923 0.692 CB 1.314 14 residues pruned to eliminate duplicates Z: 55 48.139 2.378 0.710 0.566 0.907 0.759 CB 1.665 55 residues pruned to eliminate duplicates Z: 35 62.376 2.528 0.994 0.691 0.971 0.559 CB 1.835 35 residues pruned to eliminate duplicates Z: 6 11.646 2.049 0.361 0.774 1.000 0.600 CA 1.466 6 residues pruned to eliminate duplicates Z: 20 43.938 2.411 0.857 0.816 0.947 0.684 CB 1.806 20 residues pruned to eliminate duplicates Z: 50 45.905 2.284 0.911 0.594 0.959 0.694 CB 1.431 50 residues pruned to eliminate duplicates Z: 163 117.550 2.462 1.011 0.665 0.944 0.667 CB 1.696 163 residues pruned to eliminate duplicates Z: 40 27.270 1.951 0.559 0.582 0.949 0.718 CB 1.399 31 residues pruned to eliminate duplicates Z: 17 40.880 2.321 0.797 0.908 1.000 0.812 CB 1.740 17 residues pruned to eliminate duplicates Z: 11 15.113 1.947 0.681 0.581 0.900 0.700 CB 1.501 11 residues pruned to eliminate duplicates Z: 12 12.209 1.949 0.236 0.708 0.909 0.545 CB 1.391 12 residues pruned to eliminate duplicates Z: 30 57.850 2.390 0.906 0.881 0.931 0.690 CB 1.834 30 residues pruned to eliminate duplicates Z: 13 13.507 1.926 0.406 0.726 0.917 0.750 CB 1.281 13 residues pruned to eliminate duplicates Z: 14 37.667 2.464 0.726 0.913 0.923 0.923 CB 1.883 14 residues pruned to eliminate duplicates Z: 14 23.439 1.939 0.768 0.931 1.000 0.615 CB 1.324 14 residues pruned to eliminate duplicates Z: 30 53.063 2.277 0.914 0.892 0.931 0.414 CB 1.744 30 residues pruned to eliminate duplicates Z: 30 50.386 2.267 0.855 0.919 0.966 0.724 CB 1.624 30 residues pruned to eliminate duplicates Z: 14 17.867 2.078 0.366 0.826 1.000 0.462 CB 1.317 14 residues pruned to eliminate duplicates Z: 29 49.586 2.346 1.054 0.723 1.000 0.750 CB 1.589 29 residues pruned to eliminate duplicates Z: 16 18.743 2.224 0.244 0.931 0.933 0.867 CB 1.309 16 residues pruned to eliminate duplicates Z: 22 43.596 2.462 0.622 0.851 0.952 0.762 CA 1.851 22 residues pruned to eliminate duplicates Z: 10 6.946 1.916 0.435 0.426 0.667 0.444 CB 1.363 10 residues pruned to eliminate duplicates Z: 17 38.615 2.234 0.817 0.921 1.000 0.812 CA 1.674 17 residues pruned to eliminate duplicates Z: 35 20.694 2.095 0.502 0.524 0.882 0.529 CB 1.248 35 residues pruned to eliminate duplicates Z: 17 39.254 2.263 1.042 0.893 0.938 0.375 CB 1.627 17 residues pruned to eliminate duplicates Z: 29 51.558 2.374 0.750 0.923 0.964 0.821 CB 1.709 29 residues pruned to eliminate duplicates Z: 10 12.467 2.087 0.370 0.634 0.889 0.556 CB 1.441 10 residues pruned to eliminate duplicates Z: 86 91.773 2.467 1.090 0.713 0.929 0.671 CB 1.712 86 residues pruned to eliminate duplicates Z: 32 21.905 1.926 0.652 0.590 0.903 0.581 CB 1.256 15 residues pruned to eliminate duplicates Z: 6 8.781 2.116 0.304 0.658 0.800 0.600 CA 1.536 6 residues pruned to eliminate duplicates Z: 16 33.058 2.185 0.710 0.924 0.933 0.867 CB 1.720 16 residues pruned to eliminate duplicates Z: 8 11.433 2.387 0.436 0.402 0.714 0.571 CA 1.957 8 residues pruned to eliminate duplicates Z: 6 8.684 1.803 0.879 0.689 1.000 0.600 CB 0.964 Z: 26 22.538 1.906 0.901 0.699 0.880 0.640 CB 1.178 26 residues pruned to eliminate duplicates Z: 19 16.852 2.207 0.463 0.435 0.833 0.500 CB 1.578 19 residues pruned to eliminate duplicates Z: 15 15.847 2.231 0.948 0.452 0.786 0.571 CB 1.304 15 residues pruned to eliminate duplicates Z: 14 15.773 1.822 0.557 0.852 0.846 0.615 CB 1.347 14 residues pruned to eliminate duplicates Z: 132 69.635 2.259 0.760 0.587 0.931 0.618 CB 1.512 133 residues pruned to eliminate duplicates Z: 12 33.706 2.343 0.813 0.892 1.000 0.909 CB 1.718 12 residues pruned to eliminate duplicates Z: 9 9.353 1.500 1.309 0.767 0.875 0.625 CB 0.861 9 residues pruned to eliminate duplicates Z: 8 10.209 1.847 0.197 0.811 1.000 0.714 CA 1.332 8 residues pruned to eliminate duplicates Z: 14 27.117 2.170 0.786 0.894 1.000 0.846 CB 1.392 14 residues pruned to eliminate duplicates Z: 85 78.414 2.382 0.939 0.700 0.929 0.714 CB 1.663 85 residues pruned to eliminate duplicates Z: 14 26.094 2.348 0.456 0.875 0.923 0.846 CA 1.668 14 residues pruned to eliminate duplicates Z: 8 3.170 1.750 -0.094 0.416 1.000 0.714 CB 0.825 Z: 14 24.294 1.979 0.825 0.926 1.000 0.538 CB 1.308 14 residues pruned to eliminate duplicates Z: 11 19.645 2.424 0.678 0.596 1.000 0.800 CB 1.394 11 residues pruned to eliminate duplicates Z: 15 31.716 2.345 0.912 0.928 0.929 0.786 CB 1.426 15 residues pruned to eliminate duplicates Z: 15 18.615 1.858 0.574 0.943 1.000 0.929 CB 1.179 15 residues pruned to eliminate duplicates Z: 7 8.734 1.720 0.311 0.759 1.000 0.667 CA 1.256 7 residues pruned to eliminate duplicates Z: 13 24.644 2.246 0.553 0.867 0.917 0.667 CB 1.628 13 residues pruned to eliminate duplicates Z: 31 25.070 2.271 0.537 0.394 0.867 0.567 CB 1.691 31 residues pruned to eliminate duplicates Z: 48 50.477 2.386 0.951 0.569 0.915 0.617 CB 1.617 48 residues pruned to eliminate duplicates Z: 22 37.250 2.164 1.155 0.912 0.905 0.571 CB 1.365 22 residues pruned to eliminate duplicates Z: 45 39.006 2.226 0.856 0.600 0.955 0.727 CB 1.356 45 residues pruned to eliminate duplicates Z: 31 50.277 2.274 0.580 0.903 1.000 0.767 CB 1.820 31 residues pruned to eliminate duplicates Z: 16 30.728 2.218 1.003 0.855 0.867 0.667 CB 1.521 16 residues pruned to eliminate duplicates Z: 9 15.710 2.096 0.990 0.686 0.875 0.625 CA 1.283 9 residues pruned to eliminate duplicates Z: 28 58.391 2.328 0.862 0.927 1.000 0.852 CA 1.817 28 residues pruned to eliminate duplicates Z: 14 13.263 2.068 0.645 0.492 1.000 0.692 CB 1.091 14 residues pruned to eliminate duplicates Z: 25 52.535 2.332 1.241 0.899 0.958 0.500 CB 1.531 26 residues pruned to eliminate duplicates Z: 17 22.118 2.165 0.529 0.709 0.938 0.625 CB 1.475 17 residues pruned to eliminate duplicates Z: 38 48.318 2.304 1.096 0.669 0.946 0.622 CB 1.487 38 residues pruned to eliminate duplicates Z: 11 11.867 1.999 0.094 0.692 1.000 0.900 CB 1.440 11 residues pruned to eliminate duplicates Z: 7 13.323 1.908 0.699 0.858 1.000 0.833 CB 1.235 7 residues pruned to eliminate duplicates Z: 13 21.884 2.163 0.615 0.876 0.917 0.583 CB 1.434 13 residues pruned to eliminate duplicates Z: 18 16.783 2.003 0.558 0.592 0.882 0.647 CB 1.354 18 residues pruned to eliminate duplicates Z: 6 2.364 1.538 0.085 0.298 0.800 0.400 O 0.992 6 residues pruned to eliminate duplicates Z: 15 44.505 2.397 0.847 0.918 1.000 1.000 CA 1.895 15 residues pruned to eliminate duplicates Z: 14 13.620 1.972 0.806 0.435 0.846 0.538 CB 1.341 9 residues pruned to eliminate duplicates Z: 7 9.088 1.751 0.384 0.665 1.000 0.667 CB 1.314 7 residues pruned to eliminate duplicates Z: 49 35.521 2.249 0.649 0.501 0.938 0.646 CB 1.473 49 residues pruned to eliminate duplicates Z: 36 34.908 2.237 0.756 0.535 0.886 0.429 CB 1.638 36 residues pruned to eliminate duplicates Z: 6 10.694 1.775 0.857 0.754 1.000 0.800 CB 1.157 6 residues pruned to eliminate duplicates Z: 113 67.355 2.285 0.756 0.590 0.929 0.545 CB 1.567 116 residues pruned to eliminate duplicates Z: 25 21.100 2.197 0.585 0.375 0.917 0.667 CB 1.541 25 residues pruned to eliminate duplicates Z: 19 25.346 2.264 0.442 0.622 1.000 0.611 CB 1.631 20 residues pruned to eliminate duplicates Z: 16 32.712 2.287 0.819 0.808 0.867 0.667 CB 1.792 16 residues pruned to eliminate duplicates Z: 9 21.707 2.369 0.725 0.545 1.000 0.750 CB 1.798 9 residues pruned to eliminate duplicates Z: 16 41.480 2.213 1.059 0.940 1.000 0.467 CB 1.633 16 residues pruned to eliminate duplicates Z: 17 32.753 2.232 0.935 0.870 0.938 0.562 CB 1.477 17 residues pruned to eliminate duplicates Z: 26 27.304 2.217 0.480 0.645 0.960 0.680 CB 1.513 29 residues pruned to eliminate duplicates Z: 15 23.758 1.917 0.680 0.933 1.000 0.857 CB 1.376 15 residues pruned to eliminate duplicates Z: 15 24.875 2.235 0.617 0.876 0.857 0.714 CB 1.559 15 residues pruned to eliminate duplicates Z: 6 12.754 2.038 0.409 0.766 1.000 0.600 CA 1.569 6 residues pruned to eliminate duplicates Z: 15 35.450 2.337 1.016 0.928 0.929 0.857 CB 1.516 15 residues pruned to eliminate duplicates Z: 13 21.364 1.962 0.597 0.943 1.000 0.917 CB 1.364 13 residues pruned to eliminate duplicates Z: 16 34.259 2.297 0.921 0.918 0.933 0.800 CB 1.515 16 residues pruned to eliminate duplicates Z: 16 23.382 2.240 0.506 0.869 0.867 0.733 CB 1.508 16 residues pruned to eliminate duplicates Z: 8 14.731 1.905 0.971 0.844 0.857 0.571 CB 1.287 8 residues pruned to eliminate duplicates Z: 7 5.778 1.570 1.211 0.672 0.833 0.833 CB 0.696 Z: 38 24.345 1.973 0.665 0.563 0.946 0.541 CB 1.212 36 residues pruned to eliminate duplicates Z: 17 16.889 1.983 0.223 0.845 0.938 0.875 CB 1.381 17 residues pruned to eliminate duplicates Z: 46 49.903 2.469 0.995 0.613 0.889 0.644 CB 1.527 46 residues pruned to eliminate duplicates Z: 72 85.020 2.403 0.960 0.765 0.958 0.761 CB 1.769 72 residues pruned to eliminate duplicates Z: 6 3.427 1.603 0.002 0.655 1.000 1.000 CB 0.826 Z: 12 10.722 1.971 0.050 0.667 1.000 0.636 CB 1.338 12 residues pruned to eliminate duplicates Z: 28 26.964 2.175 0.710 0.595 0.852 0.704 CB 1.495 28 residues pruned to eliminate duplicates Z: 7 6.924 2.042 0.185 0.661 0.833 0.833 CB 1.208 7 residues pruned to eliminate duplicates Z: 15 28.299 1.917 1.096 0.926 1.000 0.571 CB 1.319 15 residues pruned to eliminate duplicates Z: 15 22.064 1.940 0.522 0.935 1.000 0.929 CB 1.391 15 residues pruned to eliminate duplicates Z: 7 6.940 1.522 0.393 0.602 1.000 0.500 CA 1.213 7 residues pruned to eliminate duplicates Z: 125 95.299 2.401 0.897 0.685 0.927 0.661 CB 1.709 266 residues pruned to eliminate duplicates Z: 44 30.511 2.177 0.872 0.459 0.860 0.581 CB 1.383 31 residues pruned to eliminate duplicates Z: 15 26.228 2.241 0.707 0.900 0.929 0.857 CB 1.409 15 residues pruned to eliminate duplicates Z: 13 25.476 2.289 0.626 0.881 0.917 0.750 CB 1.561 13 residues pruned to eliminate duplicates Z: 6 3.933 1.614 -0.062 0.716 0.800 0.600 CB 1.195 6 residues pruned to eliminate duplicates Z: 88 78.476 2.351 0.888 0.708 0.943 0.678 CB 1.665 Z: 8 17.161 2.306 0.447 0.724 0.857 0.571 CA 1.852 8 residues pruned to eliminate duplicates Z: 14 23.779 1.905 0.758 0.918 1.000 0.769 CB 1.388 14 residues pruned to eliminate duplicates Z: 15 34.148 2.352 0.930 0.921 0.929 0.857 CB 1.524 15 residues pruned to eliminate duplicates Z: 9 7.076 1.757 0.310 0.556 0.875 0.500 CB 1.176 Z: 7 6.849 1.881 0.130 0.660 0.833 0.500 CA 1.361 7 residues pruned to eliminate duplicates Z: 21 20.873 2.107 0.427 0.559 1.000 0.700 CB 1.465 21 residues pruned to eliminate duplicates Z: 34 52.908 2.485 0.808 0.664 0.939 0.545 CB 1.874 34 residues pruned to eliminate duplicates Z: 56 81.245 2.444 1.010 0.780 0.982 0.727 CB 1.774 56 residues pruned to eliminate duplicates Z: 7 8.474 1.856 0.189 0.889 0.833 0.833 CB 1.355 Z: 29 20.891 2.090 0.628 0.343 0.893 0.607 CB 1.542 29 residues pruned to eliminate duplicates Z: 30 28.242 2.003 0.843 0.654 0.897 0.655 CB 1.373 30 residues pruned to eliminate duplicates Z: 15 22.643 2.291 0.249 0.852 0.929 0.571 CB 1.685 15 residues pruned to eliminate duplicates Z: 14 14.412 1.928 0.696 0.450 0.923 0.615 CB 1.394 14 residues pruned to eliminate duplicates Z: 22 32.159 2.353 0.863 0.792 0.762 0.524 CB 1.626 22 residues pruned to eliminate duplicates Z: 15 24.784 1.956 0.796 0.939 1.000 0.857 CB 1.311 15 residues pruned to eliminate duplicates Z: 9 11.458 2.008 0.920 0.334 0.750 0.625 O 1.679 9 residues pruned to eliminate duplicates Z: 9 6.106 1.676 0.545 0.288 1.000 0.625 CB 1.059 9 residues pruned to eliminate duplicates Z: 15 22.252 1.915 0.598 0.926 1.000 0.786 CB 1.363 15 residues pruned to eliminate duplicates Z: 26 22.769 2.264 0.564 0.421 0.920 0.680 CB 1.519 26 residues pruned to eliminate duplicates Z: 7 4.639 1.771 0.831 0.399 0.667 0.500 N 0.974 7 residues pruned to eliminate duplicates Z: 12 9.805 2.014 0.183 0.738 0.909 0.727 CB 1.102 Z: 15 22.092 1.934 0.614 0.931 1.000 0.929 CB 1.322 15 residues pruned to eliminate duplicates Z: 13 14.205 1.886 0.573 0.394 1.000 0.500 N 1.546 13 residues pruned to eliminate duplicates Z: 13 25.430 1.992 0.772 0.948 1.000 0.833 CB 1.436 13 residues pruned to eliminate duplicates Z: 30 46.216 2.302 0.599 0.890 0.931 0.724 CB 1.802 30 residues pruned to eliminate duplicates Z: 18 22.327 2.307 0.349 0.628 0.941 0.647 CB 1.640 18 residues pruned to eliminate duplicates Z: 15 24.259 1.955 1.001 0.890 0.929 0.643 CB 1.284 15 residues pruned to eliminate duplicates Z: 28 37.150 2.287 0.944 0.682 0.852 0.741 CB 1.597 28 residues pruned to eliminate duplicates Z: 11 14.739 1.987 0.703 0.601 0.900 0.700 CB 1.390 11 residues pruned to eliminate duplicates Z: 138 90.367 2.324 0.916 0.659 0.949 0.715 CB 1.577 100 residues pruned to eliminate duplicates Z: 10 10.260 1.870 0.919 0.361 0.778 0.667 CB 1.424 10 residues pruned to eliminate duplicates Z: 24 33.656 2.433 0.610 0.747 0.913 0.783 CB 1.573 24 residues pruned to eliminate duplicates Z: 38 40.378 2.258 0.935 0.622 0.973 0.568 CB 1.391 39 residues pruned to eliminate duplicates Z: 7 9.982 2.036 0.600 0.462 0.833 0.667 CA 1.561 Z: 7 12.668 1.869 0.670 0.802 1.000 0.833 CB 1.272 7 residues pruned to eliminate duplicates Z: 7 7.783 1.813 0.121 0.850 1.000 0.667 CB 1.158 7 residues pruned to eliminate duplicates Z: 6 8.865 2.072 0.631 0.811 1.000 1.000 CB 0.895 5 residues pruned to eliminate duplicates Z: 25 22.548 2.270 0.545 0.375 0.958 0.583 CB 1.565 25 residues pruned to eliminate duplicates Z: 27 35.704 2.089 0.741 0.850 1.000 0.692 CB 1.426 27 residues pruned to eliminate duplicates Z: 11 15.569 2.270 0.629 0.512 0.900 0.800 CB 1.462 11 residues pruned to eliminate duplicates Z: 30 64.670 2.395 1.219 0.906 0.897 0.621 CB 1.793 30 residues pruned to eliminate duplicates Z: 27 22.445 1.944 0.651 0.682 0.923 0.577 CB 1.257 27 residues pruned to eliminate duplicates Z: 29 54.152 2.348 0.779 0.939 1.000 0.857 CB 1.703 29 residues pruned to eliminate duplicates Z: 39 36.001 2.148 0.820 0.625 0.895 0.658 CB 1.485 39 residues pruned to eliminate duplicates Z: 55 35.534 2.092 0.626 0.590 0.926 0.611 CB 1.409 55 residues pruned to eliminate duplicates Z: 13 12.392 1.934 0.501 0.475 1.000 0.583 CB 1.264 13 residues pruned to eliminate duplicates Z: 9 9.265 1.881 0.286 0.634 1.000 0.750 CB 1.195 9 residues pruned to eliminate duplicates Z: 23 40.001 2.107 1.087 0.862 0.909 0.636 CB 1.567 24 residues pruned to eliminate duplicates Z: 24 18.681 1.840 0.936 0.712 0.870 0.304 CB 1.038 24 residues pruned to eliminate duplicates Z: 33 49.279 2.276 0.764 0.832 0.906 0.750 CB 1.797 33 residues pruned to eliminate duplicates Z: 33 38.135 2.256 0.868 0.641 0.906 0.406 CB 1.547 33 residues pruned to eliminate duplicates Z: 14 16.639 2.098 0.470 0.790 0.923 0.462 CB 1.257 14 residues pruned to eliminate duplicates Z: 31 49.005 2.238 0.705 0.888 0.967 0.733 CB 1.748 31 residues pruned to eliminate duplicates Z: 6 3.156 1.545 0.257 0.429 0.800 0.800 O 0.979 6 residues pruned to eliminate duplicates Z: 15 25.934 1.926 0.639 0.912 1.000 1.000 CB 1.555 15 residues pruned to eliminate duplicates Z: 14 24.339 1.913 0.892 0.918 1.000 0.769 CB 1.315 14 residues pruned to eliminate duplicates Z: 6 4.459 1.849 -0.312 0.804 1.000 0.600 CB 1.202 6 residues pruned to eliminate duplicates Z: 6 5.172 1.693 0.195 0.736 0.800 0.600 CA 1.157 6 residues pruned to eliminate duplicates Z: 10 11.752 2.050 0.730 0.494 0.889 0.556 CB 1.250 10 residues pruned to eliminate duplicates Z: 16 18.726 1.838 0.465 0.868 0.933 0.867 CB 1.406 16 residues pruned to eliminate duplicates Z: 91 95.278 2.475 1.107 0.676 0.967 0.700 CB 1.694 91 residues pruned to eliminate duplicates Z: 62 35.773 2.183 0.703 0.541 0.902 0.672 CB 1.313 57 residues pruned to eliminate duplicates Z: 7 9.153 2.266 0.375 0.484 1.000 0.833 CB 1.219 7 residues pruned to eliminate duplicates Z: 14 11.936 2.044 0.442 0.564 0.769 0.692 CB 1.372 14 residues pruned to eliminate duplicates Z: 30 62.497 2.248 1.110 0.951 1.000 0.517 CB 1.686 31 residues pruned to eliminate duplicates Z: 8 20.040 2.285 0.611 0.738 1.000 0.714 CA 1.663 8 residues pruned to eliminate duplicates Z: 80 41.869 2.098 0.716 0.551 0.911 0.696 CB 1.366 80 residues pruned to eliminate duplicates Z: 12 17.953 2.267 0.539 0.438 1.000 0.818 CB 1.655 12 residues pruned to eliminate duplicates Z: 97 50.794 2.130 0.671 0.579 0.958 0.667 CB 1.408 100 residues pruned to eliminate duplicates Z: 14 26.517 1.983 0.861 0.932 1.000 0.923 CB 1.392 14 residues pruned to eliminate duplicates Z: 49 37.536 2.238 0.714 0.583 0.917 0.646 CB 1.423 49 residues pruned to eliminate duplicates Z: 20 33.355 2.349 0.732 0.744 0.947 0.737 CB 1.596 20 residues pruned to eliminate duplicates Z: 16 26.186 2.157 1.112 0.927 0.933 0.400 CB 1.114 16 residues pruned to eliminate duplicates Z: 10 11.944 1.927 0.488 0.695 0.889 0.667 CB 1.307 10 residues pruned to eliminate duplicates Z: 13 16.073 2.065 0.502 0.580 1.000 0.667 CB 1.384 13 residues pruned to eliminate duplicates Z: 19 39.640 2.171 0.951 0.848 1.000 0.556 CB 1.637 19 residues pruned to eliminate duplicates Z: 15 23.783 2.257 0.862 0.680 0.857 0.643 CB 1.495 15 residues pruned to eliminate duplicates Z: 12 10.728 2.019 0.317 0.697 1.000 0.818 CB 1.016 12 residues pruned to eliminate duplicates Z: 32 37.279 2.313 0.749 0.634 0.903 0.677 CB 1.615 32 residues pruned to eliminate duplicates Z: 27 23.992 2.171 0.588 0.451 0.962 0.692 CB 1.493 27 residues pruned to eliminate duplicates Z: 8 4.191 1.635 -0.041 0.437 0.857 0.429 N 1.258 5 residues pruned to eliminate duplicates Z: 14 17.529 2.317 0.447 0.482 1.000 0.692 CB 1.477 14 residues pruned to eliminate duplicates Z: 24 33.029 2.305 0.739 0.645 0.913 0.609 CB 1.643 24 residues pruned to eliminate duplicates Z: 6 10.760 1.943 0.416 0.835 1.000 0.800 CB 1.310 6 residues pruned to eliminate duplicates Z: 13 22.502 2.076 0.675 0.830 0.917 0.583 CA 1.532 13 residues pruned to eliminate duplicates Z: 6 8.002 1.976 -0.018 0.766 1.000 1.000 CB 1.457 6 residues pruned to eliminate duplicates Z: 9 4.653 1.712 0.050 0.323 0.875 0.375 CB 1.270 Z: 8 4.080 1.732 0.038 0.396 1.000 0.429 CB 0.957 8 residues pruned to eliminate duplicates Z: 17 17.664 2.229 0.525 0.533 0.875 0.688 CB 1.438 17 residues pruned to eliminate duplicates Z: 30 50.941 2.287 0.686 0.893 1.000 0.828 CB 1.762 30 residues pruned to eliminate duplicates Z: 70 42.812 2.182 0.557 0.618 0.986 0.681 CB 1.378 71 residues pruned to eliminate duplicates Z: 25 26.492 2.102 0.794 0.626 0.917 0.625 CB 1.390 25 residues pruned to eliminate duplicates Z: 9 6.431 1.747 0.507 0.370 0.750 0.500 O 1.323 9 residues pruned to eliminate duplicates Z: 13 20.269 1.972 0.591 0.917 1.000 0.667 CB 1.316 13 residues pruned to eliminate duplicates Z: 6 4.010 1.891 0.250 0.410 0.600 0.400 CB 1.390 6 residues pruned to eliminate duplicates Z: 8 6.799 1.848 0.440 0.511 0.714 0.571 C 1.338 8 residues pruned to eliminate duplicates Z: 39 29.911 2.033 0.634 0.619 0.974 0.632 CB 1.340 39 residues pruned to eliminate duplicates Z: 33 35.032 2.394 0.671 0.626 0.875 0.719 CB 1.571 33 residues pruned to eliminate duplicates Z: 30 74.609 2.400 1.248 0.936 1.000 0.690 CB 1.788 30 residues pruned to eliminate duplicates Z: 15 44.359 2.200 1.229 0.940 1.000 0.500 CB 1.679 15 residues pruned to eliminate duplicates Z: 13 12.087 1.939 0.644 0.495 0.917 0.500 CB 1.200 13 residues pruned to eliminate duplicates Z: 15 23.445 1.849 0.757 0.937 1.000 0.857 CB 1.343 15 residues pruned to eliminate duplicates Z: 32 20.809 1.918 0.556 0.625 0.871 0.645 CB 1.278 32 residues pruned to eliminate duplicates Z: 7 11.621 1.900 0.778 0.791 0.833 0.833 CA 1.306 7 residues pruned to eliminate duplicates Z: 29 33.592 2.289 0.684 0.673 0.964 0.643 CB 1.456 29 residues pruned to eliminate duplicates Z: 9 10.370 1.763 0.215 0.888 1.000 0.875 CB 1.234 7 residues pruned to eliminate duplicates Z: 11 5.496 2.075 0.420 0.396 0.600 0.500 CB 1.097 8 residues pruned to eliminate duplicates Z: 7 7.894 1.694 0.988 0.511 0.833 0.667 CA 1.136 7 residues pruned to eliminate duplicates Z: 15 30.938 2.215 0.700 0.882 1.000 0.857 CB 1.589 15 residues pruned to eliminate duplicates Z: 32 53.428 2.285 0.831 0.891 0.968 0.645 CB 1.704 32 residues pruned to eliminate duplicates Z: 15 36.429 2.176 1.118 0.864 1.000 0.286 CB 1.549 15 residues pruned to eliminate duplicates Z: 15 10.337 2.011 0.380 0.567 0.857 0.643 CB 1.089 15 residues pruned to eliminate duplicates Z: 12 6.936 1.812 0.577 0.410 0.818 0.636 CB 0.983 10 residues pruned to eliminate duplicates Z: 29 58.539 2.319 0.973 0.921 0.964 0.679 CB 1.764 29 residues pruned to eliminate duplicates Z: 15 45.300 2.299 1.208 0.895 1.000 0.571 CB 1.710 15 residues pruned to eliminate duplicates Z: 87 62.795 2.395 0.817 0.529 0.919 0.640 CB 1.646 87 residues pruned to eliminate duplicates Z: 131 92.681 2.435 0.908 0.625 0.931 0.654 CB 1.671 131 residues pruned to eliminate duplicates Z: 14 18.516 2.101 0.900 0.618 0.846 0.615 CB 1.359 14 residues pruned to eliminate duplicates Z: 129 92.253 2.449 0.929 0.632 0.906 0.586 CB 1.683 129 residues pruned to eliminate duplicates Z: 25 28.111 2.149 0.556 0.685 1.000 0.708 CB 1.449 25 residues pruned to eliminate duplicates Z: 14 31.441 2.080 1.349 0.883 0.923 0.462 CB 1.399 14 residues pruned to eliminate duplicates Z: 13 9.262 1.520 0.410 0.873 1.000 0.667 CB 0.908 12 residues pruned to eliminate duplicates Z: 15 6.904 1.331 0.495 0.815 0.857 0.714 CB 0.823 14 residues pruned to eliminate duplicates Z: 23 45.138 2.501 0.930 0.720 1.000 0.636 CB 1.634 23 residues pruned to eliminate duplicates Z: 76 68.784 2.412 0.854 0.620 0.947 0.680 CB 1.675 76 residues pruned to eliminate duplicates Z: 23 35.328 2.210 0.716 0.746 0.955 0.636 CB 1.670 23 residues pruned to eliminate duplicates Z: 135 98.678 2.420 0.910 0.643 0.925 0.672 CB 1.744 135 residues pruned to eliminate duplicates Z: 31 16.331 1.738 0.565 0.614 0.933 0.500 CB 1.054 31 residues pruned to eliminate duplicates Z: 27 28.849 2.302 0.730 0.526 0.923 0.654 CB 1.500 27 residues pruned to eliminate duplicates Z: 6 4.696 1.475 0.499 0.672 0.800 0.600 CA 1.013 6 residues pruned to eliminate duplicates Z: 10 12.378 2.047 0.672 0.428 0.778 0.556 CA 1.670 10 residues pruned to eliminate duplicates Z: 47 24.849 1.951 0.720 0.520 0.870 0.522 CB 1.231 47 residues pruned to eliminate duplicates Z: 7 8.894 1.676 0.470 0.589 1.000 0.667 CA 1.354 7 residues pruned to eliminate duplicates Z: 30 51.337 2.323 0.679 0.883 0.966 0.793 CB 1.831 30 residues pruned to eliminate duplicates Z: 26 32.542 2.127 0.824 0.608 1.000 0.560 CB 1.514 26 residues pruned to eliminate duplicates Z: 10 17.297 2.164 0.469 0.860 1.000 0.889 CB 1.333 10 residues pruned to eliminate duplicates Z: 28 29.313 2.403 0.621 0.423 0.926 0.741 CB 1.696 28 residues pruned to eliminate duplicates Z: 49 45.103 2.298 0.945 0.589 0.958 0.604 CB 1.396 49 residues pruned to eliminate duplicates Z: 44 34.965 2.142 0.804 0.564 0.837 0.581 CB 1.549 44 residues pruned to eliminate duplicates Z: 11 9.989 1.607 0.368 0.859 1.000 0.900 CB 1.057 9 residues pruned to eliminate duplicates Z: 15 36.979 2.279 1.143 0.854 0.929 0.571 CB 1.610 15 residues pruned to eliminate duplicates Z: 20 13.020 1.878 0.418 0.430 0.947 0.632 CB 1.273 15 residues pruned to eliminate duplicates Z: 20 21.354 2.095 0.490 0.620 0.947 0.789 CB 1.479 20 residues pruned to eliminate duplicates Z: 15 20.039 1.862 0.685 0.895 0.929 0.571 CB 1.318 15 residues pruned to eliminate duplicates Z: 16 28.271 2.434 0.698 0.638 1.000 0.933 CB 1.553 16 residues pruned to eliminate duplicates Z: 13 21.636 1.920 0.776 0.918 1.000 0.750 CB 1.292 13 residues pruned to eliminate duplicates Z: 16 26.762 2.243 0.915 0.855 0.933 0.733 CB 1.273 16 residues pruned to eliminate duplicates Z: 8 10.169 1.899 0.739 0.812 0.857 0.714 CB 1.035 8 residues pruned to eliminate duplicates Z: 16 20.629 1.857 0.459 0.918 1.000 0.867 CB 1.387 16 residues pruned to eliminate duplicates Z: 6 3.386 1.648 0.043 0.669 1.000 0.800 CB 0.753 7 residues pruned to eliminate duplicates Z: 21 16.826 2.173 0.429 0.464 0.900 0.600 CB 1.396 21 residues pruned to eliminate duplicates Z: 11 5.272 1.978 0.249 0.246 0.900 0.400 CB 1.004 11 residues pruned to eliminate duplicates Z: 6 7.010 1.545 0.556 0.687 1.000 0.600 CA 1.098 Z: 20 21.623 2.133 0.475 0.558 0.947 0.632 CB 1.572 20 residues pruned to eliminate duplicates Z: 30 71.296 2.383 1.221 0.898 1.000 0.655 CB 1.788 30 residues pruned to eliminate duplicates Z: 16 21.885 2.184 0.282 0.924 1.000 0.933 CB 1.416 16 residues pruned to eliminate duplicates Z: 15 24.229 1.904 0.880 0.925 1.000 0.357 CB 1.270 15 residues pruned to eliminate duplicates Z: 8 3.319 1.410 0.433 0.365 0.714 0.429 N 1.005 Z: 72 65.820 2.359 0.869 0.649 0.901 0.592 CB 1.710 72 residues pruned to eliminate duplicates Z: 53 67.787 2.481 1.094 0.669 0.942 0.635 CB 1.642 53 residues pruned to eliminate duplicates Z: 7 3.626 1.627 0.114 0.505 1.000 0.500 CB 0.812 Z: 28 41.622 2.308 0.950 0.702 1.000 0.704 CB 1.481 28 residues pruned to eliminate duplicates Z: 12 7.484 1.498 0.247 0.874 1.000 0.545 CB 0.879 12 residues pruned to eliminate duplicates Z: 15 25.438 1.953 0.826 0.935 1.000 0.714 CB 1.329 15 residues pruned to eliminate duplicates Z: 17 13.716 1.842 0.688 0.402 0.938 0.438 CB 1.304 17 residues pruned to eliminate duplicates Z: 8 12.540 1.877 0.580 0.774 1.000 1.000 CB 1.254 Z: 31 25.755 1.944 0.648 0.640 0.933 0.633 CB 1.380 31 residues pruned to eliminate duplicates Z: 17 33.331 2.341 0.915 0.812 0.938 0.812 CB 1.512 17 residues pruned to eliminate duplicates Z: 39 37.059 2.275 0.667 0.612 0.921 0.711 CB 1.548 39 residues pruned to eliminate duplicates Z: 32 44.316 2.416 1.220 0.640 0.839 0.710 CB 1.552 32 residues pruned to eliminate duplicates Z: 6 10.922 2.160 0.345 0.691 1.000 0.800 CA 1.412 6 residues pruned to eliminate duplicates Z: 12 11.970 1.887 0.387 0.698 1.000 0.545 CB 1.151 12 residues pruned to eliminate duplicates Z: 17 10.354 1.864 0.556 0.298 0.750 0.438 CB 1.492 17 residues pruned to eliminate duplicates Z: 26 45.985 2.539 0.780 0.663 0.960 0.600 CB 1.822 26 residues pruned to eliminate duplicates Z: 21 30.404 2.084 0.806 0.697 0.950 0.800 CB 1.588 19 residues pruned to eliminate duplicates Z: 23 43.344 2.462 0.573 0.880 0.955 0.818 CA 1.811 23 residues pruned to eliminate duplicates Z: 11 5.340 1.440 0.047 0.914 1.000 0.900 CB 0.792 11 residues pruned to eliminate duplicates Z: 26 22.604 2.009 0.561 0.607 0.960 0.760 CB 1.357 26 residues pruned to eliminate duplicates Z: 33 38.097 2.259 0.774 0.623 0.906 0.656 CB 1.651 33 residues pruned to eliminate duplicates Z: 15 29.546 2.234 0.604 0.877 1.000 0.500 CB 1.599 15 residues pruned to eliminate duplicates Z: 14 8.099 1.524 0.461 0.591 0.923 0.462 CB 1.001 14 residues pruned to eliminate duplicates Z: 12 10.402 2.032 0.232 0.705 0.909 0.636 CB 1.144 12 residues pruned to eliminate duplicates Z: 15 12.904 2.000 0.653 0.371 0.929 0.571 CB 1.290 15 residues pruned to eliminate duplicates Z: 17 42.515 2.273 0.929 0.905 1.000 0.875 CA 1.725 17 residues pruned to eliminate duplicates Z: 32 16.596 2.028 0.492 0.395 0.839 0.613 CB 1.312 32 residues pruned to eliminate duplicates Z: 21 27.147 2.231 0.551 0.644 0.900 0.700 CB 1.704 21 residues pruned to eliminate duplicates Z: 14 16.781 1.950 0.226 0.931 1.000 1.000 CB 1.360 14 residues pruned to eliminate duplicates Z: 17 14.033 1.884 0.729 0.348 0.875 0.500 CB 1.450 17 residues pruned to eliminate duplicates Z: 15 38.550 2.402 0.889 0.882 1.000 0.714 CB 1.644 15 residues pruned to eliminate duplicates Z: 6 4.122 1.790 0.161 0.838 0.800 0.600 CB 0.828 6 residues pruned to eliminate duplicates Z: 27 28.290 2.248 0.716 0.491 0.962 0.692 CB 1.508 27 residues pruned to eliminate duplicates Z: 6 4.750 1.494 0.460 0.658 0.800 0.600 CB 1.052 6 residues pruned to eliminate duplicates Z: 6 2.757 1.537 0.239 0.507 0.800 0.800 CB 0.804 6 residues pruned to eliminate duplicates Z: 39 48.125 2.279 0.975 0.639 0.974 0.684 CB 1.564 39 residues pruned to eliminate duplicates Z: 38 58.636 2.268 0.986 0.781 0.946 0.730 CB 1.767 38 residues pruned to eliminate duplicates Z: 6 4.697 1.680 0.675 0.638 0.800 0.800 CB 0.820 Z: 30 36.698 2.167 1.188 0.574 0.931 0.517 CB 1.437 30 residues pruned to eliminate duplicates Z: 15 28.926 2.033 1.065 0.932 1.000 0.786 CB 1.286 15 residues pruned to eliminate duplicates Z: 62 63.834 2.217 0.919 0.722 0.934 0.525 CB 1.682 71 residues pruned to eliminate duplicates Z: 32 40.392 2.312 0.826 0.621 0.935 0.613 CB 1.639 32 residues pruned to eliminate duplicates Z: 30 40.313 2.282 0.777 0.611 1.000 0.552 CB 1.663 30 residues pruned to eliminate duplicates Z: 12 23.026 2.124 0.519 0.888 1.000 0.727 CA 1.551 12 residues pruned to eliminate duplicates Z: 9 6.670 1.549 0.406 0.469 0.875 0.375 CA 1.277 9 residues pruned to eliminate duplicates Z: 8 7.487 1.786 0.624 0.867 0.857 0.571 CB 0.833 8 residues pruned to eliminate duplicates Z: 31 61.885 2.292 1.254 0.877 0.933 0.533 CB 1.702 31 residues pruned to eliminate duplicates Z: 14 19.425 1.926 0.592 0.921 1.000 0.692 CB 1.236 14 residues pruned to eliminate duplicates Z: 49 69.267 2.347 0.854 0.813 0.979 0.792 CB 1.786 49 residues pruned to eliminate duplicates Z: 34 19.136 1.811 0.555 0.623 0.970 0.667 CB 1.086 34 residues pruned to eliminate duplicates Z: 32 25.297 1.947 0.593 0.594 0.935 0.677 CB 1.432 32 residues pruned to eliminate duplicates Z: 11 9.717 2.180 0.390 0.439 0.800 0.500 CB 1.351 11 residues pruned to eliminate duplicates Z: 10 5.004 1.784 0.203 0.275 0.778 0.444 CB 1.290 Z: 120 81.331 2.382 0.924 0.564 0.908 0.613 CB 1.684 120 residues pruned to eliminate duplicates Z: 9 11.879 2.004 0.640 0.358 1.000 0.625 CB 1.488 9 residues pruned to eliminate duplicates Z: 67 67.464 2.415 0.943 0.612 0.955 0.758 CB 1.667 67 residues pruned to eliminate duplicates Z: 65 42.951 2.170 0.620 0.622 0.984 0.656 CB 1.383 65 residues pruned to eliminate duplicates Z: 76 86.723 2.414 1.055 0.756 0.947 0.627 CB 1.697 77 residues pruned to eliminate duplicates Z: 15 21.560 1.885 0.706 0.928 1.000 0.500 CB 1.255 15 residues pruned to eliminate duplicates Z: 24 29.440 2.257 0.706 0.607 0.870 0.696 CB 1.655 24 residues pruned to eliminate duplicates Z: 6 2.279 1.731 0.052 0.421 0.800 0.400 CB 0.760 Z: 6 2.425 1.475 0.541 0.283 0.600 0.200 N 1.016 Z: 19 21.037 2.159 0.514 0.588 0.944 0.778 CB 1.476 19 residues pruned to eliminate duplicates Z: 27 16.674 1.781 0.476 0.643 1.000 0.654 CB 1.088 27 residues pruned to eliminate duplicates Z: 6 2.857 1.468 0.596 0.294 0.800 0.600 CB 0.858 Z: 12 9.462 2.019 1.045 0.340 0.727 0.455 CB 1.130 12 residues pruned to eliminate duplicates Z: 14 32.023 2.236 1.119 0.928 1.000 0.923 CB 1.312 14 residues pruned to eliminate duplicates Z: 31 20.219 1.844 0.601 0.670 0.967 0.733 CB 1.106 31 residues pruned to eliminate duplicates Z: 98 77.337 2.408 0.899 0.590 0.907 0.680 CB 1.736 98 residues pruned to eliminate duplicates Z: 6 15.346 2.004 1.169 0.749 1.000 0.600 CB 1.264 6 residues pruned to eliminate duplicates Z: 52 47.536 2.326 0.799 0.558 0.961 0.706 CB 1.565 52 residues pruned to eliminate duplicates Z: 17 26.355 2.038 1.029 0.855 0.875 0.562 CB 1.344 17 residues pruned to eliminate duplicates Z: 7 5.110 1.354 0.759 0.605 0.833 0.500 CB 0.951 7 residues pruned to eliminate duplicates Z: 51 50.355 2.381 0.892 0.580 0.940 0.680 CB 1.557 51 residues pruned to eliminate duplicates Z: 10 10.901 1.757 0.356 0.893 0.889 0.333 CB 1.232 10 residues pruned to eliminate duplicates Z: 35 22.476 2.058 0.844 0.414 0.824 0.471 CB 1.350 35 residues pruned to eliminate duplicates Z: 15 33.475 2.219 0.893 0.888 1.000 0.857 CA 1.534 15 residues pruned to eliminate duplicates Z: 13 8.574 1.514 0.227 0.883 1.000 0.750 CB 0.963 13 residues pruned to eliminate duplicates Z: 12 12.064 1.931 0.231 0.627 1.000 0.636 CB 1.358 12 residues pruned to eliminate duplicates Z: 25 60.345 2.359 1.251 0.931 1.000 0.750 CB 1.621 25 residues pruned to eliminate duplicates Z: 7 4.660 1.992 0.718 0.235 0.667 0.500 CB 1.134 7 residues pruned to eliminate duplicates Z: 48 24.664 1.981 0.561 0.559 0.936 0.511 CB 1.172 48 residues pruned to eliminate duplicates Z: 7 8.847 2.205 0.799 0.154 1.000 0.500 CB 1.392 7 residues pruned to eliminate duplicates Z: 17 35.488 2.199 1.109 0.904 1.000 0.625 CB 1.363 17 residues pruned to eliminate duplicates Z: 6 4.294 1.584 0.425 0.860 1.000 1.000 CB 0.625 Z: 17 12.762 2.062 0.492 0.480 0.812 0.562 CB 1.302 17 residues pruned to eliminate duplicates Z: 30 56.391 2.318 0.869 0.918 1.000 0.759 CB 1.704 30 residues pruned to eliminate duplicates Z: 22 35.653 2.362 0.795 0.642 0.952 0.714 CB 1.688 22 residues pruned to eliminate duplicates Z: 15 22.885 2.195 0.610 0.909 1.000 0.929 CB 1.228 15 residues pruned to eliminate duplicates Z: 14 17.843 1.874 0.417 0.928 1.000 0.923 CB 1.305 14 residues pruned to eliminate duplicates Z: 95 94.888 2.433 1.076 0.718 0.957 0.702 CB 1.662 95 residues pruned to eliminate duplicates Z: 12 6.771 1.488 0.194 0.876 1.000 0.727 CB 0.835 12 residues pruned to eliminate duplicates Z: 13 2.999 1.786 0.119 0.186 0.583 0.250 CB 1.084 13 residues pruned to eliminate duplicates Z: 28 27.816 2.276 0.473 0.543 0.963 0.593 CB 1.590 28 residues pruned to eliminate duplicates Z: 73 79.871 2.443 0.911 0.709 0.944 0.750 CB 1.766 73 residues pruned to eliminate duplicates Z: 20 40.736 2.258 1.135 0.927 0.947 0.474 CB 1.434 22 residues pruned to eliminate duplicates Z: 34 21.052 1.906 0.538 0.628 0.909 0.697 CB 1.219 34 residues pruned to eliminate duplicates Z: 17 19.505 2.074 0.614 0.505 1.000 0.625 CB 1.450 17 residues pruned to eliminate duplicates Z: 6 9.638 1.834 0.696 0.807 1.000 1.000 CB 1.060 6 residues pruned to eliminate duplicates Z: 10 22.852 2.387 0.455 0.902 1.000 0.889 CB 1.564 10 residues pruned to eliminate duplicates Z: 51 26.461 2.159 0.509 0.563 0.880 0.680 CB 1.227 51 residues pruned to eliminate duplicates Z: 27 23.860 2.124 0.718 0.558 0.846 0.577 CB 1.433 27 residues pruned to eliminate duplicates Z: 13 19.047 1.895 0.661 0.839 0.917 0.583 CB 1.423 13 residues pruned to eliminate duplicates Z: 8 14.671 2.095 0.897 0.440 1.000 0.571 CB 1.483 8 residues pruned to eliminate duplicates Z: 7 14.028 1.790 0.760 0.844 1.000 0.833 CA 1.352 7 residues pruned to eliminate duplicates Z: 81 61.556 2.343 0.858 0.551 0.913 0.562 CB 1.648 81 residues pruned to eliminate duplicates Z: 15 34.456 2.140 1.374 0.936 1.000 0.500 CB 1.262 15 residues pruned to eliminate duplicates Z: 19 46.360 2.346 1.045 0.839 1.000 0.722 CB 1.700 19 residues pruned to eliminate duplicates Z: 10 7.990 1.639 0.272 0.802 0.889 0.556 CB 1.104 10 residues pruned to eliminate duplicates Z: 22 35.172 2.344 0.677 0.706 0.905 0.857 CA 1.790 22 residues pruned to eliminate duplicates Z: 11 27.147 2.439 0.693 0.642 1.000 0.900 CB 1.821 11 residues pruned to eliminate duplicates Z: 37 35.702 2.223 0.907 0.639 0.917 0.667 CB 1.344 37 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 17 23.231 1.953 0.532 0.846 1.000 0.750 CB 1.442 17 residues pruned to eliminate duplicates Z: 31 27.794 2.006 0.697 0.610 0.867 0.667 CB 1.550 31 residues pruned to eliminate duplicates Z: 32 22.236 1.955 0.522 0.580 0.903 0.645 CB 1.376 32 residues pruned to eliminate duplicates Z: 44 28.504 1.936 0.752 0.515 0.907 0.535 CB 1.392 44 residues pruned to eliminate duplicates Z: 34 24.026 1.897 0.724 0.553 0.909 0.364 CB 1.335 34 residues pruned to eliminate duplicates Z: 32 25.914 1.977 0.691 0.583 0.935 0.516 CB 1.374 32 residues pruned to eliminate duplicates Z: 25 23.881 1.875 0.855 0.657 0.875 0.542 CB 1.386 25 residues pruned to eliminate duplicates Z: 31 27.463 1.995 0.691 0.621 0.900 0.567 CB 1.474 31 residues pruned to eliminate duplicates Z: 29 28.107 2.024 0.706 0.627 0.929 0.643 CB 1.470 29 residues pruned to eliminate duplicates Z: 31 27.975 1.988 0.775 0.609 0.900 0.467 CB 1.450 31 residues pruned to eliminate duplicates Z: 26 23.396 1.943 0.605 0.666 0.920 0.560 CB 1.398 26 residues pruned to eliminate duplicates Z: 40 26.183 1.951 0.637 0.590 0.923 0.667 CB 1.304 40 residues pruned to eliminate duplicates Z: 24 28.876 1.996 0.747 0.703 1.000 0.826 CB 1.435 24 residues pruned to eliminate duplicates Z: 116 74.778 2.266 0.868 0.612 0.930 0.670 CB 1.592 115 residues pruned to eliminate duplicates Z: 16 26.987 1.901 0.921 0.928 0.933 0.667 CB 1.432 16 residues pruned to eliminate duplicates Z: 31 26.516 1.953 0.697 0.631 0.933 0.567 CB 1.384 31 residues pruned to eliminate duplicates Z: 40 26.460 1.978 0.669 0.581 0.897 0.641 CB 1.322 40 residues pruned to eliminate duplicates Z: 33 26.968 1.954 0.645 0.577 0.938 0.531 CB 1.469 33 residues pruned to eliminate duplicates Z: 26 23.507 1.937 0.715 0.658 0.920 0.440 CB 1.329 26 residues pruned to eliminate duplicates Z: 31 26.954 1.995 0.776 0.605 0.867 0.567 CB 1.450 31 residues pruned to eliminate duplicates Z: 27 23.369 1.908 0.675 0.627 0.923 0.692 CB 1.378 27 residues pruned to eliminate duplicates Z: 31 27.906 1.975 0.813 0.628 0.933 0.500 CB 1.352 31 residues pruned to eliminate duplicates Z: 29 28.258 2.020 0.777 0.630 0.893 0.607 CB 1.476 29 residues pruned to eliminate duplicates Z: 14 12.567 2.000 0.751 0.283 0.769 0.462 CB 1.652 14 residues pruned to eliminate duplicates Z: 14 14.618 1.858 0.583 0.434 0.923 0.385 CA 1.599 14 residues pruned to eliminate duplicates Z: 35 23.637 1.890 0.752 0.529 0.853 0.500 CB 1.394 35 residues pruned to eliminate duplicates Z: 30 26.361 1.930 0.740 0.637 0.897 0.552 CB 1.430 30 residues pruned to eliminate duplicates Z: 40 26.724 2.006 0.587 0.614 0.923 0.538 CB 1.307 47 residues pruned to eliminate duplicates Z: 13 9.142 1.545 0.571 0.880 0.917 0.500 CB 0.859 13 residues pruned to eliminate duplicates Z: 106 60.340 2.255 0.727 0.583 0.943 0.524 CB 1.481 107 residues pruned to eliminate duplicates Z: 12 10.111 1.604 0.476 0.872 1.000 0.455 CB 0.938 12 residues pruned to eliminate duplicates Z: 38 26.947 2.067 0.572 0.583 0.946 0.568 CB 1.330 38 residues pruned to eliminate duplicates Z: 76 53.176 2.293 0.775 0.576 0.920 0.520 CB 1.525 76 residues pruned to eliminate duplicates Z: 39 32.870 2.014 0.759 0.619 0.974 0.553 CB 1.381 39 residues pruned to eliminate duplicates Z: 66 45.646 2.200 0.732 0.622 0.954 0.554 CB 1.388 66 residues pruned to eliminate duplicates Z: 41 28.453 1.997 0.696 0.635 0.925 0.525 CB 1.266 41 residues pruned to eliminate duplicates Z: 46 24.523 1.952 0.555 0.522 0.933 0.444 CB 1.263 46 residues pruned to eliminate duplicates Z: 90 60.542 2.229 0.797 0.605 0.955 0.697 CB 1.518 90 residues pruned to eliminate duplicates Z: 72 49.656 2.240 0.720 0.604 0.958 0.577 CB 1.447 72 residues pruned to eliminate duplicates Z: 39 29.448 2.052 0.654 0.598 0.974 0.632 CB 1.317 39 residues pruned to eliminate duplicates Z: 89 56.696 2.246 0.679 0.598 0.955 0.693 CB 1.529 89 residues pruned to eliminate duplicates Z: 76 53.782 2.256 0.748 0.623 0.960 0.627 CB 1.461 76 residues pruned to eliminate duplicates Z: 63 36.767 2.140 0.606 0.504 0.903 0.532 CB 1.498 63 residues pruned to eliminate duplicates Z: 64 39.621 2.144 0.631 0.501 0.968 0.619 CB 1.473 64 residues pruned to eliminate duplicates Z: 65 36.959 2.138 0.672 0.490 0.906 0.625 CB 1.440 65 residues pruned to eliminate duplicates Z: 89 55.918 2.238 0.702 0.586 0.943 0.625 CB 1.528 89 residues pruned to eliminate duplicates Z: 50 29.778 2.112 0.585 0.532 0.959 0.510 CB 1.284 50 residues pruned to eliminate duplicates Z: 92 56.436 2.201 0.754 0.586 0.956 0.670 CB 1.476 92 residues pruned to eliminate duplicates Z: 40 25.078 2.023 0.626 0.574 0.923 0.487 CB 1.231 40 residues pruned to eliminate duplicates Z: 11 20.822 2.237 0.739 0.716 0.900 0.700 CB 1.547 11 residues pruned to eliminate duplicates Z: 89 59.520 2.250 0.801 0.593 0.943 0.682 CB 1.519 89 residues pruned to eliminate duplicates Z: 65 43.631 2.207 0.743 0.594 0.953 0.562 CB 1.360 65 residues pruned to eliminate duplicates Z: 39 27.693 2.029 0.623 0.604 0.974 0.632 CB 1.268 39 residues pruned to eliminate duplicates Z: 40 23.666 1.953 0.504 0.587 1.000 0.385 CB 1.186 40 residues pruned to eliminate duplicates Z: 38 27.627 2.042 0.630 0.606 0.946 0.622 CB 1.305 38 residues pruned to eliminate duplicates Z: 64 37.902 2.148 0.622 0.481 0.984 0.540 CB 1.420 64 residues pruned to eliminate duplicates Z: 15 18.836 2.191 0.560 0.542 1.000 0.429 CB 1.414 15 residues pruned to eliminate duplicates Z: 66 35.794 2.107 0.625 0.491 0.923 0.554 CB 1.417 66 residues pruned to eliminate duplicates Z: 108 64.221 2.297 0.795 0.580 0.916 0.542 CB 1.523 108 residues pruned to eliminate duplicates Z: 40 26.095 2.036 0.533 0.594 0.974 0.590 CB 1.257 40 residues pruned to eliminate duplicates Z: 40 25.669 2.007 0.561 0.603 0.949 0.564 CB 1.254 40 residues pruned to eliminate duplicates Z: 67 43.997 2.205 0.690 0.626 0.939 0.530 CB 1.374 67 residues pruned to eliminate duplicates Z: 107 64.993 2.292 0.787 0.610 0.925 0.585 CB 1.503 107 residues pruned to eliminate duplicates Z: 39 29.862 2.043 0.713 0.598 0.974 0.605 CB 1.295 39 residues pruned to eliminate duplicates Z: 40 26.910 2.041 0.591 0.624 0.949 0.615 CB 1.243 40 residues pruned to eliminate duplicates Z: 41 49.886 2.393 0.927 0.535 0.900 0.500 CB 1.836 41 residues pruned to eliminate duplicates Z: 24 49.455 2.507 0.999 0.696 1.000 0.478 CB 1.720 24 residues pruned to eliminate duplicates Z: 34 42.752 2.421 0.867 0.606 0.939 0.545 CB 1.584 34 residues pruned to eliminate duplicates Z: 77 52.745 2.273 0.749 0.619 0.921 0.658 CB 1.477 77 residues pruned to eliminate duplicates Z: 35 60.886 2.553 1.037 0.663 0.941 0.471 CB 1.834 35 residues pruned to eliminate duplicates Z: 80 56.232 2.261 0.830 0.593 0.937 0.570 CB 1.494 80 residues pruned to eliminate duplicates Z: 132 73.283 2.277 0.833 0.610 0.924 0.656 CB 1.497 132 residues pruned to eliminate duplicates Z: 36 55.574 2.532 0.986 0.663 0.886 0.743 CB 1.813 36 residues pruned to eliminate duplicates Z: 107 60.802 2.250 0.796 0.575 0.896 0.566 CB 1.517 107 residues pruned to eliminate duplicates Z: 78 53.536 2.246 0.702 0.627 0.948 0.675 CB 1.493 78 residues pruned to eliminate duplicates Z: 78 52.726 2.244 0.734 0.608 0.935 0.545 CB 1.491 78 residues pruned to eliminate duplicates Z: 36 49.467 2.496 0.807 0.656 0.914 0.743 CB 1.754 36 residues pruned to eliminate duplicates Z: 35 57.219 2.537 0.758 0.682 0.971 0.794 CB 1.918 35 residues pruned to eliminate duplicates Z: 112 56.872 2.250 0.684 0.582 0.883 0.604 CB 1.491 112 residues pruned to eliminate duplicates Z: 78 50.086 2.232 0.682 0.606 0.935 0.610 CB 1.471 77 residues pruned to eliminate duplicates Z: 20 37.832 2.460 0.610 0.844 0.947 0.789 CB 1.720 20 residues pruned to eliminate duplicates Z: 36 56.747 2.545 0.904 0.634 0.943 0.600 CB 1.853 36 residues pruned to eliminate duplicates Z: 108 62.563 2.262 0.741 0.596 0.935 0.617 CB 1.499 108 residues pruned to eliminate duplicates Z: 36 54.066 2.509 0.716 0.685 0.971 0.686 CB 1.843 36 residues pruned to eliminate duplicates Z: 36 60.248 2.554 0.820 0.693 0.971 0.686 CB 1.890 36 residues pruned to eliminate duplicates Z: 105 65.590 2.305 0.743 0.595 0.942 0.644 CB 1.552 105 residues pruned to eliminate duplicates Z: 79 49.394 2.218 0.615 0.616 0.949 0.551 CB 1.475 79 residues pruned to eliminate duplicates Z: 46 44.852 2.456 0.702 0.543 0.911 0.600 CB 1.684 46 residues pruned to eliminate duplicates Z: 44 52.676 2.485 0.703 0.621 0.977 0.651 CB 1.733 44 residues pruned to eliminate duplicates Z: 14 36.951 2.545 0.990 0.538 1.000 0.385 CB 1.949 14 residues pruned to eliminate duplicates Z: 108 64.113 2.301 0.749 0.588 0.925 0.617 CB 1.530 108 residues pruned to eliminate duplicates Z: 76 50.786 2.288 0.633 0.612 0.933 0.640 CB 1.513 76 residues pruned to eliminate duplicates Z: 13 24.592 2.437 0.794 0.532 0.833 0.417 CA 1.889 13 residues pruned to eliminate duplicates Z: 66 60.281 2.424 0.800 0.596 0.908 0.631 CB 1.722 66 residues pruned to eliminate duplicates Z: 36 54.645 2.529 0.878 0.602 0.943 0.600 CB 1.872 36 residues pruned to eliminate duplicates Z: 12 13.375 2.220 0.857 0.252 0.818 0.273 CA 1.590 12 residues pruned to eliminate duplicates Z: 73 47.472 2.195 0.783 0.556 0.958 0.583 CB 1.414 73 residues pruned to eliminate duplicates Z: 75 50.271 2.257 0.688 0.592 0.973 0.608 CB 1.444 75 residues pruned to eliminate duplicates Z: 65 65.318 2.450 0.858 0.592 0.922 0.672 CB 1.782 65 residues pruned to eliminate duplicates Z: 75 60.165 2.421 0.772 0.559 0.905 0.676 CB 1.701 75 residues pruned to eliminate duplicates Z: 39 43.472 2.380 0.849 0.522 0.895 0.605 CB 1.753 39 residues pruned to eliminate duplicates Z: 33 35.686 2.332 0.849 0.568 0.844 0.531 CB 1.624 33 residues pruned to eliminate duplicates Z: 123 88.009 2.419 0.881 0.638 0.910 0.697 CB 1.690 274 residues pruned to eliminate duplicates Z: 18 38.505 2.171 0.804 0.881 1.000 0.941 CB 1.726 18 residues pruned to eliminate duplicates Z: 36 32.908 2.192 0.843 0.551 0.857 0.600 CB 1.528 36 residues pruned to eliminate duplicates Z: 34 32.541 2.210 0.845 0.616 0.909 0.636 CB 1.370 34 residues pruned to eliminate duplicates Z: 108 62.608 2.263 0.751 0.584 0.935 0.598 CB 1.508 108 residues pruned to eliminate duplicates Z: 32 35.359 2.237 0.736 0.600 0.903 0.677 CB 1.646 32 residues pruned to eliminate duplicates Z: 41 48.000 2.350 1.054 0.524 0.875 0.525 CB 1.754 41 residues pruned to eliminate duplicates Z: 107 61.816 2.250 0.761 0.590 0.934 0.575 CB 1.489 107 residues pruned to eliminate duplicates Z: 33 37.251 2.307 0.951 0.582 0.875 0.625 CB 1.546 33 residues pruned to eliminate duplicates Z: 41 48.046 2.342 1.001 0.554 0.900 0.575 CB 1.708 41 residues pruned to eliminate duplicates Z: 33 41.491 2.331 1.035 0.556 0.906 0.500 CB 1.616 33 residues pruned to eliminate duplicates Z: 33 36.288 2.280 1.014 0.534 0.906 0.562 CB 1.491 33 residues pruned to eliminate duplicates Z: 106 64.938 2.272 0.778 0.584 0.943 0.600 CB 1.535 106 residues pruned to eliminate duplicates Z: 32 40.840 2.295 0.863 0.592 0.935 0.516 CB 1.678 32 residues pruned to eliminate duplicates Z: 33 34.565 2.303 0.852 0.570 0.844 0.406 CB 1.587 33 residues pruned to eliminate duplicates Z: 35 36.854 2.277 0.825 0.532 0.912 0.529 CB 1.617 35 residues pruned to eliminate duplicates Z: 56 50.839 2.322 0.992 0.563 0.891 0.564 CB 1.564 56 residues pruned to eliminate duplicates Z: 66 48.312 2.271 0.979 0.558 0.877 0.508 CB 1.438 66 residues pruned to eliminate duplicates Z: 36 40.271 2.234 0.889 0.582 0.914 0.600 CB 1.631 36 residues pruned to eliminate duplicates Z: 105 63.534 2.279 0.779 0.581 0.942 0.558 CB 1.508 105 residues pruned to eliminate duplicates Z: 34 40.378 2.300 1.075 0.560 0.879 0.545 CB 1.581 34 residues pruned to eliminate duplicates Z: 32 40.835 2.329 0.911 0.614 0.903 0.581 CB 1.638 32 residues pruned to eliminate duplicates Z: 34 42.004 2.278 1.026 0.633 0.909 0.606 CB 1.537 34 residues pruned to eliminate duplicates Z: 32 38.569 2.339 0.898 0.625 0.871 0.645 CB 1.593 32 residues pruned to eliminate duplicates Z: 33 40.273 2.292 0.910 0.610 0.875 0.562 CB 1.674 33 residues pruned to eliminate duplicates Z: 68 65.704 2.433 0.833 0.609 0.925 0.537 CB 1.754 68 residues pruned to eliminate duplicates Z: 57 51.700 2.276 0.897 0.622 0.911 0.589 CB 1.566 57 residues pruned to eliminate duplicates Z: 89 61.711 2.373 0.771 0.598 0.920 0.659 CB 1.549 89 residues pruned to eliminate duplicates Z: 37 41.598 2.279 0.860 0.649 0.944 0.750 CB 1.507 Z: 18 34.904 2.226 0.746 0.815 1.000 0.882 CB 1.656 18 residues pruned to eliminate duplicates Z: 47 43.959 2.333 0.775 0.633 0.935 0.761 CB 1.477 37 residues pruned to eliminate duplicates Z: 17 31.360 2.155 0.808 0.902 1.000 0.688 CB 1.435 17 residues pruned to eliminate duplicates Z: 47 44.499 2.314 0.805 0.612 0.935 0.630 CB 1.511 47 residues pruned to eliminate duplicates Z: 17 32.175 2.189 0.752 0.898 1.000 0.875 CB 1.500 17 residues pruned to eliminate duplicates Z: 64 47.199 2.316 0.720 0.554 0.921 0.683 CB 1.538 50 residues pruned to eliminate duplicates Z: 16 36.668 2.296 0.947 0.896 1.000 0.733 CB 1.517 16 residues pruned to eliminate duplicates Z: 38 44.411 2.333 0.904 0.617 0.946 0.622 CB 1.555 38 residues pruned to eliminate duplicates Z: 177 100.477 2.421 0.861 0.625 0.920 0.631 CB 1.623 238 residues pruned to eliminate duplicates Z: 49 45.515 2.314 0.842 0.597 0.938 0.625 CB 1.499 Z: 16 37.624 2.308 0.906 0.929 1.000 0.667 CB 1.545 16 residues pruned to eliminate duplicates Z: 33 47.657 2.332 1.040 0.653 0.938 0.562 CB 1.638 33 residues pruned to eliminate duplicates Z: 34 43.862 2.320 1.031 0.648 0.970 0.727 CB 1.456 34 residues pruned to eliminate duplicates Z: 17 32.635 2.180 1.030 0.869 0.938 0.625 CB 1.436 17 residues pruned to eliminate duplicates Z: 51 41.109 2.250 0.829 0.556 0.880 0.580 CB 1.520 50 residues pruned to eliminate duplicates Z: 18 41.900 2.281 1.170 0.802 1.000 0.588 CB 1.577 18 residues pruned to eliminate duplicates Z: 37 47.776 2.346 0.964 0.614 1.000 0.583 CB 1.552 38 residues pruned to eliminate duplicates Z: 6 5.509 1.526 0.947 0.320 0.800 0.400 CA 1.264 6 residues pruned to eliminate duplicates Z: 50 42.841 2.301 0.773 0.599 0.918 0.612 CB 1.487 50 residues pruned to eliminate duplicates Z: 67 48.731 2.162 0.826 0.609 0.955 0.621 CB 1.436 33 residues pruned to eliminate duplicates Z: 6 5.375 1.756 0.688 0.460 0.800 0.800 CA 1.056 6 residues pruned to eliminate duplicates Z: 40 43.214 2.256 0.975 0.585 0.974 0.667 CB 1.469 40 residues pruned to eliminate duplicates Z: 57 43.003 2.289 0.842 0.534 0.929 0.625 CB 1.420 57 residues pruned to eliminate duplicates Z: 65 49.552 2.279 0.767 0.559 0.953 0.656 CB 1.525 50 residues pruned to eliminate duplicates Z: 9 4.241 1.850 0.062 0.359 0.875 0.250 CB 1.015 9 residues pruned to eliminate duplicates Z: 38 39.807 2.283 0.838 0.575 0.973 0.568 CB 1.492 38 residues pruned to eliminate duplicates Z: 70 45.256 2.135 0.889 0.598 0.899 0.623 CB 1.368 70 residues pruned to eliminate duplicates Z: 38 46.131 2.312 1.076 0.629 0.973 0.676 CB 1.438 38 residues pruned to eliminate duplicates Z: 50 46.579 2.307 0.863 0.593 0.939 0.694 CB 1.509 50 residues pruned to eliminate duplicates Z: 64 41.061 2.226 0.821 0.515 0.889 0.587 CB 1.415 64 residues pruned to eliminate duplicates Z: 62 49.288 2.327 0.836 0.564 0.934 0.721 CB 1.486 62 residues pruned to eliminate duplicates Z: 92 65.883 2.393 0.849 0.604 0.923 0.703 CB 1.531 190 residues pruned to eliminate duplicates Z: 66 46.886 2.277 0.814 0.546 0.938 0.677 CB 1.435 Z: 9 18.008 2.156 0.698 0.620 1.000 0.750 CA 1.553 9 residues pruned to eliminate duplicates Z: 25 24.186 2.281 0.642 0.536 0.875 0.625 CB 1.454 29 residues pruned to eliminate duplicates Z: 7 16.576 2.106 0.634 0.818 1.000 0.833 CA 1.492 7 residues pruned to eliminate duplicates Z: 12 17.450 2.269 0.558 0.635 0.909 0.727 CB 1.443 12 residues pruned to eliminate duplicates Z: 154 88.534 2.362 0.869 0.615 0.922 0.647 CB 1.578 216 residues pruned to eliminate duplicates Z: 20 24.672 2.183 0.733 0.610 0.842 0.474 CA 1.600 Z: 12 9.105 2.053 0.247 0.669 0.818 0.636 CB 1.121 12 residues pruned to eliminate duplicates Z: 135 100.465 2.440 0.905 0.689 0.955 0.716 CB 1.644 155 residues pruned to eliminate duplicates Z: 17 16.659 2.125 0.549 0.426 0.938 0.688 CB 1.458 Z: 7 14.782 2.267 0.937 0.407 0.833 0.500 CA 1.818 10 residues pruned to eliminate duplicates Z: 7 13.768 2.199 0.764 0.503 1.000 0.500 CA 1.444 6 residues pruned to eliminate duplicates Z: 7 9.483 2.055 0.567 0.561 1.000 0.667 CB 1.133 6 residues pruned to eliminate duplicates Z: 10 13.278 2.276 0.490 0.534 0.889 0.778 CB 1.419 6 residues pruned to eliminate duplicates Z: 6 3.792 1.909 0.662 0.395 0.600 0.200 CB 0.995 4 residues pruned to eliminate duplicates Z: 8 7.514 2.018 0.895 0.385 1.000 0.571 CB 0.839 6 residues pruned to eliminate duplicates Z: 6 4.067 1.638 1.176 0.344 0.600 0.400 CA 1.008 6 residues pruned to eliminate duplicates Z: 26 52.205 2.541 1.050 0.755 1.000 0.800 CB 1.597 50 residues pruned to eliminate duplicates Z: 90 91.833 2.474 0.944 0.723 0.944 0.764 CB 1.755 90 residues pruned to eliminate duplicates Z: 28 46.551 2.508 0.964 0.716 0.926 0.815 CB 1.616 28 residues pruned to eliminate duplicates Z: 27 46.017 2.503 0.947 0.728 0.923 0.808 CB 1.633 27 residues pruned to eliminate duplicates Z: 43 50.548 2.500 0.842 0.634 0.929 0.667 CB 1.608 43 residues pruned to eliminate duplicates Z: 131 93.514 2.442 0.930 0.651 0.885 0.685 CB 1.709 131 residues pruned to eliminate duplicates Z: 52 55.901 2.323 0.945 0.674 0.922 0.725 CB 1.601 57 residues pruned to eliminate duplicates Z: 17 39.561 2.353 0.688 0.929 1.000 1.000 CB 1.742 17 residues pruned to eliminate duplicates Z: 89 98.885 2.471 1.064 0.727 0.977 0.716 CB 1.723 89 residues pruned to eliminate duplicates Z: 96 93.142 2.432 1.011 0.710 0.947 0.705 CB 1.704 96 residues pruned to eliminate duplicates Z: 88 61.585 2.347 0.808 0.588 0.943 0.655 CB 1.518 88 residues pruned to eliminate duplicates Z: 91 92.241 2.459 1.020 0.711 0.944 0.711 CB 1.712 91 residues pruned to eliminate duplicates Z: 75 101.508 2.522 1.193 0.764 0.946 0.770 CB 1.784 75 residues pruned to eliminate duplicates Z: 107 91.198 2.438 1.038 0.647 0.925 0.632 CB 1.682 107 residues pruned to eliminate duplicates Z: 27 50.756 2.515 1.195 0.729 0.962 0.885 CB 1.526 27 residues pruned to eliminate duplicates Z: 128 86.730 2.447 0.914 0.614 0.898 0.654 CB 1.644 128 residues pruned to eliminate duplicates Z: 28 50.028 2.487 1.323 0.687 0.926 0.741 CB 1.517 28 residues pruned to eliminate duplicates Z: 43 51.163 2.430 0.984 0.628 0.929 0.690 CB 1.563 43 residues pruned to eliminate duplicates Z: 140 97.499 2.464 0.931 0.600 0.921 0.597 CB 1.716 140 residues pruned to eliminate duplicates Z: 73 100.184 2.539 1.120 0.786 0.958 0.750 CB 1.779 73 residues pruned to eliminate duplicates Z: 73 102.472 2.528 1.192 0.781 0.972 0.778 CB 1.749 73 residues pruned to eliminate duplicates Z: 163 114.070 2.465 0.998 0.647 0.926 0.698 CB 1.713 163 residues pruned to eliminate duplicates Z: 101 85.034 2.445 1.003 0.651 0.890 0.690 CB 1.695 101 residues pruned to eliminate duplicates Z: 89 93.047 2.490 1.051 0.699 0.932 0.693 CB 1.738 89 residues pruned to eliminate duplicates Z: 73 100.376 2.537 1.177 0.775 0.958 0.764 CB 1.753 73 residues pruned to eliminate duplicates Z: 103 88.188 2.461 1.000 0.663 0.922 0.706 CB 1.655 103 residues pruned to eliminate duplicates Z: 98 89.177 2.461 1.025 0.671 0.918 0.680 CB 1.691 98 residues pruned to eliminate duplicates Z: 81 93.221 2.469 1.155 0.743 0.925 0.675 CB 1.704 81 residues pruned to eliminate duplicates Z: 90 80.942 2.433 0.913 0.644 0.910 0.674 CB 1.771 90 residues pruned to eliminate duplicates Z: 90 84.359 2.477 1.029 0.686 0.888 0.697 CB 1.689 90 residues pruned to eliminate duplicates Z: 73 95.471 2.528 1.181 0.768 0.931 0.667 CB 1.730 73 residues pruned to eliminate duplicates Z: 85 103.759 2.510 1.165 0.740 0.952 0.619 CB 1.764 85 residues pruned to eliminate duplicates Z: 101 95.974 2.454 1.069 0.684 0.930 0.690 CB 1.716 101 residues pruned to eliminate duplicates Z: 137 105.360 2.486 1.016 0.618 0.926 0.647 CB 1.740 137 residues pruned to eliminate duplicates Z: 106 81.846 2.424 0.944 0.596 0.924 0.648 CB 1.674 106 residues pruned to eliminate duplicates Z: 53 71.970 2.407 1.019 0.761 0.962 0.731 CB 1.694 53 residues pruned to eliminate duplicates Z: 101 96.886 2.476 1.063 0.679 0.930 0.700 CB 1.731 101 residues pruned to eliminate duplicates Z: 97 89.849 2.444 1.012 0.679 0.938 0.656 CB 1.687 97 residues pruned to eliminate duplicates Z: 136 98.570 2.420 0.984 0.673 0.933 0.652 CB 1.614 136 residues pruned to eliminate duplicates Z: 131 92.600 2.440 0.968 0.626 0.908 0.631 CB 1.656 131 residues pruned to eliminate duplicates Z: 155 101.320 2.438 0.933 0.607 0.929 0.675 CB 1.685 155 residues pruned to eliminate duplicates Z: 197 110.343 2.430 0.933 0.611 0.923 0.668 CB 1.636 197 residues pruned to eliminate duplicates Z: 65 72.901 2.458 0.946 0.692 0.922 0.656 CB 1.734 65 residues pruned to eliminate duplicates Z: 103 91.935 2.450 0.980 0.681 0.931 0.686 CB 1.706 103 residues pruned to eliminate duplicates Z: 92 88.504 2.449 0.935 0.709 0.945 0.725 CB 1.713 92 residues pruned to eliminate duplicates Z: 79 84.592 2.460 1.039 0.723 0.923 0.705 CB 1.691 79 residues pruned to eliminate duplicates Z: 93 83.609 2.440 1.034 0.648 0.935 0.707 CB 1.637 93 residues pruned to eliminate duplicates Z: 101 94.143 2.480 1.069 0.684 0.920 0.720 CB 1.685 101 residues pruned to eliminate duplicates Z: 95 94.517 2.486 1.084 0.682 0.936 0.691 CB 1.700 95 residues pruned to eliminate duplicates Z: 89 93.353 2.489 0.974 0.736 0.955 0.716 CB 1.718 89 residues pruned to eliminate duplicates Z: 98 85.377 2.462 0.962 0.632 0.938 0.660 CB 1.690 98 residues pruned to eliminate duplicates Z: 178 112.202 2.445 0.981 0.626 0.921 0.655 CB 1.679 178 residues pruned to eliminate duplicates Z: 99 96.204 2.468 1.026 0.699 0.949 0.704 CB 1.708 99 residues pruned to eliminate duplicates Z: 57 83.040 2.451 1.029 0.752 0.964 0.750 CB 1.848 57 residues pruned to eliminate duplicates Z: 90 98.012 2.448 1.058 0.730 0.978 0.719 CB 1.715 90 residues pruned to eliminate duplicates Z: 74 102.325 2.519 1.238 0.758 0.973 0.726 CB 1.737 74 residues pruned to eliminate duplicates Z: 128 94.821 2.433 0.950 0.634 0.921 0.583 CB 1.698 128 residues pruned to eliminate duplicates Z: 90 94.325 2.465 1.087 0.709 0.955 0.708 CB 1.683 90 residues pruned to eliminate duplicates Z: 137 97.029 2.456 0.953 0.619 0.919 0.706 CB 1.687 137 residues pruned to eliminate duplicates Z: 93 91.428 2.435 1.069 0.696 0.935 0.707 CB 1.692 93 residues pruned to eliminate duplicates Z: 138 96.200 2.456 0.958 0.614 0.920 0.672 CB 1.669 138 residues pruned to eliminate duplicates Z: 90 79.980 2.435 0.997 0.620 0.899 0.573 CB 1.732 90 residues pruned to eliminate duplicates Z: 88 93.599 2.486 1.053 0.702 0.977 0.644 CB 1.675 88 residues pruned to eliminate duplicates Z: 75 95.613 2.499 1.184 0.756 0.932 0.716 CB 1.738 75 residues pruned to eliminate duplicates Z: 100 94.600 2.469 1.057 0.688 0.919 0.677 CB 1.714 100 residues pruned to eliminate duplicates Z: 78 92.471 2.467 1.143 0.753 0.948 0.662 CB 1.679 78 residues pruned to eliminate duplicates Z: 114 98.393 2.473 1.010 0.678 0.947 0.628 CB 1.670 114 residues pruned to eliminate duplicates Z: 94 65.777 2.401 0.787 0.536 0.914 0.624 CB 1.679 94 residues pruned to eliminate duplicates Z: 114 95.032 2.468 1.060 0.653 0.912 0.628 CB 1.672 114 residues pruned to eliminate duplicates Z: 129 96.501 2.466 0.967 0.640 0.914 0.672 CB 1.688 129 residues pruned to eliminate duplicates Z: 163 108.636 2.456 0.937 0.650 0.932 0.685 CB 1.674 163 residues pruned to eliminate duplicates Z: 66 65.549 2.429 1.050 0.602 0.877 0.477 CB 1.689 66 residues pruned to eliminate duplicates Z: 88 65.148 2.411 0.794 0.570 0.908 0.632 CB 1.661 88 residues pruned to eliminate duplicates Z: 153 90.229 2.385 0.819 0.622 0.941 0.625 CB 1.598 153 residues pruned to eliminate duplicates Z: 136 97.662 2.434 0.840 0.636 0.963 0.704 CB 1.715 136 residues pruned to eliminate duplicates Z: 105 83.613 2.410 1.019 0.628 0.913 0.625 CB 1.636 105 residues pruned to eliminate duplicates Z: 137 101.536 2.483 0.940 0.634 0.926 0.669 CB 1.720 137 residues pruned to eliminate duplicates Z: 90 90.666 2.467 1.056 0.699 0.944 0.674 CB 1.675 90 residues pruned to eliminate duplicates Z: 196 106.772 2.407 0.937 0.593 0.933 0.621 CB 1.607 196 residues pruned to eliminate duplicates Z: 114 97.273 2.462 0.992 0.676 0.938 0.646 CB 1.692 114 residues pruned to eliminate duplicates Z: 39 27.188 2.301 0.718 0.432 0.763 0.421 CB 1.568 39 residues pruned to eliminate duplicates Z: 51 37.981 2.352 0.702 0.415 0.860 0.580 CB 1.705 51 residues pruned to eliminate duplicates Z: 49 44.054 2.425 0.632 0.486 0.938 0.583 CB 1.738 49 residues pruned to eliminate duplicates Z: 29 32.635 2.440 0.681 0.551 0.893 0.607 CB 1.603 29 residues pruned to eliminate duplicates Z: 58 61.962 2.413 0.876 0.659 0.947 0.702 CB 1.651 58 residues pruned to eliminate duplicates Z: 27 37.499 2.427 0.933 0.635 0.846 0.538 CB 1.632 27 residues pruned to eliminate duplicates Z: 77 75.419 2.433 0.910 0.609 0.961 0.724 CB 1.747 77 residues pruned to eliminate duplicates Z: 113 82.029 2.370 0.933 0.608 0.946 0.643 CB 1.614 113 residues pruned to eliminate duplicates Z: 28 42.993 2.393 0.887 0.623 0.926 0.593 CB 1.762 28 residues pruned to eliminate duplicates Z: 52 48.226 2.395 0.824 0.501 0.922 0.608 CB 1.675 52 residues pruned to eliminate duplicates Z: 76 68.403 2.429 0.824 0.622 0.947 0.667 CB 1.678 76 residues pruned to eliminate duplicates Z: 27 38.874 2.433 0.912 0.646 0.885 0.615 CB 1.616 27 residues pruned to eliminate duplicates Z: 22 29.360 2.368 0.558 0.567 1.000 0.714 CB 1.627 22 residues pruned to eliminate duplicates Z: 51 56.051 2.444 0.914 0.525 0.940 0.680 CB 1.758 51 residues pruned to eliminate duplicates Z: 28 44.101 2.403 0.953 0.621 0.926 0.593 CA 1.743 28 residues pruned to eliminate duplicates Z: 19 29.396 2.364 0.792 0.550 0.944 0.611 CB 1.650 19 residues pruned to eliminate duplicates Z: 29 39.592 2.310 0.898 0.597 0.929 0.607 CA 1.675 29 residues pruned to eliminate duplicates Z: 73 71.229 2.438 0.909 0.614 0.931 0.736 CB 1.741 73 residues pruned to eliminate duplicates Z: 27 40.850 2.410 0.866 0.603 0.962 0.500 CB 1.680 27 residues pruned to eliminate duplicates Z: 77 70.221 2.427 0.856 0.604 0.961 0.776 CB 1.687 77 residues pruned to eliminate duplicates Z: 51 49.778 2.429 0.824 0.511 0.920 0.640 CB 1.710 51 residues pruned to eliminate duplicates Z: 27 45.414 2.420 1.023 0.636 0.923 0.692 CB 1.735 27 residues pruned to eliminate duplicates Z: 50 47.363 2.425 0.848 0.495 0.898 0.653 CB 1.689 50 residues pruned to eliminate duplicates Z: 28 44.630 2.441 0.895 0.631 0.926 0.667 CB 1.773 28 residues pruned to eliminate duplicates Z: 76 73.752 2.449 0.889 0.618 0.960 0.773 CB 1.715 76 residues pruned to eliminate duplicates Z: 51 46.743 2.411 0.790 0.502 0.900 0.560 CB 1.698 51 residues pruned to eliminate duplicates Z: 77 70.334 2.441 0.901 0.609 0.921 0.711 CB 1.703 77 residues pruned to eliminate duplicates Z: 50 51.364 2.437 0.792 0.529 0.939 0.673 CB 1.739 50 residues pruned to eliminate duplicates Z: 75 68.303 2.394 0.877 0.593 0.973 0.676 CB 1.662 75 residues pruned to eliminate duplicates Z: 28 27.112 2.312 0.646 0.427 0.889 0.630 CB 1.664 28 residues pruned to eliminate duplicates Z: 48 38.140 2.295 0.754 0.436 0.894 0.638 CB 1.652 48 residues pruned to eliminate duplicates Z: 50 53.046 2.435 0.842 0.529 0.980 0.673 CB 1.675 50 residues pruned to eliminate duplicates Z: 163 114.705 2.471 0.990 0.669 0.926 0.716 CB 1.693 163 residues pruned to eliminate duplicates Z: 28 22.884 2.278 0.556 0.379 0.889 0.556 CB 1.591 28 residues pruned to eliminate duplicates Z: 77 68.283 2.390 0.872 0.592 0.961 0.671 CB 1.670 77 residues pruned to eliminate duplicates Z: 28 28.575 2.310 0.655 0.400 0.926 0.704 CB 1.726 28 residues pruned to eliminate duplicates Z: 76 70.286 2.434 0.886 0.617 0.933 0.707 CB 1.695 76 residues pruned to eliminate duplicates Z: 7 7.784 1.629 0.793 0.453 1.000 0.500 CA 1.142 7 residues pruned to eliminate duplicates Z: 52 52.941 2.406 0.898 0.510 0.922 0.667 CB 1.744 52 residues pruned to eliminate duplicates Z: 52 55.599 2.430 0.771 0.605 0.961 0.765 CB 1.704 52 residues pruned to eliminate duplicates Z: 178 112.642 2.442 0.946 0.631 0.927 0.655 CB 1.701 178 residues pruned to eliminate duplicates Z: 52 52.662 2.386 0.792 0.507 0.980 0.686 CB 1.748 52 residues pruned to eliminate duplicates Z: 25 26.322 2.357 0.650 0.395 0.958 0.667 CB 1.611 25 residues pruned to eliminate duplicates Z: 28 29.449 2.323 0.722 0.439 0.926 0.667 CB 1.631 28 residues pruned to eliminate duplicates Z: 65 39.834 2.322 0.702 0.455 0.844 0.609 CB 1.564 65 residues pruned to eliminate duplicates Z: 27 23.774 2.349 0.638 0.373 0.885 0.577 CB 1.569 27 residues pruned to eliminate duplicates Z: 76 70.062 2.448 0.824 0.615 0.947 0.720 CB 1.717 76 residues pruned to eliminate duplicates Z: 68 70.153 2.438 0.884 0.614 0.985 0.672 CB 1.699 68 residues pruned to eliminate duplicates Z: 29 53.136 2.393 0.939 0.779 1.000 0.857 CB 1.692 29 residues pruned to eliminate duplicates Z: 31 48.667 2.320 0.807 0.743 1.000 0.767 CB 1.705 31 residues pruned to eliminate duplicates Z: 29 53.134 2.377 0.930 0.776 1.000 0.821 CB 1.715 29 residues pruned to eliminate duplicates Z: 77 67.993 2.418 0.803 0.632 0.934 0.711 CB 1.692 77 residues pruned to eliminate duplicates Z: 29 52.979 2.373 0.897 0.801 1.000 0.679 CB 1.709 29 residues pruned to eliminate duplicates Z: 177 115.191 2.452 0.927 0.655 0.955 0.670 CB 1.666 177 residues pruned to eliminate duplicates Z: 30 48.126 2.421 0.852 0.763 0.966 0.621 CB 1.634 30 residues pruned to eliminate duplicates Z: 28 51.188 2.404 0.941 0.795 0.963 0.704 CB 1.693 28 residues pruned to eliminate duplicates Z: 31 49.444 2.356 0.913 0.740 1.000 0.667 CB 1.616 31 residues pruned to eliminate duplicates Z: 38 46.482 2.257 0.812 0.713 0.973 0.568 CB 1.583 46 residues pruned to eliminate duplicates Z: 29 52.056 2.437 1.006 0.785 0.964 0.571 CB 1.624 29 residues pruned to eliminate duplicates Z: 31 57.349 2.358 1.155 0.751 1.000 0.633 CB 1.647 30 residues pruned to eliminate duplicates Z: 24 50.357 2.380 1.252 0.930 0.957 0.565 CB 1.432 24 residues pruned to eliminate duplicates Z: 30 58.628 2.408 1.188 0.767 1.000 0.690 CB 1.632 31 residues pruned to eliminate duplicates Z: 24 53.048 2.418 1.132 0.951 0.957 0.565 CB 1.546 24 residues pruned to eliminate duplicates Z: 69 60.179 2.348 0.915 0.596 0.926 0.559 CB 1.598 69 residues pruned to eliminate duplicates Z: 48 55.297 2.400 0.925 0.650 0.957 0.660 CB 1.586 48 residues pruned to eliminate duplicates Z: 76 70.513 2.414 0.981 0.629 0.933 0.600 CB 1.616 76 residues pruned to eliminate duplicates Z: 30 53.711 2.395 1.072 0.770 1.000 0.552 CB 1.583 30 residues pruned to eliminate duplicates Z: 31 49.724 2.380 1.030 0.767 0.967 0.467 CB 1.534 31 residues pruned to eliminate duplicates Z: 29 51.865 2.371 1.128 0.785 0.964 0.571 CB 1.568 29 residues pruned to eliminate duplicates Z: 29 47.495 2.331 1.048 0.788 0.929 0.500 CB 1.572 29 residues pruned to eliminate duplicates Z: 23 12.232 1.688 0.603 0.610 0.909 0.591 CB 0.955 23 residues pruned to eliminate duplicates Z: 11 9.375 1.905 0.353 0.614 0.800 0.500 CB 1.291 10 residues pruned to eliminate duplicates Z: 9 13.417 1.904 0.453 0.854 0.875 0.625 CB 1.448 12 residues pruned to eliminate duplicates Z: 10 12.863 1.780 0.419 0.899 1.000 0.667 CB 1.214 10 residues pruned to eliminate duplicates Z: 9 12.158 1.767 0.445 0.908 1.000 0.625 CB 1.196 8 residues pruned to eliminate duplicates Z: 9 11.101 1.905 0.412 0.851 0.750 0.625 CB 1.440 9 residues pruned to eliminate duplicates Z: 9 10.398 1.918 0.313 0.833 0.750 0.750 CB 1.460 9 residues pruned to eliminate duplicates Z: 20 18.999 2.140 0.539 0.552 0.895 0.526 CB 1.407 Z: 14 21.330 2.207 0.626 0.660 1.000 0.769 CB 1.421 14 residues pruned to eliminate duplicates Z: 11 28.106 2.300 0.659 0.897 1.000 0.900 CB 1.667 16 residues pruned to eliminate duplicates Z: 13 24.495 2.149 0.720 0.836 0.917 0.750 CB 1.563 15 residues pruned to eliminate duplicates Z: 12 32.840 2.266 0.914 0.881 1.000 0.545 CB 1.653 13 residues pruned to eliminate duplicates Z: 15 21.205 1.945 1.091 0.799 0.929 0.643 CB 1.156 15 residues pruned to eliminate duplicates Z: 19 29.429 2.300 0.784 0.620 0.944 0.667 CB 1.599 17 residues pruned to eliminate duplicates Z: 14 24.094 1.959 0.932 0.856 0.923 0.462 CB 1.410 14 residues pruned to eliminate duplicates Z: 44 30.355 2.024 0.580 0.652 0.930 0.674 CB 1.351 15 residues pruned to eliminate duplicates Z: 13 30.840 2.060 0.903 0.878 1.000 0.500 CB 1.648 13 residues pruned to eliminate duplicates Z: 20 24.710 2.263 0.610 0.568 0.947 0.421 CB 1.537 20 residues pruned to eliminate duplicates Z: 20 21.767 2.244 0.440 0.578 0.947 0.579 CB 1.513 20 residues pruned to eliminate duplicates Z: 20 24.146 2.279 0.552 0.573 0.947 0.632 CB 1.541 20 residues pruned to eliminate duplicates Z: 19 23.413 2.313 0.416 0.598 0.944 0.667 CB 1.625 19 residues pruned to eliminate duplicates Z: 20 20.407 2.263 0.363 0.557 0.947 0.579 CB 1.516 20 residues pruned to eliminate duplicates Z: 18 30.571 2.368 0.834 0.631 0.941 0.647 CB 1.603 18 residues pruned to eliminate duplicates Z: 20 23.516 2.261 0.487 0.562 1.000 0.684 CB 1.510 20 residues pruned to eliminate duplicates Z: 19 24.471 2.217 0.586 0.610 0.944 0.722 CB 1.565 19 residues pruned to eliminate duplicates Z: 17 24.630 2.278 0.656 0.619 0.938 0.750 CB 1.555 17 residues pruned to eliminate duplicates Z: 20 18.884 2.120 0.393 0.556 0.895 0.737 CB 1.552 20 residues pruned to eliminate duplicates Z: 20 23.303 2.176 0.656 0.568 0.947 0.632 CB 1.466 20 residues pruned to eliminate duplicates Z: 18 25.377 2.239 0.731 0.620 0.941 0.706 CB 1.507 18 residues pruned to eliminate duplicates Z: 21 20.146 2.074 0.596 0.549 0.900 0.700 CB 1.441 21 residues pruned to eliminate duplicates Z: 21 21.410 2.124 0.635 0.530 0.950 0.650 CB 1.409 21 residues pruned to eliminate duplicates Z: 20 18.456 2.104 0.459 0.586 0.947 0.526 CB 1.341 20 residues pruned to eliminate duplicates Z: 18 23.326 2.222 0.519 0.627 0.941 0.706 CB 1.581 18 residues pruned to eliminate duplicates Z: 19 22.974 2.205 0.628 0.587 0.944 0.667 CB 1.469 19 residues pruned to eliminate duplicates Z: 19 27.884 2.240 0.670 0.620 1.000 0.722 CB 1.569 17 residues pruned to eliminate duplicates Z: 13 23.483 2.215 0.563 0.746 1.000 0.833 CB 1.572 13 residues pruned to eliminate duplicates Z: 71 36.253 2.178 0.513 0.561 0.886 0.657 CB 1.399 71 residues pruned to eliminate duplicates Z: 19 19.562 2.160 0.419 0.575 0.944 0.778 CB 1.482 19 residues pruned to eliminate duplicates Z: 20 16.660 2.094 0.268 0.559 0.895 0.737 CB 1.519 20 residues pruned to eliminate duplicates Z: 28 18.228 2.102 0.330 0.559 0.889 0.704 CB 1.334 28 residues pruned to eliminate duplicates Z: 26 22.230 2.175 0.513 0.545 0.880 0.480 CB 1.469 26 residues pruned to eliminate duplicates Z: 27 23.630 2.159 0.543 0.550 0.962 0.538 CB 1.378 27 residues pruned to eliminate duplicates Z: 10 13.230 2.018 0.498 0.518 0.889 0.556 CB 1.613 10 residues pruned to eliminate duplicates Z: 41 25.375 1.996 0.611 0.552 0.900 0.575 CB 1.318 41 residues pruned to eliminate duplicates Z: 53 35.437 2.142 0.598 0.587 0.962 0.635 CB 1.373 53 residues pruned to eliminate duplicates Z: 41 24.972 2.004 0.605 0.533 0.900 0.650 CB 1.320 41 residues pruned to eliminate duplicates Z: 10 13.298 2.129 0.336 0.579 1.000 0.667 CB 1.444 10 residues pruned to eliminate duplicates Z: 39 26.827 2.041 0.643 0.574 0.921 0.526 CB 1.312 39 residues pruned to eliminate duplicates Z: 42 27.735 2.015 0.659 0.561 0.927 0.707 CB 1.317 42 residues pruned to eliminate duplicates Z: 34 22.095 1.954 0.605 0.609 0.909 0.606 CB 1.217 34 residues pruned to eliminate duplicates Z: 37 21.651 1.935 0.574 0.610 0.917 0.639 CB 1.164 37 residues pruned to eliminate duplicates Z: 37 23.954 1.978 0.600 0.577 0.917 0.528 CB 1.278 37 residues pruned to eliminate duplicates Z: 31 25.219 1.971 0.835 0.625 0.900 0.633 CB 1.257 31 residues pruned to eliminate duplicates Z: 19 21.962 1.916 0.806 0.761 1.000 0.722 CB 1.186 19 residues pruned to eliminate duplicates Z: 39 24.580 1.972 0.712 0.576 0.921 0.579 CB 1.192 39 residues pruned to eliminate duplicates Z: 25 23.019 1.831 0.926 0.628 0.917 0.542 CB 1.288 25 residues pruned to eliminate duplicates Z: 71 43.640 2.139 0.750 0.589 0.929 0.571 CB 1.378 71 residues pruned to eliminate duplicates Z: 29 21.495 1.845 0.806 0.619 0.929 0.429 CB 1.174 29 residues pruned to eliminate duplicates Z: 34 25.573 1.942 0.869 0.603 0.879 0.515 CB 1.266 34 residues pruned to eliminate duplicates Z: 34 19.383 1.884 0.663 0.541 0.909 0.515 CB 1.138 34 residues pruned to eliminate duplicates Z: 40 27.072 2.009 0.690 0.565 0.923 0.487 CB 1.299 40 residues pruned to eliminate duplicates Z: 26 19.353 1.865 0.840 0.632 0.880 0.600 CB 1.133 26 residues pruned to eliminate duplicates Z: 30 19.556 1.864 0.758 0.594 0.897 0.310 CB 1.130 30 residues pruned to eliminate duplicates Z: 38 22.011 1.962 0.662 0.580 0.892 0.568 CB 1.153 38 residues pruned to eliminate duplicates Z: 33 23.058 1.943 0.744 0.554 0.875 0.375 CB 1.305 33 residues pruned to eliminate duplicates Z: 33 25.409 1.905 0.825 0.591 0.938 0.469 CB 1.264 33 residues pruned to eliminate duplicates Z: 20 11.996 1.834 0.718 0.251 0.842 0.421 CB 1.380 20 residues pruned to eliminate duplicates Z: 14 12.940 2.035 0.724 0.366 0.846 0.538 CB 1.397 14 residues pruned to eliminate duplicates Z: 40 24.663 1.975 0.745 0.574 0.872 0.487 CB 1.223 40 residues pruned to eliminate duplicates Z: 31 24.191 1.907 0.889 0.596 0.900 0.400 CB 1.244 31 residues pruned to eliminate duplicates Z: 33 25.877 2.037 0.900 0.570 0.906 0.531 CB 1.219 33 residues pruned to eliminate duplicates Z: 16 13.073 1.925 0.628 0.337 0.867 0.333 CB 1.485 16 residues pruned to eliminate duplicates Z: 43 24.740 1.991 0.691 0.518 0.857 0.381 CB 1.300 43 residues pruned to eliminate duplicates Z: 15 11.706 1.960 0.632 0.367 0.857 0.500 CB 1.316 15 residues pruned to eliminate duplicates Z: 16 10.280 1.890 0.530 0.315 0.800 0.533 CB 1.408 16 residues pruned to eliminate duplicates Z: 16 10.557 1.846 0.484 0.298 0.867 0.400 CB 1.438 16 residues pruned to eliminate duplicates Z: 32 25.501 1.925 0.787 0.576 0.968 0.419 CB 1.278 32 residues pruned to eliminate duplicates Z: 7 3.663 1.955 0.684 0.083 0.667 0.500 CB 1.168 7 residues pruned to eliminate duplicates Z: 35 35.591 2.217 0.849 0.597 0.941 0.559 CB 1.442 Z: 15 28.745 2.056 0.933 0.840 0.929 0.643 CB 1.553 15 residues pruned to eliminate duplicates Z: 28 29.922 2.149 0.906 0.596 0.889 0.667 CB 1.443 28 residues pruned to eliminate duplicates Z: 26 32.549 2.179 0.736 0.642 0.960 0.520 CB 1.569 26 residues pruned to eliminate duplicates Z: 25 35.006 2.206 0.808 0.631 1.000 0.625 CB 1.585 25 residues pruned to eliminate duplicates Z: 25 34.130 2.179 0.869 0.680 0.958 0.625 CB 1.513 25 residues pruned to eliminate duplicates Z: 24 36.186 2.236 0.854 0.694 1.000 0.652 CB 1.524 24 residues pruned to eliminate duplicates Z: 37 32.307 2.145 0.798 0.562 0.917 0.583 CB 1.434 35 residues pruned to eliminate duplicates Z: 18 23.605 2.131 0.799 0.684 0.882 0.529 CB 1.430 18 residues pruned to eliminate duplicates Z: 56 51.795 2.282 0.876 0.600 0.945 0.618 CB 1.568 93 residues pruned to eliminate duplicates Z: 56 51.392 2.266 0.902 0.602 0.927 0.636 CB 1.574 56 residues pruned to eliminate duplicates Z: 15 16.405 2.048 0.698 0.417 0.929 0.286 CB 1.481 Z: 7 8.199 1.920 0.457 0.387 1.000 0.500 CA 1.349 7 residues pruned to eliminate duplicates Z: 35 27.530 2.151 0.652 0.613 0.882 0.618 CB 1.353 15 residues pruned to eliminate duplicates Z: 6 6.205 1.455 1.032 0.381 1.000 0.800 CA 1.065 6 residues pruned to eliminate duplicates Z: 24 29.303 2.196 0.780 0.673 0.913 0.696 CB 1.459 24 residues pruned to eliminate duplicates Z: 18 17.220 2.143 0.438 0.460 0.941 0.588 CB 1.500 18 residues pruned to eliminate duplicates Z: 13 13.883 1.953 0.287 0.716 1.000 0.750 CB 1.311 13 residues pruned to eliminate duplicates Z: 18 18.710 2.135 0.486 0.528 0.941 0.647 CB 1.479 18 residues pruned to eliminate duplicates Z: 11 12.721 2.017 0.440 0.583 0.900 0.500 CB 1.421 11 residues pruned to eliminate duplicates Z: 11 15.606 2.101 0.410 0.668 1.000 0.500 CB 1.426 11 residues pruned to eliminate duplicates Z: 13 13.526 2.030 0.411 0.584 0.917 0.583 CB 1.371 13 residues pruned to eliminate duplicates Z: 14 9.615 1.871 0.309 0.582 0.846 0.538 CB 1.189 14 residues pruned to eliminate duplicates Z: 14 11.445 1.973 0.389 0.545 0.846 0.385 CB 1.311 14 residues pruned to eliminate duplicates Z: 12 11.316 1.950 0.166 0.675 0.909 0.636 CB 1.406 12 residues pruned to eliminate duplicates Z: 19 14.945 2.117 0.322 0.524 0.889 0.556 CB 1.382 19 residues pruned to eliminate duplicates Z: 24 14.515 1.894 0.456 0.465 0.870 0.478 CB 1.308 24 residues pruned to eliminate duplicates Z: 56 52.937 2.337 0.788 0.582 0.964 0.491 CB 1.639 56 residues pruned to eliminate duplicates Z: 19 15.981 2.118 0.458 0.519 0.889 0.556 CB 1.347 19 residues pruned to eliminate duplicates Z: 7 9.678 2.181 0.550 0.555 0.833 0.500 CB 1.329 7 residues pruned to eliminate duplicates Z: 19 16.942 2.120 0.325 0.585 0.944 0.556 CB 1.387 19 residues pruned to eliminate duplicates Z: 19 18.840 2.158 0.556 0.571 0.889 0.667 CB 1.388 19 residues pruned to eliminate duplicates Z: 7 21.774 2.505 0.893 0.580 1.000 0.167 CA 1.736 7 residues pruned to eliminate duplicates Z: 55 59.980 2.385 0.937 0.606 0.981 0.556 CB 1.628 55 residues pruned to eliminate duplicates Z: 7 11.146 2.043 0.828 0.694 0.833 0.667 CA 1.225 7 residues pruned to eliminate duplicates Z: 55 56.662 2.378 0.890 0.598 0.981 0.574 CB 1.592 55 residues pruned to eliminate duplicates Z: 56 49.385 2.327 0.860 0.558 0.927 0.582 CB 1.568 56 residues pruned to eliminate duplicates Z: 55 58.234 2.367 0.863 0.609 1.000 0.593 CB 1.621 55 residues pruned to eliminate duplicates Z: 36 59.914 2.496 1.089 0.670 0.914 0.714 CB 1.816 36 residues pruned to eliminate duplicates Z: 48 47.540 2.323 0.855 0.590 0.936 0.638 CB 1.577 48 residues pruned to eliminate duplicates Z: 43 55.313 2.456 0.954 0.607 0.952 0.690 CB 1.687 43 residues pruned to eliminate duplicates Z: 55 54.829 2.387 0.805 0.610 0.963 0.685 CB 1.620 55 residues pruned to eliminate duplicates Z: 55 53.268 2.360 0.719 0.620 0.963 0.685 CB 1.657 55 residues pruned to eliminate duplicates Z: 44 50.864 2.392 0.917 0.591 0.930 0.581 CB 1.665 44 residues pruned to eliminate duplicates Z: 36 58.802 2.466 0.998 0.684 0.943 0.571 CB 1.807 36 residues pruned to eliminate duplicates Z: 86 56.439 2.286 0.692 0.585 0.929 0.647 CB 1.569 86 residues pruned to eliminate duplicates Z: 40 48.773 2.434 0.781 0.595 0.949 0.641 CB 1.736 40 residues pruned to eliminate duplicates Z: 55 49.098 2.371 0.666 0.598 0.926 0.685 CB 1.664 55 residues pruned to eliminate duplicates Z: 73 58.516 2.331 0.704 0.611 0.972 0.625 CB 1.607 73 residues pruned to eliminate duplicates Z: 85 59.897 2.334 0.767 0.574 0.929 0.631 CB 1.589 85 residues pruned to eliminate duplicates Z: 67 60.225 2.403 0.731 0.628 0.924 0.667 CB 1.709 67 residues pruned to eliminate duplicates Z: 36 60.043 2.522 0.872 0.651 0.971 0.629 CB 1.923 36 residues pruned to eliminate duplicates Z: 13 33.571 2.539 0.868 0.516 1.000 0.417 CA 2.010 13 residues pruned to eliminate duplicates Z: 13 38.586 2.561 1.149 0.503 1.000 0.333 CA 2.017 13 residues pruned to eliminate duplicates Z: 57 48.403 2.336 0.694 0.569 0.964 0.625 CB 1.586 57 residues pruned to eliminate duplicates Z: 44 48.558 2.410 0.850 0.542 0.930 0.535 CB 1.713 44 residues pruned to eliminate duplicates Z: 13 37.661 2.533 1.085 0.543 1.000 0.500 CA 1.973 13 residues pruned to eliminate duplicates Z: 14 28.557 2.454 1.022 0.477 0.923 0.462 CA 1.771 14 residues pruned to eliminate duplicates Z: 58 44.907 2.281 0.775 0.536 0.877 0.526 CB 1.616 58 residues pruned to eliminate duplicates Z: 16 22.619 2.264 0.908 0.426 0.867 0.333 CB 1.686 16 residues pruned to eliminate duplicates Z: 13 34.007 2.495 0.905 0.561 1.000 0.250 CA 1.946 13 residues pruned to eliminate duplicates Z: 13 35.996 2.520 0.976 0.542 1.000 0.333 CA 2.001 13 residues pruned to eliminate duplicates Z: 44 45.206 2.403 0.843 0.548 0.907 0.581 CB 1.637 44 residues pruned to eliminate duplicates Z: 40 43.510 2.282 0.923 0.556 0.923 0.513 CB 1.630 40 residues pruned to eliminate duplicates Z: 31 40.738 2.317 0.658 0.640 0.967 0.633 CB 1.756 31 residues pruned to eliminate duplicates Z: 51 50.883 2.311 0.978 0.605 0.900 0.640 CB 1.583 51 residues pruned to eliminate duplicates Z: 44 39.476 2.276 0.759 0.516 0.930 0.558 CB 1.591 44 residues pruned to eliminate duplicates Z: 33 30.280 2.261 0.718 0.573 0.844 0.562 CB 1.523 33 residues pruned to eliminate duplicates Z: 18 34.885 2.266 0.763 0.808 1.000 0.824 CB 1.619 18 residues pruned to eliminate duplicates Z: 43 41.489 2.313 0.773 0.520 0.905 0.476 CB 1.692 43 residues pruned to eliminate duplicates Z: 66 59.311 2.368 0.781 0.593 0.938 0.677 CB 1.701 66 residues pruned to eliminate duplicates Z: 67 50.290 2.282 0.782 0.581 0.909 0.561 CB 1.548 67 residues pruned to eliminate duplicates Z: 31 36.010 2.324 0.672 0.610 0.933 0.700 CB 1.633 31 residues pruned to eliminate duplicates Z: 44 40.555 2.284 0.835 0.552 0.860 0.512 CB 1.629 44 residues pruned to eliminate duplicates Z: 19 29.550 2.236 0.654 0.724 0.944 0.722 CB 1.629 19 residues pruned to eliminate duplicates Z: 84 58.452 2.322 0.698 0.588 0.928 0.602 CB 1.612 84 residues pruned to eliminate duplicates Z: 68 52.362 2.282 0.808 0.573 0.955 0.567 CB 1.513 68 residues pruned to eliminate duplicates Z: 57 51.016 2.257 0.938 0.606 0.911 0.696 CB 1.547 57 residues pruned to eliminate duplicates Z: 44 40.415 2.289 0.722 0.625 0.907 0.581 CB 1.532 44 residues pruned to eliminate duplicates Z: 89 68.113 2.362 0.831 0.607 0.943 0.568 CB 1.608 89 residues pruned to eliminate duplicates Z: 29 37.424 2.274 0.765 0.635 0.964 0.536 CB 1.611 29 residues pruned to eliminate duplicates Z: 42 28.810 2.146 0.728 0.498 0.902 0.561 CB 1.347 42 residues pruned to eliminate duplicates Z: 39 28.412 2.191 0.766 0.495 0.895 0.553 CB 1.339 39 residues pruned to eliminate duplicates Z: 65 55.967 2.358 0.780 0.578 0.906 0.656 CB 1.706 65 residues pruned to eliminate duplicates Z: 33 32.337 2.195 0.754 0.564 0.938 0.531 CB 1.488 33 residues pruned to eliminate duplicates Z: 55 49.109 2.291 0.852 0.594 0.926 0.574 CB 1.555 55 residues pruned to eliminate duplicates Z: 15 15.687 2.191 0.966 0.377 0.857 0.571 CB 1.294 15 residues pruned to eliminate duplicates Z: 30 30.674 2.198 1.056 0.512 0.862 0.483 CB 1.446 30 residues pruned to eliminate duplicates Z: 41 33.093 2.213 0.723 0.483 0.850 0.600 CB 1.642 41 residues pruned to eliminate duplicates Z: 45 45.294 2.299 0.877 0.566 0.909 0.545 CB 1.633 45 residues pruned to eliminate duplicates Z: 45 46.033 2.348 0.843 0.561 0.932 0.591 CB 1.622 45 residues pruned to eliminate duplicates Z: 58 38.514 2.170 0.785 0.548 0.930 0.456 CB 1.352 58 residues pruned to eliminate duplicates Z: 32 37.470 2.263 0.795 0.585 0.968 0.645 CB 1.577 32 residues pruned to eliminate duplicates Z: 28 15.374 1.933 0.798 0.393 0.741 0.481 CB 1.287 28 residues pruned to eliminate duplicates Z: 53 33.879 2.178 0.752 0.509 0.885 0.519 CB 1.380 53 residues pruned to eliminate duplicates Z: 42 31.560 2.211 0.832 0.472 0.878 0.561 CB 1.425 42 residues pruned to eliminate duplicates Z: 41 40.831 2.226 1.052 0.572 0.875 0.625 CB 1.507 41 residues pruned to eliminate duplicates Z: 58 45.282 2.241 0.750 0.600 0.947 0.632 CB 1.468 58 residues pruned to eliminate duplicates Z: 49 32.276 2.120 0.823 0.496 0.896 0.562 CB 1.351 49 residues pruned to eliminate duplicates Z: 57 51.348 2.355 0.753 0.594 0.929 0.518 CB 1.637 57 residues pruned to eliminate duplicates Z: 64 49.173 2.252 0.837 0.543 0.905 0.603 CB 1.588 64 residues pruned to eliminate duplicates Z: 44 47.338 2.347 0.817 0.674 0.907 0.744 CB 1.590 44 residues pruned to eliminate duplicates Z: 110 68.525 2.327 0.740 0.599 0.936 0.615 CB 1.576 110 residues pruned to eliminate duplicates Z: 24 27.858 2.231 0.713 0.612 0.913 0.652 CB 1.497 24 residues pruned to eliminate duplicates Z: 66 36.316 2.149 0.674 0.471 0.908 0.477 CB 1.421 66 residues pruned to eliminate duplicates Z: 43 29.616 2.156 0.735 0.483 0.881 0.548 CB 1.411 43 residues pruned to eliminate duplicates Z: 109 64.415 2.270 0.724 0.591 0.926 0.565 CB 1.567 109 residues pruned to eliminate duplicates Z: 69 46.812 2.260 0.808 0.549 0.853 0.471 CB 1.554 69 residues pruned to eliminate duplicates Z: 31 28.253 2.098 0.563 0.647 0.900 0.633 CB 1.524 31 residues pruned to eliminate duplicates Z: 25 30.852 2.270 0.661 0.649 0.958 0.583 CB 1.517 25 residues pruned to eliminate duplicates Z: 57 49.264 2.284 0.870 0.591 0.929 0.571 CB 1.521 57 residues pruned to eliminate duplicates Z: 92 65.325 2.332 0.823 0.578 0.923 0.615 CB 1.619 92 residues pruned to eliminate duplicates Z: 26 30.077 2.215 0.882 0.613 0.920 0.600 CB 1.409 26 residues pruned to eliminate duplicates Z: 100 69.473 2.318 0.883 0.581 0.929 0.616 CB 1.592 100 residues pruned to eliminate duplicates Z: 38 31.152 2.176 0.926 0.424 0.838 0.405 CB 1.579 38 residues pruned to eliminate duplicates Z: 26 31.781 2.237 0.861 0.589 0.960 0.520 CB 1.462 26 residues pruned to eliminate duplicates Z: 27 30.409 2.182 0.735 0.615 1.000 0.538 CB 1.413 27 residues pruned to eliminate duplicates Z: 36 34.765 2.201 0.855 0.598 0.914 0.657 CB 1.434 36 residues pruned to eliminate duplicates Z: 41 38.838 2.250 1.007 0.541 0.900 0.625 CB 1.452 41 residues pruned to eliminate duplicates Z: 28 27.792 2.167 0.651 0.607 0.963 0.593 CB 1.402 28 residues pruned to eliminate duplicates Z: 80 37.052 2.133 0.551 0.511 0.937 0.633 CB 1.330 141 residues pruned to eliminate duplicates Z: 18 30.235 2.154 0.666 0.816 1.000 0.882 CB 1.553 18 residues pruned to eliminate duplicates Z: 40 32.908 2.238 0.633 0.587 0.949 0.744 CB 1.398 40 residues pruned to eliminate duplicates Z: 36 30.790 2.220 0.625 0.620 0.914 0.714 CB 1.409 36 residues pruned to eliminate duplicates Z: 55 34.406 2.234 0.637 0.539 0.907 0.667 CB 1.358 55 residues pruned to eliminate duplicates Z: 40 35.432 2.241 0.713 0.591 0.949 0.744 CB 1.428 40 residues pruned to eliminate duplicates Z: 39 35.686 2.250 0.683 0.612 0.974 0.632 CB 1.412 39 residues pruned to eliminate duplicates Z: 81 44.969 2.144 0.753 0.550 0.925 0.575 CB 1.377 81 residues pruned to eliminate duplicates Z: 50 33.870 2.195 0.625 0.596 0.918 0.633 CB 1.348 50 residues pruned to eliminate duplicates Z: 29 34.736 2.278 0.754 0.690 0.964 0.750 CB 1.433 29 residues pruned to eliminate duplicates Z: 39 34.104 2.262 0.750 0.589 0.947 0.737 CB 1.355 39 residues pruned to eliminate duplicates Z: 29 35.476 2.252 0.926 0.686 0.964 0.607 CB 1.352 29 residues pruned to eliminate duplicates Z: 42 35.012 2.232 0.786 0.561 0.951 0.634 CB 1.359 42 residues pruned to eliminate duplicates Z: 140 88.435 2.340 0.844 0.668 0.935 0.712 CB 1.591 140 residues pruned to eliminate duplicates Z: 40 38.944 2.221 0.889 0.606 0.974 0.718 CB 1.379 40 residues pruned to eliminate duplicates Z: 47 33.431 2.235 0.639 0.580 0.935 0.696 CB 1.333 47 residues pruned to eliminate duplicates Z: 40 32.963 2.207 0.907 0.551 0.897 0.667 CB 1.330 40 residues pruned to eliminate duplicates Z: 38 35.345 2.265 0.788 0.603 0.946 0.595 CB 1.376 38 residues pruned to eliminate duplicates Z: 55 36.700 2.196 0.735 0.549 0.944 0.537 CB 1.323 55 residues pruned to eliminate duplicates Z: 40 33.973 2.257 0.823 0.579 0.897 0.564 CB 1.366 40 residues pruned to eliminate duplicates Z: 34 37.230 2.271 0.832 0.660 0.939 0.727 CB 1.430 34 residues pruned to eliminate duplicates Z: 48 37.230 2.205 0.776 0.567 0.936 0.681 CB 1.389 48 residues pruned to eliminate duplicates Z: 56 29.396 2.180 0.584 0.528 0.909 0.545 CB 1.228 56 residues pruned to eliminate duplicates Z: 39 34.767 2.261 0.828 0.556 0.947 0.711 CB 1.364 39 residues pruned to eliminate duplicates Z: 38 37.061 2.259 0.920 0.578 0.919 0.595 CB 1.418 38 residues pruned to eliminate duplicates Z: 23 16.871 2.143 0.617 0.441 0.909 0.364 CB 1.214 23 residues pruned to eliminate duplicates Z: 48 32.862 2.216 0.679 0.565 0.957 0.660 CB 1.264 48 residues pruned to eliminate duplicates Z: 47 39.518 2.247 0.806 0.586 0.978 0.587 CB 1.352 47 residues pruned to eliminate duplicates Z: 51 34.532 2.198 0.780 0.559 0.940 0.540 CB 1.254 51 residues pruned to eliminate duplicates Z: 53 35.613 2.202 0.712 0.578 0.942 0.635 CB 1.289 53 residues pruned to eliminate duplicates Z: 48 39.366 2.236 0.863 0.595 0.979 0.638 CB 1.286 48 residues pruned to eliminate duplicates Z: 66 40.976 2.199 0.692 0.548 0.954 0.585 CB 1.367 66 residues pruned to eliminate duplicates Z: 33 17.839 2.139 0.499 0.421 0.844 0.531 CB 1.266 33 residues pruned to eliminate duplicates Z: 49 34.404 2.235 0.711 0.558 0.958 0.604 CB 1.281 49 residues pruned to eliminate duplicates Z: 24 10.845 1.934 0.469 0.383 0.826 0.522 CB 1.092 24 residues pruned to eliminate duplicates Z: 54 36.003 2.195 0.709 0.580 0.943 0.642 CB 1.294 54 residues pruned to eliminate duplicates Z: 10 7.544 2.099 0.089 0.591 0.889 0.667 CB 1.134 10 residues pruned to eliminate duplicates Z: 43 36.438 2.257 0.801 0.551 0.952 0.595 CB 1.381 43 residues pruned to eliminate duplicates Z: 152 87.162 2.292 0.861 0.606 0.940 0.656 CB 1.599 152 residues pruned to eliminate duplicates Z: 63 41.655 2.178 0.749 0.529 0.935 0.629 CB 1.443 63 residues pruned to eliminate duplicates Z: 60 39.633 2.204 0.736 0.494 0.949 0.559 CB 1.429 60 residues pruned to eliminate duplicates Z: 134 88.247 2.328 0.880 0.655 0.955 0.669 CB 1.585 134 residues pruned to eliminate duplicates Z: 94 80.477 2.349 0.762 0.699 0.957 0.753 CB 1.757 94 residues pruned to eliminate duplicates Z: 91 88.511 2.401 0.887 0.720 0.944 0.756 CB 1.787 91 residues pruned to eliminate duplicates Z: 92 83.829 2.369 0.892 0.713 0.923 0.725 CB 1.752 92 residues pruned to eliminate duplicates Z: 16 25.153 2.129 0.712 0.592 0.933 0.867 CB 1.748 16 residues pruned to eliminate duplicates Z: 91 89.803 2.395 0.907 0.730 0.967 0.789 CB 1.743 91 residues pruned to eliminate duplicates Z: 14 26.688 2.194 0.703 0.618 1.000 0.692 CB 1.771 14 residues pruned to eliminate duplicates Z: 17 19.162 1.972 0.815 0.480 0.875 0.562 CB 1.561 17 residues pruned to eliminate duplicates Z: 100 83.968 2.344 0.879 0.678 0.960 0.717 CB 1.695 100 residues pruned to eliminate duplicates Z: 20 18.975 2.019 0.722 0.448 0.842 0.684 CB 1.568 20 residues pruned to eliminate duplicates Z: 90 86.126 2.407 0.907 0.703 0.933 0.730 CB 1.772 90 residues pruned to eliminate duplicates Z: 10 3.054 1.737 -0.006 0.237 0.889 0.667 CB 0.900 10 residues pruned to eliminate duplicates Z: 65 41.887 2.215 0.767 0.562 0.922 0.688 CB 1.366 65 residues pruned to eliminate duplicates Z: 16 24.700 2.244 0.714 0.529 0.933 0.600 CB 1.726 16 residues pruned to eliminate duplicates Z: 91 80.067 2.386 0.806 0.704 0.933 0.767 CB 1.744 91 residues pruned to eliminate duplicates Z: 94 82.641 2.322 0.923 0.709 0.968 0.753 CB 1.640 94 residues pruned to eliminate duplicates Z: 90 92.961 2.424 0.920 0.728 0.966 0.742 CB 1.785 90 residues pruned to eliminate duplicates Z: 89 86.173 2.380 0.923 0.741 0.966 0.693 CB 1.674 89 residues pruned to eliminate duplicates Z: 75 83.836 2.441 0.875 0.772 0.946 0.757 CB 1.769 75 residues pruned to eliminate duplicates Z: 107 82.266 2.344 0.877 0.666 0.925 0.689 CB 1.685 107 residues pruned to eliminate duplicates Z: 110 74.601 2.335 0.705 0.655 0.917 0.688 CB 1.694 110 residues pruned to eliminate duplicates Z: 142 85.664 2.330 0.856 0.643 0.929 0.695 CB 1.571 142 residues pruned to eliminate duplicates Z: 91 89.168 2.406 0.956 0.717 0.933 0.711 CB 1.758 91 residues pruned to eliminate duplicates Z: 87 73.051 2.363 0.886 0.680 0.895 0.698 CB 1.672 87 residues pruned to eliminate duplicates Z: 90 93.504 2.420 0.980 0.722 0.955 0.742 CB 1.772 90 residues pruned to eliminate duplicates Z: 29 46.206 2.445 1.010 0.670 0.964 0.750 CB 1.574 29 residues pruned to eliminate duplicates Z: 92 87.174 2.375 0.905 0.715 0.956 0.692 CB 1.740 92 residues pruned to eliminate duplicates Z: 90 89.587 2.408 0.899 0.719 0.978 0.775 CB 1.742 90 residues pruned to eliminate duplicates Z: 42 51.332 2.417 0.851 0.637 0.927 0.756 CB 1.701 42 residues pruned to eliminate duplicates Z: 94 54.292 2.266 0.792 0.532 0.925 0.667 CB 1.453 94 residues pruned to eliminate duplicates Z: 91 88.562 2.411 0.861 0.721 0.967 0.733 CB 1.763 91 residues pruned to eliminate duplicates Z: 103 80.316 2.338 0.860 0.660 0.922 0.686 CB 1.711 103 residues pruned to eliminate duplicates Z: 103 75.452 2.347 0.876 0.657 0.892 0.637 CB 1.644 103 residues pruned to eliminate duplicates Z: 30 46.363 2.457 1.070 0.653 0.897 0.621 CB 1.638 30 residues pruned to eliminate duplicates Z: 89 90.194 2.444 0.926 0.726 0.943 0.739 CB 1.766 89 residues pruned to eliminate duplicates Z: 90 78.307 2.374 0.854 0.713 0.933 0.607 CB 1.667 90 residues pruned to eliminate duplicates Z: 105 86.290 2.380 0.938 0.673 0.933 0.683 CB 1.676 105 residues pruned to eliminate duplicates Z: 80 57.469 2.266 0.996 0.556 0.886 0.582 CB 1.528 80 residues pruned to eliminate duplicates Z: 91 87.225 2.411 0.905 0.713 0.944 0.733 CB 1.748 91 residues pruned to eliminate duplicates Z: 135 94.573 2.360 0.955 0.661 0.940 0.679 CB 1.622 135 residues pruned to eliminate duplicates Z: 89 92.251 2.443 0.925 0.735 0.955 0.705 CB 1.774 89 residues pruned to eliminate duplicates Z: 91 92.483 2.413 0.960 0.714 0.967 0.689 CB 1.757 91 residues pruned to eliminate duplicates Z: 90 91.426 2.430 0.928 0.726 0.955 0.685 CB 1.767 90 residues pruned to eliminate duplicates Z: 91 91.266 2.403 0.972 0.714 0.967 0.633 CB 1.729 91 residues pruned to eliminate duplicates Z: 87 80.489 2.389 0.986 0.687 0.930 0.663 CB 1.657 87 residues pruned to eliminate duplicates Z: 96 85.768 2.349 0.951 0.678 0.947 0.674 CB 1.720 96 residues pruned to eliminate duplicates Z: 105 81.291 2.327 0.858 0.678 0.962 0.654 CB 1.627 105 residues pruned to eliminate duplicates Z: 91 86.040 2.415 0.916 0.708 0.922 0.722 CB 1.759 91 residues pruned to eliminate duplicates Z: 91 87.533 2.410 0.933 0.727 0.911 0.689 CB 1.772 91 residues pruned to eliminate duplicates Z: 88 75.523 2.347 0.866 0.688 0.908 0.667 CB 1.713 88 residues pruned to eliminate duplicates Z: 77 88.566 2.431 1.014 0.747 0.947 0.671 CB 1.757 77 residues pruned to eliminate duplicates Z: 94 84.498 2.372 0.894 0.711 0.914 0.699 CB 1.762 94 residues pruned to eliminate duplicates Z: 48 69.999 2.410 0.829 0.792 0.957 0.681 CB 1.873 48 residues pruned to eliminate duplicates Z: 92 86.231 2.393 0.937 0.707 0.934 0.692 CB 1.730 92 residues pruned to eliminate duplicates Z: 90 90.892 2.429 0.965 0.724 0.933 0.663 CB 1.769 90 residues pruned to eliminate duplicates Z: 175 88.643 2.284 0.817 0.619 0.920 0.644 CB 1.573 159 residues pruned to eliminate duplicates Z: 14 45.147 2.528 0.885 0.911 1.000 0.846 CB 1.862 14 residues pruned to eliminate duplicates Z: 52 70.737 2.407 0.902 0.771 0.941 0.686 CB 1.809 52 residues pruned to eliminate duplicates Z: 73 91.352 2.472 0.991 0.783 0.972 0.722 CB 1.754 73 residues pruned to eliminate duplicates Z: 89 86.540 2.372 0.943 0.705 0.943 0.670 CB 1.761 89 residues pruned to eliminate duplicates Z: 75 89.313 2.447 0.963 0.772 0.959 0.676 CB 1.771 75 residues pruned to eliminate duplicates Z: 60 60.155 2.295 0.795 0.700 0.898 0.712 CB 1.763 60 residues pruned to eliminate duplicates Z: 74 90.650 2.471 0.900 0.781 0.973 0.699 CB 1.814 74 residues pruned to eliminate duplicates Z: 91 90.525 2.412 0.914 0.718 0.956 0.711 CB 1.776 91 residues pruned to eliminate duplicates Z: 91 85.471 2.387 0.916 0.706 0.944 0.656 CB 1.730 91 residues pruned to eliminate duplicates Z: 53 63.315 2.340 0.848 0.750 0.923 0.692 CB 1.760 53 residues pruned to eliminate duplicates Z: 90 91.561 2.421 0.942 0.718 0.966 0.663 CB 1.754 90 residues pruned to eliminate duplicates Z: 90 92.660 2.427 0.957 0.726 0.955 0.753 CB 1.766 90 residues pruned to eliminate duplicates Z: 87 76.689 2.386 0.847 0.683 0.942 0.733 CB 1.683 87 residues pruned to eliminate duplicates Z: 99 82.167 2.354 0.936 0.672 0.918 0.735 CB 1.692 99 residues pruned to eliminate duplicates Z: 75 88.252 2.449 0.962 0.753 0.959 0.730 CB 1.776 75 residues pruned to eliminate duplicates Z: 91 89.307 2.395 0.925 0.713 0.956 0.722 CB 1.762 91 residues pruned to eliminate duplicates Z: 75 91.085 2.454 0.994 0.773 0.959 0.743 CB 1.771 75 residues pruned to eliminate duplicates Z: 79 84.192 2.412 1.033 0.726 0.923 0.692 CB 1.718 79 residues pruned to eliminate duplicates Z: 74 95.026 2.476 1.071 0.773 0.959 0.740 CB 1.777 74 residues pruned to eliminate duplicates Z: 92 90.729 2.409 0.976 0.700 0.956 0.670 CB 1.741 92 residues pruned to eliminate duplicates Z: 102 77.996 2.364 0.846 0.661 0.891 0.614 CB 1.719 102 residues pruned to eliminate duplicates Z: 89 84.666 2.383 0.920 0.703 0.955 0.648 CB 1.718 89 residues pruned to eliminate duplicates Z: 76 93.042 2.434 1.067 0.759 0.960 0.653 CB 1.767 76 residues pruned to eliminate duplicates Z: 87 78.723 2.385 0.934 0.683 0.942 0.605 CB 1.651 87 residues pruned to eliminate duplicates Z: 92 86.273 2.382 0.965 0.706 0.934 0.670 CB 1.715 92 residues pruned to eliminate duplicates Z: 74 93.181 2.457 1.049 0.771 0.973 0.671 CB 1.753 74 residues pruned to eliminate duplicates Z: 91 89.081 2.398 0.912 0.716 0.967 0.700 CB 1.741 91 residues pruned to eliminate duplicates Z: 91 91.701 2.404 0.982 0.718 0.956 0.656 CB 1.743 91 residues pruned to eliminate duplicates Z: 91 88.651 2.401 0.955 0.710 0.944 0.656 CB 1.742 91 residues pruned to eliminate duplicates Z: 75 85.654 2.430 0.996 0.766 0.946 0.622 CB 1.714 75 residues pruned to eliminate duplicates Z: 91 87.798 2.383 0.923 0.713 0.956 0.589 CB 1.743 91 residues pruned to eliminate duplicates Z: 91 89.066 2.389 1.053 0.708 0.922 0.667 CB 1.718 91 residues pruned to eliminate duplicates Z: 10 7.908 2.070 0.418 0.333 0.778 0.444 CB 1.387 10 residues pruned to eliminate duplicates Z: 11 6.916 2.075 0.560 0.333 0.700 0.500 CB 1.159 11 residues pruned to eliminate duplicates Z: 10 5.790 1.799 0.370 0.429 0.667 0.444 CB 1.265 10 residues pruned to eliminate duplicates Z: 147 90.507 2.310 0.897 0.639 0.938 0.610 CB 1.599 147 residues pruned to eliminate duplicates Z: 100 86.463 2.357 0.936 0.699 0.929 0.657 CB 1.710 100 residues pruned to eliminate duplicates Z: 84 46.327 2.218 0.608 0.575 0.904 0.651 CB 1.467 83 residues pruned to eliminate duplicates 6 1.292 1.528 0.500 0.356 0.800 0.600 CA 0.368 ? Z: 6 3.687 1.645 0.684 0.283 0.800 0.400 CA 0.951 6 residues pruned to eliminate duplicates Z: 28 31.498 2.194 0.820 0.635 0.926 0.667 CB 1.445 28 residues pruned to eliminate duplicates Z: 42 27.577 2.194 0.565 0.501 0.902 0.561 CB 1.388 42 residues pruned to eliminate duplicates Z: 49 38.983 2.261 0.746 0.536 0.917 0.646 CB 1.500 49 residues pruned to eliminate duplicates Z: 28 24.605 2.145 0.574 0.633 0.963 0.630 CB 1.286 28 residues pruned to eliminate duplicates Z: 51 33.090 2.205 0.552 0.516 0.940 0.640 CB 1.432 51 residues pruned to eliminate duplicates Z: 50 36.926 2.244 0.642 0.510 0.959 0.694 CB 1.478 50 residues pruned to eliminate duplicates Z: 51 35.384 2.230 0.785 0.451 0.880 0.660 CB 1.502 51 residues pruned to eliminate duplicates Z: 19 21.793 2.266 0.569 0.612 0.889 0.722 CB 1.461 19 residues pruned to eliminate duplicates Z: 65 50.508 2.249 0.667 0.619 0.984 0.688 CB 1.529 65 residues pruned to eliminate duplicates Z: 63 52.990 2.282 0.745 0.633 0.952 0.774 CB 1.568 66 residues pruned to eliminate duplicates Z: 14 17.130 2.181 0.239 0.821 0.923 0.846 CB 1.442 14 residues pruned to eliminate duplicates Z: 42 27.855 2.176 0.530 0.454 0.927 0.634 CB 1.478 42 residues pruned to eliminate duplicates Z: 50 39.545 2.281 0.679 0.540 0.918 0.776 CB 1.544 50 residues pruned to eliminate duplicates Z: 30 31.491 2.185 0.848 0.655 0.897 0.655 CB 1.399 30 residues pruned to eliminate duplicates Z: 41 32.771 2.265 0.584 0.497 0.950 0.650 CB 1.524 41 residues pruned to eliminate duplicates Z: 51 32.384 2.222 0.566 0.515 0.880 0.580 CB 1.474 51 residues pruned to eliminate duplicates Z: 28 34.266 2.210 0.928 0.676 0.889 0.741 CB 1.481 28 residues pruned to eliminate duplicates Z: 29 33.878 2.211 0.891 0.658 0.893 0.679 CB 1.481 29 residues pruned to eliminate duplicates Z: 21 25.340 2.200 0.773 0.646 0.950 0.600 CB 1.334 21 residues pruned to eliminate duplicates Z: 50 40.045 2.285 0.720 0.516 0.939 0.653 CB 1.525 50 residues pruned to eliminate duplicates Z: 75 45.313 2.149 0.799 0.587 0.905 0.635 CB 1.383 75 residues pruned to eliminate duplicates Z: 73 54.117 2.263 0.726 0.624 0.958 0.694 CB 1.516 73 residues pruned to eliminate duplicates Z: 35 25.619 2.123 0.653 0.513 0.941 0.588 CB 1.313 35 residues pruned to eliminate duplicates Z: 48 32.956 2.129 0.643 0.574 0.915 0.617 CB 1.399 48 residues pruned to eliminate duplicates Z: 27 18.557 2.176 0.468 0.368 0.885 0.615 CB 1.484 27 residues pruned to eliminate duplicates Z: 40 39.639 2.309 0.650 0.540 1.000 0.744 CB 1.602 40 residues pruned to eliminate duplicates Z: 26 23.019 2.268 0.602 0.377 0.960 0.600 CB 1.504 26 residues pruned to eliminate duplicates Z: 49 32.878 2.189 0.734 0.502 0.854 0.688 CB 1.460 49 residues pruned to eliminate duplicates Z: 50 42.359 2.264 0.833 0.550 0.939 0.796 CB 1.479 50 residues pruned to eliminate duplicates Z: 49 41.702 2.268 0.706 0.547 0.958 0.729 CB 1.550 49 residues pruned to eliminate duplicates Z: 50 40.813 2.271 0.755 0.545 0.959 0.755 CB 1.460 50 residues pruned to eliminate duplicates Z: 51 32.836 2.214 0.634 0.480 0.880 0.640 CB 1.488 51 residues pruned to eliminate duplicates Z: 47 40.718 2.199 0.844 0.599 0.913 0.696 CB 1.475 47 residues pruned to eliminate duplicates Z: 32 23.724 2.137 0.686 0.376 0.968 0.677 CB 1.395 32 residues pruned to eliminate duplicates Z: 29 22.667 2.206 0.508 0.426 0.929 0.714 CB 1.498 29 residues pruned to eliminate duplicates Z: 26 19.479 2.165 0.427 0.410 0.880 0.640 CB 1.574 26 residues pruned to eliminate duplicates Z: 49 37.659 2.255 0.653 0.587 0.917 0.708 CB 1.464 49 residues pruned to eliminate duplicates Z: 41 32.268 2.245 0.681 0.491 0.875 0.675 CB 1.559 41 residues pruned to eliminate duplicates Z: 51 37.929 2.267 0.711 0.555 0.900 0.660 CB 1.457 51 residues pruned to eliminate duplicates Z: 49 42.602 2.257 0.774 0.576 0.958 0.667 CB 1.489 49 residues pruned to eliminate duplicates Z: 25 21.483 2.243 0.602 0.386 0.917 0.542 CB 1.502 25 residues pruned to eliminate duplicates Z: 28 22.803 2.226 0.594 0.429 0.889 0.667 CB 1.497 28 residues pruned to eliminate duplicates Z: 75 45.930 2.186 0.720 0.617 0.892 0.662 CB 1.425 75 residues pruned to eliminate duplicates Z: 51 38.954 2.198 0.660 0.625 0.940 0.740 CB 1.428 51 residues pruned to eliminate duplicates Z: 74 52.147 2.235 0.759 0.644 0.932 0.712 CB 1.457 71 residues pruned to eliminate duplicates Z: 27 35.127 2.184 0.772 0.823 0.923 0.692 CB 1.458 29 residues pruned to eliminate duplicates Z: 25 39.352 2.092 0.892 0.849 1.000 0.792 CB 1.504 24 residues pruned to eliminate duplicates Z: 23 34.799 2.131 0.734 0.901 1.000 0.682 CB 1.433 23 residues pruned to eliminate duplicates Z: 22 36.900 2.233 0.701 0.899 0.952 0.810 CB 1.591 22 residues pruned to eliminate duplicates Z: 27 36.407 2.136 0.763 0.820 1.000 0.615 CB 1.436 27 residues pruned to eliminate duplicates Z: 33 29.162 2.001 0.784 0.654 0.938 0.594 CB 1.335 33 residues pruned to eliminate duplicates Z: 25 34.379 2.141 0.746 0.840 0.958 0.708 CB 1.462 25 residues pruned to eliminate duplicates Z: 25 39.158 2.197 0.854 0.882 0.958 0.667 CB 1.481 25 residues pruned to eliminate duplicates Z: 22 34.611 2.154 0.811 0.922 0.952 0.762 CB 1.430 22 residues pruned to eliminate duplicates Z: 25 34.265 2.136 0.899 0.834 0.917 0.500 CB 1.410 25 residues pruned to eliminate duplicates Z: 25 38.630 2.143 0.975 0.840 1.000 0.542 CB 1.390 25 residues pruned to eliminate duplicates Z: 26 36.618 2.106 0.962 0.813 1.000 0.360 CB 1.350 26 residues pruned to eliminate duplicates Z: 35 49.162 2.264 0.925 0.722 1.000 0.647 CB 1.583 37 residues pruned to eliminate duplicates Z: 23 40.781 2.178 1.086 0.917 0.955 0.591 CB 1.415 23 residues pruned to eliminate duplicates Z: 29 35.904 2.123 0.820 0.774 1.000 0.643 CB 1.379 29 residues pruned to eliminate duplicates Z: 29 33.834 2.123 0.856 0.752 0.929 0.429 CB 1.396 29 residues pruned to eliminate duplicates Z: 75 53.584 2.213 0.804 0.647 0.959 0.676 CB 1.418 75 residues pruned to eliminate duplicates Z: 48 42.297 2.227 0.664 0.635 0.979 0.681 CB 1.499 48 residues pruned to eliminate duplicates Z: 74 54.483 2.232 0.741 0.652 0.973 0.603 CB 1.464 74 residues pruned to eliminate duplicates Z: 75 51.109 2.221 0.703 0.628 0.959 0.635 CB 1.452 75 residues pruned to eliminate duplicates Z: 50 45.329 2.211 0.808 0.647 0.939 0.633 CB 1.504 50 residues pruned to eliminate duplicates Z: 26 40.593 2.184 1.016 0.819 0.960 0.560 CB 1.456 25 residues pruned to eliminate duplicates 690 residues left after pruning, divided into chains as follows: A: 6 B: 266 C: 10 D: 43 E: 33 F: 332 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.33 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.556, Connect. = 0.786 for dens.mod. cycle 1 = 0.300, Contrast = 0.634, Connect. = 0.808 for dens.mod. cycle 2 = 0.300, Contrast = 0.767, Connect. = 0.831 for dens.mod. cycle 3 = 0.300, Contrast = 0.782, Connect. = 0.833 for dens.mod. cycle 4 = 0.300, Contrast = 0.798, Connect. = 0.834 for dens.mod. cycle 5 = 0.300, Contrast = 0.804, Connect. = 0.836 for dens.mod. cycle 6 = 0.300, Contrast = 0.810, Connect. = 0.837 for dens.mod. cycle 7 = 0.300, Contrast = 0.812, Connect. = 0.838 for dens.mod. cycle 8 = 0.300, Contrast = 0.815, Connect. = 0.838 for dens.mod. cycle 9 = 0.300, Contrast = 0.815, Connect. = 0.839 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4132 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 984 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 15 56.105 2.584 1.069 0.940 1.000 0.929 CB 1.948 B: 18 36.348 2.288 0.831 0.891 1.000 0.882 CB 1.513 18 residues pruned to eliminate duplicates C: 14 24.061 2.267 0.323 0.912 1.000 0.923 CB 1.575 D: 28 44.820 2.287 0.920 0.794 0.852 0.593 CB 1.782 E: 16 22.778 2.067 0.590 0.870 1.000 0.867 CB 1.306 14 residues pruned to eliminate duplicates F: 77 52.019 2.253 0.717 0.585 0.961 0.566 CB 1.481 G: 24 43.010 2.398 0.729 0.944 0.957 0.826 CB 1.566 H: 29 54.741 2.291 0.902 0.891 0.929 0.821 CB 1.838 I: 25 40.951 2.303 0.721 0.932 0.958 0.625 CB 1.537 25 residues pruned to eliminate duplicates J: 18 39.598 2.312 0.947 0.875 0.941 0.765 CB 1.649 16 residues pruned to eliminate duplicates K: 65 49.459 2.278 0.738 0.619 0.969 0.562 CB 1.441 65 residues pruned to eliminate duplicates L: 15 39.167 2.512 0.788 0.928 0.929 0.786 CB 1.757 M: 32 68.495 2.386 1.051 0.933 0.968 0.774 CB 1.813 29 residues pruned to eliminate duplicates N: 31 74.412 2.421 1.145 0.917 1.000 0.700 CB 1.846 32 residues pruned to eliminate duplicates O: 24 51.675 2.413 1.006 0.953 0.957 0.609 CB 1.602 24 residues pruned to eliminate duplicates P: 17 24.153 2.229 0.229 0.895 1.000 0.875 CB 1.580 Q: 7 7.577 2.231 0.305 0.530 0.833 0.500 CB 1.238 R: 17 44.813 2.408 0.991 0.845 1.000 0.750 CB 1.738 15 residues pruned to eliminate duplicates S: 16 26.893 2.219 0.568 0.857 0.867 0.733 CB 1.697 T: 15 23.041 2.265 0.176 0.938 0.929 0.857 CB 1.731 16 residues pruned to eliminate duplicates U: 14 21.981 2.316 0.292 0.857 0.923 0.846 CB 1.626 14 residues pruned to eliminate duplicates V: 26 52.465 2.280 1.021 0.919 1.000 0.640 CB 1.605 25 residues pruned to eliminate duplicates W: 30 53.306 2.374 0.669 0.899 0.966 0.690 CB 1.850 X: 31 57.686 2.411 0.735 0.885 0.967 0.800 CB 1.881 31 residues pruned to eliminate duplicates Y: 15 44.782 2.501 0.868 0.909 1.000 0.857 CB 1.818 15 residues pruned to eliminate duplicates Z: 15 29.910 2.197 0.724 0.892 1.000 0.786 CB 1.516 Z: 50 56.579 2.457 0.846 0.609 0.939 0.735 CB 1.712 25 residues pruned to eliminate duplicates Z: 36 60.027 2.582 0.919 0.660 0.943 0.457 CB 1.873 37 residues pruned to eliminate duplicates Z: 15 30.301 2.299 0.607 0.854 0.929 0.786 CB 1.744 16 residues pruned to eliminate duplicates Z: 26 45.451 2.299 0.940 0.884 0.960 0.760 CB 1.535 26 residues pruned to eliminate duplicates Z: 16 38.658 2.473 0.497 0.911 1.000 0.933 CB 1.910 Z: 18 33.179 2.249 0.897 0.884 0.941 0.882 CB 1.448 18 residues pruned to eliminate duplicates Z: 6 11.574 1.892 0.806 0.755 0.800 0.600 CA 1.509 6 residues pruned to eliminate duplicates Z: 16 40.566 2.278 0.936 0.887 0.933 0.733 CB 1.835 Z: 17 48.331 2.338 1.074 0.898 1.000 0.812 CB 1.782 17 residues pruned to eliminate duplicates Z: 26 51.161 2.288 1.170 0.897 0.960 0.440 CB 1.537 26 residues pruned to eliminate duplicates Z: 24 50.475 2.313 0.913 0.862 0.957 0.783 CA 1.826 24 residues pruned to eliminate duplicates Z: 18 50.949 2.366 1.093 0.907 1.000 0.647 CB 1.773 16 residues pruned to eliminate duplicates Z: 24 46.598 2.552 0.887 0.707 0.957 0.565 CB 1.748 24 residues pruned to eliminate duplicates Z: 105 78.508 2.361 0.808 0.660 0.933 0.673 CB 1.666 64 residues pruned to eliminate duplicates Z: 32 62.912 2.384 0.873 0.914 0.968 0.871 CB 1.850 32 residues pruned to eliminate duplicates Z: 31 64.159 2.419 0.950 0.916 0.967 0.700 CB 1.814 31 residues pruned to eliminate duplicates Z: 9 21.211 2.049 0.874 0.806 1.000 0.625 CA 1.496 9 residues pruned to eliminate duplicates Z: 92 86.949 2.410 0.868 0.727 0.934 0.747 CB 1.766 90 residues pruned to eliminate duplicates Z: 17 53.541 2.384 1.164 0.913 1.000 0.938 CB 1.836 17 residues pruned to eliminate duplicates Z: 32 47.230 2.290 0.501 0.875 1.000 0.871 CB 1.795 32 residues pruned to eliminate duplicates Z: 31 63.196 2.408 0.956 0.915 0.967 0.633 CB 1.790 31 residues pruned to eliminate duplicates Z: 28 50.604 2.293 0.557 0.943 1.000 0.926 CB 1.891 28 residues pruned to eliminate duplicates Z: 134 84.607 2.359 0.770 0.655 0.925 0.699 CB 1.645 106 residues pruned to eliminate duplicates Z: 15 49.920 2.525 1.001 0.930 1.000 0.857 CB 1.847 15 residues pruned to eliminate duplicates Z: 16 40.206 2.348 0.808 0.900 0.933 0.800 CB 1.872 16 residues pruned to eliminate duplicates Z: 31 69.292 2.401 1.172 0.947 0.967 0.700 CB 1.734 31 residues pruned to eliminate duplicates Z: 22 52.300 2.281 1.090 0.864 0.952 0.619 CA 1.842 27 residues pruned to eliminate duplicates Z: 31 63.463 2.385 1.088 0.894 0.967 0.667 CB 1.727 31 residues pruned to eliminate duplicates Z: 23 54.387 2.413 1.015 0.869 0.955 0.727 CB 1.825 23 residues pruned to eliminate duplicates Z: 23 52.872 2.416 0.812 0.875 1.000 0.773 CB 1.873 23 residues pruned to eliminate duplicates Z: 12 26.503 2.499 0.355 0.883 1.000 0.727 CB 1.706 12 residues pruned to eliminate duplicates Z: 17 43.932 2.347 0.891 0.948 1.000 0.875 CB 1.709 17 residues pruned to eliminate duplicates Z: 17 41.607 2.355 0.792 0.915 1.000 0.938 CB 1.743 17 residues pruned to eliminate duplicates Z: 31 62.836 2.390 0.904 0.904 1.000 0.767 CB 1.796 31 residues pruned to eliminate duplicates Z: 47 29.745 2.268 0.457 0.593 0.870 0.696 CB 1.397 49 residues pruned to eliminate duplicates Z: 41 47.830 2.414 0.743 0.703 0.975 0.800 CB 1.533 16 residues pruned to eliminate duplicates Z: 28 52.387 2.290 0.746 0.940 0.963 0.815 CB 1.819 28 residues pruned to eliminate duplicates Z: 53 39.546 2.193 0.693 0.631 0.904 0.673 CB 1.444 Z: 16 31.997 2.122 1.034 0.892 0.933 0.533 CB 1.473 15 residues pruned to eliminate duplicates Z: 17 37.311 2.278 0.611 0.923 1.000 1.000 CB 1.786 17 residues pruned to eliminate duplicates Z: 25 44.091 2.352 0.609 0.927 1.000 0.917 CB 1.667 25 residues pruned to eliminate duplicates Z: 17 41.702 2.328 1.121 0.901 0.938 0.750 CB 1.607 17 residues pruned to eliminate duplicates Z: 48 36.841 2.296 0.687 0.453 0.894 0.617 CB 1.630 46 residues pruned to eliminate duplicates Z: 15 39.307 2.445 0.725 0.898 1.000 0.857 CB 1.781 15 residues pruned to eliminate duplicates Z: 24 38.568 2.313 0.729 0.824 0.913 0.609 CB 1.663 24 residues pruned to eliminate duplicates Z: 13 37.832 2.414 1.006 0.896 1.000 0.750 CB 1.616 15 residues pruned to eliminate duplicates Z: 13 15.705 2.145 0.516 0.580 0.917 0.833 CB 1.408 13 residues pruned to eliminate duplicates Z: 19 39.178 2.406 0.793 0.869 0.889 0.667 CB 1.759 19 residues pruned to eliminate duplicates Z: 16 44.624 2.421 1.051 0.928 1.000 0.867 CB 1.625 16 residues pruned to eliminate duplicates Z: 22 49.220 2.532 0.766 0.857 0.952 0.762 CA 1.859 22 residues pruned to eliminate duplicates Z: 6 16.850 2.120 0.477 0.809 1.000 0.800 CB 1.839 6 residues pruned to eliminate duplicates Z: 14 27.982 2.488 0.396 0.853 0.923 0.846 CB 1.790 14 residues pruned to eliminate duplicates Z: 13 28.084 2.471 0.452 0.878 1.000 0.667 CB 1.640 15 residues pruned to eliminate duplicates Z: 17 49.770 2.407 0.963 0.925 1.000 0.938 CA 1.847 17 residues pruned to eliminate duplicates Z: 15 38.246 2.405 0.835 0.908 0.929 0.857 CA 1.772 15 residues pruned to eliminate duplicates Z: 25 47.541 2.453 0.860 0.714 0.958 0.667 CB 1.829 18 residues pruned to eliminate duplicates Z: 23 37.866 2.162 0.831 0.934 0.955 0.909 CB 1.489 23 residues pruned to eliminate duplicates Z: 18 47.785 2.349 1.019 0.925 1.000 0.765 CB 1.715 18 residues pruned to eliminate duplicates Z: 29 27.519 2.355 0.668 0.394 0.893 0.786 CB 1.659 29 residues pruned to eliminate duplicates Z: 16 25.431 2.313 0.309 0.870 0.933 0.933 CB 1.696 Z: 14 30.516 2.410 0.530 0.931 0.923 0.846 CA 1.737 14 residues pruned to eliminate duplicates Z: 27 59.996 2.408 0.882 0.932 1.000 0.846 CA 1.814 27 residues pruned to eliminate duplicates Z: 17 40.846 2.356 1.073 0.930 0.875 0.875 CB 1.672 17 residues pruned to eliminate duplicates Z: 30 59.802 2.352 0.874 0.881 1.000 0.552 CB 1.824 31 residues pruned to eliminate duplicates Z: 18 45.058 2.317 1.020 0.882 1.000 0.647 CB 1.690 18 residues pruned to eliminate duplicates Z: 18 48.383 2.320 1.165 0.938 1.000 0.941 CB 1.624 18 residues pruned to eliminate duplicates Z: 16 31.285 2.420 0.405 0.931 1.000 0.933 CB 1.659 16 residues pruned to eliminate duplicates Z: 6 10.005 2.219 0.251 0.469 1.000 0.600 CB 1.664 6 residues pruned to eliminate duplicates Z: 12 29.402 2.481 0.685 0.856 0.909 0.909 CB 1.720 12 residues pruned to eliminate duplicates Z: 15 37.656 2.480 0.575 0.936 1.000 0.929 CB 1.794 15 residues pruned to eliminate duplicates Z: 17 33.331 2.294 0.500 0.900 1.000 0.812 CA 1.730 16 residues pruned to eliminate duplicates Z: 136 92.510 2.375 0.835 0.664 0.933 0.681 CB 1.681 131 residues pruned to eliminate duplicates Z: 6 11.599 2.245 0.358 0.824 1.000 0.600 CA 1.285 6 residues pruned to eliminate duplicates Z: 29 47.754 2.427 0.876 0.794 0.964 0.714 CB 1.588 29 residues pruned to eliminate duplicates Z: 162 114.280 2.492 0.906 0.670 0.944 0.665 CB 1.717 144 residues pruned to eliminate duplicates Z: 18 40.815 2.195 0.863 0.949 1.000 1.000 CA 1.670 18 residues pruned to eliminate duplicates Z: 15 35.484 2.336 0.527 0.933 1.000 1.000 CB 1.855 15 residues pruned to eliminate duplicates Z: 17 54.011 2.389 1.182 0.921 1.000 0.938 CB 1.822 17 residues pruned to eliminate duplicates Z: 15 34.368 2.276 1.300 0.802 0.929 0.786 CB 1.452 14 residues pruned to eliminate duplicates Z: 16 52.700 2.471 1.170 0.920 1.000 0.933 CB 1.788 16 residues pruned to eliminate duplicates Z: 72 53.613 2.255 0.739 0.625 0.944 0.732 CB 1.528 53 residues pruned to eliminate duplicates Z: 17 50.391 2.391 0.963 0.920 1.000 0.875 CB 1.890 17 residues pruned to eliminate duplicates Z: 23 41.376 2.409 0.556 0.833 0.955 0.818 CA 1.850 23 residues pruned to eliminate duplicates Z: 15 31.911 2.294 0.917 0.928 0.929 0.571 CB 1.463 15 residues pruned to eliminate duplicates Z: 50 38.407 2.262 0.690 0.557 0.939 0.653 CB 1.447 50 residues pruned to eliminate duplicates Z: 40 35.870 2.340 0.648 0.483 0.923 0.667 CB 1.641 40 residues pruned to eliminate duplicates Z: 17 25.123 2.068 0.312 0.894 1.000 0.812 CB 1.660 17 residues pruned to eliminate duplicates Z: 15 29.361 2.282 0.879 0.850 1.000 0.714 CB 1.356 14 residues pruned to eliminate duplicates Z: 18 30.036 2.140 0.652 0.877 0.941 0.824 CA 1.590 18 residues pruned to eliminate duplicates Z: 12 29.378 2.129 1.048 0.884 1.000 0.545 CA 1.468 Z: 15 27.750 2.346 0.423 0.867 0.929 0.643 CB 1.751 15 residues pruned to eliminate duplicates Z: 89 56.174 2.309 0.674 0.585 0.920 0.602 CB 1.550 52 residues pruned to eliminate duplicates Z: 6 12.475 1.982 0.447 0.839 1.000 0.600 CA 1.453 6 residues pruned to eliminate duplicates Z: 15 34.869 2.317 0.603 0.940 1.000 0.714 CB 1.742 15 residues pruned to eliminate duplicates Z: 64 63.790 2.443 0.798 0.632 0.905 0.651 CB 1.786 52 residues pruned to eliminate duplicates Z: 18 41.607 2.286 0.900 0.890 1.000 0.706 CB 1.672 18 residues pruned to eliminate duplicates Z: 30 62.109 2.420 1.009 0.924 0.931 0.655 CB 1.790 30 residues pruned to eliminate duplicates Z: 31 46.604 2.312 0.429 0.908 1.000 0.933 CB 1.829 31 residues pruned to eliminate duplicates Z: 88 61.061 2.331 0.848 0.585 0.943 0.678 CB 1.487 90 residues pruned to eliminate duplicates Z: 17 33.090 2.328 0.936 0.882 0.938 0.750 CB 1.416 17 residues pruned to eliminate duplicates Z: 24 35.580 2.375 0.559 0.835 0.913 0.565 CB 1.644 24 residues pruned to eliminate duplicates Z: 28 42.982 2.202 0.769 0.798 0.926 0.667 CA 1.767 28 residues pruned to eliminate duplicates Z: 16 39.170 2.233 1.062 0.858 0.933 0.800 CB 1.733 16 residues pruned to eliminate duplicates Z: 31 60.479 2.398 0.826 0.887 1.000 0.733 CB 1.818 31 residues pruned to eliminate duplicates Z: 41 41.940 2.285 0.854 0.552 0.875 0.550 CB 1.702 39 residues pruned to eliminate duplicates Z: 17 36.099 2.314 0.536 0.946 1.000 0.938 CA 1.755 17 residues pruned to eliminate duplicates Z: 75 75.606 2.458 0.856 0.663 0.973 0.743 CB 1.703 75 residues pruned to eliminate duplicates Z: 16 32.374 2.285 0.870 0.922 1.000 0.933 CB 1.375 16 residues pruned to eliminate duplicates Z: 40 50.302 2.475 0.765 0.527 1.000 0.718 CB 1.795 40 residues pruned to eliminate duplicates Z: 15 27.180 2.332 0.456 0.824 0.929 0.714 CB 1.740 15 residues pruned to eliminate duplicates Z: 17 46.294 2.281 1.013 0.934 1.000 1.000 CB 1.758 17 residues pruned to eliminate duplicates Z: 16 33.089 2.284 1.018 0.927 0.933 0.867 CB 1.393 16 residues pruned to eliminate duplicates Z: 8 16.870 1.907 0.670 0.798 1.000 0.857 CB 1.543 8 residues pruned to eliminate duplicates Z: 24 45.995 2.319 0.824 0.846 0.957 0.739 CB 1.761 24 residues pruned to eliminate duplicates Z: 32 52.589 2.278 0.731 0.858 1.000 0.742 CB 1.764 32 residues pruned to eliminate duplicates Z: 17 34.436 2.316 0.705 0.871 0.938 0.875 CA 1.696 17 residues pruned to eliminate duplicates Z: 28 65.262 2.439 0.942 0.922 1.000 0.778 CB 1.865 28 residues pruned to eliminate duplicates Z: 16 40.079 2.373 0.925 0.890 0.933 0.667 CA 1.746 16 residues pruned to eliminate duplicates Z: 50 33.954 2.279 0.583 0.504 0.878 0.673 CB 1.526 50 residues pruned to eliminate duplicates Z: 12 32.263 2.510 0.621 0.860 1.000 0.909 CB 1.758 12 residues pruned to eliminate duplicates Z: 30 50.812 2.333 0.741 0.898 0.931 0.828 CB 1.784 30 residues pruned to eliminate duplicates Z: 14 45.006 2.507 0.977 0.948 1.000 0.692 CB 1.740 14 residues pruned to eliminate duplicates Z: 24 44.755 2.329 0.898 0.826 0.957 0.652 CB 1.665 24 residues pruned to eliminate duplicates Z: 24 33.798 2.127 0.670 0.898 0.957 0.870 CB 1.484 24 residues pruned to eliminate duplicates Z: 26 39.619 2.233 0.472 0.915 1.000 0.960 CB 1.704 26 residues pruned to eliminate duplicates Z: 30 63.042 2.342 0.966 0.912 1.000 0.897 CA 1.801 30 residues pruned to eliminate duplicates Z: 14 33.048 2.242 1.267 0.825 0.923 0.692 CB 1.474 14 residues pruned to eliminate duplicates Z: 16 43.690 2.443 1.021 0.884 0.933 0.933 CB 1.769 16 residues pruned to eliminate duplicates Z: 17 30.769 2.223 0.444 0.893 1.000 0.812 CB 1.721 17 residues pruned to eliminate duplicates Z: 13 34.432 2.439 1.142 0.852 0.917 0.583 CB 1.535 14 residues pruned to eliminate duplicates Z: 39 37.641 2.269 0.887 0.583 0.947 0.632 CB 1.390 39 residues pruned to eliminate duplicates Z: 31 59.213 2.361 0.917 0.927 0.967 0.867 CB 1.732 31 residues pruned to eliminate duplicates Z: 23 40.341 2.173 1.021 0.936 0.955 0.727 CB 1.429 23 residues pruned to eliminate duplicates Z: 25 43.702 2.354 0.737 0.919 0.958 0.792 CB 1.603 25 residues pruned to eliminate duplicates Z: 6 8.724 2.264 0.188 0.677 0.800 0.800 CA 1.540 6 residues pruned to eliminate duplicates Z: 32 51.576 2.263 0.710 0.905 0.968 0.839 CB 1.762 32 residues pruned to eliminate duplicates Z: 75 55.441 2.331 0.726 0.574 0.932 0.554 CB 1.600 75 residues pruned to eliminate duplicates Z: 17 41.353 2.269 0.857 0.943 1.000 1.000 CB 1.700 17 residues pruned to eliminate duplicates Z: 13 25.483 2.337 0.606 0.860 0.917 0.667 CB 1.571 13 residues pruned to eliminate duplicates Z: 20 45.060 2.272 0.914 0.856 0.947 0.684 CB 1.852 20 residues pruned to eliminate duplicates Z: 7 12.691 2.150 0.237 0.777 1.000 0.667 CA 1.525 7 residues pruned to eliminate duplicates Z: 32 58.329 2.374 0.795 0.898 0.968 0.839 CB 1.817 32 residues pruned to eliminate duplicates Z: 13 21.839 2.129 0.837 0.550 0.917 0.750 CB 1.675 13 residues pruned to eliminate duplicates Z: 28 56.880 2.290 0.841 0.943 1.000 0.778 CB 1.799 28 residues pruned to eliminate duplicates Z: 53 40.178 2.237 0.718 0.568 0.923 0.558 CB 1.470 52 residues pruned to eliminate duplicates Z: 76 69.153 2.468 0.809 0.603 0.947 0.653 CB 1.712 76 residues pruned to eliminate duplicates Z: 12 21.133 2.173 0.590 0.885 0.909 0.909 CB 1.464 12 residues pruned to eliminate duplicates Z: 17 38.352 2.308 0.686 0.907 1.000 0.812 CB 1.752 17 residues pruned to eliminate duplicates Z: 25 51.015 2.324 1.093 0.912 0.958 0.500 CB 1.582 25 residues pruned to eliminate duplicates Z: 20 45.944 2.441 0.988 0.782 0.947 0.579 CB 1.789 20 residues pruned to eliminate duplicates Z: 18 42.476 2.357 0.801 0.911 1.000 0.765 CB 1.720 18 residues pruned to eliminate duplicates Z: 13 22.272 2.301 0.805 0.644 0.917 0.750 CB 1.475 13 residues pruned to eliminate duplicates Z: 26 24.500 2.281 0.605 0.466 1.000 0.800 CB 1.385 26 residues pruned to eliminate duplicates Z: 14 29.521 2.291 0.821 0.857 0.923 0.846 CB 1.567 14 residues pruned to eliminate duplicates Z: 16 18.267 2.075 0.306 0.922 0.933 0.933 CB 1.312 16 residues pruned to eliminate duplicates Z: 130 94.912 2.447 0.863 0.653 0.907 0.682 CB 1.752 130 residues pruned to eliminate duplicates Z: 32 66.945 2.383 1.118 0.933 0.935 0.581 CB 1.777 32 residues pruned to eliminate duplicates Z: 25 31.936 2.025 0.665 0.904 0.958 0.833 CB 1.438 25 residues pruned to eliminate duplicates Z: 29 70.429 2.417 1.201 0.926 0.964 0.679 CB 1.819 29 residues pruned to eliminate duplicates Z: 52 47.078 2.444 0.784 0.504 0.882 0.608 CB 1.707 52 residues pruned to eliminate duplicates Z: 12 21.993 2.210 0.676 0.633 1.000 0.636 CB 1.580 12 residues pruned to eliminate duplicates Z: 23 38.120 2.150 0.862 0.899 1.000 0.955 CB 1.451 23 residues pruned to eliminate duplicates Z: 13 33.701 2.393 0.909 0.899 1.000 0.667 CB 1.522 13 residues pruned to eliminate duplicates Z: 32 56.755 2.346 0.865 0.923 0.935 0.613 CB 1.750 32 residues pruned to eliminate duplicates Z: 16 41.740 2.371 0.988 0.920 0.933 0.467 CB 1.725 16 residues pruned to eliminate duplicates Z: 20 40.421 2.452 0.758 0.858 0.895 0.684 CB 1.771 20 residues pruned to eliminate duplicates Z: 6 12.317 1.868 1.076 0.540 1.000 0.800 CB 1.366 6 residues pruned to eliminate duplicates Z: 28 57.715 2.399 0.794 0.938 1.000 0.667 CB 1.794 28 residues pruned to eliminate duplicates Z: 32 64.289 2.346 0.996 0.924 1.000 0.581 CB 1.731 32 residues pruned to eliminate duplicates Z: 17 16.576 2.157 0.227 0.858 0.938 0.812 CB 1.229 17 residues pruned to eliminate duplicates Z: 14 17.641 2.209 0.273 0.853 0.846 0.769 CB 1.520 14 residues pruned to eliminate duplicates Z: 24 44.473 2.319 0.734 0.864 0.957 0.739 CA 1.767 24 residues pruned to eliminate duplicates Z: 25 39.525 2.301 0.493 0.898 1.000 0.875 CB 1.680 25 residues pruned to eliminate duplicates Z: 12 15.008 1.931 0.260 0.821 0.909 0.727 CB 1.549 12 residues pruned to eliminate duplicates Z: 20 41.416 2.158 1.138 0.855 0.895 0.842 CA 1.699 20 residues pruned to eliminate duplicates Z: 7 10.219 2.038 0.298 0.831 1.000 0.833 CA 1.185 7 residues pruned to eliminate duplicates Z: 25 55.992 2.373 1.125 0.917 1.000 0.750 CB 1.600 25 residues pruned to eliminate duplicates Z: 6 7.303 2.025 0.547 0.638 0.800 0.600 CB 1.145 6 residues pruned to eliminate duplicates Z: 15 43.859 2.362 1.111 0.916 1.000 0.857 CB 1.661 15 residues pruned to eliminate duplicates Z: 10 24.554 2.362 0.715 0.757 1.000 1.000 CB 1.608 10 residues pruned to eliminate duplicates Z: 16 39.563 2.237 0.956 0.884 0.933 0.667 CB 1.807 16 residues pruned to eliminate duplicates Z: 23 36.527 2.187 0.914 0.924 0.909 0.636 CB 1.437 22 residues pruned to eliminate duplicates Z: 12 34.432 2.592 1.125 0.527 0.909 0.364 CA 2.020 12 residues pruned to eliminate duplicates Z: 36 54.211 2.495 0.775 0.648 0.971 0.629 CB 1.854 36 residues pruned to eliminate duplicates Z: 9 19.534 2.457 0.690 0.506 0.875 0.500 CB 1.889 9 residues pruned to eliminate duplicates Z: 49 39.248 2.280 0.736 0.606 0.917 0.708 CB 1.412 49 residues pruned to eliminate duplicates Z: 13 28.644 2.075 0.988 0.912 0.917 0.667 CA 1.549 13 residues pruned to eliminate duplicates Z: 6 2.455 1.788 -0.242 0.457 0.600 0.600 N 1.410 Z: 11 15.673 2.066 0.646 0.636 0.800 0.600 CB 1.604 11 residues pruned to eliminate duplicates Z: 16 28.532 2.236 0.545 0.896 1.000 0.600 CB 1.528 16 residues pruned to eliminate duplicates Z: 25 52.175 2.358 1.223 0.913 0.958 0.542 CB 1.500 25 residues pruned to eliminate duplicates Z: 17 34.037 2.238 0.586 0.935 1.000 1.000 CB 1.670 17 residues pruned to eliminate duplicates Z: 33 48.084 2.195 0.843 0.867 0.969 0.531 CB 1.587 33 residues pruned to eliminate duplicates Z: 14 25.200 2.034 1.000 0.850 0.923 0.769 CB 1.378 14 residues pruned to eliminate duplicates Z: 26 36.664 2.226 0.438 0.897 0.960 0.960 CB 1.708 26 residues pruned to eliminate duplicates Z: 13 33.790 2.508 0.653 0.859 1.000 0.833 CB 1.731 13 residues pruned to eliminate duplicates Z: 50 49.502 2.441 0.804 0.527 0.898 0.694 CB 1.741 50 residues pruned to eliminate duplicates Z: 21 43.541 2.322 0.873 0.850 0.900 0.750 CA 1.842 21 residues pruned to eliminate duplicates Z: 31 50.011 2.306 0.700 0.907 0.933 0.767 CB 1.774 31 residues pruned to eliminate duplicates Z: 18 39.133 2.189 1.069 0.861 0.941 0.647 CB 1.635 18 residues pruned to eliminate duplicates Z: 16 44.479 2.534 0.807 0.931 1.000 0.800 CB 1.753 16 residues pruned to eliminate duplicates Z: 31 59.028 2.387 0.850 0.907 0.967 0.833 CB 1.793 31 residues pruned to eliminate duplicates Z: 7 11.320 1.910 0.372 0.813 1.000 0.500 CA 1.344 7 residues pruned to eliminate duplicates Z: 24 42.327 2.136 1.053 0.914 1.000 0.696 CB 1.422 24 residues pruned to eliminate duplicates Z: 38 18.634 1.923 0.512 0.440 0.865 0.514 CB 1.296 Z: 24 59.227 2.421 1.383 0.945 0.957 0.565 CB 1.549 24 residues pruned to eliminate duplicates Z: 15 23.901 2.306 0.404 0.927 0.929 0.929 CB 1.490 15 residues pruned to eliminate duplicates Z: 32 71.441 2.384 1.100 0.924 1.000 0.548 CB 1.799 32 residues pruned to eliminate duplicates Z: 31 54.770 2.341 0.714 0.892 0.967 0.767 CB 1.852 31 residues pruned to eliminate duplicates Z: 52 44.365 2.374 0.678 0.508 0.902 0.549 CB 1.714 52 residues pruned to eliminate duplicates Z: 35 32.348 2.199 0.728 0.597 0.912 0.559 CB 1.460 34 residues pruned to eliminate duplicates Z: 14 24.496 1.997 0.746 0.868 1.000 0.538 CB 1.425 14 residues pruned to eliminate duplicates Z: 29 55.307 2.384 0.817 0.889 0.964 0.786 CB 1.801 29 residues pruned to eliminate duplicates Z: 9 6.756 1.717 0.399 0.631 0.750 0.375 CA 1.172 9 residues pruned to eliminate duplicates Z: 177 115.928 2.477 0.888 0.642 0.943 0.693 CB 1.736 178 residues pruned to eliminate duplicates Z: 17 23.392 1.955 0.688 0.906 1.000 1.000 CB 1.260 Z: 22 42.171 2.197 1.076 0.935 0.952 0.762 CB 1.476 23 residues pruned to eliminate duplicates Z: 31 60.046 2.304 0.947 0.893 1.000 0.733 CB 1.754 31 residues pruned to eliminate duplicates Z: 7 9.826 2.348 0.199 0.803 0.667 0.667 CA 1.640 7 residues pruned to eliminate duplicates Z: 15 30.443 2.287 0.907 0.916 0.929 0.714 CB 1.419 15 residues pruned to eliminate duplicates Z: 102 87.172 2.349 0.925 0.669 0.960 0.673 CB 1.709 102 residues pruned to eliminate duplicates Z: 17 42.149 2.308 0.981 0.871 1.000 0.500 CB 1.681 17 residues pruned to eliminate duplicates Z: 17 42.087 2.366 0.668 0.930 1.000 0.875 CA 1.865 17 residues pruned to eliminate duplicates Z: 7 7.295 2.101 0.644 0.398 0.667 0.500 CA 1.440 7 residues pruned to eliminate duplicates Z: 45 41.312 2.258 0.946 0.588 0.932 0.636 CB 1.399 45 residues pruned to eliminate duplicates Z: 13 24.831 2.318 0.672 0.922 0.917 0.833 CB 1.418 13 residues pruned to eliminate duplicates Z: 23 53.920 2.420 0.915 0.845 0.955 0.682 CA 1.932 23 residues pruned to eliminate duplicates Z: 16 49.355 2.360 1.231 0.932 1.000 0.733 CB 1.691 16 residues pruned to eliminate duplicates Z: 24 36.521 2.131 0.783 0.885 0.957 0.739 CA 1.513 24 residues pruned to eliminate duplicates Z: 15 26.749 2.172 0.681 0.874 1.000 0.786 CB 1.424 15 residues pruned to eliminate duplicates Z: 163 113.789 2.469 0.911 0.649 0.963 0.673 CB 1.713 163 residues pruned to eliminate duplicates Z: 13 23.113 2.327 0.405 0.876 0.917 0.833 CB 1.618 13 residues pruned to eliminate duplicates Z: 139 93.962 2.382 0.870 0.668 0.942 0.717 CB 1.632 135 residues pruned to eliminate duplicates Z: 15 26.729 2.309 0.335 0.884 0.929 0.929 CB 1.804 15 residues pruned to eliminate duplicates Z: 49 32.639 2.041 0.687 0.614 0.938 0.708 CB 1.310 17 residues pruned to eliminate duplicates Z: 49 37.354 2.277 0.601 0.528 0.958 0.604 CB 1.502 49 residues pruned to eliminate duplicates Z: 70 43.138 2.179 0.656 0.585 0.913 0.667 CB 1.452 70 residues pruned to eliminate duplicates Z: 12 11.558 1.954 0.271 0.674 0.909 0.636 CB 1.315 14 residues pruned to eliminate duplicates Z: 16 33.305 2.316 0.501 0.906 1.000 0.867 CB 1.760 16 residues pruned to eliminate duplicates Z: 15 20.748 2.047 0.528 0.914 1.000 0.929 CB 1.253 15 residues pruned to eliminate duplicates Z: 16 12.038 1.955 0.160 0.823 0.800 0.600 CB 1.295 16 residues pruned to eliminate duplicates Z: 73 51.543 2.270 0.637 0.649 0.944 0.708 CB 1.507 73 residues pruned to eliminate duplicates Z: 14 25.698 2.114 0.539 0.782 1.000 0.615 CB 1.709 14 residues pruned to eliminate duplicates Z: 63 57.585 2.348 0.912 0.557 0.952 0.677 CB 1.620 63 residues pruned to eliminate duplicates Z: 38 24.373 2.001 0.386 0.620 0.946 0.649 CB 1.364 38 residues pruned to eliminate duplicates Z: 14 35.172 2.376 0.698 0.876 0.923 0.692 CA 1.904 14 residues pruned to eliminate duplicates Z: 45 25.420 2.145 0.415 0.578 0.932 0.591 CB 1.257 45 residues pruned to eliminate duplicates Z: 15 34.320 2.317 1.000 0.830 0.857 0.643 CB 1.737 15 residues pruned to eliminate duplicates Z: 50 48.989 2.409 0.659 0.577 0.980 0.653 CB 1.660 54 residues pruned to eliminate duplicates Z: 15 32.710 2.295 0.971 0.914 0.929 0.857 CB 1.471 15 residues pruned to eliminate duplicates Z: 130 100.697 2.433 0.989 0.662 0.930 0.659 CB 1.695 129 residues pruned to eliminate duplicates Z: 39 30.249 2.247 0.472 0.619 0.947 0.711 CB 1.399 39 residues pruned to eliminate duplicates Z: 50 36.797 2.235 0.691 0.562 0.918 0.633 CB 1.426 50 residues pruned to eliminate duplicates Z: 6 5.380 1.531 0.474 0.828 1.000 1.000 CB 0.802 6 residues pruned to eliminate duplicates Z: 9 12.435 1.966 0.121 0.875 1.000 0.750 CB 1.451 9 residues pruned to eliminate duplicates Z: 30 50.321 2.373 0.766 0.903 0.931 0.793 CB 1.706 30 residues pruned to eliminate duplicates Z: 6 7.843 2.162 0.192 0.527 1.000 0.600 CB 1.325 6 residues pruned to eliminate duplicates Z: 6 10.674 2.253 0.506 0.696 0.800 0.600 CA 1.470 6 residues pruned to eliminate duplicates Z: 24 53.671 2.424 1.273 0.946 0.957 0.565 CB 1.469 24 residues pruned to eliminate duplicates Z: 31 48.399 2.342 0.655 0.896 0.933 0.867 CB 1.750 31 residues pruned to eliminate duplicates Z: 16 30.949 2.033 1.135 0.913 1.000 0.867 CB 1.303 22 residues pruned to eliminate duplicates Z: 14 24.392 2.013 0.477 0.937 1.000 1.000 CB 1.583 14 residues pruned to eliminate duplicates Z: 90 83.766 2.391 0.872 0.731 0.978 0.742 CB 1.649 90 residues pruned to eliminate duplicates Z: 6 8.046 2.251 0.255 0.578 0.800 0.800 CB 1.476 Z: 104 83.534 2.409 0.976 0.651 0.922 0.660 CB 1.629 104 residues pruned to eliminate duplicates Z: 6 9.998 1.974 0.124 0.871 1.000 1.000 CB 1.471 6 residues pruned to eliminate duplicates Z: 13 18.399 2.241 0.222 0.841 0.917 0.750 CB 1.578 13 residues pruned to eliminate duplicates Z: 16 30.824 2.266 1.040 0.924 0.933 0.600 CB 1.296 16 residues pruned to eliminate duplicates Z: 14 21.606 2.027 0.529 0.848 0.923 0.692 CA 1.555 14 residues pruned to eliminate duplicates Z: 17 40.313 2.356 0.798 0.920 0.938 0.938 CB 1.787 17 residues pruned to eliminate duplicates Z: 45 25.739 2.132 0.479 0.547 0.955 0.568 CB 1.232 45 residues pruned to eliminate duplicates Z: 56 35.697 2.181 0.656 0.564 0.945 0.691 CB 1.324 56 residues pruned to eliminate duplicates Z: 13 26.610 2.373 0.910 0.529 0.917 0.500 CA 1.797 13 residues pruned to eliminate duplicates Z: 11 20.908 2.348 0.346 0.883 1.000 0.600 CB 1.512 11 residues pruned to eliminate duplicates Z: 12 10.856 2.062 0.898 0.450 0.727 0.636 CB 1.211 12 residues pruned to eliminate duplicates Z: 30 54.992 2.363 0.667 0.875 1.000 0.828 CB 1.885 32 residues pruned to eliminate duplicates Z: 18 34.774 2.156 0.844 0.890 1.000 0.647 CB 1.526 18 residues pruned to eliminate duplicates Z: 14 25.635 2.024 0.759 0.804 1.000 0.615 CA 1.532 13 residues pruned to eliminate duplicates Z: 15 43.863 2.522 0.912 0.901 1.000 0.857 CB 1.735 15 residues pruned to eliminate duplicates Z: 25 39.462 2.489 0.747 0.673 0.958 0.583 CB 1.649 25 residues pruned to eliminate duplicates Z: 15 25.214 1.933 0.632 0.915 1.000 0.857 CA 1.510 15 residues pruned to eliminate duplicates Z: 26 30.700 2.223 0.648 0.665 1.000 0.720 CB 1.438 14 residues pruned to eliminate duplicates Z: 24 49.085 2.369 0.903 0.881 0.957 0.522 CB 1.719 24 residues pruned to eliminate duplicates Z: 19 35.900 2.268 0.731 0.880 1.000 0.611 CB 1.562 19 residues pruned to eliminate duplicates Z: 20 34.485 2.436 0.518 0.809 1.000 0.684 CB 1.635 20 residues pruned to eliminate duplicates Z: 15 25.237 1.953 0.586 0.922 1.000 0.857 CB 1.531 15 residues pruned to eliminate duplicates Z: 6 11.603 2.094 0.878 0.632 0.800 0.600 CB 1.457 6 residues pruned to eliminate duplicates Z: 13 10.846 1.936 0.297 0.672 0.917 0.583 CB 1.160 8 residues pruned to eliminate duplicates Z: 28 34.694 2.260 0.925 0.600 0.926 0.704 CB 1.507 28 residues pruned to eliminate duplicates Z: 47 57.406 2.475 0.871 0.600 0.957 0.761 CB 1.737 47 residues pruned to eliminate duplicates Z: 18 35.759 2.177 0.838 0.911 0.941 0.706 CB 1.632 18 residues pruned to eliminate duplicates Z: 24 36.408 2.136 0.838 0.894 0.957 0.913 CB 1.451 24 residues pruned to eliminate duplicates Z: 23 42.474 2.298 0.684 0.947 1.000 1.000 CB 1.617 23 residues pruned to eliminate duplicates Z: 27 49.629 2.332 0.689 0.918 1.000 0.923 CA 1.743 27 residues pruned to eliminate duplicates Z: 14 17.774 2.199 0.378 0.801 0.769 0.692 CB 1.625 14 residues pruned to eliminate duplicates Z: 12 25.350 2.474 0.368 0.856 1.000 0.909 CB 1.665 12 residues pruned to eliminate duplicates Z: 12 30.738 2.318 0.658 0.870 1.000 0.818 CA 1.760 12 residues pruned to eliminate duplicates Z: 15 18.717 2.069 0.463 0.815 0.929 0.786 CB 1.354 15 residues pruned to eliminate duplicates Z: 8 9.544 2.271 0.067 0.840 0.714 0.571 CA 1.555 8 residues pruned to eliminate duplicates Z: 8 12.163 1.789 0.729 0.827 1.000 0.429 CB 1.120 8 residues pruned to eliminate duplicates Z: 7 12.417 1.813 0.915 0.851 0.833 0.500 CB 1.297 7 residues pruned to eliminate duplicates Z: 14 35.783 2.307 0.691 0.917 1.000 0.615 CB 1.796 14 residues pruned to eliminate duplicates Z: 17 43.006 2.315 0.906 0.883 1.000 0.812 CA 1.761 17 residues pruned to eliminate duplicates Z: 49 48.174 2.445 0.743 0.522 0.938 0.604 CB 1.703 49 residues pruned to eliminate duplicates Z: 16 32.966 2.200 1.186 0.885 0.933 0.533 CB 1.370 16 residues pruned to eliminate duplicates Z: 8 6.991 1.915 0.454 0.749 0.857 0.429 CB 0.887 8 residues pruned to eliminate duplicates Z: 42 44.431 2.418 0.651 0.506 0.976 0.683 CB 1.771 42 residues pruned to eliminate duplicates Z: 6 11.934 2.058 0.493 0.827 1.000 0.600 CB 1.309 6 residues pruned to eliminate duplicates Z: 20 9.935 1.950 0.577 0.452 0.895 0.526 CB 0.871 20 residues pruned to eliminate duplicates Z: 30 28.210 1.951 0.816 0.644 0.931 0.552 CB 1.388 38 residues pruned to eliminate duplicates Z: 16 37.598 2.215 0.667 0.943 1.000 0.800 CB 1.823 16 residues pruned to eliminate duplicates Z: 16 31.312 2.375 0.317 0.909 1.000 0.867 CB 1.834 16 residues pruned to eliminate duplicates Z: 7 9.591 1.655 0.439 0.787 1.000 0.833 CB 1.278 7 residues pruned to eliminate duplicates Z: 14 25.914 2.015 0.633 0.947 1.000 0.923 CB 1.510 14 residues pruned to eliminate duplicates Z: 28 66.273 2.327 1.091 0.936 1.000 0.852 CB 1.824 28 residues pruned to eliminate duplicates Z: 39 36.291 2.311 0.719 0.628 0.868 0.711 CB 1.513 39 residues pruned to eliminate duplicates Z: 20 31.305 2.225 0.560 0.914 0.947 0.789 CB 1.544 20 residues pruned to eliminate duplicates Z: 27 41.756 2.481 0.826 0.729 0.923 0.808 CB 1.594 27 residues pruned to eliminate duplicates Z: 32 38.356 2.103 1.166 0.691 1.000 0.710 CB 1.270 27 residues pruned to eliminate duplicates Z: 36 28.013 2.118 0.727 0.549 0.886 0.771 CB 1.393 36 residues pruned to eliminate duplicates Z: 30 53.981 2.507 1.186 0.682 0.931 0.690 CB 1.662 30 residues pruned to eliminate duplicates Z: 122 101.073 2.480 0.959 0.688 0.934 0.711 CB 1.704 122 residues pruned to eliminate duplicates Z: 18 37.312 2.194 0.949 0.904 1.000 0.706 CB 1.507 18 residues pruned to eliminate duplicates Z: 40 33.558 2.188 0.606 0.597 0.949 0.667 CB 1.469 40 residues pruned to eliminate duplicates Z: 48 40.878 2.257 0.609 0.639 0.957 0.723 CB 1.506 48 residues pruned to eliminate duplicates Z: 124 93.194 2.395 0.862 0.686 0.919 0.667 CB 1.729 192 residues pruned to eliminate duplicates Z: 7 12.533 1.917 0.321 0.844 1.000 0.833 CB 1.503 7 residues pruned to eliminate duplicates Z: 15 27.791 2.243 0.949 0.830 1.000 0.714 CB 1.277 15 residues pruned to eliminate duplicates Z: 29 34.483 2.311 0.725 0.500 0.929 0.536 CB 1.760 29 residues pruned to eliminate duplicates Z: 31 52.250 2.300 0.763 0.895 0.967 0.767 CB 1.745 31 residues pruned to eliminate duplicates Z: 29 53.634 2.330 0.780 0.912 0.964 0.857 CB 1.794 29 residues pruned to eliminate duplicates Z: 30 49.517 2.353 0.570 0.904 0.966 0.862 CB 1.836 30 residues pruned to eliminate duplicates Z: 31 60.159 2.271 0.981 0.881 1.000 0.567 CB 1.767 31 residues pruned to eliminate duplicates Z: 12 10.305 2.010 0.085 0.609 1.000 0.636 CB 1.285 12 residues pruned to eliminate duplicates Z: 20 25.556 2.070 0.772 0.632 0.947 0.737 CB 1.490 20 residues pruned to eliminate duplicates Z: 16 13.022 2.214 0.726 0.324 0.667 0.533 CB 1.601 16 residues pruned to eliminate duplicates Z: 12 16.888 2.001 0.541 0.715 1.000 0.455 CB 1.359 12 residues pruned to eliminate duplicates Z: 31 52.170 2.308 0.622 0.900 1.000 0.867 CB 1.818 31 residues pruned to eliminate duplicates Z: 15 39.159 2.408 0.823 0.854 1.000 0.857 CB 1.761 15 residues pruned to eliminate duplicates Z: 61 44.694 2.256 0.740 0.580 0.900 0.533 CB 1.512 60 residues pruned to eliminate duplicates Z: 17 31.832 2.164 0.874 0.875 1.000 0.938 CB 1.427 17 residues pruned to eliminate duplicates Z: 32 54.683 2.276 0.940 0.887 0.935 0.484 CB 1.715 32 residues pruned to eliminate duplicates Z: 17 21.177 1.955 0.777 0.858 0.938 0.812 CB 1.197 17 residues pruned to eliminate duplicates Z: 13 11.608 1.925 0.313 0.620 0.917 0.417 CB 1.291 13 residues pruned to eliminate duplicates Z: 9 8.505 2.027 0.292 0.473 0.875 0.500 CB 1.348 9 residues pruned to eliminate duplicates Z: 12 14.102 2.123 0.323 0.814 0.909 0.455 CB 1.268 12 residues pruned to eliminate duplicates Z: 49 36.876 2.080 0.990 0.589 0.958 0.625 CB 1.233 48 residues pruned to eliminate duplicates Z: 6 9.690 1.933 0.217 0.842 1.000 0.600 CB 1.373 6 residues pruned to eliminate duplicates Z: 8 5.293 1.722 0.206 0.728 0.857 0.857 CB 0.915 Z: 10 9.057 2.040 0.031 0.604 1.000 0.667 CB 1.300 10 residues pruned to eliminate duplicates Z: 11 20.540 2.040 0.633 0.865 1.000 0.700 CB 1.428 Z: 17 53.416 2.450 1.107 0.914 1.000 0.750 CB 1.829 17 residues pruned to eliminate duplicates Z: 25 46.304 2.324 0.890 0.905 0.958 0.875 CB 1.599 25 residues pruned to eliminate duplicates Z: 14 26.946 2.195 0.671 0.847 0.923 0.692 CB 1.638 14 residues pruned to eliminate duplicates Z: 28 36.786 2.436 0.680 0.608 0.889 0.593 CB 1.757 28 residues pruned to eliminate duplicates Z: 17 34.293 2.347 0.838 0.867 0.938 0.812 CB 1.552 17 residues pruned to eliminate duplicates Z: 11 21.562 2.039 0.564 0.926 1.000 0.800 CA 1.499 10 residues pruned to eliminate duplicates Z: 11 12.394 1.707 0.610 0.918 1.000 0.900 CB 1.006 11 residues pruned to eliminate duplicates Z: 47 37.921 2.231 0.743 0.622 0.913 0.630 CB 1.404 47 residues pruned to eliminate duplicates Z: 19 14.909 1.991 0.547 0.546 0.833 0.722 CB 1.309 19 residues pruned to eliminate duplicates Z: 11 24.707 2.081 0.938 0.909 1.000 0.700 CB 1.375 11 residues pruned to eliminate duplicates Z: 23 40.339 2.168 1.117 0.910 0.955 0.636 CB 1.393 23 residues pruned to eliminate duplicates Z: 12 6.455 1.562 0.265 0.789 0.727 0.455 CB 1.050 12 residues pruned to eliminate duplicates Z: 6 9.879 1.760 0.511 0.696 1.000 0.400 CA 1.388 6 residues pruned to eliminate duplicates Z: 7 5.599 1.749 -0.057 0.710 1.000 1.000 O 1.146 7 residues pruned to eliminate duplicates Z: 51 30.441 2.230 0.475 0.585 0.900 0.660 CB 1.340 51 residues pruned to eliminate duplicates Z: 28 53.714 2.259 0.808 0.912 0.963 0.741 CB 1.862 28 residues pruned to eliminate duplicates Z: 17 24.830 2.234 0.767 0.645 0.875 0.562 CB 1.570 18 residues pruned to eliminate duplicates Z: 28 66.462 2.400 1.149 0.922 1.000 0.630 CB 1.744 28 residues pruned to eliminate duplicates Z: 71 43.954 2.311 0.640 0.503 0.871 0.557 CB 1.585 71 residues pruned to eliminate duplicates Z: 50 45.823 2.354 0.900 0.568 0.898 0.571 CB 1.526 Z: 14 27.998 1.994 0.967 0.937 1.000 0.692 CB 1.378 14 residues pruned to eliminate duplicates Z: 50 40.759 2.299 0.741 0.514 0.939 0.714 CB 1.529 49 residues pruned to eliminate duplicates Z: 13 21.445 2.256 0.522 0.881 1.000 0.750 CB 1.306 13 residues pruned to eliminate duplicates Z: 18 34.446 2.280 0.548 0.909 1.000 0.824 CA 1.681 18 residues pruned to eliminate duplicates Z: 15 26.335 2.251 0.715 0.877 0.857 0.643 CB 1.545 15 residues pruned to eliminate duplicates Z: 32 53.954 2.270 0.813 0.872 1.000 0.742 CB 1.716 32 residues pruned to eliminate duplicates Z: 34 30.179 2.010 0.835 0.675 0.939 0.758 CB 1.290 32 residues pruned to eliminate duplicates Z: 92 55.491 2.247 0.712 0.581 0.945 0.538 CB 1.481 92 residues pruned to eliminate duplicates Z: 17 34.180 2.180 0.880 0.850 1.000 0.500 CB 1.544 17 residues pruned to eliminate duplicates Z: 14 24.475 1.981 0.644 0.940 1.000 0.692 CB 1.447 14 residues pruned to eliminate duplicates Z: 17 40.511 2.312 0.803 0.916 1.000 0.875 CA 1.715 17 residues pruned to eliminate duplicates Z: 14 23.428 1.977 0.550 0.933 1.000 0.923 CB 1.480 14 residues pruned to eliminate duplicates Z: 76 68.473 2.441 0.799 0.626 0.947 0.693 CB 1.689 76 residues pruned to eliminate duplicates Z: 15 10.187 1.696 0.508 0.456 0.857 0.500 CB 1.299 14 residues pruned to eliminate duplicates Z: 14 14.402 1.856 0.563 0.735 0.923 0.615 CB 1.207 Z: 13 28.853 2.469 0.624 0.832 0.917 0.833 CB 1.702 13 residues pruned to eliminate duplicates Z: 24 25.391 2.337 0.620 0.424 1.000 0.696 CB 1.513 24 residues pruned to eliminate duplicates Z: 76 74.243 2.473 0.797 0.652 0.973 0.693 CB 1.720 76 residues pruned to eliminate duplicates Z: 17 22.216 1.949 0.709 0.873 1.000 0.875 CB 1.215 17 residues pruned to eliminate duplicates Z: 13 18.702 2.289 0.386 0.852 0.833 0.500 CB 1.510 13 residues pruned to eliminate duplicates Z: 18 21.954 2.206 0.352 0.654 0.941 0.706 CA 1.644 18 residues pruned to eliminate duplicates Z: 7 5.797 1.639 0.057 0.577 1.000 0.333 CB 1.268 7 residues pruned to eliminate duplicates Z: 50 35.237 2.241 0.582 0.592 0.918 0.735 CB 1.416 50 residues pruned to eliminate duplicates Z: 41 32.427 2.341 0.715 0.481 0.800 0.550 CB 1.628 41 residues pruned to eliminate duplicates Z: 16 36.287 2.298 0.759 0.896 1.000 0.867 CB 1.660 16 residues pruned to eliminate duplicates Z: 76 68.675 2.422 0.824 0.615 0.933 0.707 CB 1.726 76 residues pruned to eliminate duplicates Z: 17 38.893 2.296 0.771 0.885 1.000 0.812 CB 1.726 17 residues pruned to eliminate duplicates Z: 29 42.546 2.356 0.499 0.906 0.964 0.821 CB 1.679 29 residues pruned to eliminate duplicates Z: 9 17.848 2.324 0.472 0.564 1.000 0.625 CB 1.734 9 residues pruned to eliminate duplicates Z: 14 12.123 1.727 0.368 0.949 1.000 1.000 CB 0.982 Z: 15 27.541 1.958 0.858 0.930 1.000 0.786 CB 1.415 15 residues pruned to eliminate duplicates Z: 24 43.451 2.370 0.729 0.925 0.913 0.870 CB 1.699 24 residues pruned to eliminate duplicates Z: 79 67.129 2.342 0.754 0.705 0.923 0.705 CB 1.663 79 residues pruned to eliminate duplicates Z: 16 47.827 2.215 1.304 0.928 1.000 0.800 CA 1.695 16 residues pruned to eliminate duplicates Z: 45 48.228 2.365 0.945 0.596 0.955 0.682 CB 1.511 48 residues pruned to eliminate duplicates Z: 25 28.624 2.212 0.790 0.615 0.917 0.542 CB 1.444 25 residues pruned to eliminate duplicates Z: 33 56.166 2.267 0.869 0.908 0.969 0.844 CB 1.718 33 residues pruned to eliminate duplicates Z: 74 48.009 2.202 0.703 0.596 0.945 0.685 CB 1.446 74 residues pruned to eliminate duplicates Z: 18 15.466 1.811 0.866 0.608 0.824 0.471 CB 1.217 18 residues pruned to eliminate duplicates Z: 197 97.012 2.359 0.824 0.594 0.908 0.684 CB 1.620 197 residues pruned to eliminate duplicates Z: 10 6.154 1.743 0.167 0.549 0.778 0.444 CB 1.235 Z: 16 32.532 2.204 0.710 0.925 0.933 0.867 CB 1.676 16 residues pruned to eliminate duplicates Z: 8 6.553 1.960 0.243 0.513 0.857 0.571 CB 1.171 Z: 16 34.174 2.253 0.776 0.932 1.000 1.000 CB 1.539 16 residues pruned to eliminate duplicates Z: 38 38.646 2.258 0.721 0.628 1.000 0.784 CB 1.450 37 residues pruned to eliminate duplicates Z: 15 24.811 2.224 0.548 0.937 1.000 0.857 CB 1.340 15 residues pruned to eliminate duplicates Z: 24 23.531 2.283 0.661 0.419 0.957 0.783 CB 1.473 24 residues pruned to eliminate duplicates Z: 19 11.452 2.005 0.928 0.467 0.667 0.500 CB 1.083 19 residues pruned to eliminate duplicates Z: 14 18.939 1.934 0.350 0.927 1.000 0.846 CB 1.409 14 residues pruned to eliminate duplicates Z: 8 6.705 1.605 0.575 0.540 0.857 0.714 O 1.125 8 residues pruned to eliminate duplicates Z: 6 5.374 1.736 0.107 0.872 1.000 0.800 CB 0.911 6 residues pruned to eliminate duplicates Z: 23 32.713 2.092 0.703 0.888 1.000 0.818 CB 1.411 23 residues pruned to eliminate duplicates Z: 6 7.014 1.755 0.477 0.804 0.800 0.600 CB 1.160 6 residues pruned to eliminate duplicates Z: 23 44.284 2.189 1.239 0.944 0.955 0.636 CB 1.398 22 residues pruned to eliminate duplicates Z: 15 20.531 2.203 0.210 0.877 0.929 0.857 CB 1.611 15 residues pruned to eliminate duplicates Z: 27 34.099 2.075 0.644 0.857 1.000 0.731 CB 1.445 27 residues pruned to eliminate duplicates Z: 55 34.611 2.228 0.672 0.543 0.907 0.593 CB 1.336 55 residues pruned to eliminate duplicates Z: 31 43.611 2.388 0.810 0.653 0.900 0.600 CB 1.775 31 residues pruned to eliminate duplicates Z: 175 109.041 2.429 0.928 0.648 0.931 0.655 CB 1.651 222 residues pruned to eliminate duplicates Z: 32 64.969 2.313 1.263 0.902 0.968 0.645 CB 1.642 32 residues pruned to eliminate duplicates Z: 188 106.496 2.437 0.843 0.625 0.914 0.695 CB 1.686 188 residues pruned to eliminate duplicates Z: 12 23.303 2.318 0.420 0.886 0.909 0.818 CB 1.694 12 residues pruned to eliminate duplicates Z: 13 13.727 1.875 0.330 0.806 0.917 0.667 CB 1.327 13 residues pruned to eliminate duplicates Z: 9 14.514 2.088 0.610 0.667 0.875 0.500 CA 1.495 9 residues pruned to eliminate duplicates Z: 8 12.800 2.095 0.500 0.667 0.857 0.429 CB 1.539 8 residues pruned to eliminate duplicates Z: 22 42.205 2.209 1.117 0.951 0.952 0.571 CB 1.425 22 residues pruned to eliminate duplicates Z: 15 34.006 2.116 1.231 0.906 0.929 0.714 CB 1.475 15 residues pruned to eliminate duplicates Z: 11 18.220 2.390 0.542 0.511 1.000 0.500 CB 1.547 11 residues pruned to eliminate duplicates Z: 12 19.837 1.877 0.829 0.760 1.000 0.455 N 1.383 12 residues pruned to eliminate duplicates Z: 7 9.335 1.843 0.197 0.887 0.833 0.833 CB 1.495 7 residues pruned to eliminate duplicates Z: 29 61.284 2.392 1.019 0.937 1.000 0.821 CB 1.668 29 residues pruned to eliminate duplicates Z: 15 16.077 1.866 0.124 0.920 1.000 0.929 CB 1.442 15 residues pruned to eliminate duplicates Z: 12 16.093 1.871 0.618 0.872 1.000 0.727 CB 1.168 12 residues pruned to eliminate duplicates Z: 17 39.118 2.317 0.747 0.908 1.000 0.938 CB 1.716 17 residues pruned to eliminate duplicates Z: 84 91.883 2.456 1.014 0.720 0.964 0.663 CB 1.735 84 residues pruned to eliminate duplicates Z: 30 25.644 1.938 0.651 0.634 0.931 0.621 CB 1.409 29 residues pruned to eliminate duplicates Z: 11 5.989 2.046 0.378 0.335 0.800 0.300 CB 1.006 Z: 7 10.591 1.638 0.520 0.829 1.000 0.667 CA 1.306 7 residues pruned to eliminate duplicates Z: 6 4.839 1.860 -0.157 0.561 1.000 0.600 CB 1.300 6 residues pruned to eliminate duplicates Z: 15 20.425 1.857 0.408 0.922 1.000 0.857 CB 1.468 15 residues pruned to eliminate duplicates Z: 9 9.334 1.768 0.230 0.852 1.000 0.625 CB 1.122 9 residues pruned to eliminate duplicates Z: 10 9.765 1.930 0.742 0.299 0.889 0.778 CB 1.364 10 residues pruned to eliminate duplicates Z: 18 38.261 2.325 0.501 0.916 1.000 0.882 CB 1.877 Z: 7 11.092 1.872 1.024 0.710 0.833 0.500 CA 1.185 7 residues pruned to eliminate duplicates Z: 32 33.982 2.279 0.841 0.629 0.806 0.548 CB 1.597 32 residues pruned to eliminate duplicates Z: 7 3.611 1.334 0.782 0.436 0.833 0.667 CB 0.795 Z: 14 6.312 1.493 0.252 0.810 1.000 0.769 CB 0.715 12 residues pruned to eliminate duplicates Z: 25 45.182 2.279 0.647 0.901 1.000 0.917 CA 1.753 25 residues pruned to eliminate duplicates Z: 9 11.141 2.052 0.749 0.478 0.875 0.750 CB 1.282 11 residues pruned to eliminate duplicates Z: 39 31.578 2.011 0.918 0.596 0.921 0.605 CB 1.316 39 residues pruned to eliminate duplicates Z: 14 24.175 2.159 0.471 0.905 0.923 0.769 CB 1.629 14 residues pruned to eliminate duplicates Z: 8 11.581 1.778 0.665 0.875 1.000 0.714 CB 1.076 9 residues pruned to eliminate duplicates Z: 10 10.868 1.747 0.571 0.564 0.889 0.667 N 1.396 Z: 16 28.682 2.051 0.835 0.918 1.000 0.933 CB 1.388 16 residues pruned to eliminate duplicates Z: 30 54.257 2.341 0.873 0.899 0.931 0.690 CB 1.764 30 residues pruned to eliminate duplicates Z: 130 95.086 2.412 0.949 0.660 0.907 0.636 CB 1.692 148 residues pruned to eliminate duplicates Z: 32 65.887 2.338 1.132 0.906 0.968 0.742 CB 1.745 32 residues pruned to eliminate duplicates Z: 90 58.227 2.248 0.738 0.601 0.966 0.618 CB 1.485 90 residues pruned to eliminate duplicates Z: 19 20.756 2.147 0.829 0.492 0.833 0.778 CB 1.506 19 residues pruned to eliminate duplicates Z: 32 33.450 2.341 0.589 0.582 0.871 0.774 CB 1.714 32 residues pruned to eliminate duplicates Z: 27 37.830 2.214 0.837 0.801 0.885 0.654 CB 1.585 27 residues pruned to eliminate duplicates Z: 32 42.626 2.256 0.520 0.898 0.903 0.742 CB 1.768 32 residues pruned to eliminate duplicates Z: 14 7.657 1.938 0.326 0.512 0.769 0.692 CB 1.062 14 residues pruned to eliminate duplicates Z: 14 18.444 2.088 0.770 0.471 0.923 0.538 CB 1.543 14 residues pruned to eliminate duplicates Z: 41 27.871 1.970 0.582 0.539 0.925 0.575 CB 1.472 40 residues pruned to eliminate duplicates Z: 30 34.901 2.065 0.977 0.698 0.966 0.759 CB 1.373 30 residues pruned to eliminate duplicates Z: 76 82.611 2.479 0.901 0.742 0.933 0.720 CB 1.746 76 residues pruned to eliminate duplicates Z: 11 8.758 1.661 0.247 0.872 1.000 0.900 CB 0.975 13 residues pruned to eliminate duplicates Z: 13 11.284 1.757 0.260 0.938 1.000 0.917 CB 1.023 13 residues pruned to eliminate duplicates Z: 23 40.654 2.400 0.781 0.840 0.864 0.727 CA 1.753 23 residues pruned to eliminate duplicates Z: 21 12.993 1.919 0.542 0.365 0.800 0.350 CB 1.419 21 residues pruned to eliminate duplicates Z: 12 17.558 1.932 0.857 0.807 0.909 0.818 CB 1.241 12 residues pruned to eliminate duplicates Z: 47 38.866 2.274 0.639 0.587 0.978 0.696 CB 1.446 47 residues pruned to eliminate duplicates Z: 19 23.844 2.212 0.402 0.654 0.944 0.722 CA 1.663 19 residues pruned to eliminate duplicates Z: 6 5.774 1.818 0.088 0.637 1.000 0.800 CB 1.148 Z: 27 23.628 2.165 0.490 0.581 0.923 0.615 CB 1.440 11 residues pruned to eliminate duplicates Z: 24 37.385 2.124 1.079 0.936 0.957 0.478 CB 1.285 24 residues pruned to eliminate duplicates Z: 8 3.822 1.673 0.074 0.435 0.857 0.571 CB 1.004 Z: 86 52.851 2.214 0.760 0.565 0.929 0.565 CB 1.486 86 residues pruned to eliminate duplicates Z: 12 19.687 2.424 0.989 0.578 0.818 0.727 CB 1.395 12 residues pruned to eliminate duplicates Z: 17 21.029 1.927 0.591 0.888 1.000 0.812 CB 1.235 17 residues pruned to eliminate duplicates Z: 12 14.945 2.170 0.378 0.689 0.818 0.545 CB 1.549 12 residues pruned to eliminate duplicates Z: 63 42.043 2.173 0.660 0.519 0.968 0.677 CB 1.501 63 residues pruned to eliminate duplicates Z: 14 22.115 2.006 0.684 0.870 0.923 0.692 CA 1.436 14 residues pruned to eliminate duplicates Z: 24 12.777 1.767 0.379 0.620 0.913 0.652 CB 1.069 19 residues pruned to eliminate duplicates Z: 118 90.741 2.414 1.008 0.657 0.889 0.607 CB 1.682 182 residues pruned to eliminate duplicates Z: 15 11.137 1.883 0.596 0.517 0.786 0.643 CB 1.238 15 residues pruned to eliminate duplicates Z: 9 4.114 2.063 0.004 0.290 0.750 0.375 CA 1.185 9 residues pruned to eliminate duplicates Z: 14 29.173 2.252 0.891 0.892 0.923 0.615 CB 1.479 14 residues pruned to eliminate duplicates Z: 15 31.060 2.265 0.998 0.905 0.929 0.786 CB 1.406 15 residues pruned to eliminate duplicates Z: 15 25.983 2.070 1.162 0.910 0.929 0.786 CB 1.185 Z: 9 9.136 1.727 0.616 0.507 1.000 0.625 N 1.149 9 residues pruned to eliminate duplicates Z: 225 111.982 2.360 0.848 0.628 0.942 0.705 CB 1.615 240 residues pruned to eliminate duplicates Z: 10 8.337 2.178 0.444 0.312 0.778 0.444 CB 1.400 11 residues pruned to eliminate duplicates Z: 32 63.085 2.338 1.003 0.917 0.968 0.548 CB 1.764 32 residues pruned to eliminate duplicates Z: 15 14.269 2.297 0.785 0.379 0.714 0.500 CB 1.482 15 residues pruned to eliminate duplicates Z: 67 91.734 2.510 0.924 0.815 0.970 0.773 CB 1.834 67 residues pruned to eliminate duplicates Z: 15 14.800 1.841 0.545 0.756 0.857 0.571 CB 1.292 15 residues pruned to eliminate duplicates Z: 53 34.533 2.188 0.743 0.504 0.865 0.635 CB 1.445 53 residues pruned to eliminate duplicates Z: 43 33.096 2.243 0.814 0.501 0.881 0.571 CB 1.424 43 residues pruned to eliminate duplicates Z: 11 18.205 2.260 0.498 0.641 0.900 0.700 CB 1.657 11 residues pruned to eliminate duplicates Z: 33 55.101 2.291 0.750 0.864 1.000 0.875 CB 1.781 33 residues pruned to eliminate duplicates Z: 90 58.893 2.210 0.943 0.604 0.944 0.674 CB 1.395 Z: 8 21.438 2.209 0.971 0.790 1.000 0.714 CA 1.443 8 residues pruned to eliminate duplicates Z: 39 38.087 2.436 0.638 0.495 0.947 0.737 CB 1.643 39 residues pruned to eliminate duplicates Z: 26 30.492 2.248 0.809 0.641 0.920 0.600 CB 1.429 26 residues pruned to eliminate duplicates Z: 17 22.473 2.179 0.777 0.728 0.875 0.500 CB 1.350 17 residues pruned to eliminate duplicates Z: 7 8.343 2.023 0.068 0.805 1.000 0.667 CB 1.208 7 residues pruned to eliminate duplicates Z: 18 7.737 1.808 0.389 0.383 0.706 0.412 CB 1.199 28 residues pruned to eliminate duplicates Z: 40 32.227 2.265 0.614 0.552 0.897 0.615 CB 1.495 40 residues pruned to eliminate duplicates Z: 41 25.762 1.961 0.566 0.582 0.875 0.675 CB 1.401 41 residues pruned to eliminate duplicates Z: 30 22.846 2.264 0.547 0.382 0.862 0.621 CB 1.592 30 residues pruned to eliminate duplicates Z: 12 18.722 2.202 0.621 0.693 0.818 0.636 CB 1.621 12 residues pruned to eliminate duplicates Z: 45 24.436 1.936 0.602 0.535 0.864 0.545 CB 1.329 45 residues pruned to eliminate duplicates Z: 15 42.238 2.315 0.955 0.903 1.000 0.714 CB 1.778 15 residues pruned to eliminate duplicates Z: 16 40.613 2.323 1.024 0.900 0.933 0.467 CB 1.707 16 residues pruned to eliminate duplicates Z: 19 13.933 1.756 0.459 0.594 0.889 0.611 CB 1.318 19 residues pruned to eliminate duplicates Z: 17 36.359 2.232 0.581 0.900 1.000 0.875 CB 1.840 17 residues pruned to eliminate duplicates Z: 38 38.937 2.314 0.698 0.567 0.919 0.568 CB 1.662 38 residues pruned to eliminate duplicates Z: 22 38.895 2.184 1.063 0.929 0.952 0.619 CB 1.384 22 residues pruned to eliminate duplicates Z: 16 29.262 2.173 0.644 0.920 1.000 1.000 CB 1.489 16 residues pruned to eliminate duplicates Z: 30 73.518 2.418 1.203 0.921 1.000 0.552 CB 1.804 30 residues pruned to eliminate duplicates Z: 15 23.275 1.948 0.446 0.914 1.000 0.857 CB 1.561 15 residues pruned to eliminate duplicates Z: 26 39.704 2.448 0.731 0.643 0.920 0.640 CB 1.782 26 residues pruned to eliminate duplicates Z: 10 3.201 1.716 -0.175 0.421 0.778 0.556 N 1.053 Z: 14 13.839 2.052 0.457 0.516 1.000 0.538 CB 1.264 14 residues pruned to eliminate duplicates Z: 23 38.678 2.350 0.656 0.818 0.909 0.727 CA 1.769 23 residues pruned to eliminate duplicates Z: 55 70.162 2.483 0.781 0.682 1.000 0.667 CB 1.828 55 residues pruned to eliminate duplicates Z: 37 27.378 2.187 0.717 0.528 0.861 0.667 CB 1.372 37 residues pruned to eliminate duplicates Z: 37 29.159 2.028 0.744 0.636 0.944 0.639 CB 1.281 37 residues pruned to eliminate duplicates Z: 19 24.334 1.826 0.930 0.782 0.889 0.667 CB 1.429 19 residues pruned to eliminate duplicates Z: 39 30.731 2.064 0.691 0.557 0.974 0.526 CB 1.388 39 residues pruned to eliminate duplicates Z: 27 36.785 2.200 0.736 0.842 0.885 0.808 CB 1.591 27 residues pruned to eliminate duplicates Z: 15 11.874 2.094 0.322 0.547 0.929 0.571 CB 1.179 15 residues pruned to eliminate duplicates Z: 9 11.730 2.053 0.437 0.555 1.000 0.625 CB 1.333 9 residues pruned to eliminate duplicates Z: 6 4.220 1.962 0.106 0.684 0.800 0.600 CB 0.918 6 residues pruned to eliminate duplicates Z: 42 32.170 2.256 0.610 0.491 0.927 0.683 CB 1.507 42 residues pruned to eliminate duplicates Z: 9 11.622 1.823 0.461 0.740 0.875 0.875 CA 1.422 9 residues pruned to eliminate duplicates Z: 10 17.311 2.301 0.421 0.535 1.000 0.556 CB 1.707 10 residues pruned to eliminate duplicates Z: 39 56.725 2.279 0.813 0.791 0.974 0.711 CB 1.771 39 residues pruned to eliminate duplicates Z: 75 65.770 2.410 0.838 0.617 0.892 0.635 CB 1.733 75 residues pruned to eliminate duplicates Z: 12 7.277 1.682 0.462 0.308 0.909 0.364 CB 1.215 9 residues pruned to eliminate duplicates Z: 23 11.125 1.688 0.542 0.585 0.864 0.591 CB 0.973 23 residues pruned to eliminate duplicates Z: 59 33.950 2.143 0.644 0.545 0.897 0.603 CB 1.350 59 residues pruned to eliminate duplicates Z: 8 9.693 1.898 0.248 0.845 0.857 0.286 CB 1.342 8 residues pruned to eliminate duplicates Z: 15 26.609 2.058 1.022 0.908 1.000 0.786 CB 1.213 15 residues pruned to eliminate duplicates Z: 6 9.104 2.167 0.035 0.791 1.000 0.400 CB 1.406 6 residues pruned to eliminate duplicates Z: 13 11.785 2.015 0.276 0.676 0.917 0.833 CB 1.227 13 residues pruned to eliminate duplicates Z: 71 42.514 2.219 0.479 0.625 0.957 0.671 CB 1.438 71 residues pruned to eliminate duplicates Z: 15 8.070 2.059 0.202 0.325 0.714 0.571 CA 1.479 15 residues pruned to eliminate duplicates Z: 13 12.253 1.726 0.697 0.512 1.000 0.667 CB 1.193 Z: 29 70.496 2.315 1.220 0.942 1.000 0.643 CB 1.797 29 residues pruned to eliminate duplicates Z: 7 8.066 2.014 0.215 0.824 1.000 0.667 CB 1.016 7 residues pruned to eliminate duplicates Z: 13 32.224 2.038 1.116 0.889 1.000 0.583 CB 1.552 13 residues pruned to eliminate duplicates Z: 12 12.130 2.165 0.255 0.684 0.909 0.818 CB 1.251 12 residues pruned to eliminate duplicates Z: 15 8.492 1.469 0.236 0.903 1.000 0.857 CB 0.891 15 residues pruned to eliminate duplicates Z: 6 6.977 1.741 0.286 0.777 1.000 0.600 CB 1.091 6 residues pruned to eliminate duplicates Z: 25 42.584 2.507 0.896 0.668 0.958 0.625 CB 1.634 25 residues pruned to eliminate duplicates Z: 12 18.405 2.101 0.386 0.577 1.000 0.636 CB 1.769 12 residues pruned to eliminate duplicates Z: 10 7.279 1.664 0.671 0.459 0.778 0.444 CB 1.170 10 residues pruned to eliminate duplicates Z: 31 19.877 1.902 0.509 0.634 1.000 0.633 CB 1.115 31 residues pruned to eliminate duplicates Z: 51 33.277 2.245 0.721 0.508 0.860 0.580 CB 1.405 51 residues pruned to eliminate duplicates Z: 17 28.989 1.989 1.043 0.878 1.000 0.688 CB 1.294 17 residues pruned to eliminate duplicates Z: 53 36.836 2.166 0.835 0.505 0.962 0.615 CB 1.330 50 residues pruned to eliminate duplicates Z: 10 9.457 1.719 0.178 0.839 0.889 0.778 CA 1.308 9 residues pruned to eliminate duplicates Z: 30 31.679 2.259 0.763 0.610 0.862 0.586 CB 1.543 30 residues pruned to eliminate duplicates Z: 7 2.977 1.579 0.188 0.335 0.667 0.500 CB 1.164 Z: 10 11.117 1.803 0.196 0.865 1.000 0.778 CB 1.258 10 residues pruned to eliminate duplicates Z: 38 32.120 2.196 0.871 0.582 0.892 0.649 CB 1.332 38 residues pruned to eliminate duplicates Z: 35 32.369 2.281 0.779 0.508 0.882 0.618 CB 1.538 35 residues pruned to eliminate duplicates Z: 8 3.526 1.483 0.492 0.538 0.857 0.714 CB 0.677 8 residues pruned to eliminate duplicates Z: 12 18.565 1.916 0.973 0.845 1.000 0.545 CB 1.101 12 residues pruned to eliminate duplicates Z: 15 22.890 2.051 1.086 0.893 0.929 0.571 CB 1.105 15 residues pruned to eliminate duplicates Z: 52 61.734 2.281 0.846 0.791 0.961 0.745 CB 1.656 62 residues pruned to eliminate duplicates Z: 20 37.139 2.186 0.969 0.834 0.947 0.737 CB 1.566 20 residues pruned to eliminate duplicates Z: 78 94.611 2.484 1.011 0.768 0.974 0.753 CB 1.748 168 residues pruned to eliminate duplicates Z: 13 13.619 1.760 0.692 0.917 1.000 0.833 CB 0.932 13 residues pruned to eliminate duplicates Z: 14 16.856 1.748 0.793 0.946 1.000 0.923 CB 1.031 14 residues pruned to eliminate duplicates Z: 17 43.469 2.290 1.066 0.902 0.938 0.812 CA 1.748 17 residues pruned to eliminate duplicates Z: 43 43.541 2.411 0.699 0.530 1.000 0.667 CB 1.592 43 residues pruned to eliminate duplicates Z: 84 85.902 2.414 0.959 0.723 0.940 0.675 CB 1.736 84 residues pruned to eliminate duplicates Z: 31 58.941 2.301 0.939 0.897 0.967 0.533 CB 1.786 31 residues pruned to eliminate duplicates Z: 73 48.563 2.240 0.546 0.649 0.958 0.667 CB 1.500 73 residues pruned to eliminate duplicates Z: 12 23.905 2.341 0.916 0.619 1.000 0.636 CB 1.436 12 residues pruned to eliminate duplicates Z: 13 11.399 1.835 0.528 0.470 0.917 0.250 CB 1.319 14 residues pruned to eliminate duplicates Z: 39 22.257 2.190 0.484 0.360 0.868 0.632 CB 1.488 39 residues pruned to eliminate duplicates Z: 9 4.082 1.709 -0.019 0.469 0.875 0.375 CB 1.016 Z: 33 27.018 1.981 0.681 0.656 0.969 0.781 CB 1.281 Z: 49 69.256 2.404 0.851 0.800 0.958 0.750 CB 1.802 49 residues pruned to eliminate duplicates Z: 24 18.657 2.037 0.519 0.410 0.913 0.565 CB 1.514 Z: 6 2.347 1.735 -0.174 0.526 0.800 0.600 CB 0.893 Z: 33 42.571 2.319 0.836 0.659 0.938 0.594 CB 1.627 34 residues pruned to eliminate duplicates Z: 17 10.181 1.595 0.355 0.839 0.938 0.938 CB 0.938 17 residues pruned to eliminate duplicates Z: 9 9.141 1.627 0.376 0.793 1.000 0.500 CB 1.116 9 residues pruned to eliminate duplicates Z: 46 74.324 2.402 1.008 0.773 0.978 0.689 CB 1.845 46 residues pruned to eliminate duplicates Z: 11 4.748 1.571 0.494 0.245 0.800 0.400 CB 1.073 Z: 6 8.452 1.622 0.430 0.742 1.000 0.800 CB 1.312 6 residues pruned to eliminate duplicates Z: 35 20.278 1.984 0.364 0.575 0.941 0.559 CB 1.269 35 residues pruned to eliminate duplicates Z: 18 19.360 2.109 0.644 0.463 0.941 0.647 CB 1.493 18 residues pruned to eliminate duplicates Z: 40 34.925 2.319 0.621 0.502 0.949 0.692 CB 1.566 40 residues pruned to eliminate duplicates Z: 24 46.836 2.268 1.263 0.871 0.913 0.609 CB 1.520 24 residues pruned to eliminate duplicates Z: 22 27.306 2.163 0.461 0.756 0.952 0.714 CB 1.575 22 residues pruned to eliminate duplicates Z: 7 10.538 1.964 0.405 0.884 1.000 0.833 CB 1.126 7 residues pruned to eliminate duplicates Z: 13 9.342 2.079 0.156 0.664 0.833 0.833 CB 1.157 13 residues pruned to eliminate duplicates Z: 8 8.055 2.162 -0.079 0.564 1.000 0.714 CB 1.437 8 residues pruned to eliminate duplicates Z: 6 2.590 1.377 0.324 0.407 0.800 0.800 CB 0.876 Z: 11 13.636 2.094 0.486 0.610 0.900 0.500 CB 1.387 11 residues pruned to eliminate duplicates Z: 15 31.151 2.303 0.622 0.915 1.000 0.857 CA 1.575 15 residues pruned to eliminate duplicates Z: 12 12.273 1.976 0.327 0.669 0.909 0.455 CB 1.327 12 residues pruned to eliminate duplicates Z: 11 18.582 2.171 0.403 0.821 1.000 0.800 CB 1.461 11 residues pruned to eliminate duplicates Z: 62 28.324 2.119 0.538 0.470 0.852 0.574 CB 1.345 62 residues pruned to eliminate duplicates Z: 13 8.031 1.494 0.291 0.895 1.000 0.667 CB 0.862 10 residues pruned to eliminate duplicates 7 1.793 1.409 0.704 0.283 0.667 0.500 CB 0.584 ? Z: 8 11.969 1.899 0.495 0.779 0.857 0.857 CB 1.453 8 residues pruned to eliminate duplicates Z: 12 17.399 2.092 0.869 0.630 0.909 0.636 CB 1.306 13 residues pruned to eliminate duplicates Z: 16 29.258 2.193 0.756 0.892 0.933 0.733 CB 1.510 16 residues pruned to eliminate duplicates Z: 39 41.707 2.236 0.825 0.608 0.974 0.658 CB 1.538 39 residues pruned to eliminate duplicates Z: 19 27.195 2.123 0.430 0.796 0.944 0.833 CB 1.725 19 residues pruned to eliminate duplicates Z: 18 49.226 2.538 1.133 0.825 1.000 0.588 CB 1.665 18 residues pruned to eliminate duplicates Z: 7 5.115 1.862 -0.156 0.606 1.000 1.000 CB 1.201 Z: 11 16.636 1.987 0.581 0.750 1.000 0.800 CB 1.340 Z: 11 6.606 1.745 0.258 0.720 0.800 0.700 CB 0.975 11 residues pruned to eliminate duplicates Z: 27 23.441 2.243 0.546 0.433 0.923 0.731 CB 1.540 27 residues pruned to eliminate duplicates Z: 25 29.659 2.188 0.532 0.866 0.917 0.708 CB 1.442 25 residues pruned to eliminate duplicates Z: 10 27.602 2.197 1.542 0.693 0.889 0.667 CA 1.553 10 residues pruned to eliminate duplicates Z: 14 13.658 2.226 0.582 0.345 0.769 0.308 CB 1.656 14 residues pruned to eliminate duplicates Z: 14 18.075 1.711 1.027 0.933 1.000 0.923 CB 1.008 14 residues pruned to eliminate duplicates Z: 13 11.203 1.633 0.480 0.634 0.917 0.500 CB 1.288 12 residues pruned to eliminate duplicates Z: 29 45.380 2.291 0.865 0.808 0.929 0.821 CB 1.653 29 residues pruned to eliminate duplicates Z: 7 2.462 1.637 0.171 0.247 0.500 0.333 CB 1.405 Z: 151 88.422 2.436 0.747 0.600 0.887 0.667 CB 1.739 151 residues pruned to eliminate duplicates Z: 48 72.917 2.398 0.843 0.824 0.979 0.851 CB 1.856 48 residues pruned to eliminate duplicates Z: 7 6.376 1.904 0.175 0.534 0.833 0.667 CB 1.351 7 residues pruned to eliminate duplicates Z: 6 6.558 1.543 0.326 0.684 1.000 0.400 CA 1.211 6 residues pruned to eliminate duplicates Z: 12 8.212 1.695 0.076 0.905 1.000 0.909 CB 0.967 12 residues pruned to eliminate duplicates Z: 14 17.801 2.155 0.674 0.491 0.923 0.692 CB 1.496 14 residues pruned to eliminate duplicates Z: 17 42.379 2.274 0.999 0.903 1.000 0.375 CB 1.661 Z: 49 38.108 2.249 0.708 0.604 0.958 0.646 CB 1.353 49 residues pruned to eliminate duplicates Z: 25 59.095 2.364 1.201 0.932 1.000 0.792 CB 1.618 25 residues pruned to eliminate duplicates Z: 11 7.804 1.944 0.659 0.466 0.800 0.600 CB 0.990 Z: 18 14.768 2.131 0.206 0.498 0.941 0.647 CB 1.484 18 residues pruned to eliminate duplicates Z: 23 29.782 2.422 0.611 0.468 1.000 0.682 CB 1.681 23 residues pruned to eliminate duplicates Z: 100 84.247 2.400 0.795 0.707 0.949 0.707 CB 1.715 100 residues pruned to eliminate duplicates Z: 50 29.027 2.139 0.467 0.547 0.980 0.592 CB 1.288 50 residues pruned to eliminate duplicates Z: 88 61.959 2.273 0.802 0.582 0.966 0.644 CB 1.552 88 residues pruned to eliminate duplicates Z: 6 7.503 1.772 0.506 0.491 1.000 0.600 CA 1.269 6 residues pruned to eliminate duplicates Z: 23 49.219 2.405 0.858 0.822 1.000 0.682 CA 1.776 23 residues pruned to eliminate duplicates Z: 15 22.652 2.079 1.307 0.441 0.929 0.500 CB 1.445 15 residues pruned to eliminate duplicates Z: 58 68.860 2.485 0.890 0.669 0.930 0.684 CB 1.787 58 residues pruned to eliminate duplicates Z: 25 43.271 2.245 1.112 0.837 0.917 0.833 CB 1.520 25 residues pruned to eliminate duplicates Z: 25 40.277 2.306 0.616 0.911 0.958 0.875 CB 1.631 25 residues pruned to eliminate duplicates Z: 64 40.586 2.173 0.711 0.516 0.889 0.571 CB 1.523 58 residues pruned to eliminate duplicates Z: 15 41.831 2.391 0.990 0.900 1.000 0.643 CB 1.678 Z: 63 42.330 2.208 0.597 0.596 0.984 0.565 CB 1.413 63 residues pruned to eliminate duplicates Z: 14 11.456 1.698 0.302 0.911 1.000 1.000 CB 1.018 14 residues pruned to eliminate duplicates Z: 108 47.390 2.179 0.673 0.499 0.897 0.617 CB 1.403 108 residues pruned to eliminate duplicates Z: 12 4.669 1.685 0.087 0.510 0.818 0.636 CB 0.929 9 residues pruned to eliminate duplicates Z: 8 20.385 2.174 0.666 0.782 1.000 0.571 CA 1.660 8 residues pruned to eliminate duplicates Z: 8 5.299 1.864 0.932 0.118 0.714 0.429 CB 1.260 8 residues pruned to eliminate duplicates Z: 33 56.735 2.300 0.827 0.839 1.000 0.719 CB 1.782 33 residues pruned to eliminate duplicates Z: 24 13.939 1.740 0.532 0.690 0.913 0.739 CB 1.004 24 residues pruned to eliminate duplicates Z: 6 6.156 2.067 0.851 0.137 0.800 0.600 CB 1.412 2 residues pruned to eliminate duplicates Z: 65 82.949 2.435 0.820 0.799 0.969 0.766 CB 1.860 65 residues pruned to eliminate duplicates Z: 7 19.246 2.130 1.024 0.630 1.000 0.833 CB 1.614 7 residues pruned to eliminate duplicates Z: 7 7.832 1.923 0.227 0.519 0.833 0.333 C 1.597 7 residues pruned to eliminate duplicates Z: 19 34.657 2.358 0.848 0.640 0.944 0.667 CB 1.741 19 residues pruned to eliminate duplicates Z: 17 31.908 2.110 1.102 0.947 0.938 0.875 CB 1.326 17 residues pruned to eliminate duplicates Z: 47 41.712 2.272 0.787 0.633 0.935 0.630 CB 1.431 66 residues pruned to eliminate duplicates Z: 15 35.702 2.232 1.184 0.913 1.000 0.214 CB 1.386 15 residues pruned to eliminate duplicates Z: 11 18.111 2.000 0.680 0.901 1.000 1.000 CB 1.217 11 residues pruned to eliminate duplicates Z: 22 54.007 2.373 1.076 0.885 0.952 0.857 CA 1.813 22 residues pruned to eliminate duplicates Z: 6 6.521 1.930 -0.115 0.743 1.000 0.800 CB 1.374 10 residues pruned to eliminate duplicates Z: 13 23.524 2.305 0.677 0.532 1.000 0.750 CB 1.702 13 residues pruned to eliminate duplicates Z: 23 42.997 2.178 1.192 0.941 0.955 0.682 CB 1.395 23 residues pruned to eliminate duplicates Z: 19 18.097 1.961 0.645 0.592 0.833 0.722 CB 1.453 19 residues pruned to eliminate duplicates Z: 25 56.339 2.357 1.148 0.914 1.000 0.542 CB 1.606 25 residues pruned to eliminate duplicates Z: 13 12.733 1.870 0.248 0.749 1.000 0.583 CB 1.261 13 residues pruned to eliminate duplicates Z: 16 13.887 2.126 0.387 0.520 0.933 0.600 CB 1.278 16 residues pruned to eliminate duplicates Z: 10 9.612 1.876 0.413 0.497 1.000 0.444 CB 1.212 10 residues pruned to eliminate duplicates Z: 56 53.893 2.346 0.936 0.579 0.891 0.600 CB 1.665 56 residues pruned to eliminate duplicates 7 1.377 1.272 0.385 0.243 0.667 0.667 CA 0.644 ? Z: 17 21.257 1.982 0.528 0.691 0.938 0.625 CB 1.573 17 residues pruned to eliminate duplicates Z: 27 18.379 1.970 0.648 0.413 0.846 0.423 CB 1.437 27 residues pruned to eliminate duplicates Z: 13 22.224 2.409 0.578 0.380 1.000 0.667 CA 1.919 13 residues pruned to eliminate duplicates Z: 18 23.419 1.873 1.089 0.847 0.941 0.588 CB 1.145 18 residues pruned to eliminate duplicates Z: 32 56.932 2.284 0.897 0.902 0.968 0.677 CB 1.740 32 residues pruned to eliminate duplicates Z: 6 4.293 1.355 0.694 0.400 1.000 0.400 CB 0.930 Z: 66 42.930 2.265 0.518 0.606 0.969 0.600 CB 1.445 66 residues pruned to eliminate duplicates Z: 19 19.421 1.941 0.699 0.600 0.833 0.722 CA 1.514 19 residues pruned to eliminate duplicates Z: 22 33.539 2.152 0.894 0.915 0.952 0.524 CB 1.333 22 residues pruned to eliminate duplicates Z: 6 4.672 1.757 0.044 0.656 1.000 0.600 CB 0.985 6 residues pruned to eliminate duplicates Z: 18 29.906 2.162 0.997 0.748 0.882 0.706 CB 1.525 18 residues pruned to eliminate duplicates Z: 6 3.023 1.312 0.782 0.191 0.800 0.400 N 1.046 Z: 13 14.386 1.742 0.648 0.937 1.000 0.833 CB 1.007 13 residues pruned to eliminate duplicates Z: 6 7.109 2.101 0.412 0.392 1.000 0.600 CB 1.202 6 residues pruned to eliminate duplicates Z: 10 4.094 1.491 0.416 0.644 0.667 0.444 N 0.848 10 residues pruned to eliminate duplicates Z: 23 29.745 2.278 0.736 0.594 0.955 0.591 CB 1.534 23 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 6 2.808 1.739 0.240 0.364 0.800 0.400 CB 0.842 6 residues pruned to eliminate duplicates Z: 7 4.026 1.743 0.215 0.302 0.833 0.333 CB 1.161 7 residues pruned to eliminate duplicates Z: 12 9.500 1.656 0.407 0.850 1.000 0.636 CB 0.911 12 residues pruned to eliminate duplicates Z: 89 55.170 2.272 0.629 0.573 0.966 0.602 CB 1.534 89 residues pruned to eliminate duplicates Z: 65 39.119 2.156 0.630 0.508 0.922 0.547 CB 1.497 65 residues pruned to eliminate duplicates Z: 65 36.607 2.165 0.636 0.467 0.922 0.531 CB 1.449 65 residues pruned to eliminate duplicates Z: 41 27.884 2.029 0.634 0.587 0.950 0.450 CB 1.287 41 residues pruned to eliminate duplicates Z: 31 27.145 2.022 0.587 0.697 1.000 0.500 CB 1.290 31 residues pruned to eliminate duplicates Z: 40 27.837 2.048 0.632 0.618 0.923 0.641 CB 1.292 40 residues pruned to eliminate duplicates Z: 39 29.324 2.043 0.692 0.598 0.921 0.553 CB 1.361 39 residues pruned to eliminate duplicates Z: 38 30.130 2.069 0.666 0.613 0.919 0.622 CB 1.406 38 residues pruned to eliminate duplicates Z: 38 28.000 2.068 0.611 0.585 0.919 0.459 CB 1.386 38 residues pruned to eliminate duplicates Z: 104 60.638 2.282 0.758 0.564 0.913 0.544 CB 1.534 104 residues pruned to eliminate duplicates Z: 28 20.967 1.920 0.508 0.646 0.963 0.556 CB 1.262 28 residues pruned to eliminate duplicates Z: 41 27.312 2.016 0.514 0.571 0.950 0.625 CB 1.390 43 residues pruned to eliminate duplicates Z: 9 4.688 1.771 0.139 0.754 0.875 0.750 CB 0.749 9 residues pruned to eliminate duplicates Z: 44 26.201 2.016 0.542 0.538 0.907 0.628 CB 1.365 44 residues pruned to eliminate duplicates Z: 62 36.760 2.205 0.561 0.457 0.967 0.557 CB 1.478 62 residues pruned to eliminate duplicates Z: 28 22.695 1.910 0.588 0.673 0.963 0.519 CB 1.276 28 residues pruned to eliminate duplicates Z: 10 6.812 1.828 0.221 0.533 0.889 0.556 CB 1.108 10 residues pruned to eliminate duplicates Z: 76 51.082 2.286 0.635 0.596 0.973 0.533 CB 1.479 76 residues pruned to eliminate duplicates Z: 88 55.455 2.272 0.665 0.586 0.943 0.609 CB 1.536 88 residues pruned to eliminate duplicates Z: 38 23.580 2.077 0.337 0.586 0.919 0.514 CB 1.400 38 residues pruned to eliminate duplicates Z: 64 45.953 2.252 0.659 0.620 0.984 0.556 CB 1.406 64 residues pruned to eliminate duplicates Z: 28 21.880 1.884 0.548 0.635 0.963 0.556 CB 1.321 28 residues pruned to eliminate duplicates Z: 39 30.531 2.072 0.635 0.589 0.974 0.553 CB 1.378 40 residues pruned to eliminate duplicates Z: 14 18.256 1.974 0.748 0.608 1.000 0.308 CB 1.324 14 residues pruned to eliminate duplicates Z: 38 29.889 2.105 0.636 0.585 0.973 0.622 CB 1.352 38 residues pruned to eliminate duplicates Z: 12 21.627 2.276 0.692 0.661 0.909 0.636 CB 1.605 12 residues pruned to eliminate duplicates Z: 43 26.525 1.989 0.628 0.519 0.929 0.714 CB 1.335 43 residues pruned to eliminate duplicates Z: 39 28.171 2.089 0.639 0.599 0.921 0.658 CB 1.319 39 residues pruned to eliminate duplicates Z: 86 59.604 2.256 0.777 0.582 0.965 0.682 CB 1.544 86 residues pruned to eliminate duplicates Z: 56 30.269 2.029 0.578 0.488 0.927 0.564 CB 1.392 56 residues pruned to eliminate duplicates Z: 44 26.719 1.996 0.606 0.587 0.953 0.605 CB 1.227 44 residues pruned to eliminate duplicates Z: 38 28.006 2.065 0.569 0.574 1.000 0.595 CB 1.323 38 residues pruned to eliminate duplicates Z: 7 3.743 1.792 0.483 0.148 0.667 0.167 CA 1.332 7 residues pruned to eliminate duplicates Z: 107 65.933 2.327 0.696 0.612 0.943 0.547 CB 1.546 104 residues pruned to eliminate duplicates Z: 7 8.523 1.719 0.982 0.361 0.833 0.500 O 1.423 7 residues pruned to eliminate duplicates Z: 107 59.578 2.317 0.666 0.554 0.896 0.481 CB 1.587 113 residues pruned to eliminate duplicates Z: 37 27.019 2.049 0.494 0.609 0.972 0.667 CB 1.365 39 residues pruned to eliminate duplicates Z: 8 15.033 2.386 0.695 0.525 1.000 0.286 CB 1.371 8 residues pruned to eliminate duplicates Z: 35 52.507 2.586 0.799 0.661 0.882 0.559 CB 1.890 35 residues pruned to eliminate duplicates Z: 66 59.499 2.462 0.749 0.589 0.908 0.569 CB 1.734 66 residues pruned to eliminate duplicates Z: 36 56.596 2.582 0.849 0.665 0.914 0.657 CB 1.882 36 residues pruned to eliminate duplicates Z: 28 38.386 2.410 0.826 0.641 0.963 0.407 CB 1.529 28 residues pruned to eliminate duplicates Z: 109 64.346 2.318 0.673 0.602 0.935 0.593 CB 1.549 109 residues pruned to eliminate duplicates Z: 64 43.965 2.265 0.636 0.605 0.952 0.556 CB 1.420 64 residues pruned to eliminate duplicates Z: 94 57.327 2.284 0.618 0.622 0.946 0.581 CB 1.516 94 residues pruned to eliminate duplicates Z: 39 44.020 2.516 0.631 0.606 0.921 0.447 CB 1.709 39 residues pruned to eliminate duplicates Z: 35 53.155 2.518 0.947 0.640 0.941 0.559 CB 1.734 35 residues pruned to eliminate duplicates Z: 65 43.076 2.246 0.645 0.596 0.969 0.656 CB 1.372 65 residues pruned to eliminate duplicates Z: 17 47.743 2.452 1.020 0.923 1.000 0.750 CB 1.693 17 residues pruned to eliminate duplicates Z: 24 49.882 2.543 0.908 0.709 1.000 0.609 CB 1.773 24 residues pruned to eliminate duplicates Z: 24 50.979 2.564 0.989 0.693 1.000 0.478 CB 1.747 24 residues pruned to eliminate duplicates Z: 69 43.433 2.212 0.675 0.586 0.941 0.559 CB 1.391 69 residues pruned to eliminate duplicates Z: 66 46.611 2.234 0.739 0.615 0.985 0.600 CB 1.355 64 residues pruned to eliminate duplicates Z: 17 42.334 2.388 1.001 0.907 0.938 0.688 CB 1.680 17 residues pruned to eliminate duplicates Z: 80 52.376 2.307 0.687 0.569 0.937 0.582 CB 1.511 80 residues pruned to eliminate duplicates Z: 67 63.432 2.478 0.765 0.607 0.894 0.652 CB 1.804 67 residues pruned to eliminate duplicates Z: 24 49.448 2.578 0.898 0.740 0.957 0.652 CB 1.777 24 residues pruned to eliminate duplicates Z: 79 50.979 2.251 0.706 0.585 0.949 0.615 CB 1.460 79 residues pruned to eliminate duplicates Z: 77 50.385 2.276 0.721 0.593 0.895 0.566 CB 1.510 77 residues pruned to eliminate duplicates Z: 94 62.213 2.316 0.675 0.618 0.935 0.645 CB 1.590 94 residues pruned to eliminate duplicates Z: 76 50.483 2.303 0.545 0.597 0.973 0.600 CB 1.535 76 residues pruned to eliminate duplicates Z: 36 45.948 2.568 0.604 0.674 0.857 0.629 CB 1.873 36 residues pruned to eliminate duplicates Z: 40 52.415 2.540 0.772 0.606 0.923 0.641 CB 1.827 40 residues pruned to eliminate duplicates Z: 35 61.160 2.595 0.754 0.674 1.000 0.735 CB 1.963 35 residues pruned to eliminate duplicates Z: 36 52.538 2.564 0.704 0.653 0.943 0.686 CB 1.870 36 residues pruned to eliminate duplicates Z: 61 57.653 2.485 0.593 0.644 0.950 0.667 CB 1.729 61 residues pruned to eliminate duplicates Z: 42 40.649 2.416 0.731 0.514 0.829 0.585 CB 1.805 42 residues pruned to eliminate duplicates Z: 45 52.252 2.454 0.898 0.539 0.909 0.545 CB 1.791 45 residues pruned to eliminate duplicates Z: 106 58.877 2.331 0.583 0.584 0.924 0.581 CB 1.555 106 residues pruned to eliminate duplicates Z: 106 60.290 2.325 0.613 0.593 0.924 0.667 CB 1.554 106 residues pruned to eliminate duplicates Z: 177 104.384 2.403 0.830 0.647 0.938 0.636 CB 1.663 317 residues pruned to eliminate duplicates Z: 18 25.720 2.231 0.377 0.792 1.000 0.882 CA 1.572 18 residues pruned to eliminate duplicates Z: 46 42.649 2.355 0.727 0.533 0.844 0.511 CB 1.792 46 residues pruned to eliminate duplicates Z: 33 29.211 2.250 0.537 0.560 0.906 0.562 CB 1.554 33 residues pruned to eliminate duplicates Z: 33 35.045 2.334 0.670 0.585 0.938 0.625 CB 1.564 33 residues pruned to eliminate duplicates Z: 108 62.992 2.308 0.698 0.575 0.935 0.589 CB 1.546 110 residues pruned to eliminate duplicates Z: 16 38.634 2.365 0.655 0.892 1.000 0.800 CB 1.830 16 residues pruned to eliminate duplicates Z: 56 49.115 2.402 0.777 0.607 0.855 0.691 CB 1.640 56 residues pruned to eliminate duplicates Z: 34 37.586 2.321 0.816 0.547 0.879 0.545 CB 1.687 34 residues pruned to eliminate duplicates Z: 35 34.680 2.318 0.689 0.576 0.824 0.618 CB 1.716 35 residues pruned to eliminate duplicates Z: 107 63.394 2.320 0.654 0.589 0.943 0.651 CB 1.561 107 residues pruned to eliminate duplicates Z: 34 37.247 2.303 0.817 0.549 0.939 0.697 CB 1.572 34 residues pruned to eliminate duplicates Z: 87 62.556 2.342 0.842 0.557 0.919 0.651 CB 1.610 87 residues pruned to eliminate duplicates Z: 70 66.360 2.430 0.925 0.574 0.899 0.667 CB 1.770 70 residues pruned to eliminate duplicates Z: 43 51.935 2.450 0.971 0.563 0.881 0.452 CB 1.773 43 residues pruned to eliminate duplicates Z: 108 62.946 2.307 0.743 0.544 0.925 0.589 CB 1.567 108 residues pruned to eliminate duplicates Z: 67 59.489 2.459 0.686 0.595 0.894 0.636 CB 1.804 67 residues pruned to eliminate duplicates Z: 36 34.445 2.271 0.748 0.543 0.886 0.600 CB 1.588 36 residues pruned to eliminate duplicates Z: 67 57.186 2.437 0.684 0.581 0.939 0.636 CB 1.689 67 residues pruned to eliminate duplicates Z: 66 61.545 2.428 0.821 0.601 0.923 0.554 CB 1.700 66 residues pruned to eliminate duplicates Z: 36 37.139 2.278 0.775 0.551 0.914 0.571 CB 1.615 36 residues pruned to eliminate duplicates Z: 32 37.966 2.360 0.853 0.601 0.871 0.548 CB 1.625 32 residues pruned to eliminate duplicates Z: 42 38.650 2.358 0.759 0.529 0.854 0.561 CB 1.657 42 residues pruned to eliminate duplicates Z: 66 62.232 2.432 0.779 0.592 0.923 0.631 CB 1.769 66 residues pruned to eliminate duplicates Z: 34 36.352 2.344 0.806 0.597 0.879 0.576 CB 1.550 34 residues pruned to eliminate duplicates Z: 22 14.269 2.235 0.526 0.300 0.810 0.381 CB 1.409 22 residues pruned to eliminate duplicates Z: 32 35.240 2.364 0.640 0.596 0.903 0.548 CB 1.649 32 residues pruned to eliminate duplicates Z: 34 37.736 2.356 0.729 0.578 0.879 0.636 CB 1.702 34 residues pruned to eliminate duplicates Z: 31 43.031 2.389 0.884 0.615 0.900 0.567 CB 1.739 31 residues pruned to eliminate duplicates Z: 35 39.019 2.311 0.828 0.597 0.853 0.618 CB 1.692 35 residues pruned to eliminate duplicates Z: 67 63.874 2.450 0.739 0.607 0.924 0.500 CB 1.804 67 residues pruned to eliminate duplicates Z: 102 98.968 2.471 0.993 0.715 0.941 0.703 CB 1.750 102 residues pruned to eliminate duplicates Z: 82 79.337 2.488 0.828 0.693 0.926 0.728 CB 1.756 82 residues pruned to eliminate duplicates Z: 89 81.169 2.463 0.895 0.671 0.909 0.636 CB 1.742 113 residues pruned to eliminate duplicates Z: 115 95.311 2.491 0.880 0.664 0.939 0.675 CB 1.745 115 residues pruned to eliminate duplicates Z: 91 87.122 2.481 0.923 0.671 0.956 0.689 CB 1.720 91 residues pruned to eliminate duplicates Z: 27 45.554 2.439 0.999 0.718 0.923 0.731 CB 1.630 27 residues pruned to eliminate duplicates Z: 26 49.618 2.504 1.023 0.763 0.960 0.840 CB 1.616 26 residues pruned to eliminate duplicates Z: 43 49.705 2.372 0.844 0.609 0.976 0.643 CB 1.620 43 residues pruned to eliminate duplicates Z: 122 91.724 2.459 0.931 0.632 0.909 0.653 CB 1.707 122 residues pruned to eliminate duplicates Z: 40 51.847 2.441 0.985 0.662 0.923 0.692 CB 1.598 40 residues pruned to eliminate duplicates Z: 108 84.360 2.430 0.943 0.638 0.897 0.645 CB 1.692 108 residues pruned to eliminate duplicates Z: 47 43.316 2.319 0.978 0.556 0.870 0.630 CB 1.516 47 residues pruned to eliminate duplicates Z: 57 39.499 2.239 0.950 0.523 0.839 0.571 CB 1.408 90 residues pruned to eliminate duplicates Z: 90 86.448 2.446 0.979 0.681 0.944 0.708 CB 1.698 90 residues pruned to eliminate duplicates Z: 43 46.959 2.421 0.860 0.626 0.905 0.643 CB 1.580 43 residues pruned to eliminate duplicates Z: 136 93.218 2.456 0.863 0.627 0.926 0.726 CB 1.680 136 residues pruned to eliminate duplicates Z: 179 112.693 2.463 0.889 0.638 0.938 0.680 CB 1.701 179 residues pruned to eliminate duplicates Z: 163 115.066 2.479 0.938 0.655 0.957 0.728 CB 1.704 163 residues pruned to eliminate duplicates Z: 26 54.610 2.470 1.277 0.749 0.960 0.760 CB 1.619 26 residues pruned to eliminate duplicates Z: 153 100.574 2.445 0.899 0.607 0.928 0.671 CB 1.711 153 residues pruned to eliminate duplicates Z: 41 55.152 2.425 1.117 0.670 0.950 0.625 CB 1.528 41 residues pruned to eliminate duplicates Z: 47 41.985 2.317 0.963 0.553 0.870 0.522 CB 1.487 58 residues pruned to eliminate duplicates Z: 87 90.123 2.503 1.016 0.703 0.919 0.721 CB 1.742 87 residues pruned to eliminate duplicates Z: 176 108.305 2.443 0.936 0.621 0.931 0.634 CB 1.657 176 residues pruned to eliminate duplicates Z: 163 108.912 2.476 0.921 0.632 0.932 0.630 CB 1.705 163 residues pruned to eliminate duplicates Z: 74 87.534 2.520 1.008 0.780 0.904 0.726 CB 1.748 74 residues pruned to eliminate duplicates Z: 135 100.672 2.476 0.872 0.661 0.918 0.687 CB 1.760 135 residues pruned to eliminate duplicates Z: 162 117.229 2.489 0.960 0.662 0.938 0.683 CB 1.737 162 residues pruned to eliminate duplicates Z: 91 86.277 2.442 0.977 0.705 0.911 0.644 CB 1.716 91 residues pruned to eliminate duplicates Z: 92 87.812 2.425 0.951 0.708 0.945 0.703 CB 1.703 92 residues pruned to eliminate duplicates Z: 93 90.538 2.462 0.997 0.723 0.924 0.707 CB 1.700 93 residues pruned to eliminate duplicates Z: 129 96.084 2.465 0.906 0.646 0.938 0.688 CB 1.682 129 residues pruned to eliminate duplicates Z: 172 110.671 2.459 0.904 0.633 0.942 0.655 CB 1.695 172 residues pruned to eliminate duplicates Z: 106 88.298 2.454 0.961 0.649 0.914 0.657 CB 1.706 106 residues pruned to eliminate duplicates Z: 101 93.000 2.466 0.990 0.685 0.930 0.670 CB 1.720 101 residues pruned to eliminate duplicates Z: 163 111.046 2.478 0.886 0.652 0.938 0.685 CB 1.728 163 residues pruned to eliminate duplicates Z: 162 115.378 2.477 0.923 0.662 0.957 0.708 CB 1.718 162 residues pruned to eliminate duplicates Z: 102 89.421 2.446 1.013 0.647 0.921 0.703 CB 1.712 102 residues pruned to eliminate duplicates Z: 137 93.784 2.481 0.854 0.610 0.919 0.713 CB 1.715 137 residues pruned to eliminate duplicates Z: 163 113.815 2.489 0.923 0.661 0.932 0.673 CB 1.727 163 residues pruned to eliminate duplicates Z: 88 83.482 2.502 0.901 0.645 0.931 0.621 CB 1.764 88 residues pruned to eliminate duplicates Z: 86 96.601 2.487 1.075 0.719 0.941 0.729 CB 1.770 86 residues pruned to eliminate duplicates Z: 85 94.904 2.503 1.058 0.722 0.940 0.702 CB 1.750 85 residues pruned to eliminate duplicates Z: 94 90.792 2.456 1.003 0.691 0.957 0.677 CB 1.679 94 residues pruned to eliminate duplicates Z: 76 97.669 2.507 1.124 0.768 0.960 0.787 CB 1.740 76 residues pruned to eliminate duplicates Z: 86 92.529 2.504 1.008 0.714 0.941 0.682 CB 1.746 86 residues pruned to eliminate duplicates Z: 108 88.780 2.427 1.012 0.640 0.907 0.654 CB 1.701 108 residues pruned to eliminate duplicates Z: 179 112.428 2.462 0.868 0.645 0.944 0.691 CB 1.696 179 residues pruned to eliminate duplicates Z: 131 95.964 2.447 0.922 0.649 0.923 0.646 CB 1.687 131 residues pruned to eliminate duplicates Z: 85 98.237 2.508 1.086 0.724 0.940 0.726 CB 1.780 85 residues pruned to eliminate duplicates Z: 90 90.393 2.477 1.037 0.676 0.933 0.764 CB 1.731 90 residues pruned to eliminate duplicates Z: 92 88.708 2.453 0.976 0.693 0.956 0.615 CB 1.682 92 residues pruned to eliminate duplicates Z: 149 99.743 2.413 0.996 0.638 0.885 0.635 CB 1.690 149 residues pruned to eliminate duplicates Z: 113 102.756 2.495 1.034 0.669 0.938 0.625 CB 1.746 113 residues pruned to eliminate duplicates Z: 100 96.832 2.481 1.005 0.693 0.949 0.606 CB 1.727 111 residues pruned to eliminate duplicates Z: 114 98.725 2.493 1.002 0.668 0.920 0.664 CB 1.730 114 residues pruned to eliminate duplicates Z: 101 94.360 2.444 1.098 0.664 0.930 0.680 CB 1.700 101 residues pruned to eliminate duplicates Z: 86 98.265 2.487 1.098 0.733 0.953 0.682 CB 1.738 86 residues pruned to eliminate duplicates Z: 95 87.151 2.429 0.996 0.685 0.936 0.660 CB 1.671 95 residues pruned to eliminate duplicates Z: 132 96.695 2.460 0.946 0.644 0.908 0.656 CB 1.698 132 residues pruned to eliminate duplicates Z: 90 90.169 2.490 0.993 0.682 0.944 0.685 CB 1.726 90 residues pruned to eliminate duplicates Z: 114 101.444 2.506 1.022 0.684 0.920 0.673 CB 1.728 114 residues pruned to eliminate duplicates Z: 138 94.968 2.480 0.918 0.606 0.912 0.606 CB 1.690 138 residues pruned to eliminate duplicates Z: 108 76.465 2.432 0.799 0.594 0.935 0.626 CB 1.652 108 residues pruned to eliminate duplicates Z: 129 100.576 2.472 1.013 0.633 0.914 0.656 CB 1.726 129 residues pruned to eliminate duplicates Z: 103 96.477 2.448 1.026 0.676 0.951 0.676 CB 1.722 103 residues pruned to eliminate duplicates Z: 96 94.126 2.438 1.062 0.710 0.926 0.663 CB 1.715 96 residues pruned to eliminate duplicates Z: 133 97.438 2.458 0.916 0.635 0.924 0.606 CB 1.717 133 residues pruned to eliminate duplicates Z: 178 112.086 2.459 0.958 0.639 0.893 0.661 CB 1.721 178 residues pruned to eliminate duplicates Z: 114 100.267 2.499 0.973 0.670 0.947 0.619 CB 1.727 114 residues pruned to eliminate duplicates Z: 136 101.007 2.477 0.944 0.637 0.919 0.667 CB 1.729 136 residues pruned to eliminate duplicates Z: 125 101.445 2.454 0.983 0.671 0.927 0.669 CB 1.724 125 residues pruned to eliminate duplicates Z: 154 101.532 2.450 0.964 0.604 0.915 0.595 CB 1.689 154 residues pruned to eliminate duplicates Z: 113 99.320 2.509 0.987 0.669 0.920 0.643 CB 1.751 113 residues pruned to eliminate duplicates Z: 162 113.831 2.477 0.921 0.663 0.932 0.689 CB 1.740 162 residues pruned to eliminate duplicates Z: 152 104.282 2.473 0.922 0.621 0.927 0.662 CB 1.718 152 residues pruned to eliminate duplicates Z: 45 49.271 2.396 0.932 0.627 0.864 0.636 CB 1.650 45 residues pruned to eliminate duplicates Z: 131 95.411 2.449 0.932 0.635 0.923 0.638 CB 1.688 131 residues pruned to eliminate duplicates Z: 117 97.922 2.498 0.949 0.656 0.931 0.647 CB 1.736 117 residues pruned to eliminate duplicates Z: 153 98.967 2.452 0.922 0.590 0.914 0.579 CB 1.709 153 residues pruned to eliminate duplicates Z: 88 66.290 2.433 0.791 0.543 0.943 0.598 CB 1.660 88 residues pruned to eliminate duplicates Z: 108 89.303 2.420 1.023 0.630 0.944 0.607 CB 1.654 108 residues pruned to eliminate duplicates Z: 162 111.473 2.484 0.898 0.657 0.932 0.671 CB 1.728 162 residues pruned to eliminate duplicates Z: 28 31.404 2.472 0.523 0.575 0.852 0.519 CB 1.753 28 residues pruned to eliminate duplicates Z: 27 34.514 2.505 0.624 0.591 0.923 0.615 CB 1.652 27 residues pruned to eliminate duplicates Z: 152 102.426 2.464 0.896 0.615 0.940 0.570 CB 1.701 152 residues pruned to eliminate duplicates Z: 51 44.475 2.467 0.661 0.488 0.900 0.680 CB 1.727 51 residues pruned to eliminate duplicates Z: 139 101.796 2.444 0.952 0.629 0.935 0.681 CB 1.722 139 residues pruned to eliminate duplicates Z: 75 67.254 2.478 0.787 0.618 0.919 0.784 CB 1.718 75 residues pruned to eliminate duplicates Z: 11 16.960 2.232 0.741 0.603 0.800 0.600 CA 1.564 11 residues pruned to eliminate duplicates Z: 79 64.811 2.431 0.779 0.591 0.923 0.615 CB 1.686 79 residues pruned to eliminate duplicates Z: 28 36.999 2.406 0.764 0.629 0.889 0.556 CB 1.672 28 residues pruned to eliminate duplicates Z: 154 97.090 2.415 0.866 0.601 0.928 0.641 CB 1.705 154 residues pruned to eliminate duplicates Z: 51 48.386 2.418 0.763 0.497 0.940 0.620 CB 1.713 51 residues pruned to eliminate duplicates Z: 50 49.967 2.464 0.760 0.526 0.918 0.571 CB 1.746 50 residues pruned to eliminate duplicates Z: 27 42.775 2.438 0.864 0.610 0.923 0.615 CB 1.802 27 residues pruned to eliminate duplicates Z: 53 45.920 2.412 0.725 0.486 0.923 0.577 CB 1.682 53 residues pruned to eliminate duplicates Z: 163 115.664 2.459 0.974 0.656 0.944 0.642 CB 1.714 163 residues pruned to eliminate duplicates Z: 153 102.676 2.460 0.893 0.608 0.941 0.658 CB 1.714 153 residues pruned to eliminate duplicates Z: 54 44.836 2.362 0.743 0.504 0.925 0.642 CB 1.612 54 residues pruned to eliminate duplicates Z: 137 106.106 2.482 0.982 0.638 0.934 0.669 CB 1.740 137 residues pruned to eliminate duplicates Z: 27 39.734 2.424 0.833 0.618 0.885 0.731 CB 1.774 27 residues pruned to eliminate duplicates Z: 53 51.243 2.405 0.823 0.511 0.904 0.558 CB 1.774 53 residues pruned to eliminate duplicates Z: 75 76.933 2.463 0.910 0.626 0.973 0.662 CB 1.735 75 residues pruned to eliminate duplicates Z: 153 98.329 2.439 0.873 0.602 0.928 0.678 CB 1.708 153 residues pruned to eliminate duplicates Z: 77 69.282 2.457 0.772 0.628 0.947 0.724 CB 1.709 77 residues pruned to eliminate duplicates Z: 51 45.475 2.371 0.787 0.516 0.900 0.600 CB 1.660 51 residues pruned to eliminate duplicates Z: 74 65.787 2.425 0.856 0.595 0.932 0.671 CB 1.677 74 residues pruned to eliminate duplicates Z: 77 71.359 2.471 0.909 0.617 0.921 0.671 CB 1.685 77 residues pruned to eliminate duplicates Z: 76 64.495 2.433 0.738 0.624 0.920 0.667 CB 1.703 76 residues pruned to eliminate duplicates Z: 68 64.593 2.458 0.853 0.621 0.910 0.687 CB 1.697 68 residues pruned to eliminate duplicates Z: 75 76.065 2.489 0.854 0.647 0.959 0.716 CB 1.741 75 residues pruned to eliminate duplicates Z: 40 39.748 2.378 0.667 0.468 0.949 0.615 CB 1.748 40 residues pruned to eliminate duplicates Z: 163 110.599 2.463 0.960 0.661 0.932 0.710 CB 1.663 163 residues pruned to eliminate duplicates Z: 162 116.744 2.469 1.007 0.656 0.944 0.627 CB 1.702 162 residues pruned to eliminate duplicates Z: 50 45.112 2.440 0.734 0.502 0.878 0.633 CB 1.732 50 residues pruned to eliminate duplicates Z: 30 24.971 2.343 0.569 0.360 0.897 0.517 CB 1.635 30 residues pruned to eliminate duplicates Z: 55 49.992 2.393 0.749 0.516 0.944 0.685 CB 1.694 55 residues pruned to eliminate duplicates Z: 77 55.833 2.345 0.817 0.535 0.934 0.697 CB 1.555 77 residues pruned to eliminate duplicates Z: 67 68.671 2.469 0.863 0.624 0.955 0.803 CB 1.712 67 residues pruned to eliminate duplicates Z: 52 51.538 2.358 0.848 0.584 0.922 0.706 CB 1.659 52 residues pruned to eliminate duplicates Z: 26 32.109 2.402 0.757 0.389 0.960 0.680 CB 1.783 26 residues pruned to eliminate duplicates Z: 50 49.572 2.433 0.710 0.536 0.939 0.714 CB 1.750 50 residues pruned to eliminate duplicates Z: 47 45.078 2.416 0.765 0.490 0.891 0.652 CB 1.767 47 residues pruned to eliminate duplicates Z: 29 25.345 2.370 0.516 0.372 0.964 0.607 CB 1.585 29 residues pruned to eliminate duplicates Z: 111 92.539 2.481 0.929 0.623 0.936 0.673 CB 1.754 111 residues pruned to eliminate duplicates Z: 51 58.814 2.446 0.807 0.619 0.980 0.720 CB 1.716 51 residues pruned to eliminate duplicates Z: 50 58.173 2.456 0.819 0.622 0.959 0.714 CB 1.729 50 residues pruned to eliminate duplicates Z: 76 71.815 2.449 0.816 0.639 0.947 0.720 CB 1.729 76 residues pruned to eliminate duplicates Z: 32 22.510 2.215 0.544 0.342 0.871 0.452 CB 1.613 32 residues pruned to eliminate duplicates Z: 67 65.550 2.465 0.798 0.628 0.955 0.697 CB 1.690 67 residues pruned to eliminate duplicates Z: 77 69.023 2.430 0.790 0.623 0.947 0.684 CB 1.711 77 residues pruned to eliminate duplicates Z: 174 115.460 2.453 0.919 0.663 0.948 0.653 CB 1.692 174 residues pruned to eliminate duplicates Z: 28 54.880 2.473 0.889 0.805 1.000 0.667 CB 1.733 28 residues pruned to eliminate duplicates Z: 53 51.311 2.404 0.806 0.573 0.962 0.654 CB 1.589 53 residues pruned to eliminate duplicates Z: 75 69.797 2.464 0.797 0.644 0.946 0.757 CB 1.694 75 residues pruned to eliminate duplicates Z: 75 71.885 2.462 0.794 0.657 0.973 0.689 CB 1.681 75 residues pruned to eliminate duplicates Z: 68 57.471 2.388 0.738 0.620 0.955 0.627 CB 1.581 68 residues pruned to eliminate duplicates Z: 76 74.114 2.477 0.848 0.642 0.947 0.653 CB 1.729 76 residues pruned to eliminate duplicates Z: 180 115.063 2.456 0.933 0.652 0.927 0.665 CB 1.695 180 residues pruned to eliminate duplicates Z: 162 113.853 2.464 1.030 0.663 0.919 0.602 CB 1.677 162 residues pruned to eliminate duplicates Z: 25 62.268 2.502 1.206 0.873 1.000 0.792 CB 1.677 25 residues pruned to eliminate duplicates Z: 56 51.405 2.365 0.715 0.579 0.945 0.655 CB 1.675 56 residues pruned to eliminate duplicates Z: 27 54.408 2.448 1.120 0.804 0.962 0.654 CB 1.639 27 residues pruned to eliminate duplicates Z: 32 44.318 2.372 0.946 0.708 0.903 0.548 CB 1.580 32 residues pruned to eliminate duplicates Z: 165 118.036 2.475 0.990 0.660 0.939 0.671 CB 1.718 165 residues pruned to eliminate duplicates Z: 25 59.923 2.367 1.222 0.928 1.000 0.458 CB 1.629 25 residues pruned to eliminate duplicates Z: 77 73.016 2.408 0.907 0.639 0.961 0.579 CB 1.666 77 residues pruned to eliminate duplicates Z: 51 56.374 2.431 0.913 0.610 0.940 0.620 CB 1.643 51 residues pruned to eliminate duplicates Z: 55 59.357 2.419 0.885 0.605 0.981 0.593 CB 1.633 55 residues pruned to eliminate duplicates Z: 26 57.649 2.501 1.114 0.826 1.000 0.480 CB 1.644 26 residues pruned to eliminate duplicates Z: 25 56.886 2.468 1.205 0.859 0.958 0.583 CB 1.638 25 residues pruned to eliminate duplicates Z: 51 63.114 2.452 0.964 0.620 0.960 0.560 CB 1.723 51 residues pruned to eliminate duplicates Z: 23 57.605 2.430 1.378 0.930 1.000 0.318 CB 1.487 23 residues pruned to eliminate duplicates Z: 77 74.299 2.436 0.965 0.627 0.947 0.579 CB 1.667 77 residues pruned to eliminate duplicates Z: 30 47.870 2.323 1.159 0.754 0.897 0.517 CB 1.577 30 residues pruned to eliminate duplicates Z: 77 71.191 2.431 0.909 0.603 0.947 0.618 CB 1.684 77 residues pruned to eliminate duplicates Z: 12 9.890 1.868 0.312 0.665 0.818 0.545 CB 1.276 12 residues pruned to eliminate duplicates Z: 10 14.825 1.837 0.393 0.905 1.000 0.556 CB 1.375 10 residues pruned to eliminate duplicates Z: 7 11.323 1.875 0.157 0.877 1.000 0.667 CB 1.548 7 residues pruned to eliminate duplicates Z: 24 11.978 1.694 0.441 0.580 0.870 0.565 CB 1.089 16 residues pruned to eliminate duplicates Z: 9 10.550 1.831 0.221 0.908 1.000 0.750 CB 1.185 9 residues pruned to eliminate duplicates Z: 14 8.771 1.794 0.226 0.634 0.846 0.385 CB 1.153 14 residues pruned to eliminate duplicates Z: 10 11.813 1.913 0.324 0.697 0.889 0.667 CB 1.461 10 residues pruned to eliminate duplicates Z: 9 11.625 1.944 0.205 0.852 0.875 0.750 CB 1.484 9 residues pruned to eliminate duplicates Z: 18 27.773 2.308 0.660 0.635 0.941 0.647 CB 1.645 18 residues pruned to eliminate duplicates Z: 16 25.532 2.147 0.790 0.662 0.933 0.667 CB 1.581 16 residues pruned to eliminate duplicates Z: 18 24.714 2.238 0.575 0.620 0.941 0.647 CB 1.614 18 residues pruned to eliminate duplicates Z: 19 22.402 2.209 0.664 0.600 0.889 0.500 CB 1.469 19 residues pruned to eliminate duplicates Z: 20 21.326 2.187 0.536 0.565 0.895 0.579 CB 1.529 20 residues pruned to eliminate duplicates Z: 18 29.018 2.258 0.704 0.675 0.941 0.647 CA 1.654 17 residues pruned to eliminate duplicates Z: 15 23.083 1.871 0.849 0.900 0.929 0.571 CB 1.371 15 residues pruned to eliminate duplicates Z: 42 33.485 2.111 0.579 0.662 0.927 0.659 CB 1.456 46 residues pruned to eliminate duplicates Z: 11 35.444 2.288 1.003 0.926 1.000 0.700 CA 1.715 11 residues pruned to eliminate duplicates Z: 18 26.880 2.267 0.728 0.644 0.882 0.647 CB 1.649 18 residues pruned to eliminate duplicates Z: 20 23.243 2.198 0.593 0.552 0.947 0.579 CB 1.529 20 residues pruned to eliminate duplicates Z: 56 35.529 2.084 0.571 0.571 0.927 0.600 CB 1.473 56 residues pruned to eliminate duplicates Z: 18 24.606 2.216 0.531 0.623 0.941 0.647 CB 1.663 18 residues pruned to eliminate duplicates Z: 18 30.521 2.341 0.568 0.658 1.000 0.706 CB 1.741 18 residues pruned to eliminate duplicates Z: 18 28.043 2.291 0.603 0.651 0.941 0.647 CB 1.710 18 residues pruned to eliminate duplicates Z: 8 6.516 1.690 0.187 0.406 1.000 0.286 CA 1.356 8 residues pruned to eliminate duplicates Z: 34 23.253 1.890 0.479 0.638 0.939 0.697 CB 1.354 34 residues pruned to eliminate duplicates Z: 41 26.433 1.966 0.605 0.551 0.925 0.650 CB 1.363 41 residues pruned to eliminate duplicates Z: 39 25.402 2.020 0.470 0.599 0.895 0.684 CB 1.412 39 residues pruned to eliminate duplicates Z: 40 28.137 2.015 0.545 0.568 0.949 0.692 CB 1.429 40 residues pruned to eliminate duplicates Z: 33 22.074 1.924 0.476 0.653 0.875 0.625 CB 1.362 33 residues pruned to eliminate duplicates Z: 21 22.477 1.871 0.542 0.748 0.950 0.700 CB 1.469 21 residues pruned to eliminate duplicates Z: 31 25.840 1.945 0.652 0.601 0.900 0.667 CB 1.482 31 residues pruned to eliminate duplicates Z: 32 24.777 1.901 0.519 0.558 0.968 0.613 CB 1.505 32 residues pruned to eliminate duplicates Z: 31 28.991 1.894 0.679 0.612 1.000 0.567 CB 1.496 31 residues pruned to eliminate duplicates Z: 33 22.266 1.877 0.557 0.587 0.875 0.625 CB 1.416 33 residues pruned to eliminate duplicates Z: 37 29.123 2.041 0.655 0.588 0.917 0.694 CB 1.440 37 residues pruned to eliminate duplicates Z: 30 21.684 1.891 0.530 0.620 0.966 0.724 CB 1.287 30 residues pruned to eliminate duplicates Z: 26 24.481 2.069 0.453 0.746 0.920 0.760 CB 1.420 26 residues pruned to eliminate duplicates Z: 30 25.072 1.945 0.687 0.599 0.897 0.552 CB 1.441 30 residues pruned to eliminate duplicates Z: 33 20.978 1.872 0.593 0.622 0.875 0.594 CB 1.267 33 residues pruned to eliminate duplicates Z: 21 23.667 1.839 0.696 0.753 1.000 0.650 CB 1.354 21 residues pruned to eliminate duplicates Z: 25 24.180 1.900 0.587 0.686 0.958 0.542 CB 1.441 25 residues pruned to eliminate duplicates Z: 26 21.296 1.876 0.597 0.677 0.880 0.720 CB 1.373 26 residues pruned to eliminate duplicates Z: 33 24.017 1.913 0.625 0.590 0.875 0.594 CB 1.432 33 residues pruned to eliminate duplicates Z: 69 68.564 2.418 0.894 0.630 0.956 0.662 CB 1.681 69 residues pruned to eliminate duplicates Z: 15 14.478 2.131 0.348 0.464 0.929 0.571 CB 1.505 6 1.516 1.362 0.252 0.100 0.600 0.400 CB 1.104 ? Z: 6 7.366 1.643 1.076 0.443 0.800 0.800 CA 1.280 6 residues pruned to eliminate duplicates Z: 14 21.797 2.258 0.690 0.604 0.923 0.615 CB 1.554 15 residues pruned to eliminate duplicates Z: 15 23.252 2.225 0.587 0.833 0.857 0.714 CB 1.540 Z: 15 28.482 2.281 0.692 0.871 0.929 0.786 CB 1.549 15 residues pruned to eliminate duplicates Z: 14 27.202 2.088 0.807 0.906 0.923 0.769 CB 1.540 14 residues pruned to eliminate duplicates Z: 14 31.158 2.255 0.818 0.807 1.000 0.692 CB 1.612 14 residues pruned to eliminate duplicates Z: 13 39.934 2.416 1.308 0.866 0.917 0.833 CB 1.651 12 residues pruned to eliminate duplicates Z: 13 26.137 2.244 0.545 0.912 1.000 1.000 CB 1.541 13 residues pruned to eliminate duplicates Z: 40 34.892 2.286 0.702 0.525 0.923 0.590 CB 1.519 56 residues pruned to eliminate duplicates Z: 28 25.801 2.162 0.658 0.595 0.889 0.630 CB 1.423 Z: 13 30.643 2.202 0.988 0.853 0.917 0.750 CB 1.629 18 residues pruned to eliminate duplicates Z: 11 20.219 2.192 0.482 0.895 1.000 0.700 CB 1.411 10 residues pruned to eliminate duplicates Z: 15 24.753 2.306 0.598 0.797 0.929 0.643 CB 1.490 15 residues pruned to eliminate duplicates Z: 24 33.436 2.235 0.722 0.660 1.000 0.609 CB 1.561 24 residues pruned to eliminate duplicates Z: 15 26.902 2.292 0.587 0.871 0.929 0.714 CB 1.553 15 residues pruned to eliminate duplicates Z: 24 33.382 2.243 0.782 0.669 0.957 0.609 CB 1.558 24 residues pruned to eliminate duplicates Z: 18 25.545 2.147 0.753 0.726 0.941 0.529 CB 1.427 18 residues pruned to eliminate duplicates Z: 6 6.623 1.759 0.558 0.409 1.000 0.400 CA 1.189 6 residues pruned to eliminate duplicates Z: 36 29.118 2.219 0.639 0.597 0.857 0.543 CB 1.439 39 residues pruned to eliminate duplicates Z: 7 7.850 1.852 0.499 0.402 1.000 0.667 CA 1.279 7 residues pruned to eliminate duplicates Z: 14 18.464 2.064 0.685 0.481 1.000 0.538 CB 1.500 13 residues pruned to eliminate duplicates Z: 12 11.013 2.042 0.164 0.661 0.909 0.636 CB 1.324 12 residues pruned to eliminate duplicates Z: 13 12.096 1.961 0.243 0.610 1.000 0.667 CB 1.291 13 residues pruned to eliminate duplicates Z: 23 13.429 1.936 0.257 0.426 0.955 0.545 CB 1.332 23 residues pruned to eliminate duplicates Z: 12 9.585 1.978 0.299 0.537 0.818 0.545 CB 1.326 12 residues pruned to eliminate duplicates Z: 19 9.977 2.033 0.201 0.424 0.778 0.500 CB 1.340 19 residues pruned to eliminate duplicates Z: 18 16.709 2.152 0.442 0.495 0.882 0.647 CB 1.488 18 residues pruned to eliminate duplicates Z: 13 11.473 1.989 0.193 0.613 0.917 0.667 CB 1.368 13 residues pruned to eliminate duplicates Z: 19 17.039 2.169 0.295 0.523 1.000 0.556 CB 1.398 19 residues pruned to eliminate duplicates Z: 19 16.362 2.164 0.416 0.512 0.889 0.444 CB 1.399 19 residues pruned to eliminate duplicates Z: 18 16.594 2.141 0.367 0.504 0.941 0.647 CB 1.455 18 residues pruned to eliminate duplicates Z: 73 50.491 2.216 0.761 0.585 0.944 0.500 CB 1.487 78 residues pruned to eliminate duplicates Z: 6 2.971 1.554 0.266 0.182 1.000 0.200 CA 0.990 6 residues pruned to eliminate duplicates Z: 20 14.053 1.982 0.244 0.492 0.947 0.579 CB 1.392 20 residues pruned to eliminate duplicates Z: 19 16.043 2.161 0.267 0.557 0.944 0.667 CB 1.383 19 residues pruned to eliminate duplicates Z: 19 13.353 2.123 0.178 0.528 0.944 0.556 CB 1.296 19 residues pruned to eliminate duplicates Z: 18 17.097 2.151 0.437 0.517 0.941 0.588 CB 1.402 18 residues pruned to eliminate duplicates Z: 17 13.079 2.157 0.277 0.528 0.875 0.562 CB 1.319 17 residues pruned to eliminate duplicates Z: 92 68.905 2.368 0.838 0.590 0.923 0.593 CB 1.650 92 residues pruned to eliminate duplicates Z: 67 58.367 2.395 0.769 0.589 0.909 0.561 CB 1.713 67 residues pruned to eliminate duplicates Z: 35 57.784 2.533 1.056 0.635 0.882 0.471 CB 1.900 35 residues pruned to eliminate duplicates Z: 45 49.304 2.383 0.901 0.566 0.955 0.568 CB 1.612 45 residues pruned to eliminate duplicates Z: 56 49.677 2.381 0.760 0.566 0.945 0.636 CB 1.586 56 residues pruned to eliminate duplicates Z: 36 56.617 2.484 0.920 0.675 0.943 0.686 CB 1.810 36 residues pruned to eliminate duplicates Z: 86 71.098 2.394 0.911 0.609 0.929 0.635 CB 1.635 86 residues pruned to eliminate duplicates Z: 42 35.178 2.295 0.697 0.586 0.951 0.610 CB 1.365 42 residues pruned to eliminate duplicates Z: 42 40.451 2.313 0.752 0.577 0.951 0.610 CB 1.521 42 residues pruned to eliminate duplicates Z: 63 58.150 2.378 0.702 0.633 0.919 0.645 CB 1.752 63 residues pruned to eliminate duplicates Z: 35 60.799 2.536 1.007 0.642 0.941 0.706 CB 1.906 35 residues pruned to eliminate duplicates Z: 64 57.395 2.345 0.884 0.565 0.905 0.619 CB 1.698 64 residues pruned to eliminate duplicates Z: 33 55.028 2.481 0.919 0.643 0.969 0.719 CB 1.845 33 residues pruned to eliminate duplicates Z: 55 53.398 2.388 0.785 0.585 0.963 0.593 CB 1.631 55 residues pruned to eliminate duplicates Z: 57 50.893 2.388 0.786 0.571 0.929 0.643 CB 1.604 57 residues pruned to eliminate duplicates Z: 36 52.316 2.497 0.836 0.637 0.943 0.686 CB 1.799 36 residues pruned to eliminate duplicates Z: 35 64.647 2.545 0.967 0.673 0.971 0.735 CB 1.946 35 residues pruned to eliminate duplicates Z: 42 59.553 2.496 0.892 0.612 1.000 0.683 CB 1.771 42 residues pruned to eliminate duplicates Z: 36 54.349 2.505 0.830 0.661 0.943 0.657 CB 1.831 36 residues pruned to eliminate duplicates Z: 123 65.648 2.310 0.581 0.579 0.943 0.639 CB 1.599 149 residues pruned to eliminate duplicates Z: 22 43.895 2.289 0.674 0.844 1.000 0.667 CA 1.860 22 residues pruned to eliminate duplicates Z: 56 47.780 2.381 0.703 0.547 0.964 0.600 CB 1.575 56 residues pruned to eliminate duplicates Z: 36 55.507 2.516 0.849 0.623 0.943 0.686 CB 1.906 36 residues pruned to eliminate duplicates Z: 35 64.639 2.545 0.941 0.662 1.000 0.618 CB 1.932 35 residues pruned to eliminate duplicates Z: 97 64.377 2.359 0.679 0.589 0.948 0.646 CB 1.607 97 residues pruned to eliminate duplicates Z: 53 45.968 2.338 0.736 0.540 0.923 0.615 CB 1.635 53 residues pruned to eliminate duplicates Z: 56 48.478 2.344 0.671 0.556 0.982 0.545 CB 1.610 56 residues pruned to eliminate duplicates Z: 29 46.495 2.509 0.715 0.676 0.929 0.571 CB 1.869 29 residues pruned to eliminate duplicates Z: 13 35.411 2.534 1.017 0.507 1.000 0.417 CB 1.986 13 residues pruned to eliminate duplicates Z: 13 27.067 2.533 0.760 0.478 0.917 0.417 CA 1.955 13 residues pruned to eliminate duplicates Z: 13 31.722 2.552 0.831 0.506 1.000 0.417 CB 1.949 13 residues pruned to eliminate duplicates Z: 44 39.479 2.352 0.710 0.536 0.884 0.605 CB 1.635 44 residues pruned to eliminate duplicates Z: 12 27.795 2.571 1.105 0.452 0.818 0.182 CB 1.988 12 residues pruned to eliminate duplicates Z: 15 24.703 2.512 0.945 0.447 0.857 0.286 CB 1.664 15 residues pruned to eliminate duplicates Z: 45 45.178 2.319 0.823 0.561 0.932 0.500 CB 1.629 45 residues pruned to eliminate duplicates Z: 66 67.036 2.425 0.813 0.632 0.954 0.631 CB 1.752 66 residues pruned to eliminate duplicates Z: 36 34.462 2.264 0.687 0.620 0.857 0.571 CB 1.588 36 residues pruned to eliminate duplicates Z: 44 46.954 2.367 0.787 0.564 0.953 0.535 CB 1.668 44 residues pruned to eliminate duplicates Z: 32 32.729 2.232 0.624 0.566 0.935 0.613 CB 1.626 32 residues pruned to eliminate duplicates Z: 73 52.782 2.330 0.708 0.542 0.917 0.597 CB 1.636 73 residues pruned to eliminate duplicates Z: 44 47.882 2.353 0.799 0.567 0.953 0.465 CB 1.696 44 residues pruned to eliminate duplicates Z: 45 40.865 2.340 0.758 0.550 0.864 0.523 CB 1.653 45 residues pruned to eliminate duplicates Z: 75 64.766 2.405 0.726 0.639 0.919 0.649 CB 1.733 75 residues pruned to eliminate duplicates Z: 47 36.135 2.219 0.669 0.540 0.870 0.630 CB 1.591 47 residues pruned to eliminate duplicates Z: 66 49.174 2.260 0.779 0.570 0.938 0.615 CB 1.511 66 residues pruned to eliminate duplicates Z: 58 44.973 2.276 0.707 0.592 0.912 0.667 CB 1.540 58 residues pruned to eliminate duplicates Z: 66 67.230 2.433 0.774 0.616 0.969 0.615 CB 1.786 66 residues pruned to eliminate duplicates Z: 55 40.110 2.284 0.566 0.600 0.907 0.630 CB 1.528 55 residues pruned to eliminate duplicates Z: 32 37.229 2.313 0.724 0.613 0.903 0.581 CB 1.668 32 residues pruned to eliminate duplicates Z: 73 62.070 2.418 0.707 0.600 0.958 0.625 CB 1.680 73 residues pruned to eliminate duplicates Z: 74 54.226 2.355 0.687 0.558 0.945 0.630 CB 1.597 74 residues pruned to eliminate duplicates Z: 43 48.117 2.375 0.747 0.602 0.976 0.595 CB 1.664 43 residues pruned to eliminate duplicates Z: 29 38.575 2.331 0.740 0.629 0.929 0.571 CB 1.714 29 residues pruned to eliminate duplicates Z: 34 32.959 2.262 0.659 0.591 0.909 0.606 CB 1.542 34 residues pruned to eliminate duplicates Z: 115 56.174 2.273 0.657 0.504 0.895 0.526 CB 1.555 115 residues pruned to eliminate duplicates Z: 33 30.464 2.241 0.785 0.551 0.812 0.531 CB 1.577 33 residues pruned to eliminate duplicates Z: 17 19.417 2.222 0.866 0.395 0.812 0.500 CB 1.610 17 residues pruned to eliminate duplicates Z: 43 48.982 2.363 0.825 0.616 0.929 0.452 CB 1.690 43 residues pruned to eliminate duplicates Z: 16 15.230 2.189 0.913 0.318 0.800 0.333 CB 1.435 16 residues pruned to eliminate duplicates Z: 73 54.837 2.360 0.769 0.564 0.917 0.556 CB 1.588 73 residues pruned to eliminate duplicates Z: 33 34.553 2.260 0.731 0.597 0.938 0.531 CB 1.518 33 residues pruned to eliminate duplicates Z: 16 14.745 2.184 0.815 0.355 0.800 0.533 CB 1.404 16 residues pruned to eliminate duplicates Z: 69 61.775 2.372 0.805 0.592 0.956 0.574 CB 1.676 69 residues pruned to eliminate duplicates Z: 32 34.150 2.309 0.713 0.587 0.871 0.645 CB 1.638 32 residues pruned to eliminate duplicates Z: 33 37.184 2.276 0.790 0.591 0.969 0.625 CB 1.526 33 residues pruned to eliminate duplicates Z: 46 42.556 2.344 0.729 0.569 0.933 0.511 CB 1.569 46 residues pruned to eliminate duplicates Z: 59 44.721 2.271 0.651 0.584 0.931 0.655 CB 1.552 59 residues pruned to eliminate duplicates Z: 46 46.696 2.362 0.822 0.637 0.889 0.667 CB 1.600 46 residues pruned to eliminate duplicates Z: 67 50.997 2.311 0.674 0.591 0.939 0.591 CB 1.583 67 residues pruned to eliminate duplicates Z: 69 51.888 2.327 0.641 0.595 0.926 0.662 CB 1.624 69 residues pruned to eliminate duplicates Z: 36 28.865 2.065 0.627 0.571 0.914 0.543 CB 1.484 36 residues pruned to eliminate duplicates Z: 30 29.485 2.191 0.707 0.620 0.966 0.690 CB 1.354 30 residues pruned to eliminate duplicates Z: 80 56.075 2.361 0.722 0.589 0.937 0.557 CB 1.522 80 residues pruned to eliminate duplicates Z: 58 46.047 2.309 0.727 0.599 0.895 0.596 CB 1.555 58 residues pruned to eliminate duplicates Z: 93 70.328 2.351 0.753 0.635 0.946 0.587 CB 1.658 93 residues pruned to eliminate duplicates Z: 57 51.082 2.324 0.713 0.639 0.929 0.679 CB 1.621 57 residues pruned to eliminate duplicates Z: 42 38.345 2.227 0.715 0.597 0.951 0.585 CB 1.503 42 residues pruned to eliminate duplicates Z: 99 64.827 2.342 0.737 0.594 0.929 0.602 CB 1.585 99 residues pruned to eliminate duplicates Z: 59 47.369 2.262 0.748 0.612 0.931 0.621 CB 1.518 59 residues pruned to eliminate duplicates Z: 42 35.755 2.277 0.718 0.544 0.902 0.659 CB 1.515 42 residues pruned to eliminate duplicates Z: 13 14.959 2.179 0.464 0.430 1.000 0.500 CB 1.456 Z: 7 2.941 1.586 0.277 0.283 0.667 0.167 CB 1.136 7 residues pruned to eliminate duplicates Z: 57 47.847 2.308 0.706 0.608 0.946 0.607 CB 1.549 70 residues pruned to eliminate duplicates Z: 39 31.214 2.231 0.842 0.557 0.816 0.474 CB 1.429 39 residues pruned to eliminate duplicates Z: 19 16.334 2.119 0.740 0.394 0.944 0.444 CB 1.237 19 residues pruned to eliminate duplicates Z: 110 59.627 2.280 0.660 0.554 0.917 0.642 CB 1.560 110 residues pruned to eliminate duplicates Z: 40 28.966 2.277 0.644 0.501 0.846 0.513 CB 1.463 40 residues pruned to eliminate duplicates Z: 101 65.022 2.325 0.749 0.591 0.940 0.570 CB 1.559 101 residues pruned to eliminate duplicates Z: 100 65.162 2.353 0.657 0.622 0.939 0.616 CB 1.594 100 residues pruned to eliminate duplicates Z: 73 50.395 2.284 0.674 0.593 0.931 0.403 CB 1.526 73 residues pruned to eliminate duplicates Z: 30 27.578 2.195 0.620 0.597 0.931 0.448 CB 1.410 30 residues pruned to eliminate duplicates Z: 118 58.650 2.276 0.593 0.592 0.923 0.598 CB 1.484 118 residues pruned to eliminate duplicates Z: 75 44.972 2.219 0.607 0.601 0.959 0.676 CB 1.388 75 residues pruned to eliminate duplicates Z: 33 33.701 2.234 0.789 0.661 0.906 0.750 CB 1.417 Z: 18 26.918 2.199 0.495 0.769 0.941 0.882 CB 1.663 18 residues pruned to eliminate duplicates Z: 47 36.560 2.271 0.549 0.631 0.978 0.696 CB 1.385 32 residues pruned to eliminate duplicates Z: 11 12.507 2.273 0.038 0.907 0.900 0.800 CB 1.324 11 residues pruned to eliminate duplicates Z: 49 34.729 2.251 0.590 0.592 0.917 0.604 CB 1.398 49 residues pruned to eliminate duplicates Z: 30 41.032 2.320 0.848 0.686 1.000 0.759 CB 1.498 29 residues pruned to eliminate duplicates Z: 16 28.210 2.270 0.786 0.914 0.933 0.733 CB 1.361 16 residues pruned to eliminate duplicates Z: 48 41.727 2.288 0.744 0.612 0.979 0.681 CB 1.402 49 residues pruned to eliminate duplicates Z: 15 35.423 2.305 1.057 0.913 1.000 0.857 CB 1.413 15 residues pruned to eliminate duplicates Z: 38 40.145 2.257 0.884 0.592 0.973 0.595 CB 1.461 38 residues pruned to eliminate duplicates Z: 50 38.505 2.268 0.731 0.568 0.980 0.735 CB 1.340 50 residues pruned to eliminate duplicates Z: 37 44.049 2.315 0.873 0.620 1.000 0.722 CB 1.511 37 residues pruned to eliminate duplicates Z: 15 36.041 2.304 1.153 0.915 1.000 0.786 CB 1.372 15 residues pruned to eliminate duplicates Z: 49 39.884 2.281 0.754 0.590 0.938 0.604 CB 1.408 49 residues pruned to eliminate duplicates Z: 33 38.789 2.277 0.746 0.691 1.000 0.688 CB 1.449 33 residues pruned to eliminate duplicates Z: 49 35.246 2.283 0.703 0.565 0.896 0.667 CB 1.371 49 residues pruned to eliminate duplicates Z: 35 35.622 2.259 0.751 0.653 0.971 0.706 CB 1.379 35 residues pruned to eliminate duplicates Z: 38 38.326 2.264 0.705 0.618 1.000 0.622 CB 1.461 38 residues pruned to eliminate duplicates Z: 37 42.411 2.304 0.841 0.634 1.000 0.722 CB 1.469 37 residues pruned to eliminate duplicates Z: 33 38.333 2.303 0.776 0.686 0.969 0.688 CB 1.442 33 residues pruned to eliminate duplicates Z: 49 39.768 2.260 0.772 0.610 0.938 0.688 CB 1.377 49 residues pruned to eliminate duplicates Z: 36 42.300 2.316 0.759 0.642 1.000 0.743 CB 1.536 37 residues pruned to eliminate duplicates Z: 12 8.951 2.007 0.747 0.454 0.636 0.364 CB 1.267 12 residues pruned to eliminate duplicates Z: 50 38.259 2.271 0.727 0.565 0.939 0.714 CB 1.394 50 residues pruned to eliminate duplicates Z: 39 39.625 2.279 0.815 0.563 1.000 0.632 CB 1.462 39 residues pruned to eliminate duplicates Z: 38 37.650 2.298 0.784 0.573 0.973 0.703 CB 1.446 38 residues pruned to eliminate duplicates Z: 50 39.251 2.279 0.706 0.567 0.939 0.735 CB 1.440 50 residues pruned to eliminate duplicates Z: 48 37.239 2.287 0.696 0.558 0.936 0.681 CB 1.414 48 residues pruned to eliminate duplicates Z: 37 39.165 2.306 0.868 0.584 0.972 0.722 CB 1.438 37 residues pruned to eliminate duplicates Z: 38 40.149 2.276 0.822 0.615 0.973 0.730 CB 1.467 38 residues pruned to eliminate duplicates Z: 40 34.240 2.217 0.708 0.556 0.949 0.667 CB 1.445 40 residues pruned to eliminate duplicates Z: 106 77.543 2.363 0.800 0.671 0.943 0.629 CB 1.611 18 residues pruned to eliminate duplicates Z: 7 12.215 2.328 0.011 0.714 1.000 0.833 CB 1.745 7 residues pruned to eliminate duplicates Z: 12 12.385 2.165 0.394 0.616 0.909 0.727 CB 1.219 12 residues pruned to eliminate duplicates Z: 100 78.994 2.418 0.732 0.680 0.929 0.697 CB 1.728 100 residues pruned to eliminate duplicates Z: 50 42.408 2.264 0.874 0.576 0.939 0.571 CB 1.413 50 residues pruned to eliminate duplicates Z: 11 11.221 2.177 0.540 0.564 0.800 0.400 CB 1.243 11 residues pruned to eliminate duplicates Z: 62 45.122 2.290 0.713 0.549 0.967 0.672 CB 1.451 62 residues pruned to eliminate duplicates Z: 150 87.193 2.343 0.815 0.630 0.919 0.651 CB 1.616 140 residues pruned to eliminate duplicates Z: 7 12.273 2.044 0.668 0.459 1.000 0.667 CB 1.532 7 residues pruned to eliminate duplicates Z: 90 85.592 2.437 0.766 0.732 0.944 0.753 CB 1.814 90 residues pruned to eliminate duplicates Z: 6 4.324 1.558 0.544 0.299 0.800 0.400 CB 1.257 6 residues pruned to eliminate duplicates Z: 90 87.751 2.430 0.810 0.733 0.955 0.798 CB 1.795 90 residues pruned to eliminate duplicates Z: 43 49.743 2.398 0.763 0.643 0.929 0.762 CB 1.710 43 residues pruned to eliminate duplicates Z: 94 81.539 2.396 0.842 0.702 0.914 0.753 CB 1.744 94 residues pruned to eliminate duplicates Z: 45 49.673 2.339 0.790 0.615 0.932 0.705 CB 1.721 45 residues pruned to eliminate duplicates Z: 19 18.955 2.157 0.563 0.482 0.833 0.722 CA 1.620 19 residues pruned to eliminate duplicates Z: 43 48.984 2.383 0.788 0.631 0.905 0.810 CB 1.735 43 residues pruned to eliminate duplicates Z: 152 78.480 2.302 0.792 0.590 0.914 0.636 CB 1.554 147 residues pruned to eliminate duplicates Z: 13 13.925 1.996 0.617 0.634 0.833 0.583 CB 1.318 13 residues pruned to eliminate duplicates Z: 136 87.872 2.364 0.798 0.668 0.926 0.711 CB 1.645 136 residues pruned to eliminate duplicates Z: 90 82.014 2.423 0.785 0.726 0.910 0.719 CB 1.801 90 residues pruned to eliminate duplicates Z: 92 85.893 2.407 0.854 0.722 0.934 0.703 CB 1.768 92 residues pruned to eliminate duplicates Z: 91 84.356 2.426 0.862 0.713 0.911 0.722 CB 1.782 91 residues pruned to eliminate duplicates Z: 84 76.420 2.385 0.903 0.704 0.928 0.627 CB 1.654 84 residues pruned to eliminate duplicates Z: 93 83.790 2.403 0.851 0.706 0.924 0.696 CB 1.762 93 residues pruned to eliminate duplicates Z: 90 87.427 2.429 0.843 0.736 0.933 0.730 CB 1.796 90 residues pruned to eliminate duplicates Z: 102 81.297 2.359 0.800 0.676 0.931 0.723 CB 1.740 102 residues pruned to eliminate duplicates Z: 96 85.967 2.408 0.878 0.699 0.937 0.726 CB 1.737 96 residues pruned to eliminate duplicates Z: 138 89.128 2.358 0.845 0.652 0.934 0.708 CB 1.627 148 residues pruned to eliminate duplicates Z: 19 34.792 2.232 0.697 0.761 0.944 0.833 CB 1.818 19 residues pruned to eliminate duplicates Z: 44 47.179 2.342 0.698 0.642 0.977 0.744 CB 1.623 44 residues pruned to eliminate duplicates Z: 90 87.662 2.439 0.862 0.720 0.944 0.708 CB 1.777 90 residues pruned to eliminate duplicates Z: 98 79.229 2.380 0.839 0.685 0.918 0.722 CB 1.691 98 residues pruned to eliminate duplicates Z: 48 45.952 2.361 0.841 0.603 0.894 0.702 CB 1.564 48 residues pruned to eliminate duplicates Z: 74 89.667 2.490 0.949 0.769 0.945 0.740 CB 1.802 74 residues pruned to eliminate duplicates Z: 92 85.232 2.412 0.813 0.714 0.956 0.747 CB 1.760 92 residues pruned to eliminate duplicates Z: 87 69.267 2.421 0.662 0.687 0.919 0.686 CB 1.703 87 residues pruned to eliminate duplicates Z: 93 83.478 2.418 0.828 0.704 0.935 0.707 CB 1.750 93 residues pruned to eliminate duplicates Z: 74 79.406 2.422 0.844 0.766 0.959 0.699 CB 1.713 74 residues pruned to eliminate duplicates Z: 27 52.276 2.515 1.079 0.738 0.962 0.692 CB 1.648 27 residues pruned to eliminate duplicates Z: 90 80.410 2.444 0.826 0.714 0.899 0.719 CB 1.751 90 residues pruned to eliminate duplicates Z: 91 91.563 2.444 0.930 0.735 0.944 0.756 CB 1.755 91 residues pruned to eliminate duplicates Z: 89 90.265 2.445 0.930 0.732 0.943 0.727 CB 1.754 89 residues pruned to eliminate duplicates Z: 43 53.322 2.432 0.957 0.635 0.905 0.643 CB 1.683 43 residues pruned to eliminate duplicates Z: 147 87.715 2.355 0.869 0.627 0.918 0.651 CB 1.595 147 residues pruned to eliminate duplicates Z: 18 43.041 2.409 1.179 0.762 0.882 0.588 CB 1.787 18 residues pruned to eliminate duplicates Z: 113 78.624 2.343 0.793 0.652 0.938 0.679 CB 1.638 113 residues pruned to eliminate duplicates Z: 91 95.506 2.428 0.952 0.746 0.967 0.733 CB 1.764 91 residues pruned to eliminate duplicates Z: 76 91.280 2.469 0.968 0.772 0.960 0.747 CB 1.777 76 residues pruned to eliminate duplicates Z: 138 95.678 2.383 0.872 0.668 0.971 0.664 CB 1.616 137 residues pruned to eliminate duplicates Z: 13 32.436 2.509 0.450 0.905 1.000 0.833 CB 1.833 13 residues pruned to eliminate duplicates Z: 150 88.861 2.350 0.918 0.618 0.913 0.604 CB 1.583 148 residues pruned to eliminate duplicates Z: 16 40.724 2.308 0.871 0.898 1.000 0.800 CA 1.742 16 residues pruned to eliminate duplicates Z: 47 73.803 2.452 0.925 0.824 0.957 0.761 CB 1.821 47 residues pruned to eliminate duplicates Z: 99 87.636 2.398 0.906 0.711 0.929 0.653 CB 1.722 99 residues pruned to eliminate duplicates Z: 104 76.187 2.371 0.800 0.648 0.903 0.650 CB 1.697 104 residues pruned to eliminate duplicates Z: 90 89.385 2.437 0.917 0.727 0.933 0.708 CB 1.772 90 residues pruned to eliminate duplicates Z: 133 91.882 2.390 0.833 0.667 0.947 0.705 CB 1.652 133 residues pruned to eliminate duplicates Z: 86 76.112 2.363 0.888 0.667 0.918 0.612 CB 1.728 86 residues pruned to eliminate duplicates Z: 43 75.211 2.413 0.934 0.874 1.000 0.810 CB 1.810 43 residues pruned to eliminate duplicates Z: 132 96.055 2.389 0.903 0.669 0.962 0.588 CB 1.642 137 residues pruned to eliminate duplicates Z: 17 46.184 2.261 1.045 0.894 1.000 0.812 CB 1.791 17 residues pruned to eliminate duplicates Z: 64 60.663 2.298 0.914 0.649 0.921 0.683 CB 1.642 64 residues pruned to eliminate duplicates Z: 98 89.367 2.413 0.916 0.696 0.948 0.670 CB 1.731 98 residues pruned to eliminate duplicates Z: 76 90.869 2.455 0.950 0.769 0.973 0.760 CB 1.775 76 residues pruned to eliminate duplicates Z: 91 88.836 2.411 0.919 0.721 0.944 0.711 CB 1.756 91 residues pruned to eliminate duplicates Z: 137 89.032 2.373 0.805 0.663 0.926 0.691 CB 1.654 137 residues pruned to eliminate duplicates Z: 98 83.107 2.382 0.869 0.692 0.938 0.608 CB 1.695 98 residues pruned to eliminate duplicates Z: 43 71.811 2.410 0.876 0.862 1.000 0.810 CB 1.800 43 residues pruned to eliminate duplicates Z: 88 85.814 2.434 0.855 0.724 0.943 0.690 CB 1.766 88 residues pruned to eliminate duplicates Z: 104 76.170 2.381 0.782 0.656 0.903 0.699 CB 1.694 104 residues pruned to eliminate duplicates Z: 92 87.516 2.403 0.893 0.710 0.945 0.681 CB 1.763 92 residues pruned to eliminate duplicates Z: 49 70.357 2.428 0.795 0.799 0.979 0.646 CB 1.832 49 residues pruned to eliminate duplicates Z: 91 89.887 2.429 0.945 0.723 0.933 0.711 CB 1.757 91 residues pruned to eliminate duplicates Z: 100 80.576 2.390 0.819 0.673 0.929 0.616 CB 1.709 100 residues pruned to eliminate duplicates Z: 99 82.116 2.403 0.867 0.685 0.918 0.622 CB 1.699 99 residues pruned to eliminate duplicates Z: 89 92.124 2.447 0.920 0.734 0.966 0.693 CB 1.755 89 residues pruned to eliminate duplicates Z: 90 89.545 2.447 0.909 0.733 0.933 0.697 CB 1.768 90 residues pruned to eliminate duplicates Z: 43 73.549 2.414 0.921 0.865 0.976 0.857 CB 1.838 43 residues pruned to eliminate duplicates Z: 91 89.088 2.427 0.888 0.725 0.944 0.722 CB 1.771 91 residues pruned to eliminate duplicates Z: 49 70.134 2.404 0.786 0.800 0.979 0.771 CB 1.851 49 residues pruned to eliminate duplicates Z: 49 69.804 2.418 0.766 0.810 0.979 0.771 CB 1.840 49 residues pruned to eliminate duplicates Z: 174 87.061 2.340 0.738 0.623 0.908 0.659 CB 1.596 174 residues pruned to eliminate duplicates Z: 100 86.339 2.395 0.853 0.698 0.960 0.687 CB 1.700 100 residues pruned to eliminate duplicates Z: 75 91.175 2.464 0.944 0.783 0.973 0.784 CB 1.773 75 residues pruned to eliminate duplicates Z: 178 92.710 2.326 0.764 0.626 0.932 0.661 CB 1.619 178 residues pruned to eliminate duplicates Z: 78 85.265 2.427 0.950 0.747 0.961 0.636 CB 1.714 78 residues pruned to eliminate duplicates Z: 49 71.966 2.430 0.849 0.797 0.979 0.688 CB 1.820 49 residues pruned to eliminate duplicates Z: 86 75.879 2.391 0.868 0.698 0.906 0.588 CB 1.698 86 residues pruned to eliminate duplicates Z: 78 72.214 2.396 0.855 0.688 0.909 0.584 CB 1.714 78 residues pruned to eliminate duplicates Z: 105 78.292 2.368 0.881 0.653 0.904 0.606 CB 1.654 105 residues pruned to eliminate duplicates Z: 109 82.763 2.374 0.923 0.641 0.917 0.593 CB 1.667 109 residues pruned to eliminate duplicates Z: 98 91.508 2.408 0.968 0.681 0.959 0.619 CB 1.732 98 residues pruned to eliminate duplicates Z: 90 93.449 2.442 0.984 0.739 0.944 0.674 CB 1.749 90 residues pruned to eliminate duplicates Z: 139 81.779 2.362 0.815 0.596 0.913 0.638 CB 1.623 139 residues pruned to eliminate duplicates Z: 8 5.386 2.046 0.274 0.357 0.714 0.429 CB 1.276 8 residues pruned to eliminate duplicates Z: 8 4.839 2.022 0.238 0.307 0.714 0.429 CB 1.267 8 residues pruned to eliminate duplicates Z: 81 39.616 2.237 0.600 0.506 0.850 0.613 CB 1.447 81 residues pruned to eliminate duplicates Z: 58 32.213 2.281 0.522 0.439 0.877 0.579 CB 1.492 58 residues pruned to eliminate duplicates Z: 64 31.211 2.217 0.550 0.420 0.873 0.603 CB 1.424 64 residues pruned to eliminate duplicates Z: 10 5.876 2.097 0.394 0.258 0.667 0.556 CB 1.326 10 residues pruned to eliminate duplicates Z: 11 6.491 2.159 0.495 0.238 0.700 0.400 CB 1.230 11 residues pruned to eliminate duplicates Z: 38 25.995 2.234 0.615 0.471 0.838 0.595 CB 1.456 38 residues pruned to eliminate duplicates Z: 200 94.038 2.340 0.783 0.605 0.920 0.673 CB 1.573 195 residues pruned to eliminate duplicates Z: 6 3.581 1.952 0.727 0.290 0.600 0.200 CB 1.002 6 residues pruned to eliminate duplicates Z: 38 22.467 2.192 0.430 0.502 0.838 0.649 CB 1.403 38 residues pruned to eliminate duplicates Z: 85 43.802 2.221 0.542 0.568 0.917 0.607 CB 1.426 85 residues pruned to eliminate duplicates Z: 82 44.927 2.277 0.561 0.571 0.889 0.593 CB 1.475 82 residues pruned to eliminate duplicates Z: 75 48.345 2.264 0.573 0.628 0.932 0.662 CB 1.501 75 residues pruned to eliminate duplicates Z: 52 35.936 2.275 0.604 0.478 0.941 0.647 CB 1.498 52 residues pruned to eliminate duplicates Z: 74 46.292 2.201 0.668 0.570 0.932 0.603 CB 1.480 74 residues pruned to eliminate duplicates Z: 51 38.396 2.286 0.716 0.503 0.920 0.680 CB 1.501 51 residues pruned to eliminate duplicates Z: 73 53.105 2.298 0.618 0.634 0.958 0.681 CB 1.548 73 residues pruned to eliminate duplicates Z: 49 39.132 2.292 0.669 0.519 0.938 0.646 CB 1.547 49 residues pruned to eliminate duplicates Z: 26 26.010 2.214 0.553 0.657 0.840 0.520 CB 1.557 26 residues pruned to eliminate duplicates Z: 60 33.021 2.262 0.564 0.455 0.881 0.610 CB 1.444 60 residues pruned to eliminate duplicates Z: 83 44.611 2.248 0.596 0.590 0.890 0.659 CB 1.415 83 residues pruned to eliminate duplicates Z: 73 54.527 2.270 0.738 0.639 0.958 0.667 CB 1.492 73 residues pruned to eliminate duplicates Z: 51 36.903 2.280 0.716 0.524 0.900 0.680 CB 1.447 51 residues pruned to eliminate duplicates Z: 50 35.910 2.296 0.599 0.504 0.939 0.633 CB 1.482 50 residues pruned to eliminate duplicates Z: 40 30.606 2.235 0.636 0.544 0.897 0.590 CB 1.430 40 residues pruned to eliminate duplicates Z: 74 47.018 2.252 0.598 0.643 0.904 0.685 CB 1.480 74 residues pruned to eliminate duplicates Z: 74 46.067 2.181 0.775 0.568 0.932 0.712 CB 1.400 74 residues pruned to eliminate duplicates Z: 20 27.219 2.187 0.717 0.669 1.000 0.789 CB 1.423 20 residues pruned to eliminate duplicates Z: 73 51.521 2.273 0.730 0.631 0.931 0.667 CB 1.467 73 residues pruned to eliminate duplicates Z: 50 34.617 2.247 0.697 0.493 0.898 0.571 CB 1.453 50 residues pruned to eliminate duplicates Z: 40 36.710 2.339 0.587 0.501 1.000 0.718 CB 1.582 40 residues pruned to eliminate duplicates Z: 50 33.376 2.286 0.529 0.524 0.898 0.653 CB 1.484 50 residues pruned to eliminate duplicates Z: 74 45.525 2.267 0.557 0.638 0.904 0.685 CB 1.468 74 residues pruned to eliminate duplicates Z: 50 39.212 2.297 0.696 0.526 0.939 0.673 CB 1.493 50 residues pruned to eliminate duplicates Z: 51 34.317 2.272 0.660 0.519 0.860 0.680 CB 1.468 51 residues pruned to eliminate duplicates Z: 55 31.153 2.235 0.650 0.484 0.796 0.611 CB 1.468 55 residues pruned to eliminate duplicates Z: 73 46.593 2.208 0.667 0.590 0.944 0.667 CB 1.449 73 residues pruned to eliminate duplicates Z: 50 38.659 2.301 0.664 0.529 0.959 0.694 CB 1.462 50 residues pruned to eliminate duplicates Z: 48 28.162 2.127 0.768 0.420 0.894 0.553 CB 1.329 48 residues pruned to eliminate duplicates Z: 26 28.618 2.334 0.673 0.437 1.000 0.760 CB 1.565 26 residues pruned to eliminate duplicates Z: 35 28.258 2.172 0.582 0.503 0.941 0.618 CB 1.494 35 residues pruned to eliminate duplicates Z: 27 26.798 2.295 0.680 0.378 0.962 0.654 CB 1.614 27 residues pruned to eliminate duplicates Z: 26 21.191 2.289 0.534 0.379 0.960 0.760 CB 1.430 26 residues pruned to eliminate duplicates Z: 26 21.842 2.235 0.612 0.390 0.960 0.720 CB 1.419 26 residues pruned to eliminate duplicates Z: 74 51.903 2.255 0.677 0.659 0.945 0.712 CB 1.466 74 residues pruned to eliminate duplicates Z: 49 39.955 2.299 0.687 0.566 0.958 0.708 CB 1.455 49 residues pruned to eliminate duplicates Z: 73 49.967 2.258 0.643 0.663 0.931 0.708 CB 1.466 73 residues pruned to eliminate duplicates Z: 15 13.940 2.160 0.452 0.313 1.000 0.714 CB 1.461 15 residues pruned to eliminate duplicates Z: 50 42.021 2.302 0.754 0.550 0.939 0.714 CB 1.509 50 residues pruned to eliminate duplicates Z: 27 22.652 2.228 0.722 0.397 0.923 0.731 CB 1.398 27 residues pruned to eliminate duplicates Z: 47 41.476 2.232 0.794 0.598 0.957 0.674 CB 1.455 47 residues pruned to eliminate duplicates Z: 31 21.157 2.202 0.551 0.357 0.933 0.667 CB 1.414 31 residues pruned to eliminate duplicates Z: 35 34.295 2.269 0.521 0.697 0.912 0.735 CB 1.561 35 residues pruned to eliminate duplicates Z: 50 34.176 2.177 0.621 0.566 0.898 0.694 CB 1.445 50 residues pruned to eliminate duplicates Z: 42 28.681 2.205 0.642 0.472 0.951 0.659 CB 1.339 42 residues pruned to eliminate duplicates Z: 75 49.271 2.228 0.741 0.628 0.905 0.649 CB 1.446 75 residues pruned to eliminate duplicates Z: 84 47.642 2.235 0.682 0.602 0.892 0.675 CB 1.415 84 residues pruned to eliminate duplicates Z: 55 39.291 2.175 0.575 0.591 0.926 0.704 CB 1.545 55 residues pruned to eliminate duplicates Z: 27 34.898 2.178 0.638 0.828 0.962 0.654 CB 1.502 27 residues pruned to eliminate duplicates Z: 36 37.850 2.268 0.520 0.712 1.000 0.743 CB 1.532 36 residues pruned to eliminate duplicates Z: 78 50.882 2.204 0.771 0.617 0.948 0.662 CB 1.403 78 residues pruned to eliminate duplicates Z: 25 33.838 2.170 0.584 0.873 1.000 0.833 CB 1.463 25 residues pruned to eliminate duplicates Z: 65 47.490 2.274 0.551 0.657 0.969 0.703 CB 1.501 65 residues pruned to eliminate duplicates Z: 77 50.858 2.216 0.717 0.610 0.947 0.684 CB 1.457 77 residues pruned to eliminate duplicates Z: 75 45.010 2.187 0.652 0.616 0.905 0.595 CB 1.434 75 residues pruned to eliminate duplicates Z: 73 54.954 2.261 0.700 0.652 0.972 0.681 CB 1.503 73 residues pruned to eliminate duplicates Z: 26 38.263 2.215 0.787 0.832 0.960 0.680 CB 1.511 26 residues pruned to eliminate duplicates Z: 23 45.211 2.266 1.016 0.897 1.000 0.591 CB 1.510 23 residues pruned to eliminate duplicates Z: 72 53.338 2.238 0.739 0.632 0.986 0.704 CB 1.458 72 residues pruned to eliminate duplicates Z: 38 40.344 2.207 0.751 0.670 0.973 0.622 CB 1.508 38 residues pruned to eliminate duplicates Z: 25 42.071 2.205 1.052 0.862 0.917 0.750 CB 1.519 25 residues pruned to eliminate duplicates Z: 84 47.652 2.223 0.683 0.603 0.904 0.627 CB 1.403 84 residues pruned to eliminate duplicates Z: 24 39.122 2.218 1.006 0.850 0.913 0.522 CB 1.487 24 residues pruned to eliminate duplicates Z: 24 37.381 2.212 0.884 0.891 0.913 0.652 CB 1.473 24 residues pruned to eliminate duplicates Z: 75 54.111 2.251 0.801 0.642 0.946 0.649 CB 1.436 75 residues pruned to eliminate duplicates Z: 74 49.459 2.230 0.718 0.637 0.932 0.575 CB 1.427 74 residues pruned to eliminate duplicates Z: 63 47.407 2.223 0.756 0.634 0.952 0.484 CB 1.428 63 residues pruned to eliminate duplicates Z: 24 39.129 2.224 0.916 0.863 0.957 0.565 CB 1.469 24 residues pruned to eliminate duplicates Z: 63 50.623 2.284 0.750 0.642 0.935 0.661 CB 1.506 63 residues pruned to eliminate duplicates Z: 25 40.617 2.166 1.010 0.862 1.000 0.667 CB 1.398 25 residues pruned to eliminate duplicates Z: 51 43.181 2.194 0.784 0.634 0.960 0.560 CB 1.433 51 residues pruned to eliminate duplicates 729 residues left after pruning, divided into chains as follows: A: 12 B: 28 C: 60 D: 34 E: 372 F: 223 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 40.96 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.560, Connect. = 0.788 for dens.mod. cycle 1 = 0.300, Contrast = 0.635, Connect. = 0.809 for dens.mod. cycle 2 = 0.300, Contrast = 0.770, Connect. = 0.832 for dens.mod. cycle 3 = 0.300, Contrast = 0.783, Connect. = 0.833 for dens.mod. cycle 4 = 0.300, Contrast = 0.798, Connect. = 0.835 for dens.mod. cycle 5 = 0.300, Contrast = 0.804, Connect. = 0.836 for dens.mod. cycle 6 = 0.300, Contrast = 0.810, Connect. = 0.837 for dens.mod. cycle 7 = 0.300, Contrast = 0.812, Connect. = 0.838 for dens.mod. cycle 8 = 0.300, Contrast = 0.814, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.814, Connect. = 0.839 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4169 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 974 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 13 25.719 2.425 0.367 0.907 0.917 0.833 CB 1.736 B: 16 44.650 2.415 0.947 0.912 1.000 0.933 CA 1.737 C: 30 66.450 2.441 1.060 0.915 0.966 0.690 CB 1.796 D: 11 17.455 2.283 0.028 0.899 1.000 0.900 CB 1.682 9 residues pruned to eliminate duplicates E: 15 45.180 2.490 1.067 0.925 1.000 0.786 CB 1.646 16 residues pruned to eliminate duplicates F: 16 32.560 2.301 0.596 0.904 0.933 0.867 CB 1.747 G: 25 50.619 2.350 0.945 0.911 1.000 0.542 CB 1.602 H: 18 42.251 2.205 1.111 0.871 1.000 0.824 CB 1.605 18 residues pruned to eliminate duplicates I: 28 61.302 2.359 0.947 0.923 0.963 0.778 CA 1.874 27 residues pruned to eliminate duplicates J: 26 47.556 2.286 0.854 0.904 0.960 0.640 CB 1.664 26 residues pruned to eliminate duplicates K: 25 51.704 2.362 0.991 0.935 0.958 0.625 CB 1.632 25 residues pruned to eliminate duplicates L: 15 28.884 2.309 0.862 0.887 0.929 0.786 CB 1.395 M: 23 43.452 2.503 0.848 0.798 0.864 0.682 CB 1.786 N: 16 40.627 2.375 0.881 0.912 0.933 0.933 CB 1.782 O: 38 24.920 2.012 0.671 0.574 0.946 0.676 CB 1.199 P: 25 47.300 2.338 0.952 0.912 0.958 0.625 CB 1.563 25 residues pruned to eliminate duplicates Q: 16 41.157 2.409 0.925 0.928 1.000 0.667 CB 1.604 15 residues pruned to eliminate duplicates R: 25 46.245 2.356 0.727 0.917 1.000 0.833 CB 1.638 25 residues pruned to eliminate duplicates S: 16 31.746 2.204 0.483 0.909 1.000 0.867 CB 1.779 16 residues pruned to eliminate duplicates T: 16 28.135 2.280 0.448 0.903 0.933 0.800 CB 1.681 16 residues pruned to eliminate duplicates U: 15 39.224 2.429 0.768 0.896 1.000 0.643 CA 1.748 V: 25 51.132 2.333 1.019 0.943 0.958 0.792 CB 1.602 26 residues pruned to eliminate duplicates W: 16 42.318 2.447 0.767 0.922 1.000 0.867 CB 1.778 17 residues pruned to eliminate duplicates X: 31 51.221 2.326 0.620 0.901 1.000 0.800 CB 1.771 Y: 38 21.325 1.939 0.420 0.613 0.973 0.622 CB 1.176 Z: 17 26.610 2.188 0.443 0.873 1.000 0.812 CB 1.535 17 residues pruned to eliminate duplicates Z: 28 65.717 2.394 1.136 0.918 0.963 0.889 CB 1.811 28 residues pruned to eliminate duplicates Z: 49 52.590 2.458 0.716 0.539 0.979 0.667 CB 1.769 Z: 20 44.927 2.415 0.905 0.874 0.895 0.789 CB 1.823 21 residues pruned to eliminate duplicates Z: 17 47.053 2.377 0.970 0.936 1.000 0.875 CB 1.749 15 residues pruned to eliminate duplicates Z: 29 76.600 2.448 1.238 0.933 1.000 0.750 CB 1.843 31 residues pruned to eliminate duplicates Z: 32 47.279 2.273 0.608 0.893 0.935 0.742 CB 1.783 32 residues pruned to eliminate duplicates Z: 15 24.483 2.272 0.549 0.812 0.857 0.857 CB 1.653 15 residues pruned to eliminate duplicates Z: 27 61.275 2.413 0.910 0.930 1.000 0.846 CA 1.824 27 residues pruned to eliminate duplicates Z: 17 43.672 2.353 1.005 0.939 1.000 0.688 CB 1.608 Z: 20 18.082 2.140 0.495 0.502 0.842 0.684 CB 1.537 Z: 50 34.498 2.263 0.541 0.585 0.898 0.694 CB 1.451 Z: 17 35.860 2.312 0.932 0.895 1.000 0.875 CB 1.439 17 residues pruned to eliminate duplicates Z: 18 35.973 2.309 1.020 0.872 0.941 0.765 CB 1.449 Z: 18 47.840 2.324 0.959 0.933 1.000 0.647 CA 1.778 18 residues pruned to eliminate duplicates Z: 28 72.046 2.381 1.096 0.951 1.000 0.889 CB 1.915 28 residues pruned to eliminate duplicates Z: 25 46.950 2.360 0.867 0.912 0.958 0.667 CB 1.607 25 residues pruned to eliminate duplicates Z: 29 65.963 2.414 1.198 0.946 0.929 0.679 CB 1.749 29 residues pruned to eliminate duplicates Z: 16 47.700 2.435 1.071 0.911 0.933 0.867 CA 1.856 15 residues pruned to eliminate duplicates Z: 25 43.683 2.256 0.808 0.862 0.958 0.750 CB 1.675 24 residues pruned to eliminate duplicates Z: 74 47.061 2.180 0.725 0.610 0.932 0.685 CB 1.417 Z: 22 47.708 2.209 1.109 0.856 0.952 0.667 CA 1.731 25 residues pruned to eliminate duplicates Z: 15 25.737 2.112 0.667 0.824 0.929 0.571 CB 1.589 15 residues pruned to eliminate duplicates Z: 23 30.753 2.128 0.546 0.884 0.955 0.818 CB 1.509 26 residues pruned to eliminate duplicates Z: 18 39.637 2.329 0.629 0.907 1.000 0.706 CB 1.801 18 residues pruned to eliminate duplicates Z: 16 49.531 2.490 1.106 0.930 1.000 0.667 CB 1.706 16 residues pruned to eliminate duplicates Z: 15 38.327 2.489 0.662 0.912 1.000 0.571 CB 1.754 15 residues pruned to eliminate duplicates Z: 18 48.780 2.320 1.040 0.894 1.000 0.647 CA 1.793 17 residues pruned to eliminate duplicates Z: 125 92.780 2.449 0.855 0.668 0.919 0.694 CB 1.707 89 residues pruned to eliminate duplicates Z: 14 21.103 2.150 0.352 0.879 0.923 0.923 CB 1.583 14 residues pruned to eliminate duplicates Z: 68 37.606 2.166 0.617 0.566 0.925 0.567 CB 1.330 62 residues pruned to eliminate duplicates Z: 91 90.598 2.441 0.901 0.717 0.956 0.744 CB 1.770 80 residues pruned to eliminate duplicates Z: 25 44.811 2.372 0.912 0.755 0.917 0.625 CB 1.753 19 residues pruned to eliminate duplicates Z: 14 31.710 2.269 0.523 0.913 1.000 0.846 CB 1.801 14 residues pruned to eliminate duplicates Z: 125 92.843 2.455 0.837 0.656 0.911 0.702 CB 1.755 125 residues pruned to eliminate duplicates Z: 61 36.475 2.276 0.723 0.480 0.850 0.700 CB 1.442 51 residues pruned to eliminate duplicates Z: 16 22.298 2.224 0.411 0.785 0.867 0.533 CB 1.648 16 residues pruned to eliminate duplicates Z: 15 39.845 2.452 0.856 0.939 1.000 0.643 CB 1.626 15 residues pruned to eliminate duplicates Z: 101 79.080 2.352 0.843 0.685 0.920 0.650 CB 1.673 110 residues pruned to eliminate duplicates Z: 15 36.155 2.412 0.805 0.927 0.929 0.929 CB 1.675 15 residues pruned to eliminate duplicates Z: 14 27.092 2.304 0.648 0.887 1.000 0.846 CB 1.427 15 residues pruned to eliminate duplicates Z: 48 24.645 1.942 0.711 0.496 0.851 0.511 CB 1.276 Z: 17 45.248 2.419 0.933 0.920 0.938 0.875 CB 1.817 17 residues pruned to eliminate duplicates Z: 29 55.318 2.394 0.733 0.892 1.000 0.857 CB 1.811 29 residues pruned to eliminate duplicates Z: 16 23.122 2.240 0.293 0.909 1.000 0.800 CB 1.462 15 residues pruned to eliminate duplicates Z: 17 42.266 2.304 0.803 0.894 1.000 0.750 CB 1.825 17 residues pruned to eliminate duplicates Z: 17 34.106 2.247 0.555 0.888 1.000 0.812 CB 1.759 16 residues pruned to eliminate duplicates Z: 20 35.163 2.144 0.885 0.878 0.947 0.737 CB 1.530 20 residues pruned to eliminate duplicates Z: 16 33.059 2.239 0.844 0.877 0.867 0.600 CB 1.732 16 residues pruned to eliminate duplicates Z: 32 71.697 2.382 1.146 0.918 1.000 0.710 CB 1.777 32 residues pruned to eliminate duplicates Z: 15 51.009 2.539 1.082 0.953 1.000 0.571 CB 1.775 15 residues pruned to eliminate duplicates Z: 18 36.282 2.279 0.521 0.913 1.000 0.882 CB 1.796 18 residues pruned to eliminate duplicates Z: 18 28.714 2.120 0.408 0.908 1.000 0.882 CB 1.658 18 residues pruned to eliminate duplicates Z: 15 41.144 2.382 0.829 0.918 1.000 0.857 CA 1.780 15 residues pruned to eliminate duplicates Z: 15 43.372 2.524 0.855 0.917 1.000 0.857 CB 1.747 15 residues pruned to eliminate duplicates Z: 31 54.151 2.335 0.694 0.885 1.000 0.767 CB 1.805 31 residues pruned to eliminate duplicates Z: 68 62.900 2.405 0.774 0.640 0.940 0.672 CB 1.680 67 residues pruned to eliminate duplicates Z: 16 33.950 2.236 0.816 0.892 0.933 0.733 CB 1.662 16 residues pruned to eliminate duplicates Z: 37 21.907 1.962 0.367 0.612 0.944 0.639 CB 1.296 37 residues pruned to eliminate duplicates Z: 13 34.549 2.481 0.683 0.882 1.000 0.833 CB 1.729 15 residues pruned to eliminate duplicates Z: 16 35.331 2.428 0.569 0.925 1.000 0.933 CB 1.680 16 residues pruned to eliminate duplicates Z: 25 45.147 2.372 0.705 0.909 0.958 0.792 CB 1.687 25 residues pruned to eliminate duplicates Z: 24 65.384 2.451 1.061 0.940 1.000 0.826 CB 1.875 24 residues pruned to eliminate duplicates Z: 47 45.004 2.292 0.914 0.533 0.913 0.543 CB 1.604 28 residues pruned to eliminate duplicates Z: 50 38.598 2.294 0.588 0.531 0.959 0.653 CB 1.531 50 residues pruned to eliminate duplicates Z: 50 39.881 2.277 0.797 0.541 0.939 0.694 CB 1.425 50 residues pruned to eliminate duplicates Z: 42 42.133 2.388 0.690 0.508 0.951 0.780 CB 1.700 42 residues pruned to eliminate duplicates Z: 14 29.247 2.364 0.457 0.859 1.000 0.692 CB 1.734 14 residues pruned to eliminate duplicates Z: 31 61.338 2.424 0.791 0.932 1.000 0.867 CB 1.802 31 residues pruned to eliminate duplicates Z: 18 37.813 2.120 1.007 0.906 0.941 0.765 CB 1.628 18 residues pruned to eliminate duplicates Z: 16 47.964 2.414 0.996 0.929 1.000 0.933 CB 1.798 16 residues pruned to eliminate duplicates Z: 6 10.890 1.938 0.352 0.854 1.000 0.600 CA 1.373 Z: 26 32.975 2.318 0.705 0.664 0.880 0.640 CB 1.629 Z: 67 56.500 2.377 0.634 0.652 0.970 0.727 CB 1.602 67 residues pruned to eliminate duplicates Z: 21 51.773 2.409 1.008 0.887 0.950 0.700 CB 1.816 21 residues pruned to eliminate duplicates Z: 18 43.532 2.325 0.977 0.909 0.941 0.529 CB 1.733 18 residues pruned to eliminate duplicates Z: 24 44.053 2.383 0.826 0.849 0.913 0.652 CB 1.714 24 residues pruned to eliminate duplicates Z: 15 30.701 2.343 0.389 0.918 1.000 0.929 CB 1.778 15 residues pruned to eliminate duplicates Z: 30 59.106 2.363 0.866 0.915 1.000 0.828 CB 1.759 30 residues pruned to eliminate duplicates Z: 76 68.298 2.416 0.789 0.634 0.947 0.707 CB 1.700 76 residues pruned to eliminate duplicates Z: 12 30.233 2.244 0.994 0.864 0.909 0.727 CB 1.642 Z: 28 65.462 2.345 1.017 0.933 1.000 0.852 CA 1.858 28 residues pruned to eliminate duplicates Z: 17 37.800 2.285 0.650 0.922 1.000 1.000 CB 1.762 17 residues pruned to eliminate duplicates Z: 32 47.748 2.274 0.620 0.865 0.968 0.806 CB 1.761 32 residues pruned to eliminate duplicates Z: 13 27.811 2.329 0.492 0.839 1.000 0.833 CB 1.724 13 residues pruned to eliminate duplicates Z: 26 46.096 2.265 0.912 0.906 0.920 0.480 CB 1.646 26 residues pruned to eliminate duplicates Z: 12 30.154 2.314 0.612 0.921 1.000 0.909 CA 1.715 12 residues pruned to eliminate duplicates Z: 13 31.330 2.136 0.937 0.881 1.000 0.583 CB 1.582 13 residues pruned to eliminate duplicates Z: 17 41.944 2.382 0.749 0.924 1.000 0.875 CB 1.767 17 residues pruned to eliminate duplicates Z: 30 51.166 2.353 0.644 0.904 0.966 0.793 CB 1.812 30 residues pruned to eliminate duplicates Z: 16 37.924 2.347 0.653 0.926 1.000 0.733 CA 1.769 16 residues pruned to eliminate duplicates Z: 16 38.644 2.363 0.697 0.924 1.000 0.867 CB 1.747 16 residues pruned to eliminate duplicates Z: 14 36.440 2.384 1.077 0.868 0.923 0.692 CB 1.617 14 residues pruned to eliminate duplicates Z: 16 38.430 2.342 0.692 0.919 1.000 0.933 CB 1.765 16 residues pruned to eliminate duplicates Z: 16 29.429 2.188 0.712 0.915 1.000 0.800 CB 1.433 16 residues pruned to eliminate duplicates Z: 23 32.328 2.134 0.686 0.911 0.955 0.773 CB 1.422 22 residues pruned to eliminate duplicates Z: 16 36.413 2.298 0.758 0.886 1.000 0.800 CB 1.679 16 residues pruned to eliminate duplicates Z: 114 98.582 2.483 0.959 0.689 0.920 0.717 CB 1.742 114 residues pruned to eliminate duplicates Z: 13 26.855 2.026 0.808 0.871 0.917 0.667 CB 1.684 13 residues pruned to eliminate duplicates Z: 30 46.227 2.461 0.881 0.667 0.966 0.690 CB 1.645 30 residues pruned to eliminate duplicates Z: 27 30.041 2.262 0.791 0.651 0.846 0.577 CB 1.493 27 residues pruned to eliminate duplicates Z: 28 65.262 2.385 1.045 0.938 1.000 0.815 CB 1.791 28 residues pruned to eliminate duplicates Z: 23 55.681 2.473 0.923 0.862 1.000 0.545 CA 1.833 23 residues pruned to eliminate duplicates Z: 16 32.986 2.298 0.749 0.896 0.933 0.600 CA 1.626 16 residues pruned to eliminate duplicates Z: 31 52.413 2.328 0.651 0.909 1.000 0.900 CB 1.768 31 residues pruned to eliminate duplicates Z: 89 87.759 2.455 0.835 0.723 0.932 0.773 CB 1.822 89 residues pruned to eliminate duplicates Z: 43 40.562 2.291 0.710 0.575 0.905 0.452 CB 1.643 40 residues pruned to eliminate duplicates Z: 22 34.445 2.160 0.804 0.912 0.952 0.905 CB 1.435 22 residues pruned to eliminate duplicates Z: 15 45.957 2.384 0.962 0.931 1.000 0.857 CB 1.834 15 residues pruned to eliminate duplicates Z: 66 59.272 2.369 0.791 0.610 0.938 0.569 CB 1.663 67 residues pruned to eliminate duplicates Z: 15 32.998 2.466 0.578 0.917 0.929 0.929 CB 1.722 15 residues pruned to eliminate duplicates Z: 6 14.273 2.332 0.434 0.830 1.000 1.000 CB 1.435 6 residues pruned to eliminate duplicates Z: 23 57.067 2.441 1.078 0.860 0.955 0.773 CB 1.848 23 residues pruned to eliminate duplicates Z: 27 48.870 2.502 0.733 0.715 0.962 0.731 CB 1.892 27 residues pruned to eliminate duplicates Z: 31 71.274 2.429 1.029 0.927 1.000 0.800 CB 1.850 31 residues pruned to eliminate duplicates Z: 27 39.391 2.227 0.829 0.800 0.846 0.577 CB 1.725 27 residues pruned to eliminate duplicates Z: 14 44.192 2.583 0.875 0.931 1.000 1.000 CB 1.768 14 residues pruned to eliminate duplicates Z: 15 34.645 2.370 0.726 0.929 0.857 0.786 CA 1.849 15 residues pruned to eliminate duplicates Z: 15 25.485 2.342 0.418 0.846 0.857 0.643 CB 1.777 15 residues pruned to eliminate duplicates Z: 16 43.686 2.306 0.947 0.909 1.000 0.800 CA 1.783 16 residues pruned to eliminate duplicates Z: 14 31.854 2.225 1.012 0.927 1.000 0.692 CB 1.383 14 residues pruned to eliminate duplicates Z: 7 10.671 2.082 0.054 0.829 1.000 1.000 CB 1.495 7 residues pruned to eliminate duplicates Z: 38 42.233 2.317 0.872 0.604 0.973 0.622 CB 1.490 39 residues pruned to eliminate duplicates Z: 20 46.911 2.413 0.832 0.837 1.000 0.789 CB 1.820 20 residues pruned to eliminate duplicates Z: 29 60.581 2.327 0.943 0.938 1.000 0.821 CB 1.761 29 residues pruned to eliminate duplicates Z: 24 55.752 2.426 1.215 0.938 0.957 0.652 CB 1.573 24 residues pruned to eliminate duplicates Z: 30 53.636 2.332 0.918 0.892 0.897 0.552 CB 1.784 31 residues pruned to eliminate duplicates Z: 18 18.851 2.113 1.132 0.393 0.882 0.412 CB 1.288 10 residues pruned to eliminate duplicates Z: 62 36.045 2.236 0.656 0.444 0.902 0.607 CB 1.464 63 residues pruned to eliminate duplicates Z: 25 43.695 2.365 0.696 0.924 0.958 0.792 CB 1.630 25 residues pruned to eliminate duplicates Z: 53 37.077 2.219 0.762 0.545 0.923 0.615 CB 1.363 52 residues pruned to eliminate duplicates Z: 16 21.314 2.238 0.364 0.910 0.933 0.867 CB 1.370 16 residues pruned to eliminate duplicates Z: 32 49.462 2.299 0.733 0.899 0.935 0.677 CB 1.704 32 residues pruned to eliminate duplicates Z: 17 47.075 2.396 1.130 0.939 1.000 0.812 CB 1.603 17 residues pruned to eliminate duplicates Z: 29 59.322 2.337 0.910 0.887 0.964 0.750 CB 1.877 29 residues pruned to eliminate duplicates Z: 16 16.000 2.306 0.973 0.306 0.733 0.400 CB 1.536 16 residues pruned to eliminate duplicates Z: 16 37.198 2.415 0.595 0.875 1.000 0.933 CB 1.814 16 residues pruned to eliminate duplicates Z: 15 26.587 2.346 0.507 0.857 0.857 0.714 CA 1.728 15 residues pruned to eliminate duplicates Z: 21 45.440 2.374 0.914 0.855 0.950 0.650 CB 1.737 21 residues pruned to eliminate duplicates Z: 15 37.600 2.466 0.866 0.941 0.929 0.571 CB 1.632 15 residues pruned to eliminate duplicates Z: 21 44.717 2.342 0.802 0.866 0.950 0.650 CB 1.826 21 residues pruned to eliminate duplicates Z: 45 43.408 2.349 0.779 0.631 0.886 0.727 CB 1.562 40 residues pruned to eliminate duplicates Z: 105 65.296 2.301 0.713 0.590 0.952 0.567 CB 1.565 102 residues pruned to eliminate duplicates Z: 16 24.732 2.270 0.590 0.929 0.933 0.867 CB 1.327 16 residues pruned to eliminate duplicates Z: 15 24.345 2.272 0.367 0.842 0.929 0.714 CB 1.681 15 residues pruned to eliminate duplicates Z: 7 14.813 1.991 0.454 0.856 1.000 0.667 CA 1.541 7 residues pruned to eliminate duplicates Z: 29 69.397 2.441 1.039 0.897 1.000 0.821 CB 1.886 29 residues pruned to eliminate duplicates Z: 137 103.440 2.471 0.963 0.638 0.926 0.676 CB 1.735 137 residues pruned to eliminate duplicates Z: 23 36.781 2.177 0.834 0.806 0.909 0.727 CB 1.655 23 residues pruned to eliminate duplicates Z: 17 45.841 2.423 1.062 0.906 1.000 0.812 CB 1.632 17 residues pruned to eliminate duplicates Z: 22 32.100 2.214 0.769 0.939 0.857 0.667 CB 1.450 23 residues pruned to eliminate duplicates Z: 14 22.150 2.233 0.507 0.800 0.923 0.615 CB 1.522 14 residues pruned to eliminate duplicates Z: 91 90.550 2.440 0.925 0.720 0.933 0.711 CB 1.784 88 residues pruned to eliminate duplicates Z: 16 22.752 2.213 0.398 0.920 1.000 0.933 CB 1.337 16 residues pruned to eliminate duplicates Z: 17 44.295 2.318 1.010 0.887 1.000 0.750 CB 1.713 17 residues pruned to eliminate duplicates Z: 7 11.739 2.069 0.309 0.781 1.000 0.667 CA 1.381 7 residues pruned to eliminate duplicates Z: 16 31.011 2.272 0.580 0.889 1.000 0.733 CB 1.606 16 residues pruned to eliminate duplicates Z: 32 41.216 2.227 0.414 0.902 1.000 0.806 CB 1.677 32 residues pruned to eliminate duplicates Z: 16 38.549 2.221 1.056 0.893 0.933 0.867 CA 1.677 16 residues pruned to eliminate duplicates Z: 16 27.900 2.259 0.872 0.933 0.933 0.867 CB 1.274 16 residues pruned to eliminate duplicates Z: 14 23.560 2.245 0.936 0.612 0.923 0.692 CB 1.464 15 residues pruned to eliminate duplicates Z: 7 10.944 2.170 0.175 0.824 0.833 0.500 CB 1.588 7 residues pruned to eliminate duplicates Z: 31 74.901 2.415 1.271 0.922 0.967 0.667 CB 1.815 31 residues pruned to eliminate duplicates Z: 15 28.629 2.312 0.532 0.865 0.929 0.714 CB 1.705 15 residues pruned to eliminate duplicates Z: 7 18.389 1.902 0.932 0.849 1.000 0.833 CB 1.515 7 residues pruned to eliminate duplicates Z: 18 30.353 2.270 0.582 0.896 0.941 0.882 CB 1.561 18 residues pruned to eliminate duplicates Z: 12 18.378 2.195 0.702 0.728 0.818 0.636 CB 1.476 12 residues pruned to eliminate duplicates Z: 9 22.238 2.196 0.495 0.844 1.000 0.500 CA 1.781 9 residues pruned to eliminate duplicates Z: 31 42.697 2.310 0.403 0.892 0.967 0.867 CB 1.788 31 residues pruned to eliminate duplicates Z: 25 54.091 2.369 1.121 0.926 0.958 0.583 CB 1.608 25 residues pruned to eliminate duplicates Z: 16 48.709 2.392 1.084 0.946 1.000 0.867 CB 1.745 16 residues pruned to eliminate duplicates Z: 33 40.224 2.307 0.807 0.590 0.906 0.594 CB 1.727 33 residues pruned to eliminate duplicates Z: 23 32.021 2.084 0.659 0.886 0.955 0.909 CB 1.493 23 residues pruned to eliminate duplicates Z: 16 24.721 2.257 0.622 0.915 0.933 0.800 CB 1.321 16 residues pruned to eliminate duplicates Z: 31 51.612 2.385 0.635 0.899 0.967 0.800 CB 1.788 31 residues pruned to eliminate duplicates Z: 14 24.553 2.249 0.542 0.878 1.000 0.692 CB 1.425 14 residues pruned to eliminate duplicates Z: 13 19.875 2.067 0.494 0.878 0.917 0.583 CB 1.471 Z: 14 28.641 2.263 0.656 0.909 1.000 0.923 CB 1.504 14 residues pruned to eliminate duplicates Z: 24 41.864 2.394 0.539 0.907 0.957 0.870 CB 1.761 24 residues pruned to eliminate duplicates Z: 27 34.299 2.376 0.705 0.577 0.923 0.654 CA 1.671 27 residues pruned to eliminate duplicates Z: 62 54.372 2.341 0.825 0.590 0.902 0.705 CB 1.658 62 residues pruned to eliminate duplicates Z: 11 30.442 2.260 0.944 0.874 1.000 0.900 CB 1.594 13 residues pruned to eliminate duplicates Z: 14 16.418 2.144 0.214 0.873 0.846 0.846 CB 1.506 14 residues pruned to eliminate duplicates Z: 38 36.868 2.362 0.669 0.532 0.892 0.541 CB 1.671 38 residues pruned to eliminate duplicates Z: 8 3.366 1.732 0.016 0.435 0.714 0.429 CB 1.082 Z: 24 35.286 2.293 0.746 0.709 0.957 0.609 CB 1.590 14 residues pruned to eliminate duplicates Z: 13 29.475 2.410 0.574 0.890 1.000 0.917 CB 1.614 13 residues pruned to eliminate duplicates Z: 12 27.279 2.123 0.827 0.856 1.000 0.636 CA 1.564 11 residues pruned to eliminate duplicates Z: 32 50.908 2.266 0.820 0.883 0.935 0.419 CB 1.713 32 residues pruned to eliminate duplicates Z: 7 13.316 2.040 0.514 0.835 0.833 0.500 CA 1.582 7 residues pruned to eliminate duplicates Z: 24 36.851 2.141 0.827 0.896 0.957 0.609 CB 1.471 23 residues pruned to eliminate duplicates Z: 163 106.034 2.466 0.869 0.628 0.932 0.691 CB 1.719 163 residues pruned to eliminate duplicates Z: 17 41.377 2.303 1.013 0.881 0.938 0.750 CB 1.724 17 residues pruned to eliminate duplicates Z: 16 42.706 2.367 1.018 0.908 0.933 0.800 CB 1.757 16 residues pruned to eliminate duplicates Z: 7 9.856 1.856 0.358 0.858 1.000 0.833 CA 1.176 7 residues pruned to eliminate duplicates Z: 18 47.513 2.341 1.463 0.926 0.941 0.471 CB 1.488 18 residues pruned to eliminate duplicates Z: 22 39.121 2.342 0.694 0.858 0.905 0.762 CA 1.752 22 residues pruned to eliminate duplicates Z: 24 47.478 2.406 0.631 0.925 1.000 0.913 CB 1.770 24 residues pruned to eliminate duplicates Z: 76 68.761 2.450 0.753 0.606 0.960 0.760 CB 1.741 76 residues pruned to eliminate duplicates Z: 31 48.308 2.278 0.668 0.889 0.967 0.767 CB 1.729 31 residues pruned to eliminate duplicates Z: 18 47.780 2.330 1.101 0.934 1.000 0.941 CB 1.651 18 residues pruned to eliminate duplicates Z: 99 49.585 2.223 0.610 0.568 0.939 0.612 CB 1.396 99 residues pruned to eliminate duplicates Z: 6 8.294 2.237 0.298 0.585 0.800 0.600 CB 1.471 4 residues pruned to eliminate duplicates Z: 14 17.455 2.236 0.506 0.632 0.923 0.769 CB 1.376 14 residues pruned to eliminate duplicates Z: 116 98.863 2.497 0.942 0.682 0.922 0.661 CB 1.745 116 residues pruned to eliminate duplicates Z: 18 28.719 2.111 0.677 0.940 1.000 0.824 CB 1.367 19 residues pruned to eliminate duplicates Z: 107 89.123 2.424 0.984 0.656 0.925 0.632 CB 1.684 107 residues pruned to eliminate duplicates Z: 39 44.714 2.375 0.766 0.680 0.921 0.763 CB 1.591 39 residues pruned to eliminate duplicates Z: 6 6.005 1.599 0.004 0.769 1.000 0.800 CB 1.319 6 residues pruned to eliminate duplicates Z: 14 12.636 2.278 0.493 0.484 0.692 0.462 CB 1.513 14 residues pruned to eliminate duplicates Z: 162 111.659 2.472 0.920 0.666 0.925 0.683 CB 1.718 162 residues pruned to eliminate duplicates Z: 13 29.112 2.377 0.897 0.910 0.917 0.500 CB 1.442 13 residues pruned to eliminate duplicates Z: 36 52.677 2.557 0.710 0.632 0.971 0.714 CB 1.852 36 residues pruned to eliminate duplicates Z: 16 42.645 2.388 0.963 0.885 0.933 0.867 CB 1.818 16 residues pruned to eliminate duplicates Z: 13 16.740 2.007 0.512 0.842 1.000 0.583 CB 1.187 13 residues pruned to eliminate duplicates Z: 14 19.507 2.355 0.075 0.850 0.923 0.769 CA 1.715 14 residues pruned to eliminate duplicates Z: 76 69.145 2.453 0.809 0.640 0.907 0.720 CB 1.741 75 residues pruned to eliminate duplicates Z: 9 14.502 2.131 0.530 0.683 1.000 0.875 CB 1.329 9 residues pruned to eliminate duplicates Z: 72 49.047 2.276 0.624 0.622 0.930 0.704 CB 1.510 71 residues pruned to eliminate duplicates Z: 73 44.567 2.253 0.529 0.601 0.931 0.611 CB 1.488 73 residues pruned to eliminate duplicates Z: 32 68.032 2.359 1.090 0.915 0.968 0.839 CB 1.810 32 residues pruned to eliminate duplicates Z: 17 46.690 2.203 1.284 0.911 1.000 0.938 CB 1.644 17 residues pruned to eliminate duplicates Z: 18 46.565 2.253 1.238 0.883 1.000 0.765 CB 1.620 18 residues pruned to eliminate duplicates Z: 12 24.058 2.231 0.684 0.849 0.909 0.818 CB 1.575 12 residues pruned to eliminate duplicates Z: 76 87.718 2.470 0.892 0.764 0.960 0.787 CB 1.786 76 residues pruned to eliminate duplicates Z: 12 16.563 2.045 0.425 0.895 0.909 0.909 CB 1.352 12 residues pruned to eliminate duplicates Z: 15 35.844 2.379 0.569 0.915 1.000 0.714 CB 1.814 15 residues pruned to eliminate duplicates Z: 33 30.279 2.193 0.689 0.584 0.875 0.406 CB 1.524 33 residues pruned to eliminate duplicates Z: 6 14.651 2.210 0.407 0.823 1.000 0.600 CA 1.593 6 residues pruned to eliminate duplicates Z: 24 36.022 2.127 0.877 0.891 0.957 0.522 CB 1.415 22 residues pruned to eliminate duplicates Z: 23 50.782 2.490 0.904 0.777 1.000 0.727 CB 1.788 23 residues pruned to eliminate duplicates Z: 16 30.039 2.001 1.203 0.928 1.000 0.733 CB 1.233 Z: 16 52.025 2.437 1.190 0.888 1.000 0.467 CB 1.813 16 residues pruned to eliminate duplicates Z: 14 17.236 2.049 0.477 0.850 1.000 0.769 CB 1.171 14 residues pruned to eliminate duplicates Z: 6 10.410 2.166 0.325 0.696 0.800 0.200 CB 1.696 6 residues pruned to eliminate duplicates Z: 48 39.195 2.304 0.618 0.544 0.915 0.638 CB 1.606 48 residues pruned to eliminate duplicates Z: 6 7.394 2.069 0.156 0.730 0.800 0.800 CB 1.405 6 residues pruned to eliminate duplicates Z: 11 22.434 2.291 0.603 0.884 0.900 0.700 CB 1.552 11 residues pruned to eliminate duplicates Z: 32 47.616 2.235 0.520 0.909 1.000 0.774 CB 1.786 32 residues pruned to eliminate duplicates Z: 14 26.405 2.448 0.299 0.869 0.923 0.769 CB 1.822 14 residues pruned to eliminate duplicates Z: 21 60.765 2.482 1.089 0.938 1.000 0.900 CB 1.823 21 residues pruned to eliminate duplicates Z: 18 44.469 2.249 1.075 0.919 1.000 0.824 CB 1.629 18 residues pruned to eliminate duplicates Z: 39 37.384 2.284 0.732 0.598 0.947 0.737 CB 1.474 39 residues pruned to eliminate duplicates Z: 31 49.636 2.289 0.706 0.882 1.000 0.900 CB 1.679 31 residues pruned to eliminate duplicates Z: 18 34.568 2.326 0.452 0.913 1.000 0.941 CB 1.757 18 residues pruned to eliminate duplicates Z: 16 29.244 2.254 0.958 0.900 0.933 0.733 CB 1.310 16 residues pruned to eliminate duplicates Z: 17 45.290 2.293 1.021 0.935 1.000 0.562 CA 1.702 17 residues pruned to eliminate duplicates Z: 11 12.717 2.103 0.578 0.557 0.800 0.500 CB 1.433 11 residues pruned to eliminate duplicates Z: 16 19.869 1.969 0.416 0.934 1.000 0.933 CB 1.283 16 residues pruned to eliminate duplicates Z: 36 46.164 2.433 1.001 0.618 0.914 0.629 CB 1.568 36 residues pruned to eliminate duplicates Z: 26 31.421 2.205 0.825 0.606 0.880 0.480 CB 1.604 26 residues pruned to eliminate duplicates Z: 28 64.707 2.365 1.057 0.936 0.963 0.852 CB 1.850 28 residues pruned to eliminate duplicates Z: 28 60.099 2.337 0.914 0.932 0.963 0.778 CA 1.876 28 residues pruned to eliminate duplicates Z: 39 33.685 2.300 0.559 0.605 0.974 0.737 CB 1.416 39 residues pruned to eliminate duplicates Z: 43 20.697 1.989 0.301 0.558 0.952 0.595 CB 1.225 44 residues pruned to eliminate duplicates Z: 7 18.288 2.457 0.926 0.780 0.667 0.667 CB 1.848 7 residues pruned to eliminate duplicates Z: 44 32.432 2.266 0.563 0.519 0.907 0.721 CB 1.511 44 residues pruned to eliminate duplicates Z: 31 63.374 2.396 0.848 0.925 1.000 0.833 CB 1.833 31 residues pruned to eliminate duplicates Z: 20 21.746 2.003 0.713 0.660 0.947 0.789 CB 1.323 20 residues pruned to eliminate duplicates Z: 32 41.474 2.254 0.488 0.885 0.968 0.742 CB 1.657 32 residues pruned to eliminate duplicates Z: 13 24.547 2.283 0.587 0.819 0.917 0.583 CB 1.619 13 residues pruned to eliminate duplicates Z: 10 8.995 1.845 0.065 0.793 0.889 0.556 CA 1.328 10 residues pruned to eliminate duplicates Z: 33 57.108 2.239 0.915 0.906 1.000 0.594 CB 1.675 32 residues pruned to eliminate duplicates Z: 36 37.880 2.325 0.601 0.651 1.000 0.686 CB 1.494 36 residues pruned to eliminate duplicates Z: 134 82.481 2.404 0.826 0.578 0.895 0.624 CB 1.690 181 residues pruned to eliminate duplicates Z: 17 36.196 2.313 0.754 0.917 0.938 0.688 CA 1.679 17 residues pruned to eliminate duplicates Z: 11 24.473 2.309 0.567 0.858 1.000 1.000 CB 1.576 Z: 10 24.552 2.317 0.531 0.903 1.000 1.000 CB 1.644 10 residues pruned to eliminate duplicates Z: 8 7.363 1.869 0.030 0.775 0.857 0.857 CB 1.324 8 residues pruned to eliminate duplicates Z: 23 31.063 2.168 0.618 0.913 0.955 0.727 CB 1.400 23 residues pruned to eliminate duplicates Z: 18 14.593 1.825 0.463 0.690 0.941 0.706 CB 1.183 17 residues pruned to eliminate duplicates Z: 27 61.297 2.414 0.855 0.943 1.000 0.808 CB 1.860 27 residues pruned to eliminate duplicates Z: 16 32.607 2.390 0.465 0.918 1.000 0.933 CB 1.696 16 residues pruned to eliminate duplicates Z: 16 24.582 1.875 0.650 0.900 0.933 0.667 CB 1.570 16 residues pruned to eliminate duplicates Z: 19 36.784 2.122 1.141 0.876 0.944 0.556 CB 1.468 19 residues pruned to eliminate duplicates Z: 12 9.773 1.923 0.162 0.570 0.909 0.545 CB 1.356 12 residues pruned to eliminate duplicates Z: 14 30.693 2.439 0.700 0.879 0.923 0.846 CB 1.613 14 residues pruned to eliminate duplicates Z: 17 35.414 2.285 0.673 0.902 1.000 0.938 CA 1.652 17 residues pruned to eliminate duplicates Z: 6 2.985 1.851 -0.232 0.469 0.800 0.800 CB 1.211 Z: 15 30.928 1.957 0.943 0.919 1.000 0.714 CB 1.531 15 residues pruned to eliminate duplicates Z: 12 30.393 2.257 0.868 0.897 1.000 0.727 CB 1.556 12 residues pruned to eliminate duplicates Z: 22 38.427 2.228 1.084 0.889 0.857 0.476 CB 1.516 11 residues pruned to eliminate duplicates Z: 36 48.540 2.499 0.636 0.628 0.971 0.514 CB 1.831 36 residues pruned to eliminate duplicates Z: 18 39.243 2.297 0.700 0.916 1.000 0.647 CB 1.721 18 residues pruned to eliminate duplicates Z: 7 7.318 2.141 0.272 0.687 0.833 0.833 CB 1.109 7 residues pruned to eliminate duplicates Z: 22 31.799 2.168 0.631 0.924 0.952 0.905 CB 1.447 22 residues pruned to eliminate duplicates Z: 14 24.482 1.959 0.487 0.942 1.000 1.000 CB 1.616 14 residues pruned to eliminate duplicates Z: 24 46.211 2.401 0.795 0.870 0.957 0.783 CA 1.707 24 residues pruned to eliminate duplicates Z: 16 29.259 2.242 0.920 0.924 0.867 0.733 CB 1.422 16 residues pruned to eliminate duplicates Z: 16 41.364 2.352 0.877 0.923 1.000 0.733 CB 1.701 16 residues pruned to eliminate duplicates Z: 92 89.602 2.414 0.936 0.728 0.923 0.703 CB 1.772 92 residues pruned to eliminate duplicates Z: 90 89.621 2.432 0.887 0.738 0.944 0.730 CB 1.772 90 residues pruned to eliminate duplicates Z: 14 33.042 2.315 0.559 0.925 1.000 1.000 CB 1.782 14 residues pruned to eliminate duplicates Z: 32 65.365 2.377 0.924 0.929 1.000 0.774 CB 1.796 32 residues pruned to eliminate duplicates Z: 16 42.092 2.328 1.002 0.926 1.000 0.800 CA 1.636 16 residues pruned to eliminate duplicates Z: 6 12.750 1.955 0.486 0.819 1.000 0.600 CA 1.487 6 residues pruned to eliminate duplicates Z: 50 47.046 2.379 0.660 0.543 0.959 0.755 CB 1.701 50 residues pruned to eliminate duplicates Z: 16 33.087 2.301 0.757 0.890 0.933 0.800 CB 1.630 16 residues pruned to eliminate duplicates Z: 49 38.051 2.279 0.688 0.574 0.958 0.500 CB 1.388 49 residues pruned to eliminate duplicates Z: 6 2.843 1.534 -0.031 0.432 0.800 0.600 N 1.147 6 residues pruned to eliminate duplicates Z: 17 35.446 2.317 0.660 0.895 0.938 0.812 CA 1.761 17 residues pruned to eliminate duplicates Z: 6 13.835 2.282 0.336 0.727 1.000 0.600 CA 1.654 6 residues pruned to eliminate duplicates Z: 16 35.306 2.269 0.869 0.939 1.000 0.733 CB 1.494 16 residues pruned to eliminate duplicates Z: 153 96.169 2.446 0.847 0.616 0.895 0.671 CB 1.729 153 residues pruned to eliminate duplicates Z: 14 17.956 2.193 0.339 0.856 0.923 0.692 CB 1.355 14 residues pruned to eliminate duplicates Z: 32 72.410 2.353 1.212 0.927 1.000 0.742 CB 1.751 32 residues pruned to eliminate duplicates Z: 72 52.084 2.275 0.762 0.645 0.915 0.718 CB 1.471 72 residues pruned to eliminate duplicates Z: 28 12.873 2.044 0.242 0.411 0.852 0.593 CB 1.258 28 residues pruned to eliminate duplicates Z: 14 24.506 1.960 0.566 0.925 1.000 1.000 CB 1.554 14 residues pruned to eliminate duplicates Z: 35 18.100 2.083 0.536 0.468 0.794 0.647 CB 1.263 35 residues pruned to eliminate duplicates Z: 34 29.528 2.151 0.620 0.601 0.879 0.485 CB 1.525 34 residues pruned to eliminate duplicates Z: 24 22.977 2.110 0.618 0.564 0.957 0.609 CB 1.380 14 residues pruned to eliminate duplicates Z: 13 22.606 2.322 0.466 0.881 0.917 0.750 CB 1.514 13 residues pruned to eliminate duplicates Z: 16 35.769 2.377 0.699 0.906 0.933 0.667 CB 1.743 16 residues pruned to eliminate duplicates Z: 11 28.122 2.268 0.794 0.921 0.900 0.800 CB 1.709 11 residues pruned to eliminate duplicates Z: 16 28.099 1.928 0.828 0.927 0.933 0.733 CB 1.546 16 residues pruned to eliminate duplicates Z: 14 13.904 2.148 0.128 0.746 0.846 0.615 CB 1.509 14 residues pruned to eliminate duplicates Z: 15 21.802 2.153 0.611 0.681 0.929 0.714 CB 1.532 15 residues pruned to eliminate duplicates Z: 10 4.365 1.786 0.233 0.504 0.889 0.778 CB 0.740 Z: 61 34.298 2.270 0.553 0.464 0.883 0.600 CB 1.474 61 residues pruned to eliminate duplicates Z: 16 21.804 1.971 0.595 0.920 1.000 0.933 CB 1.261 16 residues pruned to eliminate duplicates Z: 6 14.464 1.950 0.693 0.836 1.000 1.000 CA 1.466 6 residues pruned to eliminate duplicates Z: 24 47.584 2.376 1.197 0.940 0.913 0.304 CB 1.445 21 residues pruned to eliminate duplicates Z: 23 34.827 2.159 0.924 0.916 0.955 0.455 CB 1.323 23 residues pruned to eliminate duplicates Z: 32 33.477 2.024 0.961 0.653 0.968 0.742 CB 1.358 16 residues pruned to eliminate duplicates Z: 50 36.959 2.022 0.697 0.640 0.959 0.612 CB 1.407 47 residues pruned to eliminate duplicates Z: 8 8.749 1.680 0.173 0.819 1.000 0.714 CB 1.272 8 residues pruned to eliminate duplicates Z: 32 53.106 2.265 0.941 0.887 0.935 0.484 CB 1.673 32 residues pruned to eliminate duplicates Z: 14 26.777 1.979 0.638 0.941 1.000 0.923 CB 1.591 14 residues pruned to eliminate duplicates Z: 24 17.524 1.913 0.331 0.703 0.957 0.652 CB 1.248 Z: 19 29.549 2.189 0.760 0.899 0.889 0.611 CB 1.454 19 residues pruned to eliminate duplicates Z: 14 16.043 1.869 0.346 0.935 1.000 0.923 CB 1.233 14 residues pruned to eliminate duplicates Z: 13 31.000 2.464 0.634 0.843 0.917 0.583 CB 1.805 13 residues pruned to eliminate duplicates Z: 15 19.221 1.990 0.644 0.905 0.929 0.857 CB 1.204 15 residues pruned to eliminate duplicates Z: 50 39.823 2.266 0.752 0.607 0.939 0.612 CB 1.379 50 residues pruned to eliminate duplicates Z: 7 16.923 1.860 1.100 0.884 1.000 0.500 CB 1.278 7 residues pruned to eliminate duplicates Z: 45 56.240 2.404 0.894 0.680 0.886 0.750 CB 1.779 45 residues pruned to eliminate duplicates Z: 16 24.884 1.968 0.874 0.931 1.000 0.933 CB 1.217 16 residues pruned to eliminate duplicates Z: 31 58.982 2.303 1.025 0.904 0.967 0.633 CB 1.702 33 residues pruned to eliminate duplicates Z: 29 67.273 2.337 1.171 0.907 0.964 0.536 CB 1.847 29 residues pruned to eliminate duplicates Z: 83 78.967 2.400 0.910 0.712 0.915 0.720 CB 1.716 81 residues pruned to eliminate duplicates Z: 12 9.938 1.878 0.372 0.568 0.909 0.545 CB 1.197 10 residues pruned to eliminate duplicates Z: 13 9.753 2.111 0.561 0.348 0.667 0.333 CB 1.511 13 residues pruned to eliminate duplicates Z: 37 21.870 1.898 0.426 0.623 0.944 0.667 CB 1.270 37 residues pruned to eliminate duplicates Z: 12 10.006 1.917 0.260 0.615 0.909 0.727 CB 1.232 12 residues pruned to eliminate duplicates Z: 8 11.082 2.278 0.413 0.556 0.857 0.857 CB 1.437 8 residues pruned to eliminate duplicates Z: 16 36.231 2.192 0.701 0.925 1.000 0.933 CB 1.761 16 residues pruned to eliminate duplicates Z: 19 10.935 1.889 0.505 0.338 0.778 0.500 CB 1.391 19 residues pruned to eliminate duplicates Z: 37 34.852 2.028 1.119 0.632 0.972 0.694 CB 1.228 32 residues pruned to eliminate duplicates Z: 38 54.519 2.443 0.789 0.684 0.973 0.811 CB 1.780 63 residues pruned to eliminate duplicates Z: 9 8.993 1.657 0.278 0.899 1.000 0.750 CB 1.073 9 residues pruned to eliminate duplicates Z: 17 39.956 2.286 0.893 0.901 0.938 0.812 CB 1.758 17 residues pruned to eliminate duplicates Z: 46 47.151 2.363 0.926 0.608 0.911 0.622 CB 1.530 46 residues pruned to eliminate duplicates Z: 33 24.091 1.919 0.725 0.655 0.875 0.625 CB 1.273 33 residues pruned to eliminate duplicates Z: 37 42.569 2.330 0.787 0.623 1.000 0.722 CB 1.517 37 residues pruned to eliminate duplicates Z: 11 26.509 2.279 0.790 0.881 1.000 0.600 CB 1.488 11 residues pruned to eliminate duplicates Z: 70 46.054 2.232 0.615 0.595 0.942 0.681 CB 1.490 70 residues pruned to eliminate duplicates Z: 7 5.043 1.767 -0.156 0.617 1.000 0.833 CB 1.236 Z: 26 33.259 2.119 0.882 0.653 0.880 0.560 CB 1.644 26 residues pruned to eliminate duplicates Z: 13 23.413 2.001 0.758 0.856 1.000 0.833 CB 1.418 13 residues pruned to eliminate duplicates Z: 13 25.952 2.390 0.986 0.376 1.000 0.333 CB 1.801 13 residues pruned to eliminate duplicates Z: 31 54.279 2.281 0.957 0.896 0.933 0.533 CB 1.703 31 residues pruned to eliminate duplicates Z: 130 93.116 2.426 0.864 0.651 0.930 0.651 CB 1.694 130 residues pruned to eliminate duplicates Z: 22 39.942 2.416 0.828 0.810 0.905 0.762 CB 1.665 22 residues pruned to eliminate duplicates Z: 13 13.436 1.903 0.276 0.670 1.000 0.750 CB 1.366 13 residues pruned to eliminate duplicates Z: 12 25.623 2.117 0.681 0.907 1.000 1.000 CB 1.543 12 residues pruned to eliminate duplicates Z: 15 32.950 2.215 0.779 0.913 1.000 0.786 CB 1.581 15 residues pruned to eliminate duplicates Z: 10 14.459 2.183 0.833 0.657 0.778 0.778 CB 1.338 10 residues pruned to eliminate duplicates Z: 54 45.357 2.349 0.749 0.538 0.887 0.642 CB 1.647 54 residues pruned to eliminate duplicates Z: 15 38.543 2.283 1.032 0.937 1.000 0.714 CB 1.546 15 residues pruned to eliminate duplicates Z: 15 23.381 1.950 0.524 0.919 1.000 0.929 CB 1.482 15 residues pruned to eliminate duplicates Z: 6 11.422 1.977 0.317 0.839 1.000 0.800 CA 1.465 6 residues pruned to eliminate duplicates Z: 52 48.174 2.382 0.717 0.525 0.941 0.725 CB 1.711 52 residues pruned to eliminate duplicates Z: 23 25.905 2.070 0.597 0.717 0.955 0.727 CB 1.437 23 residues pruned to eliminate duplicates Z: 14 26.501 1.962 0.687 0.918 1.000 0.769 CB 1.566 14 residues pruned to eliminate duplicates Z: 23 32.903 2.149 0.873 0.921 0.864 0.455 CB 1.421 23 residues pruned to eliminate duplicates Z: 11 13.611 1.926 0.447 0.703 1.000 0.700 CB 1.284 11 residues pruned to eliminate duplicates Z: 33 31.060 1.987 0.843 0.683 1.000 0.750 CB 1.268 33 residues pruned to eliminate duplicates Z: 23 28.923 2.149 0.372 0.850 0.955 0.727 CB 1.624 23 residues pruned to eliminate duplicates Z: 24 24.523 2.048 0.552 0.700 0.957 0.739 CB 1.402 24 residues pruned to eliminate duplicates Z: 8 4.439 1.895 0.110 0.563 0.714 0.571 CB 1.051 Z: 6 6.019 2.030 -0.186 0.751 1.000 0.800 CB 1.302 7 residues pruned to eliminate duplicates Z: 16 26.069 2.262 0.670 0.921 0.933 0.867 CB 1.343 16 residues pruned to eliminate duplicates Z: 24 48.975 2.342 1.076 0.834 0.957 0.739 CB 1.645 24 residues pruned to eliminate duplicates Z: 14 18.719 1.887 0.653 0.943 1.000 0.615 CB 1.154 14 residues pruned to eliminate duplicates Z: 60 27.007 2.070 0.348 0.458 0.932 0.542 CB 1.411 61 residues pruned to eliminate duplicates Z: 29 53.413 2.211 0.886 0.916 1.000 0.750 CB 1.709 29 residues pruned to eliminate duplicates Z: 16 26.474 1.858 0.741 0.915 0.933 0.733 N 1.600 16 residues pruned to eliminate duplicates Z: 10 8.299 2.165 0.574 0.420 0.667 0.444 CB 1.323 10 residues pruned to eliminate duplicates Z: 27 23.613 2.114 0.635 0.618 0.923 0.577 CB 1.298 27 residues pruned to eliminate duplicates Z: 23 30.882 2.149 0.856 0.901 0.909 0.727 CB 1.296 23 residues pruned to eliminate duplicates Z: 9 11.155 2.064 0.930 0.478 0.750 0.625 CA 1.350 9 residues pruned to eliminate duplicates Z: 13 21.877 2.188 0.569 0.891 1.000 0.833 CB 1.323 13 residues pruned to eliminate duplicates Z: 77 66.790 2.420 0.791 0.620 0.921 0.776 CB 1.715 77 residues pruned to eliminate duplicates Z: 14 27.353 1.959 0.872 0.922 1.000 0.769 CB 1.455 14 residues pruned to eliminate duplicates Z: 23 37.033 2.154 1.076 0.925 0.955 0.636 CB 1.299 23 residues pruned to eliminate duplicates Z: 13 16.330 2.061 0.493 0.676 0.917 0.583 CB 1.421 Z: 11 29.561 2.351 0.741 0.903 1.000 0.800 CB 1.628 11 residues pruned to eliminate duplicates Z: 9 12.206 2.376 0.304 0.403 1.000 1.000 CB 1.542 9 residues pruned to eliminate duplicates Z: 27 21.009 2.066 0.489 0.546 0.923 0.692 CB 1.387 25 residues pruned to eliminate duplicates Z: 28 24.324 2.154 0.313 0.694 0.926 0.741 CB 1.498 28 residues pruned to eliminate duplicates Z: 17 9.445 1.974 0.162 0.415 0.875 0.562 CB 1.286 17 residues pruned to eliminate duplicates Z: 16 32.402 2.312 1.137 0.916 0.800 0.400 CB 1.495 16 residues pruned to eliminate duplicates Z: 10 12.590 1.994 0.379 0.745 0.889 0.667 CB 1.379 10 residues pruned to eliminate duplicates Z: 15 26.582 1.900 0.915 0.938 1.000 0.571 CB 1.359 15 residues pruned to eliminate duplicates Z: 14 33.701 2.270 1.003 0.870 1.000 0.692 CB 1.500 14 residues pruned to eliminate duplicates Z: 36 48.066 2.507 0.727 0.612 0.943 0.629 CB 1.790 36 residues pruned to eliminate duplicates Z: 6 5.848 2.093 0.605 0.644 0.600 0.400 CB 1.134 6 residues pruned to eliminate duplicates Z: 6 13.094 1.957 0.852 0.781 1.000 0.600 CB 1.261 6 residues pruned to eliminate duplicates Z: 6 7.668 2.135 0.317 0.698 0.800 0.600 CB 1.272 6 residues pruned to eliminate duplicates Z: 106 54.747 2.182 0.673 0.554 0.943 0.533 CB 1.472 106 residues pruned to eliminate duplicates Z: 22 24.730 2.153 0.840 0.574 0.810 0.571 CB 1.568 21 residues pruned to eliminate duplicates Z: 34 42.793 2.480 0.753 0.616 0.909 0.727 CB 1.689 34 residues pruned to eliminate duplicates Z: 84 93.529 2.477 1.059 0.744 0.940 0.723 CB 1.722 84 residues pruned to eliminate duplicates Z: 20 25.824 2.065 0.610 0.891 0.895 0.684 CB 1.431 20 residues pruned to eliminate duplicates Z: 14 32.001 2.199 0.874 0.913 1.000 0.846 CB 1.524 14 residues pruned to eliminate duplicates Z: 20 29.563 2.187 0.736 0.647 0.947 0.684 CB 1.643 20 residues pruned to eliminate duplicates Z: 11 21.246 2.372 0.324 0.905 0.900 0.900 CB 1.692 Z: 11 4.960 1.559 0.796 0.274 0.900 0.300 CB 0.804 Z: 13 21.563 2.047 0.806 0.684 0.917 0.583 CB 1.552 13 residues pruned to eliminate duplicates Z: 37 28.617 2.012 0.811 0.602 0.972 0.667 CB 1.221 37 residues pruned to eliminate duplicates Z: 13 14.292 1.899 0.295 0.909 1.000 0.917 CB 1.191 13 residues pruned to eliminate duplicates Z: 24 17.520 2.071 0.580 0.409 0.913 0.565 CB 1.344 24 residues pruned to eliminate duplicates Z: 8 7.044 1.809 0.278 0.834 1.000 0.714 CB 0.863 Z: 6 9.764 2.107 0.428 0.633 1.000 0.400 CB 1.281 6 residues pruned to eliminate duplicates Z: 15 10.954 1.809 0.593 0.389 0.714 0.500 N 1.600 15 residues pruned to eliminate duplicates Z: 16 21.925 1.856 0.485 0.920 0.933 0.667 CB 1.551 16 residues pruned to eliminate duplicates Z: 11 25.889 2.244 0.754 0.903 0.900 0.800 CB 1.647 11 residues pruned to eliminate duplicates Z: 27 30.918 1.986 0.822 0.748 0.962 0.731 CB 1.397 29 residues pruned to eliminate duplicates Z: 12 12.309 1.904 0.568 0.702 0.909 0.818 CB 1.137 12 residues pruned to eliminate duplicates Z: 8 6.640 1.800 -0.060 0.877 1.000 0.714 CB 1.077 8 residues pruned to eliminate duplicates Z: 13 11.563 1.860 0.277 0.690 0.917 0.667 CB 1.288 13 residues pruned to eliminate duplicates Z: 179 111.432 2.439 0.890 0.644 0.933 0.663 CB 1.699 179 residues pruned to eliminate duplicates Z: 6 4.367 1.928 0.172 0.713 0.600 0.600 N 1.188 6 residues pruned to eliminate duplicates Z: 25 36.286 2.164 0.760 0.828 0.917 0.750 CB 1.597 25 residues pruned to eliminate duplicates Z: 36 37.848 2.315 0.724 0.662 0.914 0.771 CB 1.509 36 residues pruned to eliminate duplicates Z: 73 55.091 2.260 0.812 0.632 0.931 0.722 CB 1.505 73 residues pruned to eliminate duplicates Z: 12 32.136 2.489 0.513 0.864 1.000 0.636 CB 1.886 12 residues pruned to eliminate duplicates Z: 7 7.648 2.006 0.326 0.692 0.667 0.500 CB 1.478 7 residues pruned to eliminate duplicates Z: 66 31.537 2.126 0.514 0.508 0.938 0.615 CB 1.284 77 residues pruned to eliminate duplicates Z: 41 30.525 2.162 0.715 0.531 0.875 0.600 CB 1.443 42 residues pruned to eliminate duplicates Z: 29 75.185 2.390 1.388 0.926 0.964 0.750 CB 1.811 29 residues pruned to eliminate duplicates Z: 9 9.274 1.976 0.247 0.636 1.000 0.750 CB 1.171 9 residues pruned to eliminate duplicates Z: 18 20.233 2.205 0.785 0.421 0.824 0.588 CB 1.643 18 residues pruned to eliminate duplicates Z: 14 14.872 1.818 0.261 0.921 1.000 0.692 CB 1.266 14 residues pruned to eliminate duplicates Z: 11 30.116 2.293 0.723 0.890 1.000 0.900 CB 1.734 11 residues pruned to eliminate duplicates Z: 41 29.841 2.238 0.690 0.463 0.875 0.675 CB 1.480 41 residues pruned to eliminate duplicates Z: 15 32.566 2.228 1.011 0.873 0.929 0.643 CB 1.524 15 residues pruned to eliminate duplicates Z: 66 31.922 2.048 0.475 0.566 0.908 0.600 CB 1.355 66 residues pruned to eliminate duplicates Z: 46 47.270 2.400 0.949 0.611 0.867 0.578 CB 1.564 46 residues pruned to eliminate duplicates Z: 19 24.431 2.225 0.554 0.622 0.944 0.611 CB 1.572 19 residues pruned to eliminate duplicates Z: 31 61.455 2.379 0.821 0.926 1.000 0.867 CB 1.816 31 residues pruned to eliminate duplicates Z: 22 41.604 2.341 0.990 0.843 0.905 0.714 CB 1.603 22 residues pruned to eliminate duplicates Z: 12 17.052 2.201 0.675 0.515 0.909 0.818 CA 1.511 12 residues pruned to eliminate duplicates Z: 31 61.731 2.300 1.099 0.895 1.000 0.633 CB 1.673 31 residues pruned to eliminate duplicates Z: 12 10.192 1.614 0.154 0.896 1.000 0.909 CB 1.182 10 residues pruned to eliminate duplicates Z: 6 3.568 1.762 0.441 0.295 0.800 0.600 CB 0.988 Z: 23 44.807 2.489 0.926 0.708 1.000 0.682 CB 1.650 23 residues pruned to eliminate duplicates Z: 61 56.855 2.292 0.923 0.651 0.900 0.550 CB 1.607 61 residues pruned to eliminate duplicates Z: 6 4.008 1.973 0.147 0.544 1.000 0.400 CB 0.759 6 residues pruned to eliminate duplicates Z: 14 22.706 1.896 0.925 0.952 1.000 0.615 CB 1.189 14 residues pruned to eliminate duplicates Z: 47 37.345 2.281 0.682 0.610 0.935 0.674 CB 1.383 50 residues pruned to eliminate duplicates Z: 11 20.911 2.257 0.858 0.685 0.800 0.400 CB 1.663 12 residues pruned to eliminate duplicates Z: 82 74.419 2.463 0.746 0.700 0.926 0.654 CB 1.730 82 residues pruned to eliminate duplicates Z: 34 41.035 2.313 0.855 0.626 0.970 0.697 CB 1.525 34 residues pruned to eliminate duplicates Z: 16 21.651 1.931 0.722 0.911 1.000 0.867 CB 1.191 16 residues pruned to eliminate duplicates Z: 7 3.917 1.652 0.314 0.569 0.833 0.500 N 0.827 Z: 26 23.018 1.983 0.436 0.708 0.920 0.800 CB 1.455 26 residues pruned to eliminate duplicates Z: 15 19.386 1.801 0.615 0.918 1.000 0.929 CB 1.257 15 residues pruned to eliminate duplicates Z: 29 30.816 2.014 1.025 0.688 0.893 0.714 CB 1.346 29 residues pruned to eliminate duplicates Z: 23 39.813 2.433 0.678 0.734 1.000 0.818 CB 1.684 23 residues pruned to eliminate duplicates Z: 17 20.613 2.047 0.578 0.696 0.938 0.812 CB 1.423 17 residues pruned to eliminate duplicates Z: 7 12.828 2.155 0.590 0.663 0.833 0.500 CA 1.578 7 residues pruned to eliminate duplicates Z: 9 11.965 2.017 0.836 0.411 0.750 0.750 CA 1.672 9 residues pruned to eliminate duplicates Z: 17 17.657 1.789 0.804 0.804 0.938 0.688 CB 1.119 17 residues pruned to eliminate duplicates Z: 6 10.953 1.819 0.627 0.846 1.000 0.600 CA 1.229 6 residues pruned to eliminate duplicates Z: 6 10.529 2.036 0.463 0.862 0.800 0.600 CB 1.451 6 residues pruned to eliminate duplicates Z: 15 27.011 1.868 0.809 0.914 1.000 0.786 CB 1.512 15 residues pruned to eliminate duplicates Z: 26 21.448 2.047 0.665 0.595 0.880 0.360 CB 1.306 26 residues pruned to eliminate duplicates Z: 7 4.589 1.625 0.429 0.248 0.833 0.500 O 1.294 Z: 78 46.557 2.311 0.737 0.523 0.896 0.571 CB 1.442 78 residues pruned to eliminate duplicates Z: 12 16.666 2.145 0.546 0.574 0.909 0.636 CB 1.552 12 residues pruned to eliminate duplicates Z: 14 18.308 1.878 0.590 0.936 1.000 0.923 CB 1.184 14 residues pruned to eliminate duplicates Z: 98 89.448 2.442 0.852 0.721 0.959 0.794 CB 1.717 98 residues pruned to eliminate duplicates Z: 16 39.376 2.302 0.886 0.894 1.000 0.467 CB 1.679 16 residues pruned to eliminate duplicates Z: 9 7.876 2.000 0.441 0.436 0.875 0.500 CB 1.179 7 residues pruned to eliminate duplicates Z: 14 28.642 2.303 0.549 0.857 1.000 0.615 CB 1.641 14 residues pruned to eliminate duplicates Z: 15 20.786 2.281 0.211 0.916 1.000 1.000 CB 1.420 15 residues pruned to eliminate duplicates Z: 26 30.634 2.122 0.771 0.740 0.880 0.600 CB 1.494 26 residues pruned to eliminate duplicates Z: 65 34.532 2.148 0.618 0.544 0.906 0.656 CB 1.312 65 residues pruned to eliminate duplicates Z: 15 32.201 2.266 0.858 0.927 1.000 0.571 CB 1.433 15 residues pruned to eliminate duplicates Z: 13 15.798 2.145 0.226 0.839 0.833 0.667 CA 1.554 13 residues pruned to eliminate duplicates Z: 68 62.035 2.454 0.711 0.603 0.910 0.642 CB 1.798 68 residues pruned to eliminate duplicates Z: 23 11.905 1.754 0.492 0.480 0.818 0.500 CB 1.210 23 residues pruned to eliminate duplicates Z: 131 90.085 2.419 0.881 0.654 0.885 0.662 CB 1.702 131 residues pruned to eliminate duplicates Z: 11 4.333 2.006 0.120 0.135 0.800 0.300 CB 1.200 11 residues pruned to eliminate duplicates Z: 16 31.096 2.255 0.792 0.899 0.933 0.667 CB 1.522 16 residues pruned to eliminate duplicates Z: 11 19.214 2.216 0.510 0.601 1.000 0.500 CB 1.649 11 residues pruned to eliminate duplicates Z: 44 28.801 2.002 0.636 0.539 0.907 0.581 CB 1.423 48 residues pruned to eliminate duplicates Z: 15 46.552 2.478 1.105 0.928 1.000 0.857 CB 1.670 15 residues pruned to eliminate duplicates Z: 19 21.920 2.070 0.577 0.622 0.944 0.667 CB 1.494 17 residues pruned to eliminate duplicates Z: 18 33.287 2.099 0.989 0.857 0.941 0.706 CB 1.513 18 residues pruned to eliminate duplicates Z: 23 37.592 2.187 0.917 0.933 0.955 0.682 CB 1.398 23 residues pruned to eliminate duplicates Z: 14 18.138 2.106 0.486 0.887 0.846 0.769 CB 1.370 14 residues pruned to eliminate duplicates Z: 6 7.142 1.779 0.346 0.667 0.800 0.600 CA 1.429 6 residues pruned to eliminate duplicates Z: 31 36.928 2.274 0.781 0.624 0.867 0.733 CB 1.708 31 residues pruned to eliminate duplicates Z: 7 10.968 1.954 0.366 0.875 1.000 0.833 CB 1.220 8 residues pruned to eliminate duplicates Z: 28 29.239 2.336 0.567 0.429 0.963 0.667 CB 1.718 28 residues pruned to eliminate duplicates Z: 31 57.666 2.291 1.008 0.900 0.967 0.633 CB 1.691 31 residues pruned to eliminate duplicates Z: 14 18.298 1.984 0.857 0.560 0.923 0.462 CB 1.408 14 residues pruned to eliminate duplicates Z: 11 16.140 2.099 0.506 0.824 1.000 0.400 CB 1.220 11 residues pruned to eliminate duplicates Z: 17 35.933 2.094 1.019 0.849 1.000 0.375 CB 1.575 17 residues pruned to eliminate duplicates Z: 24 36.967 2.190 0.943 0.718 0.913 0.609 CB 1.629 24 residues pruned to eliminate duplicates Z: 10 8.372 1.873 0.116 0.848 0.778 0.556 CB 1.274 10 residues pruned to eliminate duplicates Z: 40 26.385 1.986 0.501 0.555 0.923 0.590 CB 1.456 40 residues pruned to eliminate duplicates Z: 7 6.580 1.739 0.232 0.745 1.000 0.667 CB 1.007 7 residues pruned to eliminate duplicates Z: 16 29.796 2.002 1.231 0.912 1.000 0.867 CB 1.220 16 residues pruned to eliminate duplicates Z: 14 21.715 2.228 0.623 0.877 0.846 0.769 CB 1.429 14 residues pruned to eliminate duplicates Z: 15 27.441 1.923 0.662 0.899 1.000 0.857 CA 1.640 15 residues pruned to eliminate duplicates Z: 50 38.633 2.301 0.672 0.549 0.939 0.653 CB 1.457 50 residues pruned to eliminate duplicates Z: 13 12.271 1.851 0.294 0.662 1.000 0.750 CB 1.272 13 residues pruned to eliminate duplicates Z: 13 6.718 1.891 0.321 0.437 0.833 0.667 CB 0.994 13 residues pruned to eliminate duplicates Z: 29 62.981 2.343 1.042 0.927 1.000 0.536 CB 1.742 29 residues pruned to eliminate duplicates Z: 8 6.038 1.760 -0.022 0.860 1.000 0.571 CB 0.975 8 residues pruned to eliminate duplicates Z: 14 15.443 1.879 0.333 0.941 1.000 1.000 CB 1.187 14 residues pruned to eliminate duplicates Z: 17 31.879 2.229 0.622 0.897 0.938 0.875 CB 1.683 17 residues pruned to eliminate duplicates Z: 16 27.901 2.174 0.636 0.918 1.000 0.867 CB 1.429 16 residues pruned to eliminate duplicates Z: 37 24.314 1.957 0.686 0.538 0.889 0.667 CB 1.331 19 residues pruned to eliminate duplicates Z: 49 77.972 2.370 0.999 0.848 0.979 0.750 CB 1.800 49 residues pruned to eliminate duplicates Z: 7 12.608 1.888 0.656 0.776 1.000 1.000 CA 1.290 7 residues pruned to eliminate duplicates Z: 7 2.277 1.462 0.605 0.238 0.500 0.500 CB 1.074 7 residues pruned to eliminate duplicates Z: 13 25.325 2.539 0.369 0.890 0.833 0.667 CB 1.815 13 residues pruned to eliminate duplicates Z: 29 30.966 1.987 1.006 0.720 0.964 0.643 CB 1.248 29 residues pruned to eliminate duplicates Z: 18 27.778 2.283 0.522 0.661 1.000 0.706 CB 1.671 18 residues pruned to eliminate duplicates Z: 33 57.806 2.306 0.889 0.853 0.969 0.719 CB 1.789 33 residues pruned to eliminate duplicates Z: 16 23.248 2.239 0.594 0.901 0.933 0.800 CB 1.286 16 residues pruned to eliminate duplicates Z: 6 10.594 1.993 0.454 0.777 1.000 1.000 CB 1.280 Z: 10 4.325 1.308 0.656 0.411 0.778 0.444 CA 0.940 Z: 26 16.152 1.924 0.270 0.532 0.880 0.720 CB 1.455 26 residues pruned to eliminate duplicates Z: 37 23.028 1.953 0.710 0.487 0.889 0.694 CB 1.311 36 residues pruned to eliminate duplicates Z: 15 50.573 2.326 1.269 0.920 1.000 0.929 CB 1.803 15 residues pruned to eliminate duplicates Z: 18 20.749 2.136 0.878 0.565 0.882 0.647 CB 1.336 18 residues pruned to eliminate duplicates Z: 7 6.430 1.864 0.148 0.854 0.667 0.167 CB 1.359 7 residues pruned to eliminate duplicates Z: 12 7.304 1.878 0.167 0.696 0.818 0.636 CB 1.027 12 residues pruned to eliminate duplicates Z: 36 24.215 1.924 0.650 0.561 0.971 0.657 CB 1.252 36 residues pruned to eliminate duplicates Z: 7 11.455 1.869 0.800 0.643 0.833 0.333 CB 1.460 7 residues pruned to eliminate duplicates Z: 39 59.478 2.292 0.900 0.797 0.974 0.711 CB 1.755 39 residues pruned to eliminate duplicates Z: 46 28.538 1.949 0.797 0.589 0.956 0.622 CB 1.167 46 residues pruned to eliminate duplicates Z: 6 12.360 1.987 0.519 0.853 1.000 1.000 CB 1.354 6 residues pruned to eliminate duplicates Z: 25 25.753 2.180 0.559 0.644 0.958 0.667 CB 1.411 25 residues pruned to eliminate duplicates Z: 27 37.287 2.411 0.796 0.657 0.885 0.692 CB 1.651 27 residues pruned to eliminate duplicates Z: 14 21.624 1.925 0.463 0.932 1.000 0.846 CB 1.487 14 residues pruned to eliminate duplicates Z: 55 45.892 2.225 0.654 0.621 0.963 0.630 CB 1.572 55 residues pruned to eliminate duplicates Z: 17 13.774 2.168 0.383 0.468 0.812 0.688 CB 1.460 17 residues pruned to eliminate duplicates Z: 7 5.730 1.810 0.324 0.495 0.833 0.167 CB 1.177 7 residues pruned to eliminate duplicates Z: 12 8.052 1.642 0.693 0.479 0.818 0.455 CB 1.091 Z: 12 10.399 1.571 0.517 0.734 1.000 0.455 CB 1.066 12 residues pruned to eliminate duplicates Z: 7 10.168 1.666 0.903 0.757 1.000 0.833 CA 1.042 Z: 13 17.302 2.030 0.624 0.675 0.917 0.583 CB 1.406 13 residues pruned to eliminate duplicates Z: 12 9.075 1.706 0.376 0.645 1.000 0.727 CB 1.017 12 residues pruned to eliminate duplicates Z: 35 32.576 1.988 0.970 0.692 1.000 0.618 CB 1.197 35 residues pruned to eliminate duplicates Z: 9 11.260 1.864 0.358 0.895 1.000 0.500 CB 1.128 9 residues pruned to eliminate duplicates Z: 30 41.267 2.417 0.777 0.659 0.931 0.483 CB 1.653 30 residues pruned to eliminate duplicates Z: 6 8.180 1.764 0.780 0.882 1.000 0.800 CB 0.843 6 residues pruned to eliminate duplicates Z: 15 31.351 2.236 0.685 0.856 1.000 0.786 CB 1.641 15 residues pruned to eliminate duplicates Z: 7 11.776 1.945 0.472 0.782 0.833 0.500 CB 1.572 7 residues pruned to eliminate duplicates Z: 14 15.318 1.818 0.398 0.921 1.000 0.769 CB 1.176 14 residues pruned to eliminate duplicates Z: 37 40.279 2.290 0.688 0.678 0.917 0.722 CB 1.609 17 residues pruned to eliminate duplicates Z: 24 19.164 2.219 0.347 0.544 0.870 0.609 CB 1.472 24 residues pruned to eliminate duplicates Z: 24 38.005 2.138 0.933 0.895 0.913 0.565 CB 1.505 24 residues pruned to eliminate duplicates Z: 6 7.223 1.621 0.585 0.681 1.000 0.800 CB 1.064 6 residues pruned to eliminate duplicates Z: 7 10.746 2.041 0.172 0.823 0.833 0.167 CB 1.664 7 residues pruned to eliminate duplicates Z: 9 8.049 1.433 0.542 0.844 1.000 0.500 CB 0.959 9 residues pruned to eliminate duplicates Z: 23 31.953 2.115 0.854 0.887 0.955 0.545 CB 1.313 23 residues pruned to eliminate duplicates Z: 20 45.790 2.340 0.854 0.855 1.000 0.526 CB 1.787 20 residues pruned to eliminate duplicates Z: 6 9.587 1.970 0.651 0.391 1.000 0.800 CB 1.480 6 residues pruned to eliminate duplicates Z: 22 29.448 2.110 0.704 0.722 0.905 0.571 CB 1.616 22 residues pruned to eliminate duplicates Z: 15 17.792 1.946 0.522 0.918 1.000 0.929 CB 1.132 15 residues pruned to eliminate duplicates Z: 17 23.298 1.899 0.880 0.894 1.000 0.688 CB 1.170 17 residues pruned to eliminate duplicates Z: 9 11.373 1.988 0.319 0.725 0.875 0.500 CB 1.431 9 residues pruned to eliminate duplicates Z: 55 31.921 2.039 0.615 0.504 0.889 0.593 CB 1.478 55 residues pruned to eliminate duplicates Z: 105 83.096 2.404 0.780 0.614 0.962 0.683 CB 1.778 105 residues pruned to eliminate duplicates Z: 8 3.998 1.628 -0.057 0.458 0.857 0.571 CB 1.199 8 residues pruned to eliminate duplicates Z: 55 41.186 2.238 0.618 0.612 0.907 0.667 CB 1.534 55 residues pruned to eliminate duplicates Z: 8 3.252 1.412 0.604 0.353 0.857 0.714 CB 0.742 Z: 16 29.494 1.986 1.195 0.929 1.000 0.667 CB 1.223 16 residues pruned to eliminate duplicates Z: 16 31.595 2.230 0.784 0.905 1.000 0.800 CB 1.459 16 residues pruned to eliminate duplicates Z: 26 49.040 2.272 1.128 0.917 0.920 0.400 CB 1.556 26 residues pruned to eliminate duplicates Z: 49 79.874 2.433 0.978 0.824 0.979 0.792 CB 1.847 49 residues pruned to eliminate duplicates Z: 24 56.462 2.425 1.155 0.946 0.957 0.652 CB 1.629 25 residues pruned to eliminate duplicates Z: 27 31.029 2.077 0.562 0.854 0.962 0.846 CB 1.440 27 residues pruned to eliminate duplicates Z: 19 24.344 2.257 0.678 0.535 0.944 0.667 CA 1.549 19 residues pruned to eliminate duplicates Z: 34 16.050 1.875 0.444 0.538 0.788 0.485 CB 1.263 34 residues pruned to eliminate duplicates Z: 25 32.333 2.248 0.761 0.697 0.917 0.667 CB 1.519 25 residues pruned to eliminate duplicates Z: 8 8.231 1.611 0.825 0.598 0.857 0.429 CB 1.125 8 residues pruned to eliminate duplicates Z: 13 23.847 2.177 0.352 0.802 1.000 0.833 CB 1.796 13 residues pruned to eliminate duplicates Z: 13 16.527 1.885 0.538 0.928 1.000 0.833 CB 1.152 13 residues pruned to eliminate duplicates Z: 8 10.626 1.811 0.327 0.900 1.000 0.429 CB 1.194 9 residues pruned to eliminate duplicates Z: 27 39.759 2.528 0.538 0.636 1.000 0.692 CB 1.765 27 residues pruned to eliminate duplicates Z: 32 33.921 2.223 0.770 0.614 0.871 0.677 CB 1.596 32 residues pruned to eliminate duplicates Z: 16 26.372 2.035 0.768 0.877 0.933 0.400 CB 1.473 16 residues pruned to eliminate duplicates Z: 6 2.968 1.693 -0.390 0.633 1.000 0.800 CB 1.135 6 residues pruned to eliminate duplicates Z: 6 2.013 1.516 0.437 0.495 0.800 0.600 CB 0.519 Z: 37 36.531 2.429 0.685 0.489 0.861 0.500 CB 1.746 37 residues pruned to eliminate duplicates Z: 13 19.165 1.829 0.895 0.935 1.000 0.417 CB 1.112 13 residues pruned to eliminate duplicates Z: 44 55.916 2.378 0.924 0.611 0.953 0.674 CB 1.759 80 residues pruned to eliminate duplicates Z: 17 35.823 2.252 0.833 0.887 0.938 0.688 CB 1.669 17 residues pruned to eliminate duplicates Z: 88 87.343 2.441 0.922 0.726 0.943 0.747 CB 1.727 40 residues pruned to eliminate duplicates Z: 31 59.646 2.329 0.959 0.905 0.967 0.567 CB 1.757 31 residues pruned to eliminate duplicates Z: 67 51.020 2.284 0.693 0.637 0.894 0.682 CB 1.597 67 residues pruned to eliminate duplicates Z: 10 14.889 2.032 0.767 0.463 1.000 0.556 CA 1.435 10 residues pruned to eliminate duplicates Z: 16 24.123 1.983 0.758 0.925 1.000 0.933 CB 1.253 16 residues pruned to eliminate duplicates Z: 7 5.015 1.577 0.132 0.699 1.000 0.667 N 0.956 Z: 9 3.236 1.633 0.152 0.297 0.625 0.500 CB 1.221 Z: 26 21.068 2.252 0.523 0.426 0.840 0.600 CB 1.580 26 residues pruned to eliminate duplicates Z: 14 15.109 1.884 0.278 0.927 1.000 1.000 CB 1.220 14 residues pruned to eliminate duplicates Z: 13 10.654 1.930 0.619 0.618 0.833 0.667 CB 1.057 13 residues pruned to eliminate duplicates Z: 6 4.624 1.673 0.228 0.624 0.800 0.200 C 1.119 3 residues pruned to eliminate duplicates Z: 8 3.247 1.519 0.207 0.506 0.857 0.571 CB 0.776 8 residues pruned to eliminate duplicates Z: 95 87.616 2.379 1.062 0.684 0.936 0.649 CB 1.661 95 residues pruned to eliminate duplicates Z: 7 6.617 1.511 0.537 0.738 1.000 0.667 CA 0.940 7 residues pruned to eliminate duplicates Z: 19 36.136 2.171 0.841 0.780 0.944 0.667 CB 1.763 19 residues pruned to eliminate duplicates Z: 36 25.505 1.996 0.692 0.567 0.914 0.400 CB 1.309 36 residues pruned to eliminate duplicates Z: 35 24.993 1.992 0.489 0.586 0.941 0.676 CB 1.414 35 residues pruned to eliminate duplicates Z: 71 73.970 2.476 0.859 0.655 0.929 0.643 CB 1.791 71 residues pruned to eliminate duplicates Z: 6 6.250 1.605 0.572 0.702 0.800 0.600 CB 1.151 6 residues pruned to eliminate duplicates Z: 17 37.569 2.267 0.893 0.912 1.000 0.875 CB 1.550 17 residues pruned to eliminate duplicates 6 1.508 1.431 0.277 0.413 0.800 0.400 CB 0.505 ? Z: 35 30.234 1.971 0.790 0.669 0.971 0.706 CB 1.295 35 residues pruned to eliminate duplicates Z: 27 41.027 2.411 0.863 0.721 0.962 0.731 CB 1.526 27 residues pruned to eliminate duplicates Z: 23 19.478 1.968 0.659 0.565 0.909 0.682 CB 1.313 23 residues pruned to eliminate duplicates Z: 22 11.969 2.077 0.247 0.432 0.810 0.476 CB 1.336 22 residues pruned to eliminate duplicates Z: 83 84.375 2.475 0.853 0.703 0.951 0.707 CB 1.776 83 residues pruned to eliminate duplicates Z: 8 16.069 2.161 0.928 0.548 0.857 0.857 CA 1.623 8 residues pruned to eliminate duplicates Z: 29 31.390 2.302 0.766 0.551 0.821 0.536 CB 1.690 29 residues pruned to eliminate duplicates Z: 80 82.847 2.455 0.915 0.697 0.937 0.684 CB 1.769 80 residues pruned to eliminate duplicates Z: 14 19.271 1.851 0.787 0.918 1.000 0.615 CB 1.139 14 residues pruned to eliminate duplicates Z: 66 79.600 2.369 0.865 0.792 0.954 0.708 CB 1.813 66 residues pruned to eliminate duplicates Z: 72 46.178 2.210 0.694 0.616 0.915 0.732 CB 1.433 72 residues pruned to eliminate duplicates Z: 9 10.972 1.719 0.286 0.862 1.000 0.875 CB 1.288 9 residues pruned to eliminate duplicates Z: 15 16.458 1.972 0.632 0.867 0.857 0.857 CB 1.167 15 residues pruned to eliminate duplicates Z: 26 20.570 2.061 0.392 0.543 0.920 0.600 CB 1.494 26 residues pruned to eliminate duplicates Z: 31 67.066 2.390 1.108 0.923 0.967 0.733 CB 1.767 31 residues pruned to eliminate duplicates Z: 34 26.682 1.986 0.944 0.633 0.939 0.727 CB 1.131 34 residues pruned to eliminate duplicates Z: 22 40.549 2.356 0.726 0.885 0.905 0.762 CA 1.736 22 residues pruned to eliminate duplicates Z: 22 60.486 2.410 1.074 0.910 1.000 0.476 CA 1.873 22 residues pruned to eliminate duplicates Z: 23 51.212 2.235 1.288 0.917 1.000 0.955 CB 1.507 7 1.480 1.212 0.398 0.295 0.667 0.500 CA 0.673 ? Z: 66 62.544 2.407 0.770 0.629 0.938 0.585 CB 1.718 66 residues pruned to eliminate duplicates Z: 9 15.746 2.025 0.707 0.820 0.750 0.375 CA 1.628 9 residues pruned to eliminate duplicates Z: 13 13.217 1.752 0.864 0.469 0.917 0.500 CB 1.315 Z: 15 27.166 2.310 0.813 0.901 0.929 0.929 CB 1.332 15 residues pruned to eliminate duplicates Z: 6 12.042 2.021 0.764 0.865 0.800 0.600 CB 1.383 6 residues pruned to eliminate duplicates Z: 20 18.068 2.011 0.512 0.538 0.895 0.632 CB 1.468 20 residues pruned to eliminate duplicates Z: 26 14.174 1.793 0.475 0.512 0.920 0.600 CB 1.152 26 residues pruned to eliminate duplicates Z: 19 27.362 2.354 0.716 0.609 0.889 0.667 CA 1.619 19 residues pruned to eliminate duplicates Z: 6 3.764 1.781 0.096 0.360 1.000 0.600 CB 1.003 4 residues pruned to eliminate duplicates Z: 75 41.015 2.194 0.533 0.574 0.919 0.568 CB 1.437 75 residues pruned to eliminate duplicates Z: 6 9.647 2.083 0.629 0.625 0.800 0.600 CB 1.413 6 residues pruned to eliminate duplicates Z: 23 51.576 2.378 1.284 0.890 0.909 0.545 CB 1.603 21 residues pruned to eliminate duplicates Z: 9 4.312 1.545 0.300 0.358 0.750 0.625 CA 1.180 9 residues pruned to eliminate duplicates Z: 16 28.534 1.989 1.171 0.922 1.000 0.667 CB 1.200 16 residues pruned to eliminate duplicates Z: 34 36.186 2.242 0.703 0.724 0.909 0.788 CB 1.484 34 residues pruned to eliminate duplicates Z: 11 29.653 2.144 0.925 0.722 1.000 0.700 CA 1.860 11 residues pruned to eliminate duplicates Z: 38 45.463 2.414 0.611 0.612 1.000 0.568 CB 1.728 38 residues pruned to eliminate duplicates Z: 22 49.441 2.362 0.738 0.939 1.000 0.857 CB 1.826 22 residues pruned to eliminate duplicates Z: 19 17.379 2.112 0.375 0.589 0.833 0.667 CB 1.554 19 residues pruned to eliminate duplicates Z: 6 8.626 2.156 0.396 0.655 0.800 0.800 CA 1.387 6 residues pruned to eliminate duplicates Z: 19 39.778 2.237 0.743 0.847 1.000 0.833 CA 1.785 19 residues pruned to eliminate duplicates Z: 20 29.905 2.092 1.072 0.586 0.895 0.526 CB 1.630 19 residues pruned to eliminate duplicates Z: 6 3.829 1.630 0.621 0.634 0.800 0.800 CB 0.714 6 residues pruned to eliminate duplicates Z: 6 2.798 1.521 0.444 0.389 0.600 0.400 CA 1.068 Z: 25 27.607 2.095 0.885 0.614 0.917 0.542 CB 1.398 28 residues pruned to eliminate duplicates Z: 30 18.990 1.831 0.586 0.573 1.000 0.621 CB 1.132 30 residues pruned to eliminate duplicates Z: 13 16.024 2.127 0.468 0.871 1.000 0.667 CB 1.080 13 residues pruned to eliminate duplicates Z: 61 30.902 2.174 0.604 0.468 0.917 0.633 CB 1.289 61 residues pruned to eliminate duplicates Z: 13 23.778 2.380 0.687 0.390 1.000 0.583 CB 1.921 13 residues pruned to eliminate duplicates Z: 14 9.283 1.848 0.740 0.359 0.692 0.538 CB 1.345 14 residues pruned to eliminate duplicates Z: 14 30.934 2.066 1.223 0.901 0.923 0.538 CB 1.444 14 residues pruned to eliminate duplicates Z: 30 18.474 2.199 0.503 0.446 0.828 0.552 CB 1.326 30 residues pruned to eliminate duplicates Z: 7 8.742 1.741 0.190 0.720 1.000 0.833 O 1.412 7 residues pruned to eliminate duplicates Z: 6 2.285 2.037 0.185 0.296 0.800 0.600 CB 0.665 6 residues pruned to eliminate duplicates Z: 90 91.484 2.445 0.903 0.723 0.966 0.674 CB 1.764 90 residues pruned to eliminate duplicates Z: 10 3.977 1.474 0.297 0.382 0.889 0.444 CB 0.885 10 residues pruned to eliminate duplicates Z: 7 6.366 1.693 0.191 0.728 1.000 0.833 CB 1.050 Z: 15 16.461 1.957 0.752 0.476 0.929 0.571 CB 1.415 15 residues pruned to eliminate duplicates Z: 9 21.461 2.333 0.619 0.764 1.000 0.625 CA 1.590 9 residues pruned to eliminate duplicates Z: 38 47.572 2.293 0.937 0.604 0.973 0.541 CB 1.640 38 residues pruned to eliminate duplicates Z: 11 23.328 2.421 0.827 0.786 0.900 0.500 CB 1.441 11 residues pruned to eliminate duplicates Z: 15 12.365 2.047 0.590 0.370 0.857 0.500 CB 1.362 14 residues pruned to eliminate duplicates Z: 19 20.259 2.081 0.495 0.599 0.944 0.722 CB 1.478 19 residues pruned to eliminate duplicates Z: 19 46.998 2.347 1.135 0.913 1.000 0.833 CB 1.564 19 residues pruned to eliminate duplicates Z: 7 7.749 1.822 0.228 0.843 0.833 0.667 CB 1.263 7 residues pruned to eliminate duplicates Z: 23 48.711 2.426 0.815 0.809 1.000 0.773 CA 1.801 23 residues pruned to eliminate duplicates Z: 12 26.089 2.253 1.051 0.875 0.818 0.455 CB 1.514 13 residues pruned to eliminate duplicates Z: 6 6.862 1.705 0.838 0.873 1.000 0.600 CB 0.713 6 residues pruned to eliminate duplicates Z: 14 21.382 1.997 0.827 0.920 0.923 0.692 CB 1.240 14 residues pruned to eliminate duplicates Z: 25 26.841 2.153 0.530 0.619 0.958 0.667 CB 1.551 25 residues pruned to eliminate duplicates Z: 10 11.017 1.784 0.235 0.869 0.889 0.889 CA 1.370 10 residues pruned to eliminate duplicates Z: 8 16.272 2.370 0.387 0.573 1.000 0.429 CA 1.743 8 residues pruned to eliminate duplicates Z: 6 2.305 1.179 0.741 0.327 0.800 0.600 CB 0.759 Using tripeptides from previous cycle as seeds Z: 12 23.628 2.211 0.630 0.878 0.909 0.818 CB 1.578 12 residues pruned to eliminate duplicates Z: 19 18.001 2.097 0.390 0.580 0.889 0.722 CB 1.516 19 residues pruned to eliminate duplicates Z: 19 18.199 2.073 0.483 0.548 0.889 0.500 CB 1.498 19 residues pruned to eliminate duplicates Z: 33 17.254 1.983 0.478 0.424 0.875 0.531 CB 1.288 33 residues pruned to eliminate duplicates Z: 18 22.519 2.149 0.636 0.629 0.941 0.706 CB 1.461 18 residues pruned to eliminate duplicates Z: 20 21.138 2.043 0.617 0.545 0.895 0.526 CB 1.570 20 residues pruned to eliminate duplicates Z: 19 19.894 2.091 0.665 0.558 0.889 0.500 CB 1.432 19 residues pruned to eliminate duplicates Z: 17 23.227 2.148 0.611 0.650 1.000 0.812 CB 1.459 17 residues pruned to eliminate duplicates Z: 14 20.126 2.223 0.516 0.680 0.846 0.692 CB 1.658 14 residues pruned to eliminate duplicates Z: 20 17.593 2.052 0.521 0.561 0.842 0.632 CB 1.447 20 residues pruned to eliminate duplicates Z: 146 81.473 2.339 0.693 0.638 0.931 0.697 CB 1.613 146 residues pruned to eliminate duplicates Z: 28 16.418 1.906 0.277 0.579 0.963 0.630 CB 1.249 28 residues pruned to eliminate duplicates Z: 20 6.446 1.779 0.134 0.215 0.842 0.421 CB 1.217 20 residues pruned to eliminate duplicates Z: 27 19.015 2.052 0.358 0.533 0.962 0.615 CB 1.347 27 residues pruned to eliminate duplicates Z: 12 9.627 1.805 0.349 0.509 0.909 0.636 CB 1.301 12 residues pruned to eliminate duplicates Z: 9 8.705 1.989 0.054 0.622 1.000 0.875 CB 1.309 9 residues pruned to eliminate duplicates Z: 11 8.930 1.769 0.407 0.569 0.900 0.500 CB 1.180 11 residues pruned to eliminate duplicates Z: 26 17.042 1.918 0.485 0.653 0.880 0.600 CB 1.180 26 residues pruned to eliminate duplicates Z: 43 29.231 2.017 0.547 0.647 0.929 0.619 CB 1.357 43 residues pruned to eliminate duplicates Z: 26 25.015 1.961 0.734 0.703 0.960 0.720 CB 1.274 26 residues pruned to eliminate duplicates Z: 25 20.688 1.969 0.484 0.705 0.958 0.792 CB 1.252 25 residues pruned to eliminate duplicates Z: 42 27.747 2.030 0.478 0.654 0.927 0.756 CB 1.350 42 residues pruned to eliminate duplicates Z: 39 21.368 1.960 0.525 0.544 0.868 0.684 CB 1.279 39 residues pruned to eliminate duplicates Z: 20 12.498 1.655 0.638 0.644 0.842 0.579 CB 1.098 20 residues pruned to eliminate duplicates Z: 28 15.486 1.884 0.301 0.633 0.889 0.815 CB 1.208 28 residues pruned to eliminate duplicates Z: 16 13.357 1.756 0.224 0.761 1.000 0.733 CB 1.272 16 residues pruned to eliminate duplicates Z: 17 14.835 1.814 0.457 0.800 0.938 0.812 CB 1.152 17 residues pruned to eliminate duplicates Z: 16 19.395 1.878 0.592 0.851 1.000 0.933 CB 1.239 16 residues pruned to eliminate duplicates Z: 17 17.251 1.842 0.769 0.808 0.938 0.875 CB 1.079 17 residues pruned to eliminate duplicates Z: 18 17.993 1.806 0.764 0.758 0.882 0.765 CB 1.234 18 residues pruned to eliminate duplicates Z: 23 22.564 1.866 0.759 0.696 0.955 0.818 CB 1.283 23 residues pruned to eliminate duplicates Z: 14 21.399 1.879 0.968 0.942 1.000 0.769 CB 1.113 14 residues pruned to eliminate duplicates Z: 29 24.367 1.919 0.777 0.711 0.929 0.536 CB 1.200 29 residues pruned to eliminate duplicates Z: 19 17.560 1.737 0.791 0.776 0.944 0.611 CB 1.105 19 residues pruned to eliminate duplicates Z: 19 15.719 1.686 1.167 0.766 0.833 0.444 CB 0.961 19 residues pruned to eliminate duplicates Z: 17 22.122 1.818 0.883 0.849 1.000 0.812 CB 1.198 17 residues pruned to eliminate duplicates Z: 20 23.177 2.165 0.652 0.632 0.895 0.684 CB 1.467 20 residues pruned to eliminate duplicates Z: 43 35.055 2.093 0.641 0.657 0.952 0.643 CB 1.430 43 residues pruned to eliminate duplicates Z: 19 20.981 2.189 0.461 0.559 0.944 0.667 CB 1.546 19 residues pruned to eliminate duplicates Z: 42 34.780 2.145 0.556 0.661 0.927 0.732 CB 1.512 42 residues pruned to eliminate duplicates Z: 18 26.882 2.314 0.696 0.623 0.882 0.588 CB 1.677 18 residues pruned to eliminate duplicates Z: 14 25.176 2.032 0.873 0.897 0.923 0.615 CA 1.423 14 residues pruned to eliminate duplicates Z: 19 28.683 2.248 0.766 0.672 0.889 0.667 CB 1.635 19 residues pruned to eliminate duplicates Z: 11 34.277 2.273 1.041 0.886 1.000 0.800 CB 1.685 11 residues pruned to eliminate duplicates Z: 43 34.943 2.135 0.585 0.667 0.929 0.690 CB 1.470 43 residues pruned to eliminate duplicates Z: 19 30.954 2.279 0.711 0.682 0.944 0.667 CB 1.676 19 residues pruned to eliminate duplicates Z: 58 39.082 2.083 0.661 0.582 0.947 0.632 CB 1.459 61 residues pruned to eliminate duplicates Z: 13 31.742 2.144 0.862 0.883 1.000 0.583 CB 1.659 13 residues pruned to eliminate duplicates Z: 57 36.252 2.058 0.549 0.592 0.964 0.607 CB 1.443 57 residues pruned to eliminate duplicates Z: 18 24.465 2.237 0.744 0.630 0.882 0.706 CB 1.526 18 residues pruned to eliminate duplicates Z: 18 31.384 2.333 0.644 0.675 1.000 0.706 CB 1.690 18 residues pruned to eliminate duplicates Z: 18 28.935 2.310 0.538 0.639 1.000 0.706 CB 1.735 18 residues pruned to eliminate duplicates Z: 41 34.592 2.143 0.512 0.666 0.975 0.650 CB 1.485 41 residues pruned to eliminate duplicates Z: 28 23.345 2.102 0.512 0.600 0.926 0.481 CB 1.388 28 residues pruned to eliminate duplicates Z: 41 36.805 2.125 0.668 0.690 0.950 0.675 CB 1.453 41 residues pruned to eliminate duplicates Z: 57 42.745 2.108 0.682 0.611 0.964 0.643 CB 1.503 58 residues pruned to eliminate duplicates Z: 6 8.838 1.913 0.415 0.450 1.000 0.800 CB 1.537 6 residues pruned to eliminate duplicates Z: 38 27.202 2.038 0.581 0.573 0.892 0.595 CB 1.450 38 residues pruned to eliminate duplicates Z: 7 8.203 2.143 0.201 0.621 0.833 0.833 CB 1.392 7 residues pruned to eliminate duplicates Z: 39 25.262 2.049 0.404 0.599 0.921 0.711 CB 1.407 39 residues pruned to eliminate duplicates Z: 25 26.807 2.078 0.580 0.738 0.958 0.833 CB 1.404 25 residues pruned to eliminate duplicates Z: 40 30.725 2.048 0.578 0.560 0.974 0.615 CB 1.474 40 residues pruned to eliminate duplicates Z: 35 23.508 1.990 0.546 0.533 0.882 0.618 CB 1.438 35 residues pruned to eliminate duplicates Z: 39 28.297 2.053 0.494 0.575 0.947 0.632 CB 1.470 39 residues pruned to eliminate duplicates Z: 40 27.717 2.014 0.544 0.563 0.897 0.615 CB 1.496 40 residues pruned to eliminate duplicates Z: 26 23.892 1.945 0.455 0.714 0.960 0.720 CB 1.450 26 residues pruned to eliminate duplicates Z: 33 26.869 1.983 0.665 0.549 0.906 0.562 CB 1.513 33 residues pruned to eliminate duplicates Z: 41 28.426 2.017 0.624 0.537 0.900 0.625 CB 1.470 41 residues pruned to eliminate duplicates Z: 39 26.663 2.055 0.516 0.590 0.921 0.658 CB 1.383 39 residues pruned to eliminate duplicates Z: 31 28.205 2.050 0.696 0.570 0.867 0.500 CB 1.598 31 residues pruned to eliminate duplicates Z: 25 24.420 1.894 0.579 0.685 0.958 0.667 CB 1.467 25 residues pruned to eliminate duplicates Z: 33 23.186 1.969 0.639 0.565 0.844 0.531 CB 1.414 33 residues pruned to eliminate duplicates Z: 38 27.093 2.059 0.616 0.565 0.865 0.703 CB 1.453 38 residues pruned to eliminate duplicates Z: 24 25.084 1.924 0.665 0.696 0.957 0.652 CB 1.426 24 residues pruned to eliminate duplicates Z: 38 33.056 2.064 0.746 0.581 0.946 0.541 CB 1.474 38 residues pruned to eliminate duplicates Z: 30 33.454 2.057 0.820 0.604 0.966 0.586 CB 1.556 31 residues pruned to eliminate duplicates Z: 21 24.720 1.869 0.659 0.765 0.950 0.550 CB 1.484 21 residues pruned to eliminate duplicates Z: 42 28.280 1.997 0.673 0.549 0.878 0.463 CB 1.435 42 residues pruned to eliminate duplicates Z: 36 22.618 1.990 0.692 0.512 0.829 0.514 CB 1.353 36 residues pruned to eliminate duplicates Z: 30 29.357 2.012 0.736 0.601 0.966 0.586 CB 1.468 30 residues pruned to eliminate duplicates Z: 32 26.764 1.987 0.796 0.550 0.903 0.548 CB 1.420 32 residues pruned to eliminate duplicates Z: 70 46.719 2.181 0.736 0.564 0.870 0.652 CB 1.605 126 residues pruned to eliminate duplicates Z: 33 27.770 1.943 0.807 0.570 0.875 0.469 CB 1.493 Z: 7 2.892 1.723 0.708 0.239 0.667 0.167 CB 0.815 7 residues pruned to eliminate duplicates Z: 30 24.973 2.041 0.645 0.609 0.828 0.724 CB 1.505 32 residues pruned to eliminate duplicates Z: 6 5.238 1.807 0.773 0.297 0.800 0.800 CA 1.147 6 residues pruned to eliminate duplicates Z: 12 22.302 2.248 0.795 0.688 1.000 0.818 CB 1.403 12 residues pruned to eliminate duplicates Z: 34 35.702 2.259 0.823 0.593 0.909 0.636 CB 1.518 58 residues pruned to eliminate duplicates Z: 30 31.340 2.295 0.736 0.595 0.897 0.655 CB 1.488 30 residues pruned to eliminate duplicates Z: 80 41.262 2.048 0.845 0.555 0.911 0.570 CB 1.277 80 residues pruned to eliminate duplicates Z: 15 29.957 2.194 0.863 0.895 0.929 0.857 CB 1.511 Z: 14 37.936 2.390 0.966 0.889 1.000 0.769 CB 1.613 15 residues pruned to eliminate duplicates Z: 13 32.143 2.299 0.819 0.878 0.917 0.667 CB 1.757 13 residues pruned to eliminate duplicates Z: 21 33.574 2.376 0.843 0.689 0.900 0.700 CB 1.602 35 residues pruned to eliminate duplicates Z: 17 32.309 2.350 0.770 0.769 1.000 0.625 CB 1.530 Z: 14 30.399 2.191 0.737 0.867 1.000 0.846 CB 1.622 14 residues pruned to eliminate duplicates Z: 23 33.921 2.309 0.727 0.661 1.000 0.727 CB 1.562 16 residues pruned to eliminate duplicates Z: 14 33.507 2.325 0.785 0.913 1.000 0.923 CB 1.585 14 residues pruned to eliminate duplicates Z: 17 30.324 2.249 0.689 0.774 0.938 0.500 CA 1.671 17 residues pruned to eliminate duplicates Z: 25 32.190 2.284 0.747 0.641 0.958 0.708 CB 1.505 24 residues pruned to eliminate duplicates Z: 14 27.557 2.211 0.902 0.831 0.846 0.769 CB 1.613 14 residues pruned to eliminate duplicates Z: 25 31.088 2.253 0.589 0.650 0.958 0.542 CB 1.609 25 residues pruned to eliminate duplicates Z: 24 28.550 2.287 0.680 0.629 0.870 0.609 CB 1.577 24 residues pruned to eliminate duplicates Z: 34 28.271 2.154 0.641 0.588 0.909 0.424 CB 1.408 59 residues pruned to eliminate duplicates Z: 32 34.975 2.275 0.679 0.627 0.935 0.581 CB 1.560 32 residues pruned to eliminate duplicates Z: 26 29.308 2.192 0.678 0.620 0.920 0.520 CB 1.548 Z: 6 4.538 1.739 0.380 0.282 1.000 0.600 CA 1.082 6 residues pruned to eliminate duplicates Z: 31 28.543 2.082 0.682 0.610 0.933 0.533 CB 1.436 26 residues pruned to eliminate duplicates Z: 6 3.229 1.445 0.915 0.406 1.000 0.600 CB 0.576 6 residues pruned to eliminate duplicates Z: 19 14.955 1.796 0.392 0.705 1.000 0.722 CB 1.170 19 residues pruned to eliminate duplicates Z: 18 14.370 1.833 0.361 0.730 1.000 0.588 CB 1.136 18 residues pruned to eliminate duplicates Z: 19 13.729 1.812 0.273 0.704 1.000 0.722 CB 1.165 19 residues pruned to eliminate duplicates Z: 16 13.827 1.860 0.292 0.694 0.933 0.733 CB 1.333 16 residues pruned to eliminate duplicates Z: 16 14.428 1.845 0.377 0.715 0.933 0.733 CB 1.292 16 residues pruned to eliminate duplicates Z: 18 13.558 1.836 0.263 0.689 1.000 0.647 CB 1.193 18 residues pruned to eliminate duplicates Z: 16 16.345 1.854 0.480 0.703 1.000 0.533 CB 1.278 16 residues pruned to eliminate duplicates Z: 19 13.431 1.793 0.328 0.661 0.944 0.611 CB 1.212 19 residues pruned to eliminate duplicates Z: 16 14.376 1.924 0.292 0.761 1.000 0.533 CB 1.184 16 residues pruned to eliminate duplicates Z: 19 12.329 1.793 0.435 0.685 0.833 0.500 CB 1.143 19 residues pruned to eliminate duplicates Z: 15 16.802 1.969 0.510 0.733 0.929 0.500 CB 1.319 15 residues pruned to eliminate duplicates Z: 18 13.354 1.837 0.340 0.681 0.941 0.588 CB 1.183 18 residues pruned to eliminate duplicates Z: 16 15.001 1.839 0.394 0.690 1.000 0.667 CB 1.269 16 residues pruned to eliminate duplicates Z: 37 21.442 1.957 0.432 0.559 0.944 0.639 CB 1.275 37 residues pruned to eliminate duplicates Z: 20 12.130 1.793 0.251 0.638 0.895 0.632 CB 1.218 20 residues pruned to eliminate duplicates Z: 74 48.925 2.221 0.703 0.579 0.945 0.548 CB 1.484 74 residues pruned to eliminate duplicates Z: 22 11.581 1.737 0.284 0.630 0.905 0.476 CB 1.108 22 residues pruned to eliminate duplicates Z: 36 22.789 1.957 0.491 0.582 0.943 0.629 CB 1.293 36 residues pruned to eliminate duplicates Z: 37 19.816 1.983 0.402 0.541 0.889 0.611 CB 1.284 37 residues pruned to eliminate duplicates Z: 37 22.272 1.955 0.436 0.554 0.944 0.667 CB 1.328 37 residues pruned to eliminate duplicates Z: 38 23.169 1.964 0.421 0.606 0.973 0.595 CB 1.268 38 residues pruned to eliminate duplicates Z: 31 17.645 1.872 0.321 0.641 0.967 0.667 CB 1.180 31 residues pruned to eliminate duplicates Z: 44 40.253 2.282 0.784 0.555 0.953 0.651 CB 1.499 44 residues pruned to eliminate duplicates Z: 36 22.491 1.973 0.399 0.573 0.943 0.600 CB 1.362 36 residues pruned to eliminate duplicates Z: 17 16.362 2.158 0.522 0.478 0.875 0.562 CB 1.455 17 residues pruned to eliminate duplicates Z: 36 19.988 1.914 0.396 0.588 0.943 0.657 CB 1.232 37 residues pruned to eliminate duplicates Z: 13 11.875 1.868 0.165 0.728 1.000 0.833 CB 1.283 13 residues pruned to eliminate duplicates Z: 32 18.566 1.858 0.382 0.652 0.935 0.645 CB 1.205 32 residues pruned to eliminate duplicates Z: 36 23.306 1.961 0.504 0.587 0.943 0.686 CB 1.304 36 residues pruned to eliminate duplicates Z: 13 12.515 1.962 0.342 0.566 1.000 0.417 CB 1.288 13 residues pruned to eliminate duplicates Z: 104 59.864 2.252 0.705 0.591 0.932 0.621 CB 1.510 104 residues pruned to eliminate duplicates Z: 18 16.291 2.133 0.502 0.456 0.882 0.588 CB 1.463 18 residues pruned to eliminate duplicates Z: 38 19.290 1.924 0.376 0.560 0.892 0.541 CB 1.268 38 residues pruned to eliminate duplicates Z: 37 23.804 1.959 0.468 0.563 1.000 0.583 CB 1.298 36 residues pruned to eliminate duplicates Z: 6 4.435 1.858 0.141 0.687 1.000 0.200 CB 0.788 6 residues pruned to eliminate duplicates Z: 37 18.410 1.833 0.490 0.561 0.889 0.667 CB 1.191 38 residues pruned to eliminate duplicates Z: 8 17.962 2.281 0.835 0.573 1.000 0.714 CA 1.512 8 residues pruned to eliminate duplicates Z: 66 63.591 2.433 0.821 0.609 0.908 0.646 CB 1.768 66 residues pruned to eliminate duplicates Z: 31 41.662 2.420 0.878 0.623 0.967 0.667 CB 1.542 31 residues pruned to eliminate duplicates Z: 43 50.318 2.487 0.868 0.589 0.952 0.619 CB 1.612 43 residues pruned to eliminate duplicates Z: 43 48.941 2.443 0.950 0.570 0.929 0.619 CB 1.596 43 residues pruned to eliminate duplicates Z: 37 55.749 2.503 0.922 0.627 1.000 0.639 CB 1.714 37 residues pruned to eliminate duplicates Z: 64 59.721 2.381 0.816 0.596 0.921 0.587 CB 1.725 64 residues pruned to eliminate duplicates Z: 145 68.501 2.237 0.641 0.603 0.938 0.660 CB 1.504 155 residues pruned to eliminate duplicates Z: 22 43.026 2.306 0.743 0.865 0.952 0.714 CA 1.797 22 residues pruned to eliminate duplicates Z: 43 48.426 2.458 0.855 0.575 0.905 0.643 CB 1.685 43 residues pruned to eliminate duplicates Z: 66 63.164 2.413 0.737 0.623 0.954 0.738 CB 1.745 66 residues pruned to eliminate duplicates Z: 73 49.590 2.237 0.684 0.581 0.944 0.611 CB 1.519 72 residues pruned to eliminate duplicates Z: 21 41.443 2.311 0.708 0.841 0.950 0.750 CA 1.843 21 residues pruned to eliminate duplicates Z: 50 53.703 2.427 0.779 0.590 0.980 0.653 CB 1.664 50 residues pruned to eliminate duplicates Z: 44 46.387 2.433 0.763 0.582 0.930 0.674 CB 1.638 44 residues pruned to eliminate duplicates Z: 103 48.693 2.210 0.596 0.547 0.882 0.627 CB 1.479 103 residues pruned to eliminate duplicates Z: 24 42.514 2.302 0.596 0.844 1.000 0.696 CA 1.796 24 residues pruned to eliminate duplicates Z: 74 49.384 2.237 0.575 0.611 0.986 0.671 CB 1.496 74 residues pruned to eliminate duplicates Z: 14 41.268 2.377 0.924 0.886 1.000 0.769 CA 1.806 14 residues pruned to eliminate duplicates Z: 35 59.403 2.560 0.810 0.650 1.000 0.618 CB 1.913 35 residues pruned to eliminate duplicates Z: 73 50.991 2.238 0.672 0.612 0.958 0.681 CB 1.507 73 residues pruned to eliminate duplicates Z: 13 36.683 2.577 1.043 0.512 1.000 0.417 CB 1.988 13 residues pruned to eliminate duplicates Z: 13 35.652 2.554 0.905 0.560 1.000 0.500 CB 1.994 13 residues pruned to eliminate duplicates Z: 55 43.480 2.374 0.616 0.560 0.926 0.593 CB 1.571 55 residues pruned to eliminate duplicates Z: 13 32.904 2.549 0.751 0.575 1.000 0.500 CA 1.979 13 residues pruned to eliminate duplicates Z: 75 47.151 2.211 0.611 0.591 0.946 0.635 CB 1.491 75 residues pruned to eliminate duplicates Z: 6 16.388 2.348 0.833 0.451 1.000 0.600 CA 1.790 Z: 6 15.553 2.488 0.913 0.360 1.000 0.800 CA 1.699 Z: 6 7.558 1.816 0.997 0.338 1.000 0.400 CA 1.112 Z: 7 11.997 1.931 0.969 0.437 1.000 0.500 CA 1.375 7 residues pruned to eliminate duplicates Z: 14 23.098 2.515 0.854 0.448 0.846 0.308 CB 1.713 14 residues pruned to eliminate duplicates Z: 44 45.712 2.343 0.776 0.584 0.907 0.558 CB 1.704 44 residues pruned to eliminate duplicates Z: 32 33.348 2.264 0.635 0.608 0.903 0.742 CB 1.617 32 residues pruned to eliminate duplicates Z: 33 28.403 2.205 0.495 0.568 0.938 0.625 CB 1.521 33 residues pruned to eliminate duplicates Z: 33 30.774 2.191 0.722 0.563 0.844 0.688 CB 1.608 33 residues pruned to eliminate duplicates Z: 32 35.275 2.260 0.723 0.592 0.935 0.645 CB 1.593 32 residues pruned to eliminate duplicates Z: 67 60.115 2.358 0.765 0.607 0.955 0.515 CB 1.683 67 residues pruned to eliminate duplicates Z: 68 52.026 2.348 0.718 0.564 0.896 0.567 CB 1.655 68 residues pruned to eliminate duplicates Z: 32 32.430 2.241 0.656 0.571 0.903 0.548 CB 1.622 32 residues pruned to eliminate duplicates Z: 33 31.438 2.199 0.676 0.516 0.938 0.469 CB 1.583 33 residues pruned to eliminate duplicates Z: 32 33.924 2.272 0.827 0.562 0.871 0.516 CB 1.587 32 residues pruned to eliminate duplicates Z: 30 40.541 2.347 0.784 0.663 0.897 0.586 CB 1.725 30 residues pruned to eliminate duplicates Z: 31 32.454 2.281 0.721 0.591 0.867 0.600 CB 1.595 31 residues pruned to eliminate duplicates Z: 49 38.109 2.220 0.623 0.562 0.917 0.562 CB 1.569 49 residues pruned to eliminate duplicates Z: 55 48.207 2.341 0.673 0.619 0.907 0.630 CB 1.648 55 residues pruned to eliminate duplicates Z: 34 30.858 2.192 0.692 0.540 0.909 0.606 CB 1.531 34 residues pruned to eliminate duplicates Z: 35 29.961 2.142 0.739 0.520 0.882 0.676 CB 1.533 35 residues pruned to eliminate duplicates Z: 31 35.997 2.302 0.785 0.582 0.867 0.633 CB 1.705 31 residues pruned to eliminate duplicates Z: 32 30.891 2.276 0.706 0.568 0.839 0.516 CB 1.595 32 residues pruned to eliminate duplicates Z: 31 36.386 2.292 0.782 0.560 0.900 0.467 CB 1.704 31 residues pruned to eliminate duplicates Z: 65 62.313 2.390 0.789 0.606 0.953 0.609 CB 1.730 65 residues pruned to eliminate duplicates Z: 36 27.588 2.240 0.576 0.506 0.857 0.514 CB 1.532 36 residues pruned to eliminate duplicates Z: 45 36.850 2.256 0.809 0.475 0.909 0.432 CB 1.535 45 residues pruned to eliminate duplicates Z: 104 59.331 2.232 0.676 0.590 0.942 0.621 CB 1.523 122 residues pruned to eliminate duplicates Z: 8 10.128 1.994 0.430 0.515 0.857 0.571 CB 1.542 8 residues pruned to eliminate duplicates Z: 32 31.999 2.261 0.621 0.593 0.903 0.581 CB 1.587 32 residues pruned to eliminate duplicates Z: 32 30.780 2.227 0.638 0.586 0.871 0.581 CB 1.603 32 residues pruned to eliminate duplicates Z: 66 64.247 2.403 0.808 0.628 0.954 0.554 CB 1.705 66 residues pruned to eliminate duplicates Z: 106 55.734 2.212 0.638 0.584 0.952 0.543 CB 1.455 106 residues pruned to eliminate duplicates Z: 15 14.618 2.181 0.733 0.374 0.857 0.500 CB 1.379 15 residues pruned to eliminate duplicates Z: 68 41.392 2.199 0.589 0.595 0.881 0.537 CB 1.501 68 residues pruned to eliminate duplicates Z: 18 15.117 2.167 0.740 0.383 0.765 0.471 CB 1.441 18 residues pruned to eliminate duplicates Z: 83 53.799 2.278 0.696 0.575 0.927 0.573 CB 1.544 83 residues pruned to eliminate duplicates Z: 26 28.508 2.284 0.516 0.627 0.960 0.680 CB 1.522 26 residues pruned to eliminate duplicates Z: 85 57.712 2.233 0.787 0.584 0.929 0.548 CB 1.568 84 residues pruned to eliminate duplicates Z: 15 22.665 2.224 0.345 0.845 1.000 0.857 CB 1.506 15 residues pruned to eliminate duplicates Z: 41 27.441 2.125 0.611 0.524 0.900 0.550 CB 1.375 41 residues pruned to eliminate duplicates Z: 98 65.083 2.335 0.722 0.605 0.959 0.619 CB 1.551 244 residues pruned to eliminate duplicates Z: 41 32.340 2.196 0.582 0.585 0.950 0.575 CB 1.428 Z: 12 22.065 2.320 0.401 0.909 1.000 0.909 CB 1.452 12 residues pruned to eliminate duplicates Z: 42 38.541 2.245 0.671 0.588 0.976 0.659 CB 1.512 41 residues pruned to eliminate duplicates Z: 15 27.055 2.241 0.654 0.901 1.000 0.929 CB 1.393 15 residues pruned to eliminate duplicates Z: 97 60.045 2.281 0.742 0.544 0.938 0.604 CB 1.577 139 residues pruned to eliminate duplicates Z: 56 46.313 2.218 0.803 0.618 0.945 0.582 CB 1.477 13 residues pruned to eliminate duplicates Z: 13 34.144 2.452 0.703 0.911 1.000 0.667 CB 1.674 13 residues pruned to eliminate duplicates Z: 84 57.209 2.294 0.696 0.587 0.928 0.602 CB 1.601 56 residues pruned to eliminate duplicates Z: 15 29.664 2.259 0.757 0.825 0.929 0.571 CB 1.623 15 residues pruned to eliminate duplicates Z: 79 47.959 2.264 0.702 0.491 0.910 0.641 CB 1.561 163 residues pruned to eliminate duplicates Z: 93 69.565 2.325 0.769 0.625 0.967 0.652 CB 1.622 119 residues pruned to eliminate duplicates Z: 129 67.628 2.279 0.646 0.579 0.953 0.570 CB 1.549 Z: 7 6.201 1.924 0.180 0.804 1.000 0.667 CB 0.855 7 residues pruned to eliminate duplicates Z: 36 27.940 1.990 0.706 0.604 0.971 0.514 CB 1.297 36 residues pruned to eliminate duplicates Z: 7 9.419 1.982 0.239 0.792 1.000 0.500 CB 1.212 7 residues pruned to eliminate duplicates Z: 36 26.907 2.034 0.654 0.571 0.943 0.629 CB 1.339 36 residues pruned to eliminate duplicates Z: 36 27.870 2.003 0.710 0.577 0.943 0.571 CB 1.355 36 residues pruned to eliminate duplicates Z: 37 27.190 2.007 0.642 0.579 0.972 0.583 CB 1.311 37 residues pruned to eliminate duplicates Z: 22 12.951 1.735 0.439 0.575 0.952 0.619 CB 1.105 22 residues pruned to eliminate duplicates Z: 66 44.802 2.205 0.712 0.583 0.985 0.631 CB 1.381 195 residues pruned to eliminate duplicates Z: 37 25.198 1.982 0.559 0.569 0.944 0.611 CB 1.345 Z: 13 20.314 2.117 0.801 0.643 0.917 0.667 CB 1.469 13 residues pruned to eliminate duplicates Z: 30 26.255 2.165 0.702 0.513 0.931 0.621 CB 1.403 31 residues pruned to eliminate duplicates Z: 12 17.653 2.194 0.726 0.649 0.818 0.727 CB 1.495 12 residues pruned to eliminate duplicates Z: 36 26.241 2.025 0.569 0.583 0.971 0.714 CB 1.327 36 residues pruned to eliminate duplicates Z: 12 17.295 2.082 0.610 0.672 1.000 0.545 CB 1.327 12 residues pruned to eliminate duplicates Z: 36 23.955 2.025 0.545 0.560 0.943 0.571 CB 1.296 36 residues pruned to eliminate duplicates Z: 36 26.608 2.036 0.692 0.558 0.943 0.543 CB 1.309 36 residues pruned to eliminate duplicates Z: 36 24.543 2.034 0.526 0.580 0.943 0.629 CB 1.312 36 residues pruned to eliminate duplicates Z: 36 28.028 1.986 0.760 0.595 0.943 0.686 CB 1.313 36 residues pruned to eliminate duplicates Z: 13 21.042 2.187 0.696 0.645 0.917 0.667 CB 1.559 13 residues pruned to eliminate duplicates Z: 87 54.751 2.220 0.731 0.579 0.930 0.651 CB 1.530 123 residues pruned to eliminate duplicates Z: 74 53.060 2.273 0.773 0.608 0.932 0.548 CB 1.493 74 residues pruned to eliminate duplicates Z: 34 24.228 2.024 0.639 0.504 0.939 0.545 CB 1.347 Z: 6 11.361 2.170 0.718 0.430 1.000 0.800 CA 1.465 6 residues pruned to eliminate duplicates Z: 38 23.963 2.044 0.571 0.566 0.946 0.649 CB 1.216 34 residues pruned to eliminate duplicates Z: 7 25.221 2.547 1.009 0.624 1.000 0.667 CB 1.790 7 residues pruned to eliminate duplicates Z: 37 50.553 2.505 0.842 0.627 0.917 0.444 CB 1.767 37 residues pruned to eliminate duplicates Z: 25 48.203 2.563 0.841 0.697 0.958 0.708 CB 1.817 25 residues pruned to eliminate duplicates Z: 88 65.401 2.391 0.836 0.575 0.897 0.598 CB 1.656 119 residues pruned to eliminate duplicates Z: 35 58.130 2.586 0.846 0.639 0.971 0.529 CB 1.890 35 residues pruned to eliminate duplicates Z: 65 64.686 2.501 0.794 0.604 0.906 0.656 CB 1.802 65 residues pruned to eliminate duplicates Z: 89 74.680 2.470 0.845 0.617 0.909 0.682 CB 1.720 89 residues pruned to eliminate duplicates Z: 34 65.939 2.602 0.889 0.691 1.000 0.667 CB 1.961 34 residues pruned to eliminate duplicates Z: 66 61.736 2.486 0.807 0.585 0.892 0.646 CB 1.762 66 residues pruned to eliminate duplicates Z: 67 68.348 2.489 0.805 0.621 0.924 0.697 CB 1.807 67 residues pruned to eliminate duplicates Z: 35 51.218 2.455 0.976 0.612 0.971 0.647 CB 1.678 35 residues pruned to eliminate duplicates Z: 37 56.242 2.565 0.821 0.646 0.944 0.611 CB 1.855 37 residues pruned to eliminate duplicates Z: 24 42.104 2.537 0.714 0.702 1.000 0.826 CB 1.680 24 residues pruned to eliminate duplicates Z: 78 50.406 2.215 0.644 0.586 0.974 0.610 CB 1.491 116 residues pruned to eliminate duplicates Z: 67 61.459 2.469 0.706 0.596 0.924 0.667 CB 1.774 67 residues pruned to eliminate duplicates Z: 260 119.550 2.410 0.790 0.604 0.934 0.660 CB 1.669 172 residues pruned to eliminate duplicates Z: 15 32.589 2.423 0.510 0.891 1.000 0.857 CB 1.710 15 residues pruned to eliminate duplicates Z: 36 51.169 2.568 0.676 0.627 0.971 0.571 CB 1.835 36 residues pruned to eliminate duplicates Z: 178 108.166 2.467 0.852 0.623 0.921 0.621 CB 1.721 178 residues pruned to eliminate duplicates Z: 67 67.423 2.469 0.751 0.617 0.939 0.606 CB 1.829 67 residues pruned to eliminate duplicates Z: 36 59.222 2.559 0.829 0.672 0.971 0.543 CB 1.877 36 residues pruned to eliminate duplicates Z: 13 29.018 2.502 0.940 0.545 0.833 0.417 CA 1.981 13 residues pruned to eliminate duplicates Z: 13 28.817 2.570 0.779 0.529 0.917 0.500 CB 1.929 13 residues pruned to eliminate duplicates Z: 12 34.737 2.628 0.785 0.553 1.000 0.545 CA 2.121 12 residues pruned to eliminate duplicates Z: 35 60.510 2.596 0.790 0.636 1.000 0.559 CB 1.966 35 residues pruned to eliminate duplicates Z: 69 55.388 2.376 0.749 0.546 0.912 0.588 CB 1.695 69 residues pruned to eliminate duplicates Z: 37 52.875 2.542 0.787 0.602 0.944 0.472 CB 1.863 37 residues pruned to eliminate duplicates Z: 36 52.146 2.564 0.713 0.631 0.943 0.629 CB 1.882 36 residues pruned to eliminate duplicates Z: 35 53.709 2.557 0.789 0.634 0.941 0.588 CB 1.886 35 residues pruned to eliminate duplicates Z: 68 61.172 2.457 0.726 0.585 0.940 0.612 CB 1.728 68 residues pruned to eliminate duplicates Z: 64 58.072 2.420 0.783 0.563 0.873 0.667 CB 1.827 64 residues pruned to eliminate duplicates Z: 13 29.896 2.586 1.076 0.468 0.917 0.500 CB 1.812 13 residues pruned to eliminate duplicates Z: 66 59.952 2.456 0.728 0.580 0.908 0.615 CB 1.788 66 residues pruned to eliminate duplicates Z: 68 65.518 2.455 0.848 0.577 0.910 0.612 CB 1.799 68 residues pruned to eliminate duplicates Z: 36 32.106 2.279 0.673 0.533 0.886 0.571 CB 1.556 36 residues pruned to eliminate duplicates Z: 31 37.755 2.398 0.831 0.588 0.833 0.667 CB 1.730 31 residues pruned to eliminate duplicates Z: 35 32.447 2.280 0.730 0.502 0.882 0.618 CB 1.595 35 residues pruned to eliminate duplicates Z: 33 39.813 2.272 0.895 0.567 0.906 0.531 CB 1.691 33 residues pruned to eliminate duplicates Z: 27 28.114 2.165 0.863 0.548 0.808 0.615 CA 1.616 27 residues pruned to eliminate duplicates Z: 32 36.683 2.327 0.766 0.554 0.935 0.613 CB 1.625 32 residues pruned to eliminate duplicates Z: 66 66.736 2.483 0.769 0.609 0.954 0.646 CB 1.781 66 residues pruned to eliminate duplicates Z: 32 35.407 2.298 0.797 0.557 0.903 0.742 CB 1.613 32 residues pruned to eliminate duplicates Z: 20 34.599 2.230 0.872 0.729 0.947 0.789 CB 1.634 20 residues pruned to eliminate duplicates Z: 31 42.075 2.411 0.885 0.607 0.900 0.667 CB 1.698 31 residues pruned to eliminate duplicates Z: 33 39.638 2.308 0.951 0.573 0.844 0.625 CB 1.718 33 residues pruned to eliminate duplicates Z: 33 36.632 2.278 0.922 0.586 0.844 0.562 CB 1.614 33 residues pruned to eliminate duplicates Z: 32 33.554 2.305 0.713 0.580 0.903 0.484 CB 1.564 32 residues pruned to eliminate duplicates Z: 32 36.900 2.356 0.852 0.591 0.871 0.581 CB 1.598 32 residues pruned to eliminate duplicates Z: 37 33.665 2.186 0.803 0.555 0.889 0.611 CB 1.517 37 residues pruned to eliminate duplicates Z: 66 65.672 2.487 0.814 0.603 0.923 0.569 CB 1.775 66 residues pruned to eliminate duplicates Z: 70 62.015 2.410 0.779 0.570 0.942 0.594 CB 1.727 70 residues pruned to eliminate duplicates Z: 65 58.905 2.456 0.808 0.605 0.875 0.625 CB 1.714 65 residues pruned to eliminate duplicates Z: 64 56.666 2.430 0.777 0.604 0.905 0.524 CB 1.655 64 residues pruned to eliminate duplicates Z: 36 33.208 2.255 0.835 0.520 0.829 0.486 CB 1.605 36 residues pruned to eliminate duplicates Z: 35 35.224 2.260 0.875 0.557 0.824 0.647 CB 1.638 35 residues pruned to eliminate duplicates Z: 17 17.832 2.346 0.769 0.376 0.812 0.438 CB 1.509 17 residues pruned to eliminate duplicates Z: 74 59.147 2.385 0.720 0.573 0.932 0.575 CB 1.689 74 residues pruned to eliminate duplicates Z: 66 57.833 2.364 0.857 0.575 0.923 0.600 CB 1.647 66 residues pruned to eliminate duplicates Z: 13 15.689 2.310 0.842 0.425 0.833 0.417 CB 1.381 13 residues pruned to eliminate duplicates Z: 92 71.557 2.387 0.817 0.615 0.923 0.593 CB 1.680 92 residues pruned to eliminate duplicates Z: 35 35.015 2.278 0.784 0.578 0.912 0.588 CB 1.503 35 residues pruned to eliminate duplicates Z: 36 35.845 2.260 0.780 0.544 0.886 0.571 CB 1.629 36 residues pruned to eliminate duplicates Z: 39 36.349 2.324 0.646 0.523 0.868 0.500 CB 1.736 39 residues pruned to eliminate duplicates Z: 126 93.024 2.431 0.927 0.638 0.928 0.616 CB 1.682 126 residues pruned to eliminate duplicates Z: 171 106.607 2.471 0.831 0.609 0.935 0.665 CB 1.742 171 residues pruned to eliminate duplicates Z: 6 3.896 1.834 0.717 0.165 0.600 0.200 CB 1.386 6 residues pruned to eliminate duplicates Z: 116 94.157 2.483 0.833 0.674 0.939 0.704 CB 1.751 116 residues pruned to eliminate duplicates Z: 113 100.166 2.497 0.928 0.678 0.938 0.714 CB 1.780 113 residues pruned to eliminate duplicates Z: 73 87.333 2.507 1.011 0.760 0.931 0.778 CB 1.742 73 residues pruned to eliminate duplicates Z: 27 44.506 2.431 0.982 0.719 0.923 0.769 CB 1.610 27 residues pruned to eliminate duplicates Z: 114 97.885 2.497 0.885 0.678 0.947 0.673 CB 1.754 114 residues pruned to eliminate duplicates Z: 27 44.010 2.431 0.884 0.734 0.962 0.731 CB 1.588 27 residues pruned to eliminate duplicates Z: 115 94.048 2.473 0.928 0.660 0.921 0.746 CB 1.730 115 residues pruned to eliminate duplicates Z: 44 48.580 2.334 0.938 0.612 0.953 0.674 CB 1.545 44 residues pruned to eliminate duplicates Z: 92 84.311 2.378 1.004 0.720 0.912 0.637 CB 1.667 92 residues pruned to eliminate duplicates Z: 94 83.609 2.444 0.886 0.650 0.925 0.624 CB 1.768 94 residues pruned to eliminate duplicates Z: 113 88.052 2.445 0.949 0.655 0.893 0.670 CB 1.693 113 residues pruned to eliminate duplicates Z: 43 55.768 2.331 1.085 0.641 1.000 0.667 CB 1.552 43 residues pruned to eliminate duplicates Z: 77 97.627 2.495 1.116 0.763 0.974 0.776 CB 1.724 77 residues pruned to eliminate duplicates Z: 86 93.934 2.495 1.065 0.714 0.929 0.682 CB 1.752 86 residues pruned to eliminate duplicates Z: 43 38.847 2.313 0.880 0.572 0.881 0.548 CB 1.460 43 residues pruned to eliminate duplicates Z: 27 45.223 2.399 1.186 0.696 0.962 0.654 CB 1.471 27 residues pruned to eliminate duplicates Z: 93 87.180 2.426 1.006 0.685 0.946 0.630 CB 1.666 93 residues pruned to eliminate duplicates Z: 84 93.011 2.488 1.059 0.711 0.928 0.735 CB 1.774 84 residues pruned to eliminate duplicates Z: 174 110.789 2.459 0.860 0.642 0.936 0.682 CB 1.722 174 residues pruned to eliminate duplicates Z: 128 91.138 2.430 0.946 0.626 0.898 0.622 CB 1.692 128 residues pruned to eliminate duplicates Z: 91 86.843 2.476 0.973 0.679 0.922 0.711 CB 1.724 91 residues pruned to eliminate duplicates Z: 71 96.722 2.527 1.099 0.781 0.971 0.729 CB 1.752 71 residues pruned to eliminate duplicates Z: 96 83.558 2.441 0.965 0.649 0.926 0.663 CB 1.679 96 residues pruned to eliminate duplicates Z: 141 92.960 2.447 0.890 0.614 0.900 0.650 CB 1.693 141 residues pruned to eliminate duplicates Z: 137 93.212 2.463 0.804 0.627 0.926 0.713 CB 1.724 137 residues pruned to eliminate duplicates Z: 136 96.063 2.469 0.856 0.632 0.933 0.689 CB 1.708 136 residues pruned to eliminate duplicates Z: 153 95.693 2.444 0.823 0.616 0.908 0.651 CB 1.719 153 residues pruned to eliminate duplicates Z: 87 93.662 2.498 1.037 0.715 0.930 0.651 CB 1.757 87 residues pruned to eliminate duplicates Z: 179 107.133 2.435 0.820 0.636 0.933 0.629 CB 1.710 179 residues pruned to eliminate duplicates Z: 86 90.693 2.481 1.013 0.716 0.929 0.694 CB 1.743 86 residues pruned to eliminate duplicates Z: 126 97.525 2.442 0.978 0.655 0.920 0.656 CB 1.699 126 residues pruned to eliminate duplicates Z: 113 80.852 2.456 0.811 0.581 0.911 0.625 CB 1.744 113 residues pruned to eliminate duplicates Z: 120 100.563 2.443 0.923 0.678 0.975 0.672 CB 1.710 120 residues pruned to eliminate duplicates Z: 74 86.918 2.469 1.012 0.753 0.959 0.699 CB 1.706 74 residues pruned to eliminate duplicates Z: 95 94.070 2.484 0.955 0.690 0.957 0.681 CB 1.754 95 residues pruned to eliminate duplicates Z: 104 81.070 2.434 0.901 0.642 0.893 0.660 CB 1.692 104 residues pruned to eliminate duplicates Z: 158 87.908 2.410 0.840 0.564 0.892 0.631 CB 1.667 158 residues pruned to eliminate duplicates Z: 128 92.099 2.440 0.897 0.638 0.906 0.654 CB 1.714 128 residues pruned to eliminate duplicates Z: 161 108.663 2.447 0.844 0.654 0.931 0.675 CB 1.772 161 residues pruned to eliminate duplicates Z: 149 99.236 2.457 0.897 0.596 0.926 0.682 CB 1.725 149 residues pruned to eliminate duplicates Z: 151 104.381 2.460 0.902 0.607 0.947 0.673 CB 1.739 151 residues pruned to eliminate duplicates Z: 162 104.922 2.458 0.859 0.651 0.913 0.671 CB 1.723 162 residues pruned to eliminate duplicates Z: 154 94.700 2.440 0.843 0.605 0.915 0.627 CB 1.684 154 residues pruned to eliminate duplicates Z: 116 100.627 2.501 0.969 0.672 0.930 0.722 CB 1.747 116 residues pruned to eliminate duplicates Z: 162 109.996 2.483 0.868 0.650 0.932 0.634 CB 1.744 162 residues pruned to eliminate duplicates Z: 162 111.199 2.482 0.892 0.654 0.938 0.652 CB 1.724 162 residues pruned to eliminate duplicates Z: 138 91.603 2.448 0.849 0.593 0.927 0.613 CB 1.706 138 residues pruned to eliminate duplicates Z: 180 108.458 2.437 0.799 0.630 0.950 0.682 CB 1.723 180 residues pruned to eliminate duplicates Z: 71 95.041 2.503 1.126 0.769 0.971 0.729 CB 1.731 71 residues pruned to eliminate duplicates Z: 110 87.947 2.477 0.886 0.612 0.927 0.651 CB 1.751 110 residues pruned to eliminate duplicates Z: 162 112.016 2.476 0.910 0.655 0.938 0.652 CB 1.723 162 residues pruned to eliminate duplicates Z: 90 98.799 2.461 1.071 0.723 0.978 0.685 CB 1.718 90 residues pruned to eliminate duplicates Z: 22 62.911 2.461 1.202 0.915 1.000 0.714 CB 1.790 22 residues pruned to eliminate duplicates Z: 136 99.103 2.459 0.887 0.635 0.941 0.637 CB 1.721 136 residues pruned to eliminate duplicates Z: 163 115.250 2.474 0.933 0.653 0.951 0.673 CB 1.726 163 residues pruned to eliminate duplicates Z: 98 90.208 2.463 1.003 0.675 0.928 0.619 CB 1.703 98 residues pruned to eliminate duplicates Z: 73 96.864 2.523 1.105 0.781 0.972 0.722 CB 1.725 73 residues pruned to eliminate duplicates Z: 101 93.261 2.452 0.989 0.672 0.950 0.610 CB 1.717 101 residues pruned to eliminate duplicates Z: 114 97.219 2.489 1.002 0.680 0.912 0.664 CB 1.706 114 residues pruned to eliminate duplicates Z: 179 110.747 2.443 0.912 0.632 0.933 0.629 CB 1.683 179 residues pruned to eliminate duplicates Z: 78 94.243 2.479 1.134 0.759 0.948 0.649 CB 1.701 78 residues pruned to eliminate duplicates Z: 136 100.861 2.474 0.927 0.623 0.941 0.637 CB 1.724 136 residues pruned to eliminate duplicates Z: 165 104.697 2.447 0.859 0.641 0.927 0.659 CB 1.699 165 residues pruned to eliminate duplicates Z: 86 95.923 2.488 1.066 0.722 0.941 0.729 CB 1.760 86 residues pruned to eliminate duplicates Z: 137 97.501 2.463 0.920 0.621 0.919 0.640 CB 1.717 137 residues pruned to eliminate duplicates Z: 180 107.129 2.430 0.863 0.632 0.927 0.654 CB 1.686 180 residues pruned to eliminate duplicates Z: 113 100.491 2.482 1.006 0.658 0.946 0.643 CB 1.740 113 residues pruned to eliminate duplicates Z: 114 101.723 2.472 1.018 0.682 0.929 0.681 CB 1.747 114 residues pruned to eliminate duplicates Z: 155 100.020 2.433 0.906 0.605 0.922 0.630 CB 1.705 155 residues pruned to eliminate duplicates Z: 155 90.878 2.339 0.929 0.611 0.922 0.571 CB 1.584 155 residues pruned to eliminate duplicates Z: 62 57.904 2.419 0.823 0.599 0.885 0.623 CB 1.729 62 residues pruned to eliminate duplicates Z: 130 100.434 2.442 0.982 0.657 0.922 0.690 CB 1.712 130 residues pruned to eliminate duplicates Z: 91 88.610 2.448 1.008 0.678 0.967 0.667 CB 1.668 91 residues pruned to eliminate duplicates Z: 99 87.716 2.440 0.923 0.668 0.939 0.653 CB 1.723 99 residues pruned to eliminate duplicates Z: 137 100.067 2.479 0.872 0.626 0.941 0.669 CB 1.745 137 residues pruned to eliminate duplicates Z: 162 113.024 2.478 0.911 0.655 0.938 0.683 CB 1.736 162 residues pruned to eliminate duplicates Z: 137 100.334 2.471 0.948 0.626 0.919 0.625 CB 1.727 137 residues pruned to eliminate duplicates Z: 179 113.739 2.424 0.945 0.644 0.921 0.624 CB 1.715 179 residues pruned to eliminate duplicates Z: 97 94.448 2.473 1.057 0.697 0.927 0.677 CB 1.708 97 residues pruned to eliminate duplicates Z: 114 97.196 2.491 0.954 0.694 0.903 0.655 CB 1.743 114 residues pruned to eliminate duplicates Z: 38 29.258 2.240 0.561 0.507 0.865 0.514 CB 1.580 38 residues pruned to eliminate duplicates Z: 50 54.421 2.438 0.803 0.544 0.959 0.612 CB 1.766 50 residues pruned to eliminate duplicates Z: 129 96.501 2.435 0.896 0.657 0.938 0.602 CB 1.704 129 residues pruned to eliminate duplicates Z: 29 43.161 2.383 0.942 0.567 0.929 0.643 CB 1.779 29 residues pruned to eliminate duplicates Z: 161 111.984 2.434 0.934 0.657 0.944 0.688 CB 1.722 161 residues pruned to eliminate duplicates Z: 75 69.495 2.471 0.787 0.610 0.946 0.676 CB 1.742 75 residues pruned to eliminate duplicates Z: 76 69.260 2.445 0.757 0.616 0.960 0.720 CB 1.737 76 residues pruned to eliminate duplicates Z: 50 44.104 2.431 0.675 0.505 0.898 0.592 CB 1.714 50 residues pruned to eliminate duplicates Z: 76 66.298 2.439 0.688 0.634 0.947 0.707 CB 1.732 76 residues pruned to eliminate duplicates Z: 28 37.208 2.434 0.746 0.608 0.926 0.741 CB 1.642 28 residues pruned to eliminate duplicates Z: 26 41.883 2.449 0.859 0.588 0.920 0.640 CA 1.839 26 residues pruned to eliminate duplicates Z: 42 41.388 2.426 0.668 0.488 0.951 0.780 CB 1.699 42 residues pruned to eliminate duplicates Z: 41 42.785 2.436 0.715 0.484 0.950 0.600 CB 1.732 41 residues pruned to eliminate duplicates Z: 28 33.375 2.318 0.773 0.582 0.889 0.556 CB 1.624 28 residues pruned to eliminate duplicates Z: 27 39.945 2.437 0.811 0.608 0.923 0.692 CB 1.736 27 residues pruned to eliminate duplicates Z: 78 65.216 2.415 0.806 0.595 0.909 0.675 CB 1.712 78 residues pruned to eliminate duplicates Z: 51 50.975 2.419 0.843 0.515 0.940 0.640 CB 1.696 51 residues pruned to eliminate duplicates Z: 27 35.065 2.378 0.766 0.599 0.846 0.692 CB 1.761 27 residues pruned to eliminate duplicates Z: 77 67.194 2.411 0.779 0.625 0.921 0.724 CB 1.734 77 residues pruned to eliminate duplicates Z: 27 38.236 2.361 0.879 0.604 0.923 0.692 CB 1.658 27 residues pruned to eliminate duplicates Z: 85 72.207 2.441 0.859 0.580 0.929 0.643 CB 1.732 85 residues pruned to eliminate duplicates Z: 78 66.029 2.386 0.842 0.587 0.935 0.662 CB 1.684 78 residues pruned to eliminate duplicates Z: 75 71.576 2.473 0.766 0.640 0.959 0.689 CB 1.741 75 residues pruned to eliminate duplicates Z: 53 49.853 2.374 0.769 0.532 0.942 0.692 CB 1.693 53 residues pruned to eliminate duplicates Z: 27 29.091 2.382 0.689 0.421 0.923 0.615 CB 1.668 27 residues pruned to eliminate duplicates Z: 53 44.433 2.335 0.688 0.528 0.942 0.615 CB 1.614 53 residues pruned to eliminate duplicates Z: 77 67.281 2.431 0.748 0.600 0.947 0.776 CB 1.743 77 residues pruned to eliminate duplicates Z: 76 74.288 2.451 0.758 0.659 0.973 0.693 CB 1.763 76 residues pruned to eliminate duplicates Z: 51 48.948 2.415 0.711 0.529 0.920 0.680 CB 1.769 51 residues pruned to eliminate duplicates Z: 76 60.225 2.328 0.848 0.572 0.947 0.680 CB 1.592 76 residues pruned to eliminate duplicates Z: 86 66.620 2.425 0.802 0.571 0.918 0.729 CB 1.682 86 residues pruned to eliminate duplicates Z: 7 20.712 2.350 1.097 0.531 1.000 0.833 CB 1.664 7 residues pruned to eliminate duplicates Z: 24 29.684 2.410 0.682 0.472 0.913 0.565 CB 1.721 24 residues pruned to eliminate duplicates Z: 51 48.901 2.362 0.809 0.543 0.920 0.680 CB 1.686 51 residues pruned to eliminate duplicates Z: 72 58.330 2.366 0.695 0.615 0.930 0.690 CB 1.666 72 residues pruned to eliminate duplicates Z: 50 47.347 2.449 0.730 0.522 0.898 0.633 CB 1.741 50 residues pruned to eliminate duplicates Z: 52 50.992 2.400 0.737 0.521 0.961 0.647 CB 1.747 52 residues pruned to eliminate duplicates Z: 50 51.654 2.405 0.743 0.555 0.959 0.673 CB 1.739 50 residues pruned to eliminate duplicates Z: 40 48.974 2.488 0.694 0.540 1.000 0.769 CB 1.790 40 residues pruned to eliminate duplicates Z: 77 73.405 2.421 0.848 0.633 0.961 0.724 CB 1.730 76 residues pruned to eliminate duplicates Z: 6 9.792 2.207 0.857 0.397 1.000 0.600 CA 1.191 6 residues pruned to eliminate duplicates Z: 56 48.367 2.330 0.767 0.485 0.964 0.673 CB 1.669 56 residues pruned to eliminate duplicates Z: 69 60.447 2.423 0.637 0.622 0.941 0.750 CB 1.750 69 residues pruned to eliminate duplicates Z: 77 63.568 2.431 0.687 0.616 0.921 0.750 CB 1.729 77 residues pruned to eliminate duplicates Z: 77 66.348 2.418 0.751 0.618 0.934 0.697 CB 1.720 77 residues pruned to eliminate duplicates Z: 163 112.602 2.454 0.920 0.670 0.932 0.679 CB 1.722 163 residues pruned to eliminate duplicates Z: 29 43.618 2.317 0.610 0.859 0.964 0.821 CB 1.687 29 residues pruned to eliminate duplicates Z: 75 64.737 2.429 0.694 0.642 0.959 0.703 CB 1.670 75 residues pruned to eliminate duplicates Z: 77 65.220 2.402 0.722 0.604 0.974 0.684 CB 1.684 77 residues pruned to eliminate duplicates Z: 51 53.059 2.419 0.700 0.592 0.980 0.700 CB 1.706 51 residues pruned to eliminate duplicates Z: 24 45.486 2.409 0.767 0.931 0.957 0.870 CB 1.628 24 residues pruned to eliminate duplicates Z: 25 55.885 2.497 1.068 0.869 0.958 0.792 CB 1.684 26 residues pruned to eliminate duplicates Z: 26 43.528 2.258 0.790 0.899 0.960 0.680 CB 1.604 26 residues pruned to eliminate duplicates Z: 30 49.851 2.418 0.862 0.751 1.000 0.552 CB 1.643 30 residues pruned to eliminate duplicates Z: 68 61.383 2.425 0.668 0.619 0.970 0.657 CB 1.707 68 residues pruned to eliminate duplicates Z: 76 72.620 2.435 0.812 0.628 0.973 0.627 CB 1.731 76 residues pruned to eliminate duplicates Z: 77 68.707 2.391 0.825 0.634 0.947 0.592 CB 1.681 77 residues pruned to eliminate duplicates Z: 162 118.217 2.478 0.976 0.671 0.938 0.621 CB 1.732 162 residues pruned to eliminate duplicates Z: 25 53.612 2.380 1.140 0.911 0.958 0.667 CB 1.589 25 residues pruned to eliminate duplicates Z: 30 53.245 2.404 0.972 0.760 1.000 0.621 CB 1.655 30 residues pruned to eliminate duplicates Z: 51 55.865 2.404 0.802 0.621 0.960 0.600 CB 1.695 50 residues pruned to eliminate duplicates Z: 25 56.191 2.319 1.210 0.944 0.958 0.625 CB 1.618 25 residues pruned to eliminate duplicates Z: 55 56.575 2.389 0.825 0.617 0.963 0.648 CB 1.641 55 residues pruned to eliminate duplicates Z: 54 57.283 2.393 0.788 0.618 0.981 0.660 CB 1.677 54 residues pruned to eliminate duplicates Z: 85 55.786 2.242 0.739 0.581 0.952 0.571 CB 1.517 86 residues pruned to eliminate duplicates Z: 24 54.338 2.420 1.165 0.943 0.957 0.565 CB 1.566 24 residues pruned to eliminate duplicates Z: 26 54.122 2.429 1.171 0.840 0.960 0.480 CB 1.595 26 residues pruned to eliminate duplicates Z: 77 74.138 2.426 0.878 0.645 0.947 0.645 CB 1.721 77 residues pruned to eliminate duplicates Z: 54 53.215 2.380 0.873 0.601 0.906 0.604 CB 1.645 54 residues pruned to eliminate duplicates Z: 56 55.747 2.389 0.776 0.589 0.945 0.509 CB 1.720 56 residues pruned to eliminate duplicates Z: 77 72.058 2.402 0.913 0.641 0.934 0.632 CB 1.687 77 residues pruned to eliminate duplicates Z: 38 34.593 2.309 0.564 0.593 0.946 0.676 CB 1.523 35 residues pruned to eliminate duplicates Z: 6 4.453 1.942 0.734 0.252 0.600 0.400 CB 1.311 6 residues pruned to eliminate duplicates Z: 19 27.928 2.135 0.688 0.769 0.889 0.889 CB 1.619 19 residues pruned to eliminate duplicates Z: 56 34.969 2.233 0.582 0.547 0.891 0.709 CB 1.431 57 residues pruned to eliminate duplicates Z: 16 24.791 2.267 0.623 0.916 0.933 0.933 CB 1.317 16 residues pruned to eliminate duplicates Z: 52 35.980 2.200 0.748 0.503 0.922 0.529 CB 1.418 53 residues pruned to eliminate duplicates Z: 15 31.455 2.286 0.876 0.914 1.000 0.857 CB 1.387 15 residues pruned to eliminate duplicates Z: 45 35.658 2.249 0.742 0.531 0.932 0.682 CB 1.429 45 residues pruned to eliminate duplicates Z: 54 39.368 2.270 0.666 0.596 0.925 0.623 CB 1.410 54 residues pruned to eliminate duplicates Z: 49 38.307 2.276 0.704 0.583 0.917 0.729 CB 1.437 49 residues pruned to eliminate duplicates Z: 39 40.448 2.287 0.791 0.616 1.000 0.658 CB 1.436 39 residues pruned to eliminate duplicates Z: 39 39.789 2.313 0.772 0.608 0.974 0.711 CB 1.460 39 residues pruned to eliminate duplicates Z: 37 44.766 2.334 0.879 0.647 1.000 0.778 CB 1.484 37 residues pruned to eliminate duplicates Z: 39 37.464 2.279 0.792 0.580 0.947 0.579 CB 1.455 39 residues pruned to eliminate duplicates Z: 37 43.159 2.334 0.827 0.627 1.000 0.694 CB 1.498 37 residues pruned to eliminate duplicates Z: 49 36.716 2.302 0.556 0.601 0.958 0.646 CB 1.402 49 residues pruned to eliminate duplicates Z: 49 39.803 2.294 0.665 0.598 0.958 0.750 CB 1.430 49 residues pruned to eliminate duplicates Z: 38 43.085 2.318 0.818 0.618 0.973 0.703 CB 1.545 38 residues pruned to eliminate duplicates Z: 40 40.145 2.293 0.736 0.602 0.974 0.667 CB 1.504 40 residues pruned to eliminate duplicates Z: 137 84.081 2.375 0.725 0.683 0.941 0.728 CB 1.581 137 residues pruned to eliminate duplicates Z: 92 59.158 2.368 0.644 0.592 0.945 0.681 CB 1.544 92 residues pruned to eliminate duplicates Z: 35 34.904 2.291 0.760 0.630 0.971 0.676 CB 1.353 35 residues pruned to eliminate duplicates Z: 45 36.807 2.246 0.764 0.520 0.955 0.568 CB 1.439 45 residues pruned to eliminate duplicates Z: 55 38.124 2.238 0.753 0.546 0.944 0.685 CB 1.338 55 residues pruned to eliminate duplicates Z: 44 38.684 2.268 0.849 0.528 0.907 0.581 CB 1.509 44 residues pruned to eliminate duplicates Z: 39 37.379 2.277 0.778 0.555 0.947 0.553 CB 1.498 39 residues pruned to eliminate duplicates Z: 38 40.149 2.323 0.765 0.602 0.973 0.730 CB 1.501 38 residues pruned to eliminate duplicates Z: 55 36.408 2.257 0.648 0.515 0.907 0.667 CB 1.447 55 residues pruned to eliminate duplicates Z: 37 42.526 2.347 0.870 0.589 1.000 0.639 CB 1.482 37 residues pruned to eliminate duplicates Z: 26 14.218 2.213 0.345 0.413 0.840 0.440 CB 1.246 26 residues pruned to eliminate duplicates Z: 43 38.653 2.317 0.800 0.578 0.952 0.548 CB 1.393 43 residues pruned to eliminate duplicates Z: 63 43.513 2.319 0.657 0.548 0.919 0.694 CB 1.493 63 residues pruned to eliminate duplicates Z: 64 32.553 2.183 0.581 0.491 0.937 0.619 CB 1.281 64 residues pruned to eliminate duplicates Z: 19 15.783 2.216 0.476 0.466 0.944 0.500 CB 1.247 19 residues pruned to eliminate duplicates Z: 58 35.290 2.198 0.649 0.526 0.947 0.596 CB 1.328 58 residues pruned to eliminate duplicates Z: 105 83.917 2.388 0.812 0.685 0.933 0.702 CB 1.720 105 residues pruned to eliminate duplicates Z: 64 47.003 2.291 0.717 0.572 0.937 0.603 CB 1.500 64 residues pruned to eliminate duplicates Z: 49 40.427 2.294 0.648 0.606 0.979 0.729 CB 1.425 49 residues pruned to eliminate duplicates Z: 23 12.723 2.147 0.497 0.389 0.864 0.727 CB 1.099 23 residues pruned to eliminate duplicates Z: 101 82.911 2.408 0.804 0.689 0.940 0.760 CB 1.708 101 residues pruned to eliminate duplicates Z: 51 34.043 2.253 0.624 0.563 0.940 0.620 CB 1.317 51 residues pruned to eliminate duplicates Z: 56 35.338 2.225 0.668 0.517 0.945 0.491 CB 1.335 56 residues pruned to eliminate duplicates Z: 50 34.368 2.272 0.663 0.552 0.918 0.592 CB 1.345 50 residues pruned to eliminate duplicates Z: 12 3.302 1.664 0.048 0.328 0.727 0.364 CB 0.948 12 residues pruned to eliminate duplicates Z: 93 58.094 2.337 0.739 0.579 0.913 0.685 CB 1.512 93 residues pruned to eliminate duplicates Z: 54 46.490 2.358 0.685 0.600 0.925 0.660 CB 1.580 54 residues pruned to eliminate duplicates Z: 64 45.220 2.292 0.729 0.560 0.937 0.667 CB 1.449 64 residues pruned to eliminate duplicates Z: 90 96.509 2.445 0.970 0.736 0.955 0.753 CB 1.799 90 residues pruned to eliminate duplicates Z: 82 46.530 2.239 0.806 0.485 0.901 0.568 CB 1.441 93 residues pruned to eliminate duplicates Z: 6 7.016 1.889 0.622 0.405 0.800 0.600 C 1.415 6 residues pruned to eliminate duplicates Z: 201 91.809 2.350 0.729 0.597 0.920 0.645 CB 1.583 203 residues pruned to eliminate duplicates Z: 6 5.411 1.588 0.614 0.387 0.800 0.200 N 1.330 6 residues pruned to eliminate duplicates Z: 139 93.530 2.397 0.839 0.677 0.942 0.725 CB 1.629 139 residues pruned to eliminate duplicates Z: 7 16.253 2.236 0.718 0.490 1.000 0.833 CA 1.745 7 residues pruned to eliminate duplicates Z: 91 82.526 2.444 0.730 0.724 0.956 0.756 CB 1.759 91 residues pruned to eliminate duplicates Z: 109 79.561 2.378 0.777 0.644 0.935 0.713 CB 1.693 109 residues pruned to eliminate duplicates Z: 140 95.387 2.382 0.859 0.665 0.950 0.691 CB 1.652 140 residues pruned to eliminate duplicates Z: 89 88.691 2.455 0.905 0.729 0.932 0.727 CB 1.766 89 residues pruned to eliminate duplicates Z: 91 89.900 2.444 0.903 0.714 0.944 0.678 CB 1.777 91 residues pruned to eliminate duplicates Z: 136 87.658 2.381 0.765 0.662 0.941 0.711 CB 1.643 136 residues pruned to eliminate duplicates Z: 92 90.478 2.433 0.881 0.712 0.945 0.725 CB 1.810 92 residues pruned to eliminate duplicates Z: 42 54.114 2.456 0.817 0.642 0.951 0.659 CB 1.743 42 residues pruned to eliminate duplicates Z: 88 93.413 2.473 0.885 0.734 0.966 0.782 CB 1.803 88 residues pruned to eliminate duplicates Z: 140 90.934 2.389 0.821 0.669 0.942 0.633 CB 1.610 140 residues pruned to eliminate duplicates Z: 101 81.546 2.371 0.822 0.696 0.920 0.730 CB 1.715 101 residues pruned to eliminate duplicates Z: 75 89.149 2.471 1.057 0.759 0.919 0.703 CB 1.762 75 residues pruned to eliminate duplicates Z: 43 54.189 2.407 0.886 0.637 0.952 0.714 CB 1.702 43 residues pruned to eliminate duplicates Z: 41 56.408 2.483 0.964 0.651 0.925 0.725 CB 1.718 41 residues pruned to eliminate duplicates Z: 100 80.024 2.377 0.841 0.663 0.919 0.687 CB 1.719 100 residues pruned to eliminate duplicates Z: 60 53.445 2.402 0.813 0.587 0.915 0.678 CB 1.606 60 residues pruned to eliminate duplicates Z: 88 95.718 2.483 0.924 0.742 0.954 0.713 CB 1.813 88 residues pruned to eliminate duplicates Z: 149 89.029 2.335 0.812 0.644 0.946 0.682 CB 1.598 149 residues pruned to eliminate duplicates Z: 86 82.730 2.442 0.891 0.736 0.929 0.718 CB 1.691 86 residues pruned to eliminate duplicates Z: 139 94.416 2.387 0.838 0.673 0.957 0.674 CB 1.634 139 residues pruned to eliminate duplicates Z: 90 89.090 2.440 0.908 0.731 0.944 0.629 CB 1.747 90 residues pruned to eliminate duplicates Z: 92 98.341 2.435 0.997 0.734 0.978 0.758 CB 1.756 92 residues pruned to eliminate duplicates Z: 73 96.655 2.507 1.004 0.793 0.986 0.750 CB 1.778 73 residues pruned to eliminate duplicates Z: 40 57.373 2.502 0.927 0.669 0.949 0.641 CB 1.718 40 residues pruned to eliminate duplicates Z: 75 94.043 2.473 0.967 0.784 0.986 0.716 CB 1.774 75 residues pruned to eliminate duplicates Z: 90 88.823 2.456 0.838 0.736 0.944 0.708 CB 1.788 90 residues pruned to eliminate duplicates Z: 89 93.998 2.464 0.950 0.726 0.966 0.648 CB 1.762 89 residues pruned to eliminate duplicates Z: 91 90.289 2.435 0.834 0.731 0.967 0.767 CB 1.791 91 residues pruned to eliminate duplicates Z: 108 87.226 2.417 0.868 0.671 0.963 0.682 CB 1.657 108 residues pruned to eliminate duplicates Z: 88 93.358 2.473 0.917 0.738 0.954 0.690 CB 1.788 88 residues pruned to eliminate duplicates Z: 89 95.584 2.467 0.954 0.733 0.966 0.716 CB 1.775 89 residues pruned to eliminate duplicates Z: 88 90.564 2.475 0.902 0.714 0.954 0.678 CB 1.780 88 residues pruned to eliminate duplicates Z: 143 89.748 2.380 0.818 0.660 0.937 0.648 CB 1.601 143 residues pruned to eliminate duplicates Z: 90 91.493 2.461 0.870 0.733 0.966 0.730 CB 1.770 90 residues pruned to eliminate duplicates Z: 151 80.645 2.383 0.746 0.590 0.880 0.640 CB 1.650 151 residues pruned to eliminate duplicates Z: 107 87.440 2.415 0.912 0.676 0.925 0.623 CB 1.691 107 residues pruned to eliminate duplicates Z: 131 81.200 2.352 0.806 0.622 0.908 0.662 CB 1.646 131 residues pruned to eliminate duplicates Z: 138 96.245 2.400 0.897 0.676 0.942 0.686 CB 1.631 138 residues pruned to eliminate duplicates Z: 73 97.185 2.503 1.084 0.778 0.958 0.736 CB 1.793 73 residues pruned to eliminate duplicates Z: 113 80.057 2.387 0.803 0.654 0.920 0.696 CB 1.655 113 residues pruned to eliminate duplicates Z: 97 84.004 2.409 0.883 0.681 0.927 0.552 CB 1.727 97 residues pruned to eliminate duplicates Z: 96 86.469 2.445 0.909 0.689 0.926 0.705 CB 1.726 96 residues pruned to eliminate duplicates Z: 87 99.719 2.494 1.012 0.734 0.965 0.733 CB 1.800 87 residues pruned to eliminate duplicates Z: 90 94.348 2.453 0.923 0.738 0.966 0.663 CB 1.772 90 residues pruned to eliminate duplicates Z: 93 86.922 2.422 0.925 0.708 0.935 0.598 CB 1.722 93 residues pruned to eliminate duplicates Z: 89 86.735 2.448 0.901 0.724 0.920 0.682 CB 1.763 89 residues pruned to eliminate duplicates Z: 76 91.865 2.462 1.017 0.763 0.960 0.613 CB 1.762 76 residues pruned to eliminate duplicates Z: 90 94.814 2.468 0.897 0.736 0.978 0.685 CB 1.777 90 residues pruned to eliminate duplicates Z: 44 70.845 2.393 1.008 0.824 0.953 0.837 CB 1.780 44 residues pruned to eliminate duplicates Z: 174 88.467 2.328 0.750 0.627 0.902 0.647 CB 1.625 174 residues pruned to eliminate duplicates Z: 49 73.992 2.411 0.959 0.796 0.979 0.771 CB 1.782 49 residues pruned to eliminate duplicates Z: 107 86.078 2.399 0.917 0.671 0.943 0.689 CB 1.646 107 residues pruned to eliminate duplicates Z: 77 88.604 2.454 1.004 0.751 0.961 0.724 CB 1.719 77 residues pruned to eliminate duplicates Z: 90 89.156 2.449 0.870 0.733 0.955 0.618 CB 1.753 90 residues pruned to eliminate duplicates Z: 137 99.586 2.409 0.930 0.677 0.963 0.735 CB 1.620 139 residues pruned to eliminate duplicates Z: 31 58.227 2.332 0.809 0.922 1.000 0.800 CB 1.772 31 residues pruned to eliminate duplicates Z: 44 71.870 2.404 0.912 0.850 0.977 0.767 CB 1.808 44 residues pruned to eliminate duplicates Z: 90 92.124 2.453 0.907 0.725 0.955 0.685 CB 1.784 90 residues pruned to eliminate duplicates Z: 74 85.646 2.434 0.956 0.749 0.945 0.630 CB 1.783 74 residues pruned to eliminate duplicates Z: 48 76.172 2.438 0.891 0.826 1.000 0.809 CB 1.818 48 residues pruned to eliminate duplicates Z: 75 91.105 2.475 0.985 0.771 0.959 0.716 CB 1.768 75 residues pruned to eliminate duplicates Z: 73 94.342 2.499 1.029 0.782 0.958 0.694 CB 1.785 73 residues pruned to eliminate duplicates Z: 43 72.335 2.411 0.917 0.869 0.976 0.810 CB 1.807 43 residues pruned to eliminate duplicates Z: 94 88.249 2.398 0.954 0.702 0.914 0.667 CB 1.778 94 residues pruned to eliminate duplicates Z: 49 69.205 2.412 0.817 0.812 0.979 0.771 CB 1.774 49 residues pruned to eliminate duplicates Z: 92 94.875 2.439 0.921 0.722 0.978 0.637 CB 1.777 92 residues pruned to eliminate duplicates Z: 75 97.296 2.488 1.018 0.770 0.986 0.757 CB 1.798 75 residues pruned to eliminate duplicates Z: 101 82.662 2.377 0.804 0.713 0.940 0.670 CB 1.691 101 residues pruned to eliminate duplicates Z: 90 96.259 2.457 0.959 0.746 0.966 0.730 CB 1.761 90 residues pruned to eliminate duplicates Z: 89 93.938 2.438 0.933 0.735 0.966 0.636 CB 1.781 89 residues pruned to eliminate duplicates Z: 43 73.031 2.397 0.948 0.862 1.000 0.643 CB 1.772 43 residues pruned to eliminate duplicates Z: 88 98.047 2.475 0.969 0.739 0.977 0.644 CB 1.782 88 residues pruned to eliminate duplicates Z: 199 84.354 2.326 0.725 0.558 0.899 0.596 CB 1.571 199 residues pruned to eliminate duplicates Z: 78 91.310 2.447 1.051 0.741 0.961 0.636 CB 1.739 78 residues pruned to eliminate duplicates Z: 52 69.297 2.373 0.903 0.758 0.961 0.627 CB 1.777 52 residues pruned to eliminate duplicates Z: 93 87.146 2.401 0.954 0.710 0.946 0.500 CB 1.692 93 residues pruned to eliminate duplicates Z: 89 94.210 2.458 0.975 0.736 0.966 0.636 CB 1.733 89 residues pruned to eliminate duplicates Z: 139 96.661 2.401 0.854 0.678 0.942 0.630 CB 1.666 139 residues pruned to eliminate duplicates Z: 49 77.196 2.430 0.969 0.810 0.979 0.708 CB 1.815 49 residues pruned to eliminate duplicates Z: 90 88.070 2.442 0.864 0.731 0.944 0.618 CB 1.765 90 residues pruned to eliminate duplicates Z: 88 63.148 2.296 0.795 0.634 0.897 0.563 CB 1.615 88 residues pruned to eliminate duplicates Z: 41 22.663 2.190 0.577 0.438 0.825 0.600 CB 1.341 41 residues pruned to eliminate duplicates Z: 11 6.282 2.137 0.511 0.258 0.700 0.400 CB 1.159 11 residues pruned to eliminate duplicates Z: 8 6.867 2.047 0.570 0.359 0.714 0.571 CB 1.315 8 residues pruned to eliminate duplicates Z: 11 5.970 2.174 0.540 0.239 0.600 0.500 CB 1.271 11 residues pruned to eliminate duplicates Z: 22 9.507 2.154 0.414 0.310 0.667 0.476 CB 1.262 22 residues pruned to eliminate duplicates Z: 152 88.877 2.345 0.849 0.629 0.927 0.589 CB 1.594 152 residues pruned to eliminate duplicates Z: 81 41.956 2.226 0.568 0.517 0.925 0.575 CB 1.429 81 residues pruned to eliminate duplicates Z: 85 84.207 2.436 0.940 0.709 0.929 0.607 CB 1.732 85 residues pruned to eliminate duplicates Z: 38 20.946 2.175 0.511 0.479 0.811 0.622 CB 1.320 38 residues pruned to eliminate duplicates Z: 20 11.000 2.143 0.412 0.335 0.737 0.368 CB 1.355 20 residues pruned to eliminate duplicates Z: 43 21.416 2.142 0.473 0.432 0.810 0.500 CB 1.388 43 residues pruned to eliminate duplicates Z: 19 14.459 2.214 0.562 0.365 0.833 0.444 CB 1.367 19 residues pruned to eliminate duplicates Z: 13 8.544 2.011 0.424 0.378 0.750 0.417 CB 1.308 13 residues pruned to eliminate duplicates Z: 83 45.448 2.261 0.551 0.564 0.902 0.622 CB 1.491 83 residues pruned to eliminate duplicates Z: 55 29.694 2.242 0.519 0.464 0.833 0.593 CB 1.478 55 residues pruned to eliminate duplicates Z: 37 33.938 2.282 0.693 0.557 0.889 0.667 CB 1.559 37 residues pruned to eliminate duplicates Z: 72 51.459 2.280 0.683 0.612 0.958 0.732 CB 1.495 72 residues pruned to eliminate duplicates Z: 50 38.896 2.314 0.722 0.514 0.918 0.673 CB 1.498 50 residues pruned to eliminate duplicates Z: 31 27.187 2.159 0.648 0.623 0.867 0.700 CB 1.433 31 residues pruned to eliminate duplicates Z: 73 47.277 2.262 0.601 0.617 0.931 0.667 CB 1.479 73 residues pruned to eliminate duplicates Z: 27 32.769 2.279 0.806 0.650 0.846 0.654 CB 1.605 27 residues pruned to eliminate duplicates Z: 40 35.250 2.334 0.593 0.491 0.974 0.718 CB 1.572 40 residues pruned to eliminate duplicates Z: 28 29.171 2.265 0.719 0.610 0.889 0.667 CB 1.461 28 residues pruned to eliminate duplicates Z: 18 15.476 2.070 0.381 0.647 0.824 0.647 CB 1.390 18 residues pruned to eliminate duplicates Z: 49 39.640 2.289 0.706 0.530 0.958 0.667 CB 1.485 49 residues pruned to eliminate duplicates Z: 41 33.728 2.300 0.632 0.482 0.975 0.650 CB 1.484 41 residues pruned to eliminate duplicates Z: 42 34.522 2.296 0.643 0.494 0.951 0.780 CB 1.512 42 residues pruned to eliminate duplicates Z: 52 35.030 2.272 0.557 0.513 0.941 0.706 CB 1.454 52 residues pruned to eliminate duplicates Z: 73 51.697 2.273 0.655 0.614 0.958 0.750 CB 1.517 73 residues pruned to eliminate duplicates Z: 49 35.839 2.274 0.661 0.511 0.917 0.688 CB 1.478 49 residues pruned to eliminate duplicates Z: 30 24.710 2.260 0.525 0.501 0.897 0.621 CB 1.484 30 residues pruned to eliminate duplicates Z: 50 37.043 2.305 0.570 0.509 0.939 0.694 CB 1.543 50 residues pruned to eliminate duplicates Z: 61 35.236 2.262 0.608 0.450 0.900 0.583 CB 1.462 61 residues pruned to eliminate duplicates Z: 43 32.135 2.222 0.587 0.474 1.000 0.690 CB 1.443 43 residues pruned to eliminate duplicates Z: 42 30.184 2.265 0.531 0.484 0.927 0.732 CB 1.491 42 residues pruned to eliminate duplicates Z: 36 32.958 2.299 0.668 0.548 0.971 0.743 CB 1.427 36 residues pruned to eliminate duplicates Z: 72 51.272 2.261 0.718 0.620 0.944 0.704 CB 1.481 72 residues pruned to eliminate duplicates Z: 72 47.793 2.240 0.721 0.598 0.930 0.704 CB 1.441 72 residues pruned to eliminate duplicates Z: 50 35.775 2.317 0.571 0.525 0.939 0.653 CB 1.460 50 residues pruned to eliminate duplicates Z: 26 33.496 2.364 0.658 0.616 0.960 0.600 CB 1.595 26 residues pruned to eliminate duplicates Z: 50 40.217 2.318 0.705 0.527 0.939 0.653 CB 1.508 50 residues pruned to eliminate duplicates Z: 47 39.679 2.293 0.558 0.601 0.978 0.717 CB 1.520 47 residues pruned to eliminate duplicates Z: 49 41.836 2.330 0.680 0.533 0.958 0.646 CB 1.559 49 residues pruned to eliminate duplicates Z: 27 24.248 2.327 0.517 0.381 0.962 0.731 CB 1.589 27 residues pruned to eliminate duplicates Z: 25 25.476 2.322 0.620 0.421 1.000 0.792 CB 1.501 25 residues pruned to eliminate duplicates Z: 82 46.547 2.227 0.724 0.554 0.889 0.667 CB 1.438 82 residues pruned to eliminate duplicates Z: 41 38.448 2.312 0.718 0.520 0.975 0.750 CB 1.540 41 residues pruned to eliminate duplicates Z: 62 44.433 2.230 0.673 0.584 0.934 0.656 CB 1.505 62 residues pruned to eliminate duplicates Z: 50 39.817 2.260 0.716 0.536 0.939 0.694 CB 1.508 50 residues pruned to eliminate duplicates Z: 48 36.883 2.240 0.796 0.488 0.915 0.681 CB 1.478 48 residues pruned to eliminate duplicates Z: 71 49.502 2.237 0.788 0.599 0.957 0.729 CB 1.406 71 residues pruned to eliminate duplicates Z: 59 40.086 2.273 0.702 0.492 0.931 0.776 CB 1.473 59 residues pruned to eliminate duplicates Z: 50 41.754 2.316 0.781 0.526 0.939 0.714 CB 1.502 50 residues pruned to eliminate duplicates Z: 50 32.671 2.247 0.615 0.526 0.878 0.714 CB 1.428 50 residues pruned to eliminate duplicates Z: 26 20.098 2.221 0.754 0.391 0.920 0.600 CB 1.259 26 residues pruned to eliminate duplicates Z: 41 39.724 2.309 0.794 0.529 0.975 0.775 CB 1.511 41 residues pruned to eliminate duplicates Z: 49 40.906 2.319 0.718 0.555 0.958 0.750 CB 1.466 49 residues pruned to eliminate duplicates Z: 75 50.035 2.247 0.720 0.630 0.905 0.716 CB 1.471 75 residues pruned to eliminate duplicates Z: 38 22.832 2.048 0.692 0.399 0.919 0.595 CB 1.311 38 residues pruned to eliminate duplicates Z: 73 53.835 2.278 0.758 0.646 0.931 0.764 CB 1.485 73 residues pruned to eliminate duplicates Z: 50 40.304 2.242 0.677 0.618 0.918 0.755 CB 1.491 50 residues pruned to eliminate duplicates Z: 27 34.417 2.155 0.625 0.825 1.000 0.846 CB 1.455 27 residues pruned to eliminate duplicates Z: 72 52.509 2.231 0.714 0.667 0.944 0.803 CB 1.479 72 residues pruned to eliminate duplicates Z: 73 49.490 2.271 0.645 0.648 0.931 0.694 CB 1.461 73 residues pruned to eliminate duplicates Z: 24 33.283 2.206 0.524 0.875 1.000 0.739 CB 1.502 24 residues pruned to eliminate duplicates Z: 26 34.270 2.180 0.705 0.847 0.960 0.800 CB 1.426 26 residues pruned to eliminate duplicates Z: 80 47.477 2.251 0.614 0.603 0.899 0.646 CB 1.484 80 residues pruned to eliminate duplicates Z: 82 51.223 2.247 0.808 0.595 0.877 0.679 CB 1.459 82 residues pruned to eliminate duplicates Z: 26 37.295 2.211 0.758 0.839 1.000 0.720 CB 1.433 26 residues pruned to eliminate duplicates Z: 65 47.582 2.235 0.647 0.629 0.953 0.719 CB 1.501 65 residues pruned to eliminate duplicates Z: 23 39.627 2.241 0.796 0.881 1.000 0.636 CB 1.519 23 residues pruned to eliminate duplicates Z: 70 56.348 2.289 0.735 0.654 0.971 0.638 CB 1.524 70 residues pruned to eliminate duplicates Z: 25 41.010 2.194 0.962 0.859 1.000 0.500 CB 1.431 25 residues pruned to eliminate duplicates Z: 63 50.841 2.263 0.754 0.644 0.968 0.613 CB 1.468 63 residues pruned to eliminate duplicates Z: 63 51.716 2.267 0.802 0.655 0.935 0.661 CB 1.488 63 residues pruned to eliminate duplicates Z: 30 36.459 2.086 0.883 0.769 1.000 0.552 CB 1.358 30 residues pruned to eliminate duplicates Z: 23 41.140 2.215 1.086 0.906 0.955 0.545 CB 1.415 23 residues pruned to eliminate duplicates Z: 27 34.184 2.142 0.941 0.793 0.885 0.462 CB 1.410 27 residues pruned to eliminate duplicates Z: 24 34.283 2.178 0.944 0.837 0.957 0.478 CB 1.320 24 residues pruned to eliminate duplicates Z: 26 38.539 2.139 1.037 0.836 0.960 0.600 CB 1.379 26 residues pruned to eliminate duplicates Z: 73 54.767 2.256 0.849 0.640 0.917 0.639 CB 1.480 74 residues pruned to eliminate duplicates Z: 23 41.787 2.190 1.120 0.921 0.955 0.591 CB 1.414 22 residues pruned to eliminate duplicates Z: 22 44.126 2.212 1.097 0.939 1.000 0.667 CB 1.442 22 residues pruned to eliminate duplicates 598 residues left after pruning, divided into chains as follows: A: 8 B: 9 C: 42 D: 31 E: 66 F: 193 G: 27 H: 222 CC for partial structure against native data = 34.03 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 1 used as input for final density modification = 0.300, Contrast = 0.568, Connect. = 0.779 for dens.mod. cycle 1 = 0.300, Contrast = 0.650, Connect. = 0.803 for dens.mod. cycle 2 = 0.300, Contrast = 0.773, Connect. = 0.828 for dens.mod. cycle 3 = 0.300, Contrast = 0.787, Connect. = 0.830 for dens.mod. cycle 4 = 0.300, Contrast = 0.802, Connect. = 0.832 for dens.mod. cycle 5 = 0.300, Contrast = 0.808, Connect. = 0.834 for dens.mod. cycle 6 = 0.300, Contrast = 0.815, Connect. = 0.835 for dens.mod. cycle 7 = 0.300, Contrast = 0.817, Connect. = 0.837 for dens.mod. cycle 8 = 0.300, Contrast = 0.820, Connect. = 0.837 for dens.mod. cycle 9 = 0.300, Contrast = 0.820, Connect. = 0.838 for dens.mod. cycle 10 TimeTaking 472.22