++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 21:34:12 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: ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.ins Phases from ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.phi Native data from ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.hkl Listing output to ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.lst Phases output to ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.phs Poly-Ala trace output to ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.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 21 21 21 Allowed origin shift code: 4 138543 Reflections read from file ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.phi 138543 Reflections read from file ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.hkl 138543 Unique data, highest resolution = 1.404 Angstroms Anisotropic scaling: intensities multiplied by 0.000066h^2 -0.000059k^2 +0.000025l^2 +0.000000kl +0.000000hl +0.000000hk 1390 Reflections with d > 1.604 and 0 in range 1.604 > d > 1.404 added Density sharpening factor set to 1.64 Fourier grid = 256 x 256 x 48 0.000 <= z <= 0.250 92 Point spherical net set up with radius 2.42A 40 Extra Fourier layers will be generated <|E^2-1|> = 0.606 ** -f missing ?? ** = 0.295, Contrast = 0.160, Connect. = 0.626 for dens.mod. cycle 1 = 0.300, Contrast = 0.412, Connect. = 0.706 for dens.mod. cycle 2 = 0.300, Contrast = 0.642, Connect. = 0.795 for dens.mod. cycle 3 = 0.300, Contrast = 0.710, Connect. = 0.815 for dens.mod. cycle 4 = 0.300, Contrast = 0.734, Connect. = 0.824 for dens.mod. cycle 5 = 0.300, Contrast = 0.745, Connect. = 0.828 for dens.mod. cycle 6 = 0.300, Contrast = 0.752, Connect. = 0.830 for dens.mod. cycle 7 = 0.300, Contrast = 0.757, Connect. = 0.832 for dens.mod. cycle 8 = 0.300, Contrast = 0.760, Connect. = 0.833 for dens.mod. cycle 9 = 0.300, Contrast = 0.762, Connect. = 0.834 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4724 peaks > 0.5 sigma used to seed fragment search Space for about 918 unique residues taking solvent into account 1020 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 20 32.530 2.282 0.615 0.830 0.947 0.895 CB 1.608 B: 9 22.993 2.372 0.491 0.900 1.000 1.000 CB 1.642 9 residues pruned to eliminate duplicates C: 19 42.265 2.280 0.806 0.868 1.000 0.778 CB 1.768 D: 19 41.117 2.273 0.867 0.904 0.944 0.889 CB 1.722 19 residues pruned to eliminate duplicates E: 20 32.994 2.057 0.883 0.922 0.947 0.737 CB 1.450 F: 19 38.115 2.126 0.847 0.947 1.000 0.889 CB 1.581 19 residues pruned to eliminate duplicates G: 19 30.654 2.231 0.537 0.961 1.000 0.944 CB 1.442 H: 19 45.614 2.251 0.921 0.931 1.000 0.944 CB 1.739 20 residues pruned to eliminate duplicates I: 18 57.387 2.362 1.403 0.935 1.000 0.941 C 1.709 18 residues pruned to eliminate duplicates J: 20 37.327 2.220 0.696 0.946 1.000 0.947 CB 1.573 K: 19 50.393 2.252 1.241 0.926 0.944 0.944 CB 1.748 19 residues pruned to eliminate duplicates L: 19 49.123 2.320 1.032 0.915 0.944 0.833 C 1.839 19 residues pruned to eliminate duplicates M: 21 21.347 2.221 0.885 0.476 0.850 0.600 CB 1.374 N: 19 32.833 2.073 0.816 0.921 0.944 0.889 CB 1.532 19 residues pruned to eliminate duplicates O: 16 48.660 2.297 1.169 0.938 1.000 0.933 CA 1.754 P: 16 32.943 2.234 0.557 0.921 1.000 1.000 CB 1.721 16 residues pruned to eliminate duplicates Q: 18 26.132 2.069 0.636 0.826 0.941 0.706 C 1.500 R: 21 38.362 2.159 0.749 0.934 1.000 0.900 CB 1.583 20 residues pruned to eliminate duplicates S: 18 46.796 2.201 1.062 0.940 1.000 0.882 CB 1.736 20 residues pruned to eliminate duplicates T: 18 41.692 2.301 0.900 0.957 1.000 1.000 CB 1.588 19 residues pruned to eliminate duplicates U: 16 41.306 2.292 1.005 0.926 0.933 0.933 CA 1.743 16 residues pruned to eliminate duplicates V: 15 52.881 2.387 1.255 0.906 1.000 0.929 CB 1.868 W: 21 34.927 2.146 0.577 0.939 1.000 0.950 CB 1.603 21 residues pruned to eliminate duplicates X: 16 38.486 2.158 1.026 0.885 1.000 0.933 C 1.641 15 residues pruned to eliminate duplicates Y: 30 23.738 2.273 0.729 0.457 0.862 0.483 CB 1.359 Z: 17 38.759 2.283 0.940 0.884 0.938 0.750 CB 1.686 Z: 19 53.914 2.369 1.161 0.931 1.000 0.944 CB 1.734 20 residues pruned to eliminate duplicates Z: 17 59.471 2.469 1.221 0.940 1.000 0.875 C 1.882 17 residues pruned to eliminate duplicates Z: 18 41.305 2.321 0.692 0.928 1.000 1.000 CB 1.787 18 residues pruned to eliminate duplicates Z: 18 31.531 2.086 0.695 0.942 1.000 0.941 CB 1.500 Z: 20 31.918 2.163 0.632 0.911 1.000 0.947 CB 1.470 18 residues pruned to eliminate duplicates Z: 15 46.376 2.377 0.937 0.931 1.000 1.000 C 1.881 15 residues pruned to eliminate duplicates Z: 17 31.328 2.270 0.415 0.941 1.000 0.938 CB 1.692 17 residues pruned to eliminate duplicates Z: 19 31.059 2.203 0.708 0.947 0.944 0.889 CB 1.424 19 residues pruned to eliminate duplicates Z: 19 25.220 2.230 0.824 0.519 0.944 0.556 CB 1.519 Z: 19 52.444 2.316 1.248 0.923 0.944 0.667 C 1.767 19 residues pruned to eliminate duplicates Z: 13 31.171 2.248 0.804 0.879 1.000 0.917 CB 1.608 Z: 18 36.154 2.161 1.091 0.870 0.941 0.824 C 1.505 19 residues pruned to eliminate duplicates Z: 16 37.896 2.290 0.751 0.922 1.000 0.867 CB 1.716 16 residues pruned to eliminate duplicates Z: 20 38.516 2.204 0.853 0.941 1.000 0.947 CB 1.501 20 residues pruned to eliminate duplicates Z: 19 36.597 2.062 0.953 0.934 1.000 0.833 CB 1.494 18 residues pruned to eliminate duplicates Z: 14 45.160 2.394 1.136 0.898 0.923 0.692 C 1.898 18 residues pruned to eliminate duplicates Z: 17 35.540 2.262 0.695 0.882 1.000 0.812 C 1.677 15 residues pruned to eliminate duplicates Z: 17 54.583 2.494 1.029 0.939 1.000 0.938 CB 1.874 17 residues pruned to eliminate duplicates Z: 20 34.231 2.220 0.592 0.950 1.000 0.895 CB 1.532 20 residues pruned to eliminate duplicates Z: 19 42.162 2.257 0.888 0.947 1.000 0.889 CB 1.611 21 residues pruned to eliminate duplicates Z: 18 53.545 2.265 1.213 0.953 1.000 0.941 CB 1.784 19 residues pruned to eliminate duplicates Z: 21 35.811 2.155 0.824 0.910 0.950 0.800 CB 1.521 21 residues pruned to eliminate duplicates Z: 26 21.777 2.289 0.748 0.455 0.800 0.640 CB 1.425 21 residues pruned to eliminate duplicates Z: 15 43.634 2.357 1.002 0.875 1.000 0.786 C 1.798 15 residues pruned to eliminate duplicates Z: 14 44.798 2.525 1.086 0.856 0.923 0.846 C 1.884 14 residues pruned to eliminate duplicates Z: 15 39.539 2.340 0.777 0.920 1.000 0.929 CA 1.790 15 residues pruned to eliminate duplicates Z: 15 39.355 2.399 0.846 0.902 1.000 0.857 C 1.694 15 residues pruned to eliminate duplicates Z: 19 32.608 2.203 0.656 0.943 1.000 0.944 CB 1.460 19 residues pruned to eliminate duplicates Z: 17 36.518 2.104 1.156 0.918 0.938 0.938 C 1.514 17 residues pruned to eliminate duplicates Z: 12 33.022 2.179 0.868 0.882 1.000 0.909 CB 1.769 12 residues pruned to eliminate duplicates Z: 21 23.345 2.166 0.925 0.351 0.950 0.550 CB 1.550 22 residues pruned to eliminate duplicates Z: 16 36.151 2.366 1.000 0.868 0.867 0.667 C 1.664 16 residues pruned to eliminate duplicates Z: 30 26.757 2.304 1.052 0.454 0.862 0.552 CB 1.278 Z: 14 32.932 2.155 0.788 0.864 1.000 0.615 CB 1.739 13 residues pruned to eliminate duplicates Z: 26 18.672 2.219 0.657 0.419 0.760 0.600 CB 1.453 26 residues pruned to eliminate duplicates Z: 18 52.711 2.380 1.064 0.931 1.000 0.824 C 1.818 18 residues pruned to eliminate duplicates Z: 24 23.281 2.345 0.759 0.459 0.783 0.609 CB 1.568 Z: 19 48.491 2.367 0.869 0.921 1.000 0.944 C 1.818 18 residues pruned to eliminate duplicates Z: 15 45.252 2.404 0.993 0.913 1.000 0.857 C 1.786 16 residues pruned to eliminate duplicates Z: 23 22.754 2.097 0.956 0.367 0.909 0.409 CB 1.501 24 residues pruned to eliminate duplicates Z: 15 38.139 2.380 1.032 0.898 0.929 0.857 C 1.624 15 residues pruned to eliminate duplicates Z: 15 41.890 2.367 0.855 0.875 1.000 0.857 C 1.853 15 residues pruned to eliminate duplicates Z: 18 38.116 2.152 1.014 0.936 1.000 0.941 CB 1.486 19 residues pruned to eliminate duplicates Z: 18 47.903 2.373 0.904 0.922 1.000 0.941 CB 1.809 18 residues pruned to eliminate duplicates Z: 16 43.477 2.297 0.955 0.918 1.000 0.867 C 1.764 16 residues pruned to eliminate duplicates Z: 19 45.322 2.131 1.128 0.943 1.000 1.000 CB 1.632 18 residues pruned to eliminate duplicates Z: 8 8.848 2.120 0.392 0.604 0.857 0.714 CB 1.198 Z: 21 23.774 2.018 0.950 0.567 0.900 0.650 CB 1.407 Z: 18 43.191 2.276 0.957 0.939 0.941 0.824 CB 1.737 18 residues pruned to eliminate duplicates Z: 9 20.929 2.290 0.623 0.792 1.000 0.875 CB 1.541 9 residues pruned to eliminate duplicates Z: 42 41.429 2.218 0.681 0.631 0.927 0.756 CB 1.656 26 residues pruned to eliminate duplicates Z: 13 32.716 2.219 0.839 0.877 1.000 0.750 CB 1.681 13 residues pruned to eliminate duplicates Z: 18 30.443 2.168 0.969 0.849 0.882 0.647 C 1.453 18 residues pruned to eliminate duplicates Z: 16 32.703 2.234 0.576 0.889 1.000 0.733 CA 1.728 16 residues pruned to eliminate duplicates Z: 26 42.380 2.319 0.794 0.741 0.960 0.800 CB 1.710 18 residues pruned to eliminate duplicates Z: 17 40.828 2.231 0.974 0.864 1.000 0.750 C 1.699 17 residues pruned to eliminate duplicates Z: 17 39.861 2.203 0.995 0.865 1.000 0.625 C 1.662 17 residues pruned to eliminate duplicates Z: 14 42.711 2.364 1.076 0.886 1.000 0.769 C 1.740 14 residues pruned to eliminate duplicates Z: 41 47.406 2.278 1.059 0.584 0.900 0.675 CB 1.638 10 residues pruned to eliminate duplicates Z: 20 41.827 2.219 1.043 0.923 1.000 0.842 C 1.488 20 residues pruned to eliminate duplicates Z: 16 40.383 2.320 0.895 0.919 1.000 0.733 C 1.671 16 residues pruned to eliminate duplicates Z: 16 59.861 2.506 1.296 0.944 1.000 0.800 CB 1.861 17 residues pruned to eliminate duplicates Z: 19 43.620 2.271 0.929 0.939 1.000 0.833 CB 1.630 19 residues pruned to eliminate duplicates Z: 8 19.517 2.198 0.638 0.817 1.000 0.857 CB 1.555 Z: 27 53.996 2.366 0.901 0.773 1.000 0.769 CB 1.850 18 residues pruned to eliminate duplicates Z: 15 30.779 2.306 0.789 0.895 0.857 0.786 C 1.667 15 residues pruned to eliminate duplicates Z: 19 21.559 2.166 0.852 0.503 0.889 0.389 CB 1.422 20 residues pruned to eliminate duplicates Z: 16 33.208 2.302 0.688 0.860 1.000 0.800 C 1.623 16 residues pruned to eliminate duplicates Z: 6 2.214 1.451 0.519 0.742 0.800 0.800 C 0.452 6 residues pruned to eliminate duplicates Z: 17 50.554 2.397 1.088 0.936 1.000 0.875 C 1.758 17 residues pruned to eliminate duplicates Z: 15 36.241 2.467 0.575 0.917 0.929 0.857 C 1.895 15 residues pruned to eliminate duplicates Z: 19 53.096 2.369 1.155 0.931 1.000 1.000 CB 1.712 19 residues pruned to eliminate duplicates Z: 43 41.592 2.227 0.951 0.574 0.929 0.667 CB 1.482 18 residues pruned to eliminate duplicates Z: 19 32.792 2.191 0.796 0.950 0.944 0.778 CB 1.434 19 residues pruned to eliminate duplicates Z: 24 23.327 2.350 0.950 0.440 0.783 0.652 CB 1.443 26 residues pruned to eliminate duplicates Z: 9 16.795 2.086 0.492 0.837 1.000 0.750 CA 1.427 Z: 15 36.355 2.192 0.793 0.947 1.000 1.000 CB 1.708 15 residues pruned to eliminate duplicates Z: 70 53.541 2.244 1.017 0.553 0.899 0.681 CB 1.505 32 residues pruned to eliminate duplicates Z: 19 31.121 2.214 0.583 0.953 1.000 0.944 CB 1.440 19 residues pruned to eliminate duplicates Z: 21 32.832 2.160 0.556 0.929 1.000 0.900 CB 1.529 21 residues pruned to eliminate duplicates Z: 15 48.660 2.346 1.197 0.924 1.000 1.000 C 1.772 15 residues pruned to eliminate duplicates Z: 18 56.700 2.395 1.135 0.925 1.000 0.882 CA 1.887 18 residues pruned to eliminate duplicates Z: 19 40.170 2.265 0.803 0.952 1.000 0.889 CB 1.598 19 residues pruned to eliminate duplicates Z: 18 33.252 2.099 0.941 0.886 1.000 0.941 C 1.428 18 residues pruned to eliminate duplicates Z: 16 45.295 2.280 1.082 0.904 1.000 0.800 CA 1.754 16 residues pruned to eliminate duplicates Z: 28 31.978 2.279 1.131 0.496 0.889 0.556 CB 1.431 27 residues pruned to eliminate duplicates Z: 18 40.102 2.288 0.850 0.948 1.000 1.000 CB 1.586 18 residues pruned to eliminate duplicates Z: 19 48.655 2.372 0.997 0.906 1.000 0.889 CB 1.721 19 residues pruned to eliminate duplicates Z: 15 45.576 2.348 1.155 0.883 0.929 0.929 C 1.874 15 residues pruned to eliminate duplicates Z: 18 29.097 2.026 0.800 0.876 0.941 0.882 CA 1.495 18 residues pruned to eliminate duplicates Z: 29 37.671 2.251 0.683 0.704 0.929 0.679 CB 1.681 29 residues pruned to eliminate duplicates Z: 19 52.862 2.348 1.187 0.941 1.000 0.667 C 1.683 19 residues pruned to eliminate duplicates Z: 23 27.252 1.933 0.705 0.953 1.000 0.909 CB 1.213 Z: 17 36.104 2.250 1.009 0.866 0.938 0.750 C 1.559 17 residues pruned to eliminate duplicates Z: 11 20.197 2.152 0.911 0.486 0.900 0.800 CB 1.750 11 residues pruned to eliminate duplicates Z: 17 38.177 2.212 1.033 0.877 1.000 0.812 C 1.542 17 residues pruned to eliminate duplicates Z: 7 19.225 2.284 0.656 0.872 1.000 1.000 CB 1.511 7 residues pruned to eliminate duplicates Z: 16 32.693 2.187 0.784 0.815 0.933 0.800 CA 1.762 16 residues pruned to eliminate duplicates Z: 18 28.858 2.102 0.911 0.863 0.941 0.882 C 1.358 18 residues pruned to eliminate duplicates Z: 16 42.356 2.311 1.003 0.866 1.000 0.867 CA 1.730 16 residues pruned to eliminate duplicates Z: 10 24.374 1.942 1.162 0.839 1.000 0.667 CB 1.445 7 residues pruned to eliminate duplicates Z: 12 37.066 2.333 0.786 0.907 1.000 1.000 CA 1.907 12 residues pruned to eliminate duplicates Z: 18 35.793 2.222 0.813 0.944 1.000 0.824 CB 1.492 18 residues pruned to eliminate duplicates Z: 18 44.548 2.276 1.032 0.948 1.000 0.941 CB 1.613 20 residues pruned to eliminate duplicates Z: 14 38.585 2.494 1.035 0.909 0.846 0.769 C 1.768 14 residues pruned to eliminate duplicates Z: 15 45.042 2.351 0.929 0.935 1.000 0.929 CA 1.850 16 residues pruned to eliminate duplicates Z: 22 37.077 2.068 0.883 0.922 1.000 0.905 CB 1.462 Z: 15 52.583 2.392 1.183 0.924 1.000 0.929 CB 1.891 15 residues pruned to eliminate duplicates Z: 16 41.167 2.224 1.139 0.822 1.000 0.867 C 1.690 16 residues pruned to eliminate duplicates Z: 18 43.335 2.389 0.786 0.916 1.000 0.882 CB 1.740 17 residues pruned to eliminate duplicates Z: 17 21.891 2.009 0.550 0.832 0.938 0.812 CB 1.407 17 residues pruned to eliminate duplicates Z: 13 29.457 2.275 0.602 0.873 1.000 0.917 CB 1.700 13 residues pruned to eliminate duplicates Z: 23 42.928 2.053 1.350 0.926 1.000 0.955 CB 1.331 23 residues pruned to eliminate duplicates Z: 14 45.470 2.375 1.171 0.864 1.000 0.769 C 1.793 14 residues pruned to eliminate duplicates Z: 12 36.629 2.283 1.042 0.905 1.000 0.909 CB 1.686 8 residues pruned to eliminate duplicates Z: 118 67.260 2.176 1.015 0.584 0.923 0.650 CB 1.417 105 residues pruned to eliminate duplicates Z: 7 9.178 1.976 0.105 0.817 1.000 1.000 CB 1.303 7 residues pruned to eliminate duplicates Z: 76 50.406 2.193 0.884 0.616 0.907 0.733 CB 1.392 76 residues pruned to eliminate duplicates Z: 27 50.011 2.367 0.884 0.782 0.962 0.846 CB 1.784 27 residues pruned to eliminate duplicates Z: 17 37.840 2.227 0.771 0.895 1.000 0.938 CA 1.719 17 residues pruned to eliminate duplicates Z: 13 30.190 2.167 0.731 0.923 1.000 1.000 CB 1.633 13 residues pruned to eliminate duplicates Z: 15 43.901 2.336 0.995 0.908 1.000 0.786 CA 1.789 15 residues pruned to eliminate duplicates Z: 16 40.919 2.292 0.982 0.906 1.000 0.800 CA 1.654 15 residues pruned to eliminate duplicates Z: 18 31.114 2.091 0.922 0.854 0.941 0.706 C 1.473 18 residues pruned to eliminate duplicates Z: 17 28.114 2.020 0.697 0.921 1.000 0.938 CA 1.443 17 residues pruned to eliminate duplicates Z: 15 42.097 2.396 0.995 0.845 0.929 0.714 C 1.884 15 residues pruned to eliminate duplicates Z: 14 35.002 2.152 0.911 0.905 1.000 0.538 CB 1.680 14 residues pruned to eliminate duplicates Z: 16 47.640 2.310 1.111 0.924 1.000 1.000 CA 1.771 16 residues pruned to eliminate duplicates Z: 19 39.205 2.124 0.941 0.924 1.000 0.778 CB 1.574 19 residues pruned to eliminate duplicates Z: 29 40.911 2.292 0.694 0.723 0.929 0.786 CB 1.754 29 residues pruned to eliminate duplicates Z: 8 18.741 1.933 1.041 0.867 1.000 0.857 CB 1.314 7 residues pruned to eliminate duplicates Z: 19 41.033 2.331 0.656 0.937 1.000 0.944 CB 1.743 19 residues pruned to eliminate duplicates Z: 42 47.817 2.239 0.803 0.644 0.976 0.732 CB 1.658 34 residues pruned to eliminate duplicates Z: 19 50.913 2.252 1.281 0.955 1.000 0.778 CB 1.604 19 residues pruned to eliminate duplicates Z: 16 24.883 2.392 0.853 0.540 0.800 0.400 CB 1.742 9 residues pruned to eliminate duplicates Z: 25 33.237 1.992 0.836 0.934 1.000 0.958 CB 1.294 25 residues pruned to eliminate duplicates Z: 16 52.808 2.317 1.379 0.897 1.000 0.800 CA 1.771 16 residues pruned to eliminate duplicates Z: 16 36.261 2.254 0.807 0.889 1.000 0.933 CA 1.655 16 residues pruned to eliminate duplicates Z: 19 25.748 2.384 0.709 0.511 0.889 0.722 CB 1.658 19 residues pruned to eliminate duplicates Z: 20 38.735 2.211 0.835 0.948 1.000 0.895 CB 1.512 20 residues pruned to eliminate duplicates Z: 16 45.996 2.311 1.100 0.884 1.000 0.600 CA 1.769 16 residues pruned to eliminate duplicates Z: 15 38.993 2.414 0.882 0.911 0.929 0.786 C 1.750 15 residues pruned to eliminate duplicates Z: 44 41.820 2.087 0.735 0.624 0.977 0.698 CB 1.605 18 residues pruned to eliminate duplicates Z: 19 40.076 2.226 1.020 0.949 1.000 0.833 CB 1.449 19 residues pruned to eliminate duplicates Z: 16 36.789 2.198 1.109 0.888 1.000 0.867 C 1.476 16 residues pruned to eliminate duplicates Z: 17 38.254 2.187 1.138 0.868 0.938 0.812 C 1.595 17 residues pruned to eliminate duplicates Z: 7 13.222 2.106 0.184 0.848 1.000 1.000 CB 1.607 7 residues pruned to eliminate duplicates Z: 19 35.761 2.145 0.713 0.939 1.000 0.889 CB 1.595 19 residues pruned to eliminate duplicates Z: 8 10.377 2.094 0.722 0.402 0.857 0.571 CB 1.406 8 residues pruned to eliminate duplicates Z: 16 37.305 2.155 0.911 0.882 1.000 0.867 CA 1.693 16 residues pruned to eliminate duplicates Z: 12 28.898 2.229 0.670 0.890 1.000 0.909 CB 1.683 12 residues pruned to eliminate duplicates Z: 18 53.423 2.340 1.347 0.944 1.000 0.941 CB 1.633 18 residues pruned to eliminate duplicates Z: 27 25.065 2.260 1.103 0.417 0.769 0.462 CB 1.466 26 residues pruned to eliminate duplicates Z: 18 44.168 2.274 1.052 0.960 1.000 0.824 CB 1.573 18 residues pruned to eliminate duplicates Z: 16 28.874 2.086 0.607 0.894 1.000 0.800 CA 1.596 16 residues pruned to eliminate duplicates Z: 18 48.270 2.365 1.134 0.931 0.941 0.824 C 1.723 18 residues pruned to eliminate duplicates Z: 16 43.524 2.360 0.898 0.921 1.000 0.867 C 1.766 15 residues pruned to eliminate duplicates Z: 23 30.836 1.981 0.678 0.937 1.000 0.955 CB 1.376 23 residues pruned to eliminate duplicates Z: 19 38.131 2.110 0.876 0.925 1.000 0.889 CB 1.593 19 residues pruned to eliminate duplicates Z: 18 46.000 2.278 1.115 0.960 1.000 0.941 CB 1.585 18 residues pruned to eliminate duplicates Z: 35 47.951 2.293 1.077 0.687 0.882 0.706 CB 1.649 35 residues pruned to eliminate duplicates Z: 13 25.413 2.236 0.404 0.886 1.000 0.917 CB 1.687 13 residues pruned to eliminate duplicates Z: 7 22.636 2.269 0.863 0.886 1.000 0.667 CB 1.577 7 residues pruned to eliminate duplicates Z: 19 32.478 2.104 0.642 0.908 1.000 0.778 CB 1.573 19 residues pruned to eliminate duplicates Z: 99 65.522 2.209 1.005 0.619 0.888 0.633 CB 1.504 132 residues pruned to eliminate duplicates Z: 45 39.737 2.077 0.742 0.620 0.977 0.727 CB 1.513 45 residues pruned to eliminate duplicates Z: 16 32.559 2.090 0.806 0.923 1.000 1.000 CB 1.565 16 residues pruned to eliminate duplicates Z: 19 45.468 2.348 0.873 0.917 1.000 0.944 CB 1.720 19 residues pruned to eliminate duplicates Z: 11 9.333 1.880 0.579 0.284 0.800 0.400 CB 1.584 11 residues pruned to eliminate duplicates Z: 24 16.402 2.273 0.797 0.317 0.696 0.478 CB 1.473 24 residues pruned to eliminate duplicates Z: 24 15.021 2.141 0.751 0.417 0.826 0.478 CB 1.103 17 residues pruned to eliminate duplicates Z: 28 39.604 2.282 0.739 0.758 0.926 0.741 CB 1.650 28 residues pruned to eliminate duplicates Z: 23 33.546 2.044 0.890 0.914 1.000 0.955 CB 1.310 23 residues pruned to eliminate duplicates Z: 15 55.161 2.345 1.453 0.925 1.000 0.929 CA 1.799 15 residues pruned to eliminate duplicates Z: 16 48.003 2.349 1.102 0.922 1.000 0.933 CA 1.765 16 residues pruned to eliminate duplicates Z: 16 61.090 2.507 1.310 0.939 1.000 0.867 CB 1.892 16 residues pruned to eliminate duplicates Z: 38 25.187 2.098 0.622 0.436 0.865 0.595 CB 1.503 Z: 48 35.566 2.089 0.991 0.522 0.872 0.617 CB 1.399 37 residues pruned to eliminate duplicates Z: 16 45.631 2.320 0.977 0.961 1.000 1.000 CB 1.758 16 residues pruned to eliminate duplicates Z: 31 36.804 2.179 0.661 0.649 0.933 0.733 CB 1.731 31 residues pruned to eliminate duplicates Z: 16 34.844 2.135 0.818 0.896 1.000 1.000 CA 1.661 16 residues pruned to eliminate duplicates Z: 19 39.651 2.118 1.048 0.938 1.000 0.889 CB 1.499 19 residues pruned to eliminate duplicates Z: 23 38.785 2.025 1.019 0.908 1.000 0.864 CB 1.437 22 residues pruned to eliminate duplicates Z: 6 11.887 2.210 0.211 0.875 0.800 0.800 CB 1.806 6 residues pruned to eliminate duplicates Z: 33 40.470 2.216 0.910 0.655 0.906 0.688 CB 1.615 33 residues pruned to eliminate duplicates Z: 7 19.847 2.268 0.718 0.886 1.000 1.000 CB 1.500 8 residues pruned to eliminate duplicates Z: 16 37.269 2.094 1.095 0.861 1.000 0.867 CA 1.612 16 residues pruned to eliminate duplicates Z: 19 35.114 2.208 0.686 0.909 0.944 0.722 CB 1.671 19 residues pruned to eliminate duplicates Z: 29 29.061 2.117 0.743 0.533 0.964 0.536 CB 1.494 29 residues pruned to eliminate duplicates Z: 17 23.398 2.040 0.380 0.877 1.000 1.000 CA 1.509 17 residues pruned to eliminate duplicates Z: 28 38.519 2.294 0.541 0.717 0.963 0.778 CB 1.790 28 residues pruned to eliminate duplicates Z: 24 32.503 1.961 0.779 0.921 0.957 0.870 CB 1.429 23 residues pruned to eliminate duplicates Z: 25 12.969 2.090 0.448 0.337 0.875 0.500 CB 1.194 25 residues pruned to eliminate duplicates Z: 19 50.056 2.268 1.192 0.954 1.000 0.889 CB 1.632 Z: 35 25.893 2.080 0.716 0.456 0.882 0.588 CB 1.475 28 residues pruned to eliminate duplicates Z: 41 27.483 2.055 0.635 0.446 0.925 0.625 CB 1.478 40 residues pruned to eliminate duplicates Z: 15 34.997 2.214 0.836 0.894 1.000 0.786 C 1.650 14 residues pruned to eliminate duplicates Z: 74 47.173 2.188 0.862 0.529 0.863 0.603 CB 1.526 76 residues pruned to eliminate duplicates Z: 24 38.329 1.953 1.031 0.911 1.000 0.957 CB 1.428 24 residues pruned to eliminate duplicates Z: 8 10.423 1.794 0.274 0.835 1.000 0.714 CB 1.291 8 residues pruned to eliminate duplicates Z: 16 42.212 2.228 1.069 0.908 1.000 0.733 C 1.679 16 residues pruned to eliminate duplicates Z: 35 23.170 2.080 0.565 0.436 0.853 0.618 CB 1.529 13 residues pruned to eliminate duplicates Z: 16 47.826 2.294 1.278 0.901 1.000 0.733 CA 1.686 16 residues pruned to eliminate duplicates Z: 12 29.481 2.295 0.638 0.910 1.000 0.818 CB 1.677 12 residues pruned to eliminate duplicates Z: 6 7.465 2.064 0.343 0.387 1.000 0.800 CB 1.358 Z: 11 13.646 1.779 0.403 0.790 1.000 0.700 CA 1.341 11 residues pruned to eliminate duplicates Z: 18 49.853 2.207 1.302 0.936 1.000 0.882 CB 1.657 18 residues pruned to eliminate duplicates Z: 8 12.532 1.919 0.224 0.806 1.000 0.571 CA 1.545 8 residues pruned to eliminate duplicates Z: 65 39.082 2.094 0.792 0.562 0.875 0.641 CB 1.401 55 residues pruned to eliminate duplicates Z: 13 11.856 1.898 0.455 0.462 0.917 0.417 CB 1.405 4 residues pruned to eliminate duplicates Z: 17 36.399 2.112 1.137 0.879 0.938 0.812 CB 1.560 17 residues pruned to eliminate duplicates Z: 147 65.051 2.141 0.809 0.543 0.925 0.685 CB 1.441 154 residues pruned to eliminate duplicates Z: 7 10.868 1.992 0.175 0.848 1.000 1.000 C 1.407 7 residues pruned to eliminate duplicates Z: 23 41.144 2.053 1.304 0.925 1.000 0.955 CB 1.301 23 residues pruned to eliminate duplicates Z: 16 23.407 2.082 0.294 0.943 1.000 0.933 CA 1.555 16 residues pruned to eliminate duplicates Z: 47 42.402 2.312 0.893 0.591 0.870 0.674 CB 1.506 47 residues pruned to eliminate duplicates Z: 29 35.515 2.221 0.840 0.697 0.857 0.750 CB 1.601 29 residues pruned to eliminate duplicates Z: 16 38.001 2.195 0.891 0.940 1.000 0.800 CB 1.641 16 residues pruned to eliminate duplicates Z: 35 26.980 2.137 0.755 0.478 0.882 0.794 CB 1.430 35 residues pruned to eliminate duplicates Z: 19 43.596 2.253 1.129 0.944 0.944 0.889 CB 1.571 19 residues pruned to eliminate duplicates Z: 16 43.042 2.268 1.263 0.843 1.000 0.733 C 1.612 16 residues pruned to eliminate duplicates Z: 17 33.688 2.047 1.008 0.923 1.000 0.750 CA 1.440 17 residues pruned to eliminate duplicates Z: 19 49.908 2.128 1.391 0.947 1.000 0.944 CB 1.597 19 residues pruned to eliminate duplicates Z: 16 39.826 2.266 0.832 0.916 1.000 1.000 CA 1.749 16 residues pruned to eliminate duplicates Z: 33 52.069 2.291 1.109 0.694 0.938 0.656 CB 1.702 33 residues pruned to eliminate duplicates Z: 41 44.759 2.235 1.071 0.599 0.900 0.675 CB 1.545 41 residues pruned to eliminate duplicates Z: 19 46.934 2.214 1.088 0.892 1.000 0.944 CB 1.719 19 residues pruned to eliminate duplicates Z: 17 29.991 1.982 0.754 0.921 1.000 0.875 CA 1.517 17 residues pruned to eliminate duplicates Z: 23 38.936 2.245 0.969 0.667 0.955 0.727 C 1.685 19 residues pruned to eliminate duplicates Z: 10 5.918 1.976 0.459 0.370 0.889 0.444 CB 0.885 10 residues pruned to eliminate duplicates Z: 7 12.647 2.089 0.205 0.817 1.000 0.833 C 1.558 7 residues pruned to eliminate duplicates Z: 17 36.974 2.100 0.943 0.928 1.000 0.938 CB 1.586 17 residues pruned to eliminate duplicates Z: 6 10.356 1.936 0.339 0.875 1.000 0.600 CB 1.299 6 residues pruned to eliminate duplicates Z: 11 14.240 2.167 0.610 0.571 0.800 0.300 CB 1.506 10 residues pruned to eliminate duplicates Z: 24 26.977 1.979 0.478 0.920 1.000 0.913 CB 1.354 24 residues pruned to eliminate duplicates Z: 19 47.969 2.115 1.294 0.943 1.000 0.833 CB 1.615 19 residues pruned to eliminate duplicates Z: 18 32.889 2.001 0.939 0.896 1.000 0.765 CB 1.472 18 residues pruned to eliminate duplicates Z: 27 26.506 2.057 0.807 0.492 0.962 0.615 CB 1.467 27 residues pruned to eliminate duplicates Z: 33 53.470 2.248 1.258 0.675 0.969 0.719 CB 1.636 33 residues pruned to eliminate duplicates Z: 17 26.639 2.048 0.674 0.881 0.938 0.812 CA 1.501 17 residues pruned to eliminate duplicates Z: 33 22.929 2.011 0.549 0.474 0.875 0.750 CB 1.527 33 residues pruned to eliminate duplicates Z: 17 31.343 2.033 0.895 0.914 1.000 0.812 CA 1.439 17 residues pruned to eliminate duplicates Z: 28 31.649 2.332 0.970 0.500 0.815 0.667 CB 1.627 24 residues pruned to eliminate duplicates Z: 28 27.377 2.195 1.112 0.458 0.926 0.519 CB 1.282 28 residues pruned to eliminate duplicates Z: 8 12.076 1.812 0.657 0.726 1.000 0.571 C 1.240 8 residues pruned to eliminate duplicates Z: 16 29.339 2.120 0.677 0.940 1.000 1.000 CA 1.480 16 residues pruned to eliminate duplicates Z: 17 41.425 2.190 1.137 0.882 1.000 0.875 CA 1.601 17 residues pruned to eliminate duplicates Z: 19 35.410 2.081 0.849 0.936 1.000 1.000 CB 1.510 19 residues pruned to eliminate duplicates Z: 24 35.553 2.020 0.860 0.880 1.000 0.739 CB 1.430 24 residues pruned to eliminate duplicates Z: 14 40.674 2.383 0.975 0.914 0.923 0.846 C 1.835 14 residues pruned to eliminate duplicates Z: 16 37.388 2.211 0.818 0.938 1.000 0.933 CA 1.671 16 residues pruned to eliminate duplicates Z: 10 15.336 1.836 0.800 0.799 1.000 0.778 CA 1.191 10 residues pruned to eliminate duplicates Z: 24 33.312 2.008 0.874 0.919 1.000 0.913 CB 1.301 24 residues pruned to eliminate duplicates Z: 24 40.823 1.994 1.416 0.924 1.000 0.870 CB 1.241 24 residues pruned to eliminate duplicates Z: 18 45.014 2.219 1.205 0.943 1.000 0.588 CB 1.546 18 residues pruned to eliminate duplicates Z: 19 37.191 2.128 0.888 0.927 1.000 0.944 CB 1.529 19 residues pruned to eliminate duplicates Z: 147 63.503 2.138 0.835 0.521 0.904 0.616 CB 1.451 147 residues pruned to eliminate duplicates Z: 55 29.257 2.070 0.652 0.428 0.889 0.519 CB 1.412 55 residues pruned to eliminate duplicates Z: 17 33.327 2.071 1.031 0.905 0.938 0.812 CA 1.504 17 residues pruned to eliminate duplicates Z: 17 36.426 2.090 1.060 0.894 1.000 0.750 CB 1.518 17 residues pruned to eliminate duplicates Z: 8 19.166 2.027 0.667 0.913 1.000 0.857 CA 1.517 8 residues pruned to eliminate duplicates Z: 10 15.719 1.943 0.551 0.899 0.889 0.667 CA 1.399 10 residues pruned to eliminate duplicates Z: 19 44.875 2.102 1.183 0.938 1.000 0.889 CB 1.604 19 residues pruned to eliminate duplicates Z: 8 8.092 1.621 0.414 0.808 0.857 0.714 CA 1.190 Z: 55 48.284 2.252 0.985 0.598 0.889 0.722 CB 1.506 55 residues pruned to eliminate duplicates Z: 18 41.013 2.329 0.920 0.919 0.941 0.647 C 1.666 18 residues pruned to eliminate duplicates Z: 15 53.030 2.366 1.482 0.910 0.929 0.857 C 1.843 15 residues pruned to eliminate duplicates Z: 24 36.218 1.974 0.965 0.909 1.000 0.783 CB 1.381 24 residues pruned to eliminate duplicates Z: 29 25.507 2.227 0.897 0.425 0.857 0.500 CB 1.439 29 residues pruned to eliminate duplicates Z: 9 15.698 2.010 0.493 0.867 1.000 1.000 CB 1.353 9 residues pruned to eliminate duplicates Z: 13 29.813 2.184 0.976 0.876 1.000 0.917 CB 1.449 13 residues pruned to eliminate duplicates Z: 38 41.927 2.106 0.981 0.623 0.946 0.649 CB 1.555 38 residues pruned to eliminate duplicates Z: 24 38.205 1.984 1.161 0.919 0.957 0.783 CB 1.369 24 residues pruned to eliminate duplicates Z: 17 34.616 2.094 0.929 0.908 1.000 0.938 CA 1.522 17 residues pruned to eliminate duplicates Z: 24 39.155 2.009 1.262 0.928 1.000 0.957 CB 1.258 24 residues pruned to eliminate duplicates Z: 23 31.951 2.253 0.758 0.611 0.955 0.727 CB 1.622 23 residues pruned to eliminate duplicates Z: 17 34.107 2.117 0.871 0.915 1.000 0.875 CB 1.521 17 residues pruned to eliminate duplicates Z: 10 12.389 2.044 0.742 0.395 0.889 0.444 CA 1.457 10 residues pruned to eliminate duplicates Z: 16 14.468 2.107 0.729 0.415 0.867 0.600 CB 1.293 10 residues pruned to eliminate duplicates Z: 17 31.948 2.030 0.873 0.919 1.000 1.000 CA 1.480 17 residues pruned to eliminate duplicates Z: 9 15.961 1.962 0.588 0.911 1.000 0.750 CA 1.283 9 residues pruned to eliminate duplicates Z: 32 51.471 2.224 1.136 0.700 0.968 0.742 CB 1.676 32 residues pruned to eliminate duplicates Z: 18 19.382 2.292 0.808 0.398 0.882 0.588 CB 1.432 18 residues pruned to eliminate duplicates Z: 51 31.349 2.230 0.812 0.435 0.880 0.540 CB 1.333 60 residues pruned to eliminate duplicates Z: 15 36.304 2.092 1.019 0.944 1.000 0.929 CA 1.590 15 residues pruned to eliminate duplicates Z: 37 37.312 2.203 1.010 0.598 0.861 0.583 CB 1.486 37 residues pruned to eliminate duplicates Z: 23 40.690 1.994 1.083 0.949 1.000 0.955 CB 1.442 23 residues pruned to eliminate duplicates Z: 42 43.001 2.107 1.106 0.616 0.902 0.683 CB 1.502 42 residues pruned to eliminate duplicates Z: 24 23.053 2.305 0.877 0.417 0.826 0.609 CB 1.466 24 residues pruned to eliminate duplicates Z: 23 21.830 2.335 0.934 0.438 0.818 0.682 CB 1.343 23 residues pruned to eliminate duplicates Z: 67 48.919 2.164 0.807 0.562 0.894 0.697 CB 1.622 67 residues pruned to eliminate duplicates Z: 24 37.086 1.924 1.091 0.927 1.000 0.739 CB 1.347 24 residues pruned to eliminate duplicates Z: 16 29.451 2.118 0.873 0.854 0.933 0.867 CB 1.517 16 residues pruned to eliminate duplicates Z: 10 16.480 1.850 0.611 0.917 1.000 1.000 CB 1.301 10 residues pruned to eliminate duplicates Z: 10 16.209 1.884 0.604 0.851 1.000 0.778 CB 1.324 10 residues pruned to eliminate duplicates Z: 23 23.122 2.051 0.556 0.470 1.000 0.591 CB 1.592 23 residues pruned to eliminate duplicates Z: 30 19.324 2.016 0.498 0.544 0.793 0.517 CB 1.436 30 residues pruned to eliminate duplicates Z: 16 39.275 2.157 1.053 0.947 1.000 0.933 CA 1.582 16 residues pruned to eliminate duplicates Z: 8 16.370 2.053 1.550 0.802 0.857 0.714 CB 1.059 Z: 32 43.716 2.115 0.996 0.776 0.968 0.774 CB 1.507 32 residues pruned to eliminate duplicates Z: 9 9.541 1.737 0.262 0.811 1.000 0.750 CB 1.174 9 residues pruned to eliminate duplicates Z: 19 38.227 2.123 1.002 0.917 0.944 0.667 CB 1.584 19 residues pruned to eliminate duplicates Z: 19 45.338 2.289 1.068 0.943 0.944 0.944 CB 1.656 19 residues pruned to eliminate duplicates Z: 42 49.511 2.181 1.078 0.618 0.927 0.683 CB 1.646 24 residues pruned to eliminate duplicates Z: 31 22.671 2.122 0.845 0.455 0.833 0.567 CB 1.329 31 residues pruned to eliminate duplicates Z: 16 43.584 2.249 1.324 0.878 0.933 0.667 C 1.674 16 residues pruned to eliminate duplicates Z: 24 18.230 2.250 0.745 0.437 0.870 0.522 CB 1.188 24 residues pruned to eliminate duplicates Z: 8 13.926 1.849 0.538 0.802 1.000 0.857 CB 1.422 8 residues pruned to eliminate duplicates Z: 31 48.557 2.285 1.200 0.672 0.933 0.667 CB 1.612 31 residues pruned to eliminate duplicates Z: 18 37.872 2.157 0.941 0.949 1.000 1.000 CB 1.514 18 residues pruned to eliminate duplicates Z: 25 19.199 2.254 0.782 0.382 0.792 0.500 CB 1.397 25 residues pruned to eliminate duplicates Z: 13 38.765 2.362 0.740 0.927 1.000 0.917 CA 1.908 13 residues pruned to eliminate duplicates Z: 18 38.070 2.030 1.151 0.920 1.000 0.882 CB 1.489 18 residues pruned to eliminate duplicates Z: 19 44.496 2.129 1.180 0.933 1.000 0.833 CB 1.578 19 residues pruned to eliminate duplicates Z: 16 45.854 2.333 1.135 0.870 1.000 0.733 CA 1.736 16 residues pruned to eliminate duplicates Z: 23 42.797 2.052 1.290 0.948 1.000 0.864 CB 1.341 23 residues pruned to eliminate duplicates Z: 24 39.442 1.995 1.081 0.925 1.000 0.826 CB 1.390 24 residues pruned to eliminate duplicates Z: 16 40.484 2.206 0.989 0.922 1.000 0.933 CB 1.676 16 residues pruned to eliminate duplicates Z: 8 6.213 1.977 0.318 0.492 0.714 0.286 CA 1.272 8 residues pruned to eliminate duplicates Z: 37 43.986 2.134 1.071 0.658 0.944 0.667 CB 1.517 37 residues pruned to eliminate duplicates Z: 27 31.060 2.156 0.762 0.537 0.962 0.731 CB 1.608 27 residues pruned to eliminate duplicates Z: 19 47.250 2.133 1.248 0.932 1.000 0.722 CB 1.621 19 residues pruned to eliminate duplicates Z: 17 41.739 2.421 0.741 0.891 1.000 0.812 CB 1.781 17 residues pruned to eliminate duplicates Z: 7 12.023 1.943 0.593 0.679 0.833 0.667 CB 1.613 7 residues pruned to eliminate duplicates Z: 17 16.569 2.004 0.689 0.410 0.938 0.562 CB 1.435 17 residues pruned to eliminate duplicates Z: 20 29.178 2.173 0.487 0.928 1.000 0.842 CB 1.451 20 residues pruned to eliminate duplicates Z: 13 14.848 2.257 0.390 0.501 0.833 0.583 CB 1.638 13 residues pruned to eliminate duplicates Z: 24 25.134 1.932 0.467 0.909 0.957 0.913 CB 1.372 24 residues pruned to eliminate duplicates Z: 19 41.625 2.106 1.170 0.938 0.944 0.722 CB 1.580 19 residues pruned to eliminate duplicates Z: 20 19.220 2.114 0.512 0.426 0.947 0.421 CA 1.573 20 residues pruned to eliminate duplicates Z: 20 43.682 2.055 1.239 0.942 1.000 0.895 CB 1.511 20 residues pruned to eliminate duplicates Z: 10 10.974 1.803 0.414 0.556 0.889 0.778 C 1.530 8 residues pruned to eliminate duplicates Z: 13 26.828 2.155 0.547 0.918 1.000 1.000 CB 1.638 12 residues pruned to eliminate duplicates Z: 7 25.425 2.262 1.142 0.893 1.000 1.000 CB 1.538 7 residues pruned to eliminate duplicates Z: 58 48.101 2.238 1.013 0.557 0.895 0.684 CB 1.496 58 residues pruned to eliminate duplicates Z: 39 30.028 2.284 0.788 0.446 0.763 0.421 CB 1.653 39 residues pruned to eliminate duplicates Z: 18 41.503 2.253 0.967 0.950 1.000 0.882 CB 1.566 18 residues pruned to eliminate duplicates Z: 14 22.511 2.033 0.565 0.854 1.000 0.923 CB 1.449 14 residues pruned to eliminate duplicates Z: 13 28.401 2.150 0.895 0.881 1.000 1.000 CB 1.457 13 residues pruned to eliminate duplicates Z: 15 42.670 2.432 0.788 0.937 1.000 0.786 C 1.826 16 residues pruned to eliminate duplicates Z: 16 47.446 2.214 1.274 0.919 1.000 0.800 CA 1.714 16 residues pruned to eliminate duplicates Z: 35 41.148 2.208 0.937 0.596 0.941 0.647 CB 1.600 35 residues pruned to eliminate duplicates Z: 23 40.054 2.034 0.953 0.947 1.000 0.864 CB 1.485 23 residues pruned to eliminate duplicates Z: 68 48.127 2.155 0.882 0.532 0.910 0.687 CB 1.543 68 residues pruned to eliminate duplicates Z: 13 17.303 1.817 0.688 0.837 0.917 0.833 CA 1.329 13 residues pruned to eliminate duplicates Z: 28 32.341 2.230 0.494 0.742 0.963 0.815 CB 1.561 28 residues pruned to eliminate duplicates Z: 18 33.550 1.967 1.124 0.911 0.941 0.765 CB 1.466 18 residues pruned to eliminate duplicates Z: 17 32.832 2.007 0.982 0.920 1.000 0.875 CA 1.452 17 residues pruned to eliminate duplicates Z: 29 42.761 2.301 0.767 0.750 0.929 0.786 CB 1.712 29 residues pruned to eliminate duplicates Z: 26 35.381 2.107 1.235 0.706 0.920 0.760 CB 1.355 24 residues pruned to eliminate duplicates Z: 38 24.859 2.013 0.578 0.446 0.865 0.676 CB 1.572 38 residues pruned to eliminate duplicates Z: 34 25.486 2.090 0.619 0.405 0.939 0.636 CB 1.543 34 residues pruned to eliminate duplicates Z: 16 36.027 2.137 0.949 0.933 1.000 0.867 CA 1.558 16 residues pruned to eliminate duplicates Z: 24 20.214 2.115 0.729 0.479 0.913 0.696 CB 1.290 24 residues pruned to eliminate duplicates Z: 14 39.018 2.459 0.862 0.916 0.923 0.692 CB 1.809 14 residues pruned to eliminate duplicates Z: 8 13.247 2.063 1.096 0.588 0.714 0.571 CB 1.489 8 residues pruned to eliminate duplicates Z: 11 9.196 1.926 1.132 0.496 0.800 0.600 CB 0.889 11 residues pruned to eliminate duplicates Z: 28 39.401 2.182 0.933 0.634 0.963 0.556 CB 1.646 28 residues pruned to eliminate duplicates Z: 24 31.566 1.970 0.883 0.901 1.000 0.957 CB 1.266 24 residues pruned to eliminate duplicates Z: 53 26.325 2.055 0.550 0.471 0.865 0.654 CB 1.364 53 residues pruned to eliminate duplicates Z: 18 45.443 2.275 1.133 0.867 0.941 0.882 CB 1.765 18 residues pruned to eliminate duplicates Z: 41 33.643 2.214 1.027 0.416 0.800 0.450 CB 1.618 35 residues pruned to eliminate duplicates Z: 16 50.343 2.336 1.149 0.883 1.000 0.800 C 1.872 16 residues pruned to eliminate duplicates Z: 22 44.841 2.099 1.295 0.952 1.000 0.857 CB 1.399 22 residues pruned to eliminate duplicates Z: 9 13.617 1.957 0.331 0.896 1.000 1.000 CA 1.325 9 residues pruned to eliminate duplicates Z: 27 43.993 2.276 0.821 0.729 1.000 0.808 CB 1.693 27 residues pruned to eliminate duplicates Z: 33 54.013 2.183 1.177 0.701 0.969 0.844 CA 1.727 33 residues pruned to eliminate duplicates Z: 14 25.041 2.045 0.919 0.569 1.000 0.615 CB 1.655 14 residues pruned to eliminate duplicates Z: 13 32.570 2.143 1.307 0.906 0.917 0.833 CB 1.476 13 residues pruned to eliminate duplicates Z: 9 26.299 1.941 1.366 0.853 1.000 0.750 C 1.496 9 residues pruned to eliminate duplicates Z: 10 8.587 1.686 0.303 0.657 0.889 0.444 CA 1.267 10 residues pruned to eliminate duplicates Z: 17 25.592 2.016 0.513 0.936 1.000 0.938 CA 1.460 17 residues pruned to eliminate duplicates Z: 19 31.649 2.066 1.227 0.861 0.944 0.778 C 1.261 19 residues pruned to eliminate duplicates Z: 18 46.955 2.191 1.173 0.947 1.000 0.647 CB 1.653 18 residues pruned to eliminate duplicates Z: 38 25.374 2.073 0.577 0.469 0.946 0.730 CB 1.393 38 residues pruned to eliminate duplicates Z: 17 35.921 2.018 1.097 0.903 1.000 0.812 CA 1.512 17 residues pruned to eliminate duplicates Z: 23 41.357 2.048 1.325 0.932 1.000 0.864 CB 1.292 23 residues pruned to eliminate duplicates Z: 23 33.199 2.008 0.672 0.956 1.000 1.000 CB 1.448 23 residues pruned to eliminate duplicates Z: 12 5.970 1.806 0.431 0.247 0.909 0.364 CB 1.025 12 residues pruned to eliminate duplicates Z: 8 6.514 1.899 0.365 0.438 0.714 0.571 CA 1.418 8 residues pruned to eliminate duplicates Z: 9 9.716 1.887 0.710 0.657 0.750 0.625 CB 1.227 9 residues pruned to eliminate duplicates Z: 10 9.332 1.978 0.786 0.457 0.889 0.556 CB 1.035 10 residues pruned to eliminate duplicates Z: 27 24.157 2.100 0.645 0.462 0.885 0.692 CB 1.610 27 residues pruned to eliminate duplicates Z: 12 15.309 2.095 1.125 0.500 0.727 0.455 CB 1.425 9 residues pruned to eliminate duplicates Z: 17 38.957 2.406 0.717 0.911 0.938 0.938 CB 1.782 17 residues pruned to eliminate duplicates Z: 19 47.593 2.123 1.309 0.932 1.000 0.833 CB 1.598 19 residues pruned to eliminate duplicates Z: 19 44.848 2.319 0.971 0.904 0.944 0.778 C 1.743 19 residues pruned to eliminate duplicates Z: 13 24.823 2.099 0.668 0.888 1.000 1.000 CB 1.474 13 residues pruned to eliminate duplicates Z: 9 14.192 1.874 0.384 0.873 1.000 0.875 CA 1.409 9 residues pruned to eliminate duplicates Z: 8 27.778 2.267 1.076 0.889 1.000 0.857 CB 1.607 8 residues pruned to eliminate duplicates Z: 16 32.458 2.082 0.848 0.907 1.000 0.800 CB 1.548 16 residues pruned to eliminate duplicates Z: 18 36.991 2.233 0.847 0.930 1.000 0.824 CB 1.521 18 residues pruned to eliminate duplicates Z: 6 4.294 1.767 -0.009 0.391 1.000 0.800 CB 1.230 6 residues pruned to eliminate duplicates Z: 41 40.385 2.095 1.002 0.634 0.950 0.725 CB 1.414 41 residues pruned to eliminate duplicates Z: 50 61.577 2.349 1.051 0.616 0.939 0.673 CB 1.742 53 residues pruned to eliminate duplicates Z: 19 43.132 2.092 1.103 0.918 1.000 0.889 CB 1.629 19 residues pruned to eliminate duplicates Z: 41 38.511 2.218 1.008 0.578 0.875 0.600 CB 1.449 41 residues pruned to eliminate duplicates Z: 55 46.640 2.389 0.890 0.508 0.852 0.537 CB 1.636 60 residues pruned to eliminate duplicates Z: 8 4.503 1.908 0.304 0.528 0.714 0.714 CB 0.931 Z: 19 41.390 2.215 0.954 0.956 1.000 0.722 CB 1.548 19 residues pruned to eliminate duplicates Z: 6 9.351 1.755 0.942 0.669 1.000 0.600 CB 1.050 6 residues pruned to eliminate duplicates Z: 18 42.700 2.338 0.952 0.884 0.941 0.824 CB 1.742 18 residues pruned to eliminate duplicates Z: 23 40.975 2.014 1.375 0.930 1.000 0.818 CB 1.277 23 residues pruned to eliminate duplicates Z: 10 16.536 1.863 0.662 0.911 1.000 0.778 CB 1.262 10 residues pruned to eliminate duplicates Z: 19 32.932 2.180 0.751 0.940 1.000 0.889 CB 1.412 19 residues pruned to eliminate duplicates Z: 24 40.365 2.318 0.865 0.576 1.000 0.739 CA 1.809 19 residues pruned to eliminate duplicates Z: 7 8.719 2.080 -0.008 0.625 1.000 0.833 CB 1.534 7 residues pruned to eliminate duplicates Z: 41 42.655 2.143 0.991 0.612 0.925 0.725 CB 1.537 41 residues pruned to eliminate duplicates Z: 23 23.190 2.359 0.797 0.457 0.818 0.682 CB 1.490 23 residues pruned to eliminate duplicates Z: 6 9.804 1.920 0.208 0.866 1.000 1.000 CB 1.383 6 residues pruned to eliminate duplicates Z: 14 18.900 2.154 0.988 0.524 0.846 0.538 CB 1.413 14 residues pruned to eliminate duplicates Z: 32 52.058 2.193 1.106 0.697 0.968 0.742 CA 1.747 32 residues pruned to eliminate duplicates Z: 37 23.201 2.036 0.557 0.464 0.889 0.722 CB 1.423 37 residues pruned to eliminate duplicates Z: 25 17.489 2.216 0.617 0.420 0.792 0.500 CB 1.368 25 residues pruned to eliminate duplicates Z: 36 39.307 2.266 0.987 0.611 0.886 0.686 CB 1.499 36 residues pruned to eliminate duplicates Z: 6 4.760 2.049 0.372 0.452 0.800 0.800 CB 0.995 6 residues pruned to eliminate duplicates Z: 8 18.023 2.088 0.800 0.858 1.000 0.857 C 1.335 8 residues pruned to eliminate duplicates Z: 24 29.076 1.972 0.809 0.918 0.957 0.870 CB 1.253 24 residues pruned to eliminate duplicates Z: 7 11.539 2.146 0.858 0.431 0.833 0.500 CB 1.523 7 residues pruned to eliminate duplicates Z: 93 61.937 2.211 0.978 0.636 0.902 0.641 CB 1.440 93 residues pruned to eliminate duplicates Z: 19 43.124 2.277 0.930 0.904 1.000 0.778 C 1.648 19 residues pruned to eliminate duplicates Z: 14 43.682 2.472 1.159 0.911 0.923 0.923 C 1.743 14 residues pruned to eliminate duplicates Z: 30 51.595 2.269 0.923 0.764 1.000 0.759 CB 1.737 29 residues pruned to eliminate duplicates Z: 19 40.818 2.109 1.028 0.927 1.000 0.833 CB 1.576 19 residues pruned to eliminate duplicates Z: 16 19.061 2.119 1.012 0.558 0.867 0.600 CB 1.259 16 residues pruned to eliminate duplicates Z: 17 39.384 2.211 0.862 0.938 1.000 0.875 CB 1.664 18 residues pruned to eliminate duplicates Z: 32 49.870 2.294 1.033 0.703 0.935 0.774 CB 1.707 32 residues pruned to eliminate duplicates Z: 9 17.073 1.984 0.413 0.910 1.000 0.750 CB 1.528 9 residues pruned to eliminate duplicates Z: 17 31.829 2.057 0.852 0.874 1.000 0.938 CB 1.520 17 residues pruned to eliminate duplicates Z: 41 24.135 2.074 0.587 0.418 0.875 0.625 CB 1.444 41 residues pruned to eliminate duplicates Z: 18 50.002 2.188 1.263 0.935 1.000 0.824 CB 1.707 18 residues pruned to eliminate duplicates Z: 8 3.435 1.845 0.763 0.198 0.714 0.286 CB 0.801 8 residues pruned to eliminate duplicates Z: 23 39.943 2.057 1.246 0.927 1.000 0.909 CB 1.292 23 residues pruned to eliminate duplicates Z: 26 32.840 2.362 0.927 0.444 0.840 0.560 CB 1.820 26 residues pruned to eliminate duplicates Z: 9 13.778 1.953 0.189 0.907 1.000 1.000 CB 1.490 9 residues pruned to eliminate duplicates Z: 20 10.516 2.005 0.489 0.388 0.842 0.579 CB 1.080 20 residues pruned to eliminate duplicates Z: 8 9.098 1.775 0.748 0.542 0.714 0.571 N 1.489 Z: 6 5.618 2.010 0.671 0.384 0.600 0.600 C 1.411 6 residues pruned to eliminate duplicates Z: 17 33.240 2.064 1.144 0.831 0.938 0.750 CB 1.504 17 residues pruned to eliminate duplicates Z: 7 6.767 1.720 0.208 0.735 0.833 0.833 CA 1.292 7 residues pruned to eliminate duplicates Z: 8 7.372 1.720 0.631 0.585 0.857 0.571 C 1.068 8 residues pruned to eliminate duplicates Z: 14 35.381 2.101 1.156 0.907 1.000 0.923 CB 1.539 14 residues pruned to eliminate duplicates Z: 16 34.806 2.134 0.886 0.929 1.000 0.867 CB 1.562 16 residues pruned to eliminate duplicates Z: 24 35.500 2.000 1.122 0.928 1.000 0.913 CB 1.221 24 residues pruned to eliminate duplicates Z: 7 13.119 1.848 0.525 0.877 1.000 0.667 CA 1.379 6 residues pruned to eliminate duplicates Z: 9 11.487 1.924 0.154 0.873 1.000 0.875 CB 1.332 9 residues pruned to eliminate duplicates Z: 11 14.971 1.734 0.572 0.859 1.000 0.700 CA 1.277 11 residues pruned to eliminate duplicates Z: 23 41.049 2.037 1.320 0.919 1.000 0.864 CB 1.305 23 residues pruned to eliminate duplicates Z: 10 15.783 1.867 0.474 0.913 1.000 0.444 CA 1.354 10 residues pruned to eliminate duplicates Z: 8 9.628 1.970 0.607 0.639 0.714 0.714 CB 1.413 8 residues pruned to eliminate duplicates Z: 18 48.860 2.277 1.258 0.952 1.000 0.882 CB 1.587 18 residues pruned to eliminate duplicates Z: 6 7.810 1.819 0.409 0.839 0.800 0.400 CB 1.272 6 residues pruned to eliminate duplicates Z: 9 7.858 1.904 0.724 0.375 1.000 0.750 CA 0.967 9 residues pruned to eliminate duplicates Z: 29 24.358 2.014 0.635 0.481 0.964 0.750 CB 1.478 29 residues pruned to eliminate duplicates Z: 6 10.902 2.093 0.455 0.865 0.800 0.600 CB 1.466 6 residues pruned to eliminate duplicates Z: 22 17.575 2.300 0.591 0.442 0.810 0.619 CB 1.375 22 residues pruned to eliminate duplicates Z: 8 9.391 1.941 0.198 0.746 0.857 0.857 CB 1.429 8 residues pruned to eliminate duplicates Z: 13 10.538 2.036 0.606 0.457 0.917 0.500 CB 1.060 13 residues pruned to eliminate duplicates Z: 33 48.816 2.212 1.209 0.702 0.875 0.750 CB 1.680 33 residues pruned to eliminate duplicates Z: 22 40.435 2.083 1.167 0.960 1.000 0.810 CB 1.339 22 residues pruned to eliminate duplicates Z: 18 38.359 2.082 0.921 0.903 1.000 0.765 CB 1.658 18 residues pruned to eliminate duplicates Z: 24 30.738 1.941 0.767 0.906 1.000 0.696 CB 1.329 24 residues pruned to eliminate duplicates Z: 32 44.921 2.254 1.057 0.705 0.903 0.742 CB 1.599 32 residues pruned to eliminate duplicates Z: 36 28.746 1.924 0.585 0.687 1.000 0.714 CB 1.342 28 residues pruned to eliminate duplicates Z: 20 25.243 2.280 0.955 0.494 0.895 0.684 CB 1.460 20 residues pruned to eliminate duplicates Z: 42 41.212 2.089 1.043 0.592 0.902 0.610 CB 1.530 42 residues pruned to eliminate duplicates Z: 14 29.558 2.071 0.841 0.884 1.000 0.923 CB 1.553 14 residues pruned to eliminate duplicates Z: 27 26.251 2.081 0.719 0.541 0.923 0.731 CB 1.498 27 residues pruned to eliminate duplicates Z: 23 44.073 2.361 1.263 0.617 0.909 0.682 C 1.732 23 residues pruned to eliminate duplicates Z: 9 9.105 1.761 0.055 0.763 1.000 0.750 CA 1.372 9 residues pruned to eliminate duplicates Z: 36 42.312 2.097 1.075 0.671 0.943 0.657 CB 1.489 38 residues pruned to eliminate duplicates Z: 53 50.061 2.267 0.962 0.557 0.904 0.769 CB 1.633 42 residues pruned to eliminate duplicates Z: 23 42.554 2.059 1.373 0.927 1.000 0.864 CB 1.301 23 residues pruned to eliminate duplicates Z: 19 38.567 2.074 0.912 0.939 1.000 0.889 CB 1.593 19 residues pruned to eliminate duplicates Z: 16 37.762 2.118 0.995 0.906 1.000 1.000 C 1.641 16 residues pruned to eliminate duplicates Z: 8 3.839 1.808 0.191 0.309 0.714 0.571 CB 1.166 8 residues pruned to eliminate duplicates Z: 16 31.016 2.153 0.588 0.930 1.000 0.933 CB 1.637 16 residues pruned to eliminate duplicates Z: 22 39.597 2.076 1.132 0.959 1.000 0.810 CB 1.339 22 residues pruned to eliminate duplicates Z: 31 20.802 2.023 0.725 0.437 0.867 0.600 CB 1.340 31 residues pruned to eliminate duplicates Z: 13 31.458 2.120 0.944 0.904 1.000 0.750 CB 1.570 13 residues pruned to eliminate duplicates Z: 32 27.239 1.916 0.861 0.583 0.871 0.581 CB 1.454 32 residues pruned to eliminate duplicates Z: 6 6.540 1.910 0.655 0.285 1.000 0.400 CA 1.178 6 residues pruned to eliminate duplicates Z: 6 7.559 1.789 0.223 0.823 1.000 0.600 CB 1.168 5 residues pruned to eliminate duplicates Z: 62 40.623 2.066 0.715 0.636 0.918 0.738 CB 1.407 62 residues pruned to eliminate duplicates Z: 21 32.699 2.083 0.803 0.930 1.000 0.800 CB 1.362 21 residues pruned to eliminate duplicates Z: 23 43.952 2.071 1.354 0.955 1.000 0.909 CB 1.321 23 residues pruned to eliminate duplicates Z: 15 35.331 2.358 0.908 0.885 0.857 0.643 C 1.769 15 residues pruned to eliminate duplicates Z: 22 40.063 2.082 1.092 0.919 1.000 1.000 CB 1.415 22 residues pruned to eliminate duplicates Z: 13 20.227 2.095 0.514 0.870 1.000 0.833 CB 1.343 13 residues pruned to eliminate duplicates Z: 11 13.845 2.071 0.671 0.526 1.000 0.700 CB 1.233 11 residues pruned to eliminate duplicates Z: 22 29.531 2.219 0.992 0.544 0.810 0.571 CB 1.725 125 residues pruned to eliminate duplicates Z: 17 25.884 2.009 0.594 0.918 1.000 0.938 CB 1.425 17 residues pruned to eliminate duplicates Z: 34 44.717 2.139 1.053 0.722 0.970 0.636 CB 1.496 34 residues pruned to eliminate duplicates Z: 16 17.465 2.112 0.661 0.533 0.867 0.600 CB 1.436 16 residues pruned to eliminate duplicates Z: 10 7.979 1.633 0.288 0.669 1.000 0.444 CB 1.082 Z: 25 23.679 2.357 0.717 0.444 0.792 0.542 CB 1.599 Z: 9 18.551 1.977 0.852 0.869 1.000 0.625 CB 1.309 9 residues pruned to eliminate duplicates Z: 6 3.242 1.654 -0.161 0.485 1.000 0.600 N 1.061 Z: 6 5.609 1.578 0.270 0.732 1.000 0.800 CB 1.016 6 residues pruned to eliminate duplicates Z: 8 17.028 2.024 0.401 0.880 1.000 0.857 CB 1.644 8 residues pruned to eliminate duplicates Z: 23 28.565 1.937 0.552 0.924 1.000 0.864 CB 1.423 23 residues pruned to eliminate duplicates Z: 19 37.352 2.187 0.811 0.944 1.000 0.833 CB 1.539 19 residues pruned to eliminate duplicates Z: 16 44.433 2.144 1.312 0.925 1.000 0.800 CB 1.624 Z: 10 8.873 1.609 0.406 0.767 1.000 0.556 CB 1.032 10 residues pruned to eliminate duplicates Z: 79 54.323 2.144 1.074 0.601 0.910 0.615 CB 1.380 79 residues pruned to eliminate duplicates Z: 24 35.213 2.011 0.885 0.915 1.000 0.957 CB 1.369 24 residues pruned to eliminate duplicates Z: 13 14.671 2.093 1.079 0.565 0.833 0.583 CB 1.097 13 residues pruned to eliminate duplicates Z: 28 47.500 2.258 1.025 0.721 0.926 0.778 CB 1.768 16 residues pruned to eliminate duplicates Z: 8 13.065 2.087 0.798 0.557 0.857 0.714 CB 1.452 8 residues pruned to eliminate duplicates Z: 17 11.452 1.901 0.457 0.406 0.750 0.438 CB 1.521 17 residues pruned to eliminate duplicates Z: 16 44.625 2.299 1.065 0.912 1.000 0.867 CA 1.719 16 residues pruned to eliminate duplicates Z: 12 8.890 1.884 0.861 0.470 0.818 0.727 CB 0.963 12 residues pruned to eliminate duplicates Z: 29 19.030 2.194 0.617 0.395 0.857 0.643 CB 1.321 29 residues pruned to eliminate duplicates Z: 28 24.223 2.188 0.961 0.482 0.852 0.593 CB 1.298 28 residues pruned to eliminate duplicates Z: 45 27.215 2.119 0.723 0.396 0.841 0.591 CB 1.491 45 residues pruned to eliminate duplicates Z: 13 26.926 2.224 0.582 0.892 1.000 1.000 CB 1.587 13 residues pruned to eliminate duplicates Z: 16 15.758 2.200 0.705 0.472 0.867 0.600 CB 1.288 16 residues pruned to eliminate duplicates Z: 39 21.708 2.035 0.627 0.462 0.816 0.579 CB 1.354 7 residues pruned to eliminate duplicates Z: 19 47.211 2.116 1.234 0.944 1.000 0.833 CB 1.631 19 residues pruned to eliminate duplicates Z: 27 25.143 2.194 1.038 0.433 0.885 0.577 CB 1.336 27 residues pruned to eliminate duplicates Z: 19 18.857 2.123 0.594 0.474 0.944 0.611 CB 1.427 27 residues pruned to eliminate duplicates Z: 44 26.903 2.179 0.713 0.477 0.860 0.605 CB 1.307 44 residues pruned to eliminate duplicates Z: 14 12.434 1.913 0.703 0.505 1.000 0.692 CB 1.054 14 residues pruned to eliminate duplicates Z: 36 35.596 2.048 0.825 0.657 0.914 0.629 CB 1.522 36 residues pruned to eliminate duplicates Z: 15 10.503 2.091 0.981 0.362 0.786 0.643 CB 1.000 15 residues pruned to eliminate duplicates Z: 6 11.321 2.022 0.717 0.610 0.800 0.800 CA 1.642 6 residues pruned to eliminate duplicates Z: 17 28.892 2.209 0.331 0.944 1.000 0.938 CB 1.701 17 residues pruned to eliminate duplicates Z: 31 54.269 2.292 1.085 0.740 1.000 0.733 CB 1.672 28 residues pruned to eliminate duplicates Z: 15 9.951 1.982 0.984 0.442 0.857 0.500 CB 0.837 12 residues pruned to eliminate duplicates Z: 7 16.598 2.124 0.894 0.761 0.833 0.833 CB 1.603 7 residues pruned to eliminate duplicates Z: 28 41.630 2.220 0.864 0.694 0.963 0.778 CB 1.684 28 residues pruned to eliminate duplicates Z: 16 29.250 2.202 0.849 0.827 0.867 0.667 C 1.613 16 residues pruned to eliminate duplicates Z: 24 29.830 1.877 0.886 0.924 0.957 0.870 CB 1.291 24 residues pruned to eliminate duplicates Z: 6 2.969 1.594 0.310 0.292 0.800 0.400 CB 1.003 6 residues pruned to eliminate duplicates Z: 7 8.791 1.905 0.570 0.360 1.000 0.667 CB 1.394 7 residues pruned to eliminate duplicates Z: 6 5.598 1.593 0.761 0.625 0.800 0.600 CB 0.992 6 residues pruned to eliminate duplicates Z: 14 27.253 2.096 0.725 0.885 1.000 0.846 CB 1.510 14 residues pruned to eliminate duplicates Z: 12 13.353 2.159 0.695 0.507 0.909 0.545 CB 1.201 12 residues pruned to eliminate duplicates Z: 8 10.564 1.916 0.257 0.741 1.000 0.571 CB 1.336 8 residues pruned to eliminate duplicates Z: 28 17.621 1.960 0.571 0.432 0.852 0.519 CB 1.388 28 residues pruned to eliminate duplicates Z: 36 29.776 2.085 1.193 0.585 0.829 0.629 CB 1.224 36 residues pruned to eliminate duplicates Z: 9 8.818 1.686 0.342 0.730 0.875 0.625 CB 1.280 9 residues pruned to eliminate duplicates Z: 14 14.632 2.077 0.759 0.378 0.846 0.615 CB 1.495 14 residues pruned to eliminate duplicates Z: 20 22.450 2.198 0.922 0.382 0.895 0.632 CB 1.544 20 residues pruned to eliminate duplicates Z: 15 16.577 2.097 0.600 0.524 0.857 0.714 CB 1.503 15 residues pruned to eliminate duplicates Z: 12 4.412 2.022 0.475 0.332 0.636 0.364 CB 0.842 12 residues pruned to eliminate duplicates Z: 18 30.443 2.145 0.557 0.920 1.000 0.882 CB 1.557 18 residues pruned to eliminate duplicates Z: 11 23.633 2.140 0.956 0.622 1.000 0.700 CB 1.591 11 residues pruned to eliminate duplicates Z: 38 39.233 2.097 1.084 0.633 0.865 0.649 CB 1.506 38 residues pruned to eliminate duplicates Z: 40 36.523 2.171 0.795 0.572 0.897 0.692 CB 1.561 40 residues pruned to eliminate duplicates Z: 16 31.632 2.078 0.783 0.894 1.000 0.933 CB 1.581 16 residues pruned to eliminate duplicates Z: 6 12.988 2.119 0.545 0.757 1.000 0.800 CB 1.411 6 residues pruned to eliminate duplicates Z: 10 6.221 1.887 0.813 0.317 0.889 0.444 CB 0.834 10 residues pruned to eliminate duplicates Z: 8 10.243 1.863 0.514 0.703 0.857 0.571 CA 1.331 8 residues pruned to eliminate duplicates Z: 6 3.698 2.204 0.368 0.289 0.800 0.400 CB 0.869 Z: 23 30.191 2.221 1.053 0.572 0.864 0.636 CB 1.525 23 residues pruned to eliminate duplicates Z: 8 4.157 1.792 0.184 0.425 0.571 0.286 CB 1.401 8 residues pruned to eliminate duplicates Z: 19 46.444 2.124 1.209 0.939 1.000 0.889 CB 1.621 19 residues pruned to eliminate duplicates Z: 19 41.359 2.078 1.184 0.906 1.000 0.778 CB 1.527 19 residues pruned to eliminate duplicates Z: 37 37.193 2.170 0.637 0.650 0.972 0.778 CB 1.560 37 residues pruned to eliminate duplicates Z: 41 44.649 2.182 1.100 0.582 0.925 0.650 CB 1.539 41 residues pruned to eliminate duplicates Z: 21 18.825 2.051 0.748 0.505 0.850 0.400 CB 1.375 21 residues pruned to eliminate duplicates Z: 6 6.256 1.847 0.431 0.514 0.800 0.400 CB 1.304 6 residues pruned to eliminate duplicates Z: 44 48.316 2.147 1.065 0.606 0.977 0.581 CB 1.539 44 residues pruned to eliminate duplicates Z: 44 22.356 2.141 0.693 0.410 0.837 0.558 CB 1.234 44 residues pruned to eliminate duplicates Z: 6 8.849 1.803 0.474 0.840 1.000 0.600 CB 1.112 6 residues pruned to eliminate duplicates Z: 24 32.850 1.982 1.012 0.912 1.000 0.870 CB 1.217 24 residues pruned to eliminate duplicates Z: 11 10.956 2.083 0.434 0.481 0.900 0.300 CB 1.313 11 residues pruned to eliminate duplicates Z: 7 5.175 1.673 0.515 0.400 0.833 0.333 CB 1.112 7 residues pruned to eliminate duplicates Z: 7 7.421 1.626 0.952 0.706 1.000 0.833 CB 0.791 7 residues pruned to eliminate duplicates Z: 11 16.607 2.409 0.620 0.414 0.900 0.600 CB 1.636 11 residues pruned to eliminate duplicates Z: 9 9.749 1.838 0.584 0.662 0.875 0.875 CB 1.164 9 residues pruned to eliminate duplicates Z: 23 35.821 2.175 0.912 0.634 0.955 0.682 CB 1.696 23 residues pruned to eliminate duplicates Z: 6 13.116 1.926 0.649 0.855 1.000 0.800 CB 1.364 6 residues pruned to eliminate duplicates Z: 19 29.742 2.232 0.534 0.956 0.944 0.944 CB 1.489 19 residues pruned to eliminate duplicates Z: 8 8.189 1.762 0.705 0.710 0.857 0.714 CB 0.993 8 residues pruned to eliminate duplicates Z: 21 17.043 2.069 0.829 0.382 0.900 0.450 CB 1.269 21 residues pruned to eliminate duplicates Z: 17 32.527 1.947 1.089 0.925 1.000 0.875 CA 1.403 17 residues pruned to eliminate duplicates Z: 32 49.840 2.303 1.065 0.718 0.903 0.742 CB 1.711 31 residues pruned to eliminate duplicates Z: 15 21.820 2.371 0.703 0.440 0.929 0.643 CB 1.654 15 residues pruned to eliminate duplicates Z: 21 11.762 1.797 0.828 0.377 0.750 0.550 CB 1.217 21 residues pruned to eliminate duplicates Z: 10 9.906 2.018 0.814 0.339 0.778 0.444 CB 1.382 10 residues pruned to eliminate duplicates Z: 9 7.168 2.021 0.503 0.338 0.875 0.625 CB 1.139 9 residues pruned to eliminate duplicates Z: 53 38.634 2.169 0.825 0.546 0.904 0.635 CB 1.432 53 residues pruned to eliminate duplicates Z: 28 39.229 2.310 1.096 0.628 0.926 0.630 CB 1.494 28 residues pruned to eliminate duplicates Z: 27 47.292 2.274 1.149 0.681 0.923 0.731 CB 1.742 27 residues pruned to eliminate duplicates Z: 19 30.701 2.111 0.497 0.944 1.000 0.889 CB 1.586 19 residues pruned to eliminate duplicates Z: 11 4.180 1.492 0.023 0.371 0.800 0.500 C 1.243 11 residues pruned to eliminate duplicates Z: 8 19.312 1.966 0.710 0.925 1.000 1.000 CA 1.524 8 residues pruned to eliminate duplicates Z: 20 41.650 2.192 1.060 0.918 0.947 0.895 C 1.575 20 residues pruned to eliminate duplicates Z: 35 32.578 2.014 1.058 0.641 0.882 0.706 CB 1.338 35 residues pruned to eliminate duplicates Z: 19 42.102 2.269 0.833 0.913 0.944 0.556 CB 1.788 19 residues pruned to eliminate duplicates Z: 7 9.567 1.945 0.375 0.842 0.833 0.667 CA 1.305 7 residues pruned to eliminate duplicates Z: 20 24.593 2.284 0.710 0.613 0.947 0.684 CB 1.371 20 residues pruned to eliminate duplicates Z: 54 29.706 2.077 0.674 0.499 0.830 0.642 CB 1.414 54 residues pruned to eliminate duplicates Z: 33 23.670 2.121 0.906 0.380 0.875 0.500 CB 1.345 33 residues pruned to eliminate duplicates Z: 22 20.793 2.028 0.482 0.555 0.905 0.762 CB 1.581 22 residues pruned to eliminate duplicates Z: 6 5.274 1.561 0.722 0.477 0.800 0.600 CB 1.122 6 residues pruned to eliminate duplicates Z: 24 39.237 2.006 1.275 0.928 1.000 0.913 CB 1.255 24 residues pruned to eliminate duplicates Z: 23 43.661 2.024 1.520 0.930 1.000 0.727 CB 1.277 23 residues pruned to eliminate duplicates Z: 13 23.324 2.237 0.595 0.550 1.000 0.583 C 1.796 13 residues pruned to eliminate duplicates Z: 72 52.797 2.204 0.891 0.659 0.901 0.732 CB 1.439 72 residues pruned to eliminate duplicates Z: 21 18.292 1.984 0.734 0.481 0.850 0.600 CB 1.426 21 residues pruned to eliminate duplicates Z: 39 41.521 2.114 1.001 0.655 0.947 0.632 CB 1.456 39 residues pruned to eliminate duplicates Z: 10 13.475 2.056 0.756 0.442 1.000 0.556 CB 1.320 10 residues pruned to eliminate duplicates Z: 13 15.652 2.213 0.669 0.433 0.917 0.750 CB 1.430 13 residues pruned to eliminate duplicates Z: 6 5.915 1.474 0.602 0.825 1.000 0.800 CA 0.845 6 residues pruned to eliminate duplicates Z: 32 25.489 2.180 1.031 0.461 0.871 0.548 CB 1.235 32 residues pruned to eliminate duplicates Z: 48 36.394 2.331 0.938 0.439 0.830 0.489 CB 1.507 48 residues pruned to eliminate duplicates Z: 21 38.569 2.120 0.917 0.893 1.000 0.950 CB 1.523 21 residues pruned to eliminate duplicates Z: 57 39.800 2.022 0.782 0.620 0.929 0.821 CB 1.419 57 residues pruned to eliminate duplicates Z: 39 38.091 2.197 0.649 0.613 0.947 0.658 CB 1.618 39 residues pruned to eliminate duplicates Z: 14 11.648 2.122 0.314 0.556 0.923 0.692 CB 1.189 14 residues pruned to eliminate duplicates Z: 14 11.533 2.033 0.683 0.435 0.692 0.615 CB 1.445 14 residues pruned to eliminate duplicates Z: 17 39.751 2.211 1.092 0.882 1.000 0.750 C 1.555 17 residues pruned to eliminate duplicates Z: 38 42.248 2.176 0.776 0.649 0.973 0.730 CB 1.608 38 residues pruned to eliminate duplicates Z: 17 39.470 2.412 0.990 0.742 0.938 0.812 C 1.765 17 residues pruned to eliminate duplicates Z: 8 12.388 2.031 0.566 0.415 1.000 0.714 CA 1.610 7 residues pruned to eliminate duplicates Z: 8 4.641 1.549 0.516 0.751 0.857 0.857 CB 0.696 8 residues pruned to eliminate duplicates Z: 52 37.319 2.034 0.951 0.520 0.902 0.627 CB 1.432 52 residues pruned to eliminate duplicates Z: 57 43.610 2.384 0.910 0.474 0.821 0.554 CB 1.600 57 residues pruned to eliminate duplicates Z: 38 42.516 2.153 0.903 0.621 0.919 0.703 CB 1.656 38 residues pruned to eliminate duplicates Z: 18 48.756 2.244 1.375 0.932 1.000 0.765 C 1.550 18 residues pruned to eliminate duplicates Z: 9 10.521 1.858 0.166 0.742 1.000 0.375 CA 1.383 9 residues pruned to eliminate duplicates Z: 9 22.557 2.086 1.179 0.820 1.000 1.000 CB 1.329 9 residues pruned to eliminate duplicates Z: 10 4.130 1.619 0.212 0.235 0.778 0.333 CB 1.227 10 residues pruned to eliminate duplicates Z: 54 56.516 2.191 1.219 0.707 0.925 0.755 CB 1.432 54 residues pruned to eliminate duplicates Z: 13 21.496 2.139 0.758 0.559 0.917 0.667 CA 1.700 13 residues pruned to eliminate duplicates Z: 10 17.739 2.143 0.976 0.576 0.889 0.556 CB 1.460 10 residues pruned to eliminate duplicates Z: 29 19.280 2.007 0.682 0.451 0.893 0.536 CB 1.272 29 residues pruned to eliminate duplicates Z: 8 5.006 1.391 0.205 0.711 1.000 0.429 C 0.932 8 residues pruned to eliminate duplicates Z: 16 37.545 2.217 0.956 0.937 1.000 0.933 CA 1.556 16 residues pruned to eliminate duplicates Z: 19 49.324 2.225 1.253 0.957 1.000 0.722 CB 1.591 19 residues pruned to eliminate duplicates Z: 15 49.222 2.314 1.190 0.895 1.000 0.929 C 1.860 15 residues pruned to eliminate duplicates Z: 7 11.384 1.995 0.450 0.833 0.833 0.667 C 1.446 7 residues pruned to eliminate duplicates Z: 22 26.763 2.168 1.080 0.543 0.905 0.667 CB 1.372 22 residues pruned to eliminate duplicates Z: 9 13.559 2.126 0.552 0.452 1.000 0.500 CA 1.526 9 residues pruned to eliminate duplicates Z: 19 43.734 2.267 1.020 0.913 1.000 0.611 CB 1.592 19 residues pruned to eliminate duplicates Z: 19 47.016 2.416 0.871 0.770 1.000 0.889 C 1.930 19 residues pruned to eliminate duplicates Z: 41 23.188 2.004 0.716 0.455 0.825 0.550 CB 1.353 41 residues pruned to eliminate duplicates Z: 24 37.282 2.127 0.768 0.786 1.000 0.870 CB 1.606 24 residues pruned to eliminate duplicates Z: 89 48.911 2.086 0.876 0.545 0.886 0.591 CB 1.437 88 residues pruned to eliminate duplicates Z: 31 36.039 2.055 1.263 0.672 0.933 0.700 CB 1.293 38 residues pruned to eliminate duplicates Z: 25 22.527 1.961 1.049 0.634 0.917 0.750 CB 1.101 25 residues pruned to eliminate duplicates Z: 7 13.625 2.043 0.516 0.772 1.000 1.000 CA 1.411 7 residues pruned to eliminate duplicates Z: 26 22.032 2.219 0.879 0.361 0.880 0.440 CB 1.394 26 residues pruned to eliminate duplicates Z: 27 23.734 2.146 0.713 0.476 0.962 0.577 CB 1.348 27 residues pruned to eliminate duplicates Z: 16 32.693 2.134 1.017 0.814 1.000 0.867 CB 1.492 16 residues pruned to eliminate duplicates Z: 9 8.845 1.901 0.490 0.337 1.000 0.500 CB 1.320 9 residues pruned to eliminate duplicates Z: 13 13.173 2.071 0.629 0.277 1.000 0.583 CB 1.450 11 residues pruned to eliminate duplicates Z: 12 6.929 1.683 0.530 0.463 1.000 0.727 CB 0.843 14 residues pruned to eliminate duplicates Z: 18 44.696 2.288 1.340 0.780 0.941 0.765 C 1.681 18 residues pruned to eliminate duplicates Z: 11 21.871 2.005 0.660 0.862 1.000 0.800 CB 1.525 11 residues pruned to eliminate duplicates Z: 9 4.892 1.963 0.380 0.288 0.875 0.500 CB 0.925 9 residues pruned to eliminate duplicates Z: 13 23.474 2.159 0.686 0.819 0.917 0.833 CB 1.540 13 residues pruned to eliminate duplicates Z: 52 41.980 2.322 0.937 0.494 0.882 0.529 CB 1.490 52 residues pruned to eliminate duplicates Z: 39 39.422 2.060 1.061 0.656 0.921 0.737 CB 1.415 39 residues pruned to eliminate duplicates Z: 14 11.880 2.155 0.839 0.400 0.846 0.615 CB 1.091 14 residues pruned to eliminate duplicates Z: 7 5.955 1.619 0.613 0.600 0.833 0.500 CB 1.016 5 residues pruned to eliminate duplicates Z: 21 37.347 2.157 0.653 0.919 1.000 0.900 CB 1.650 21 residues pruned to eliminate duplicates Z: 7 2.117 1.368 -0.057 0.397 0.833 0.333 N 0.896 Z: 6 9.555 1.684 0.786 0.823 1.000 0.600 CA 1.074 6 residues pruned to eliminate duplicates Z: 56 45.189 2.182 0.997 0.533 0.927 0.636 CB 1.461 56 residues pruned to eliminate duplicates Z: 7 7.988 1.599 0.375 0.824 0.833 0.667 CA 1.344 7 residues pruned to eliminate duplicates Z: 97 57.998 2.175 0.830 0.629 0.885 0.729 CB 1.489 97 residues pruned to eliminate duplicates Z: 32 29.294 2.066 0.817 0.465 0.935 0.452 CB 1.552 32 residues pruned to eliminate duplicates Z: 11 8.225 1.817 0.427 0.386 0.800 0.500 CA 1.416 14 residues pruned to eliminate duplicates Z: 21 21.966 2.046 0.977 0.538 0.900 0.800 CB 1.300 21 residues pruned to eliminate duplicates Z: 10 18.748 1.894 0.684 0.933 1.000 0.889 CA 1.367 10 residues pruned to eliminate duplicates Z: 6 12.680 2.057 0.880 0.750 1.000 0.600 CB 1.173 6 residues pruned to eliminate duplicates Z: 30 17.902 2.100 0.749 0.369 0.828 0.655 CB 1.258 30 residues pruned to eliminate duplicates Z: 14 6.087 1.742 0.307 0.409 0.846 0.385 CB 0.964 14 residues pruned to eliminate duplicates Z: 42 47.369 2.176 1.027 0.608 0.951 0.659 CB 1.590 44 residues pruned to eliminate duplicates Z: 9 10.605 2.227 0.618 0.368 0.750 0.625 CA 1.599 9 residues pruned to eliminate duplicates Z: 29 29.738 2.160 0.846 0.608 0.893 0.714 CB 1.425 29 residues pruned to eliminate duplicates Z: 40 26.818 2.216 0.713 0.449 0.872 0.590 CB 1.367 40 residues pruned to eliminate duplicates Z: 18 45.744 2.131 1.358 0.931 1.000 0.882 CB 1.543 19 residues pruned to eliminate duplicates Z: 16 23.790 1.945 0.664 0.807 0.933 0.733 C 1.555 16 residues pruned to eliminate duplicates Z: 8 3.392 1.304 0.613 0.269 0.857 0.429 N 0.924 8 residues pruned to eliminate duplicates Z: 10 12.433 1.794 0.753 0.834 0.889 0.667 C 1.112 10 residues pruned to eliminate duplicates Z: 14 16.330 2.095 0.846 0.488 0.846 0.615 CB 1.401 14 residues pruned to eliminate duplicates Z: 39 37.638 2.242 0.910 0.627 0.842 0.711 CB 1.502 39 residues pruned to eliminate duplicates Z: 17 25.615 2.177 0.883 0.484 1.000 0.625 CB 1.587 17 residues pruned to eliminate duplicates Z: 10 12.070 1.747 0.380 0.784 1.000 0.556 CA 1.301 10 residues pruned to eliminate duplicates Z: 6 6.391 1.935 0.330 0.511 0.800 0.400 C 1.372 6 residues pruned to eliminate duplicates Z: 24 26.561 2.217 0.887 0.421 0.913 0.609 CB 1.574 49 residues pruned to eliminate duplicates Z: 41 22.523 2.239 0.564 0.427 0.825 0.425 CB 1.330 41 residues pruned to eliminate duplicates Z: 16 19.701 2.186 0.671 0.530 1.000 0.600 CB 1.353 16 residues pruned to eliminate duplicates Z: 10 15.175 1.849 0.515 0.861 1.000 0.778 CB 1.327 10 residues pruned to eliminate duplicates Z: 29 38.270 2.187 0.787 0.714 0.964 0.750 CB 1.581 29 residues pruned to eliminate duplicates Z: 13 33.232 2.384 1.233 0.578 0.917 0.667 CA 1.824 13 residues pruned to eliminate duplicates Z: 19 51.664 2.334 1.116 0.950 1.000 0.889 CB 1.700 19 residues pruned to eliminate duplicates Z: 18 33.171 2.031 0.880 0.878 1.000 0.882 CB 1.529 18 residues pruned to eliminate duplicates Z: 9 8.378 1.633 0.074 0.827 1.000 0.625 C 1.274 9 residues pruned to eliminate duplicates Z: 19 44.543 2.116 1.206 0.943 1.000 0.722 CB 1.559 18 residues pruned to eliminate duplicates Z: 29 37.023 2.173 0.618 0.762 0.964 0.821 CB 1.635 29 residues pruned to eliminate duplicates Z: 37 26.305 2.061 0.681 0.445 0.917 0.722 CB 1.461 36 residues pruned to eliminate duplicates Z: 6 6.652 1.654 0.466 0.489 1.000 0.800 CA 1.240 6 residues pruned to eliminate duplicates Z: 6 10.362 1.711 0.416 0.810 1.000 0.400 CA 1.460 6 residues pruned to eliminate duplicates Z: 45 32.458 2.310 0.726 0.414 0.909 0.523 CB 1.478 45 residues pruned to eliminate duplicates Z: 12 28.158 2.205 1.089 0.791 0.909 0.545 C 1.571 12 residues pruned to eliminate duplicates Z: 17 23.493 2.252 0.803 0.567 0.938 0.812 CB 1.446 17 residues pruned to eliminate duplicates Z: 22 46.222 2.103 1.414 0.960 1.000 0.905 CB 1.361 22 residues pruned to eliminate duplicates Z: 33 31.215 2.018 0.829 0.746 0.969 0.844 CB 1.239 33 residues pruned to eliminate duplicates Z: 11 13.640 2.161 0.616 0.557 0.800 0.400 CB 1.460 11 residues pruned to eliminate duplicates Z: 37 34.327 2.041 0.681 0.695 0.972 0.806 CB 1.435 37 residues pruned to eliminate duplicates 6 1.900 1.228 0.449 0.367 0.600 0.400 C 0.917 ? Z: 20 40.957 2.449 1.024 0.603 0.895 0.632 CB 1.921 21 residues pruned to eliminate duplicates Z: 50 38.414 2.267 0.961 0.494 0.918 0.633 CB 1.352 56 residues pruned to eliminate duplicates Z: 59 43.415 2.144 0.927 0.558 0.897 0.707 CB 1.454 59 residues pruned to eliminate duplicates Z: 6 2.412 1.215 0.122 0.589 0.800 0.400 CB 0.909 Z: 32 19.469 2.144 0.757 0.411 0.806 0.452 CB 1.264 32 residues pruned to eliminate duplicates Z: 37 50.333 2.146 1.082 0.718 0.972 0.667 CB 1.585 43 residues pruned to eliminate duplicates Z: 6 2.674 1.459 0.783 0.100 0.600 0.400 N 1.277 6 residues pruned to eliminate duplicates Z: 29 40.235 2.215 1.025 0.674 0.929 0.571 CB 1.555 29 residues pruned to eliminate duplicates 715 residues left after pruning, divided into chains as follows: A: 18 B: 33 C: 69 D: 90 E: 94 F: 28 G: 383 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 37.96 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.493, Connect. = 0.771 for dens.mod. cycle 1 = 0.300, Contrast = 0.570, Connect. = 0.796 for dens.mod. cycle 2 = 0.300, Contrast = 0.694, Connect. = 0.826 for dens.mod. cycle 3 = 0.300, Contrast = 0.705, Connect. = 0.829 for dens.mod. cycle 4 = 0.300, Contrast = 0.719, Connect. = 0.832 for dens.mod. cycle 5 = 0.300, Contrast = 0.725, Connect. = 0.833 for dens.mod. cycle 6 = 0.300, Contrast = 0.733, Connect. = 0.834 for dens.mod. cycle 7 = 0.300, Contrast = 0.737, Connect. = 0.835 for dens.mod. cycle 8 = 0.300, Contrast = 0.741, Connect. = 0.836 for dens.mod. cycle 9 = 0.300, Contrast = 0.744, Connect. = 0.836 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4819 peaks > 0.5 sigma used to seed fragment search Space for about 918 unique residues taking solvent into account 1075 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 46.626 2.540 0.728 0.936 1.000 0.938 CB 1.848 B: 19 49.688 2.444 0.705 0.891 1.000 0.833 C 2.021 C: 19 41.431 2.401 0.692 0.921 0.889 0.833 CB 1.903 19 residues pruned to eliminate duplicates D: 20 35.205 2.365 0.397 0.951 1.000 0.895 CB 1.685 E: 13 35.026 2.486 0.705 0.901 0.917 0.833 CB 1.857 13 residues pruned to eliminate duplicates F: 20 37.072 2.351 0.446 0.950 1.000 0.895 CB 1.726 20 residues pruned to eliminate duplicates G: 19 48.517 2.466 0.732 0.919 1.000 1.000 CB 1.886 17 residues pruned to eliminate duplicates H: 21 40.016 2.204 0.683 0.930 1.000 0.750 CB 1.687 I: 19 48.467 2.435 0.795 0.897 0.944 0.833 CA 1.981 19 residues pruned to eliminate duplicates J: 20 42.747 2.350 0.638 0.944 1.000 0.842 CB 1.766 20 residues pruned to eliminate duplicates K: 18 47.102 2.456 0.720 0.932 1.000 0.941 CB 1.889 18 residues pruned to eliminate duplicates L: 18 48.484 2.487 0.711 0.901 1.000 0.941 CB 1.972 18 residues pruned to eliminate duplicates M: 19 44.205 2.439 0.580 0.960 1.000 0.944 CB 1.851 20 residues pruned to eliminate duplicates N: 24 24.604 2.465 0.780 0.424 0.783 0.609 CB 1.617 O: 18 57.072 2.499 1.091 0.929 1.000 0.941 C 1.854 19 residues pruned to eliminate duplicates P: 17 37.791 2.254 0.992 0.890 0.938 0.688 C 1.614 Q: 19 49.592 2.474 0.833 0.914 1.000 0.833 C 1.822 19 residues pruned to eliminate duplicates R: 20 34.776 2.126 0.755 0.908 0.947 0.789 CB 1.603 S: 21 45.743 2.312 0.782 0.952 1.000 0.950 CB 1.709 19 residues pruned to eliminate duplicates T: 15 46.385 2.471 0.830 0.864 1.000 1.000 C 2.010 U: 13 26.208 2.279 0.681 0.905 0.917 0.667 CB 1.533 12 residues pruned to eliminate duplicates V: 41 31.929 2.289 0.869 0.503 0.850 0.525 CB 1.384 W: 17 59.069 2.587 0.994 0.928 1.000 0.750 C 2.005 17 residues pruned to eliminate duplicates X: 19 54.678 2.485 0.905 0.898 1.000 0.833 C 1.948 19 residues pruned to eliminate duplicates Y: 16 47.240 2.496 0.948 0.903 0.933 0.933 CA 1.916 15 residues pruned to eliminate duplicates Z: 20 29.590 2.273 0.279 0.951 1.000 0.947 CB 1.609 20 residues pruned to eliminate duplicates Z: 16 37.173 2.439 0.529 0.868 1.000 0.800 CA 1.881 16 residues pruned to eliminate duplicates Z: 15 31.425 2.526 0.474 0.898 0.786 0.786 C 2.052 Z: 40 39.855 2.381 0.856 0.509 0.897 0.436 CB 1.595 Z: 19 40.716 2.235 0.738 0.935 1.000 0.944 CB 1.722 Z: 18 42.383 2.294 0.740 0.951 1.000 1.000 CB 1.775 18 residues pruned to eliminate duplicates Z: 17 47.406 2.404 0.887 0.892 1.000 0.938 CA 1.876 17 residues pruned to eliminate duplicates Z: 17 44.943 2.382 0.796 0.929 0.938 0.562 CB 1.960 18 residues pruned to eliminate duplicates Z: 15 46.417 2.527 0.919 0.891 0.929 0.929 CA 1.981 Z: 19 42.791 2.425 0.684 0.914 0.889 0.722 CB 1.966 19 residues pruned to eliminate duplicates Z: 16 36.982 2.367 0.756 0.909 0.933 0.933 CA 1.747 16 residues pruned to eliminate duplicates Z: 20 43.628 2.373 0.727 0.942 0.947 0.895 CB 1.788 20 residues pruned to eliminate duplicates Z: 19 42.082 2.385 0.598 0.927 0.944 0.833 CA 1.931 19 residues pruned to eliminate duplicates Z: 17 41.729 2.204 0.977 0.923 1.000 0.875 CA 1.683 17 residues pruned to eliminate duplicates Z: 16 29.429 2.277 0.767 0.876 0.800 0.733 C 1.715 16 residues pruned to eliminate duplicates Z: 18 35.621 2.167 0.953 0.889 0.941 0.824 C 1.562 19 residues pruned to eliminate duplicates Z: 19 44.883 2.428 0.764 0.944 0.944 0.833 CB 1.811 20 residues pruned to eliminate duplicates Z: 22 36.513 2.158 0.632 0.933 1.000 0.857 CB 1.579 22 residues pruned to eliminate duplicates Z: 16 56.239 2.351 1.396 0.886 1.000 0.933 CA 1.861 15 residues pruned to eliminate duplicates Z: 20 46.986 2.345 0.858 0.932 1.000 0.895 C 1.727 18 residues pruned to eliminate duplicates Z: 28 41.313 2.370 0.571 0.745 0.926 0.815 CB 1.853 20 residues pruned to eliminate duplicates Z: 17 49.024 2.363 0.935 0.898 1.000 0.875 CA 1.916 17 residues pruned to eliminate duplicates Z: 19 37.202 2.293 0.469 0.924 1.000 0.944 CB 1.828 19 residues pruned to eliminate duplicates Z: 14 33.846 2.220 0.750 0.899 1.000 0.923 CA 1.728 Z: 15 38.803 2.488 0.749 0.900 0.857 0.857 C 1.987 15 residues pruned to eliminate duplicates Z: 19 37.798 2.207 0.674 0.928 1.000 0.944 CB 1.689 19 residues pruned to eliminate duplicates Z: 16 50.368 2.435 1.104 0.855 1.000 0.800 CA 1.873 16 residues pruned to eliminate duplicates Z: 15 32.241 2.421 0.650 0.858 0.857 0.786 C 1.853 16 residues pruned to eliminate duplicates Z: 53 36.060 2.303 0.813 0.435 0.827 0.538 CB 1.549 42 residues pruned to eliminate duplicates Z: 19 57.154 2.416 0.984 0.925 1.000 0.722 C 1.972 19 residues pruned to eliminate duplicates Z: 20 47.597 2.321 0.809 0.943 1.000 0.895 CB 1.801 20 residues pruned to eliminate duplicates Z: 18 51.596 2.502 0.821 0.909 1.000 0.882 C 1.950 18 residues pruned to eliminate duplicates Z: 20 37.442 2.185 0.518 0.937 1.000 0.895 CB 1.802 20 residues pruned to eliminate duplicates Z: 16 42.396 2.404 0.792 0.867 0.933 0.867 CA 1.992 16 residues pruned to eliminate duplicates Z: 21 50.643 2.301 1.086 0.942 0.950 0.900 CB 1.723 20 residues pruned to eliminate duplicates Z: 64 69.511 2.398 0.837 0.679 0.952 0.698 CB 1.771 42 residues pruned to eliminate duplicates Z: 43 32.337 2.298 0.715 0.440 0.881 0.619 CB 1.528 52 residues pruned to eliminate duplicates Z: 21 46.508 2.326 0.771 0.916 1.000 0.950 CB 1.783 21 residues pruned to eliminate duplicates Z: 14 42.166 2.614 0.544 0.922 1.000 0.846 C 2.038 13 residues pruned to eliminate duplicates Z: 39 29.484 2.305 0.685 0.395 0.842 0.579 CB 1.634 39 residues pruned to eliminate duplicates Z: 15 43.999 2.525 0.806 0.923 0.929 0.786 C 1.951 15 residues pruned to eliminate duplicates Z: 16 54.805 2.410 1.221 0.900 1.000 0.800 CA 1.889 16 residues pruned to eliminate duplicates Z: 16 51.335 2.372 1.166 0.888 1.000 0.933 CA 1.859 16 residues pruned to eliminate duplicates Z: 21 39.637 2.154 0.654 0.945 1.000 0.950 C 1.722 21 residues pruned to eliminate duplicates Z: 19 50.613 2.453 0.842 0.931 1.000 0.889 C 1.845 19 residues pruned to eliminate duplicates Z: 17 56.278 2.575 0.981 0.910 1.000 0.938 C 1.956 18 residues pruned to eliminate duplicates Z: 13 31.988 2.327 0.513 0.906 1.000 0.917 CB 1.865 13 residues pruned to eliminate duplicates Z: 19 33.281 2.164 0.565 0.915 0.944 0.889 CB 1.734 19 residues pruned to eliminate duplicates Z: 17 32.013 2.241 0.942 0.789 0.812 0.625 C 1.756 17 residues pruned to eliminate duplicates Z: 19 54.124 2.443 1.116 0.928 1.000 0.944 C 1.727 21 residues pruned to eliminate duplicates Z: 16 48.489 2.455 0.898 0.843 1.000 0.800 C 2.001 16 residues pruned to eliminate duplicates Z: 6 6.759 1.963 0.955 0.471 0.600 0.600 C 1.352 Z: 16 45.953 2.342 0.882 0.933 1.000 0.933 CA 1.879 16 residues pruned to eliminate duplicates Z: 19 45.455 2.381 0.713 0.908 1.000 0.833 CB 1.865 19 residues pruned to eliminate duplicates Z: 17 55.882 2.536 1.064 0.943 1.000 0.750 C 1.849 17 residues pruned to eliminate duplicates Z: 35 40.025 2.398 0.660 0.598 0.912 0.706 CB 1.723 35 residues pruned to eliminate duplicates Z: 9 22.624 2.287 0.666 0.802 1.000 0.750 CA 1.612 Z: 33 27.961 2.375 0.721 0.409 0.875 0.531 CB 1.521 33 residues pruned to eliminate duplicates Z: 18 41.614 2.394 0.632 0.955 1.000 0.824 CB 1.775 18 residues pruned to eliminate duplicates Z: 16 53.269 2.375 1.161 0.895 1.000 0.933 C 1.921 16 residues pruned to eliminate duplicates Z: 14 43.363 2.570 0.852 0.918 0.923 0.923 C 1.930 15 residues pruned to eliminate duplicates Z: 11 25.322 2.384 0.594 0.858 0.800 0.600 CB 1.940 10 residues pruned to eliminate duplicates Z: 7 21.656 2.436 0.550 0.879 1.000 1.000 CB 1.697 7 residues pruned to eliminate duplicates Z: 20 46.970 2.378 0.724 0.953 1.000 0.895 CB 1.810 20 residues pruned to eliminate duplicates Z: 24 33.954 2.099 0.596 0.912 1.000 0.826 CB 1.497 Z: 19 54.783 2.450 1.021 0.913 1.000 0.833 C 1.844 19 residues pruned to eliminate duplicates Z: 13 36.793 2.291 0.793 0.901 1.000 0.667 CB 1.846 13 residues pruned to eliminate duplicates Z: 15 61.435 2.571 1.238 0.913 1.000 0.929 CA 2.020 16 residues pruned to eliminate duplicates Z: 10 19.924 2.054 0.649 0.869 1.000 0.778 CB 1.432 10 residues pruned to eliminate duplicates Z: 16 39.335 2.376 0.617 0.920 1.000 0.933 C 1.861 16 residues pruned to eliminate duplicates Z: 16 43.755 2.463 0.968 0.876 0.933 0.867 CA 1.815 16 residues pruned to eliminate duplicates Z: 16 38.961 2.394 0.692 0.827 1.000 0.733 CA 1.872 16 residues pruned to eliminate duplicates Z: 17 45.579 2.302 1.015 0.817 1.000 0.812 C 1.865 17 residues pruned to eliminate duplicates Z: 20 44.390 2.291 0.872 0.942 1.000 0.842 CB 1.646 20 residues pruned to eliminate duplicates Z: 28 37.798 2.439 0.336 0.742 0.963 0.741 CB 1.867 18 residues pruned to eliminate duplicates Z: 14 39.301 2.572 0.772 0.925 0.846 0.846 C 1.984 14 residues pruned to eliminate duplicates Z: 59 65.997 2.533 0.848 0.562 0.879 0.603 CB 1.982 44 residues pruned to eliminate duplicates Z: 41 44.387 2.291 0.666 0.642 0.950 0.750 CB 1.695 24 residues pruned to eliminate duplicates Z: 20 36.600 2.135 0.767 0.908 1.000 0.895 CB 1.581 20 residues pruned to eliminate duplicates Z: 14 37.824 2.636 0.505 0.937 0.923 0.846 C 1.994 14 residues pruned to eliminate duplicates Z: 6 18.210 2.369 0.760 0.761 0.800 0.800 CA 1.936 8 residues pruned to eliminate duplicates Z: 8 6.775 1.826 0.546 0.429 0.714 0.571 C 1.366 7 residues pruned to eliminate duplicates Z: 17 48.827 2.395 0.903 0.946 1.000 0.812 C 1.852 17 residues pruned to eliminate duplicates Z: 14 44.873 2.643 0.851 0.886 0.923 0.769 C 1.988 14 residues pruned to eliminate duplicates Z: 16 37.383 2.422 0.682 0.910 0.933 0.800 C 1.801 16 residues pruned to eliminate duplicates Z: 20 37.943 2.126 0.815 0.908 1.000 0.842 CB 1.603 20 residues pruned to eliminate duplicates Z: 15 44.831 2.505 0.919 0.885 0.929 0.857 C 1.937 15 residues pruned to eliminate duplicates Z: 16 57.141 2.435 1.241 0.893 1.000 0.933 CA 1.940 16 residues pruned to eliminate duplicates Z: 16 48.080 2.425 1.154 0.837 0.933 0.800 CA 1.904 16 residues pruned to eliminate duplicates Z: 17 62.077 2.579 1.221 0.933 0.938 0.750 C 2.018 16 residues pruned to eliminate duplicates Z: 14 24.184 2.022 0.786 0.769 0.923 0.538 CB 1.586 Z: 16 37.464 2.293 1.022 0.856 0.867 0.600 C 1.776 17 residues pruned to eliminate duplicates Z: 15 35.369 2.289 0.693 0.945 1.000 0.929 CA 1.688 Z: 22 35.919 2.152 0.623 0.915 1.000 0.762 CB 1.586 22 residues pruned to eliminate duplicates Z: 21 31.325 2.309 0.435 0.837 0.900 0.900 CB 1.757 21 residues pruned to eliminate duplicates Z: 55 54.162 2.295 0.947 0.603 0.907 0.685 CB 1.649 15 residues pruned to eliminate duplicates Z: 25 30.969 2.125 0.393 0.872 1.000 0.875 CB 1.557 24 residues pruned to eliminate duplicates Z: 15 44.704 2.635 0.822 0.905 0.929 0.786 C 1.908 15 residues pruned to eliminate duplicates Z: 25 45.027 2.366 0.717 0.776 0.958 0.792 CB 1.851 25 residues pruned to eliminate duplicates Z: 19 50.597 2.412 0.880 0.950 1.000 0.889 CB 1.812 20 residues pruned to eliminate duplicates Z: 18 49.304 2.544 0.833 0.925 0.941 0.765 C 1.912 18 residues pruned to eliminate duplicates Z: 14 32.102 2.220 0.712 0.917 1.000 0.769 CB 1.653 14 residues pruned to eliminate duplicates Z: 78 66.184 2.478 0.817 0.539 0.883 0.558 CB 1.827 78 residues pruned to eliminate duplicates Z: 18 37.103 2.285 0.678 0.847 1.000 0.765 CA 1.742 18 residues pruned to eliminate duplicates Z: 13 32.298 2.346 0.493 0.904 1.000 0.917 CA 1.895 13 residues pruned to eliminate duplicates Z: 15 46.346 2.435 1.045 0.931 1.000 0.929 C 1.739 15 residues pruned to eliminate duplicates Z: 19 54.074 2.408 1.002 0.948 1.000 0.833 CB 1.826 19 residues pruned to eliminate duplicates Z: 16 51.933 2.463 1.057 0.863 1.000 0.733 CA 1.942 16 residues pruned to eliminate duplicates Z: 20 45.475 2.310 0.905 0.951 1.000 0.842 CB 1.633 28 residues pruned to eliminate duplicates Z: 16 49.147 2.506 0.842 0.904 1.000 0.933 CA 1.958 16 residues pruned to eliminate duplicates Z: 16 51.610 2.386 1.145 0.913 1.000 0.800 CA 1.842 16 residues pruned to eliminate duplicates Z: 16 57.314 2.659 0.952 0.932 1.000 0.867 C 1.991 16 residues pruned to eliminate duplicates Z: 6 17.333 2.537 0.328 0.607 1.000 0.800 CB 2.079 6 residues pruned to eliminate duplicates Z: 38 31.485 2.320 0.711 0.465 0.892 0.541 CB 1.515 38 residues pruned to eliminate duplicates Z: 16 45.234 2.424 0.977 0.901 0.933 0.800 CA 1.864 16 residues pruned to eliminate duplicates Z: 16 54.118 2.463 1.048 0.864 1.000 0.800 C 2.032 16 residues pruned to eliminate duplicates Z: 20 48.605 2.364 0.812 0.937 1.000 0.789 CB 1.812 20 residues pruned to eliminate duplicates Z: 16 47.744 2.406 1.168 0.880 0.933 0.800 CA 1.836 16 residues pruned to eliminate duplicates Z: 74 45.310 2.221 0.541 0.597 0.932 0.712 CB 1.517 93 residues pruned to eliminate duplicates Z: 17 29.488 2.167 0.545 0.888 1.000 0.875 CA 1.586 17 residues pruned to eliminate duplicates Z: 19 45.909 2.213 0.991 0.922 1.000 1.000 CB 1.726 19 residues pruned to eliminate duplicates Z: 13 34.884 2.299 0.736 0.876 1.000 0.667 CA 1.834 13 residues pruned to eliminate duplicates Z: 19 35.312 2.189 0.718 0.919 0.944 0.889 CB 1.653 19 residues pruned to eliminate duplicates Z: 126 72.985 2.242 0.739 0.579 0.936 0.640 CB 1.658 43 residues pruned to eliminate duplicates Z: 18 54.307 2.516 1.009 0.951 1.000 0.941 C 1.796 18 residues pruned to eliminate duplicates Z: 18 43.201 2.429 0.736 0.925 1.000 1.000 CB 1.743 18 residues pruned to eliminate duplicates Z: 24 43.297 2.182 0.942 0.923 1.000 0.957 CB 1.498 Z: 16 38.132 2.357 0.709 0.924 1.000 0.800 C 1.716 16 residues pruned to eliminate duplicates Z: 13 27.879 2.298 0.455 0.883 1.000 0.917 CB 1.739 13 residues pruned to eliminate duplicates Z: 16 46.545 2.403 0.991 0.868 1.000 0.667 CA 1.836 16 residues pruned to eliminate duplicates Z: 40 28.452 2.189 0.705 0.424 0.821 0.385 CB 1.610 40 residues pruned to eliminate duplicates Z: 39 36.563 2.294 0.677 0.536 0.868 0.605 CB 1.714 39 residues pruned to eliminate duplicates Z: 25 37.483 2.102 0.828 0.912 1.000 0.792 CB 1.410 25 residues pruned to eliminate duplicates Z: 30 40.849 2.323 0.680 0.719 0.931 0.759 CB 1.713 29 residues pruned to eliminate duplicates Z: 17 28.438 2.072 0.688 0.915 1.000 0.875 CA 1.437 17 residues pruned to eliminate duplicates Z: 18 28.852 2.139 0.871 0.783 0.824 0.765 C 1.655 18 residues pruned to eliminate duplicates Z: 18 49.991 2.508 0.772 0.937 1.000 1.000 CB 1.898 18 residues pruned to eliminate duplicates Z: 25 36.391 2.142 0.735 0.902 1.000 0.917 CB 1.426 25 residues pruned to eliminate duplicates Z: 12 39.940 2.302 1.071 0.908 1.000 0.818 CB 1.794 14 residues pruned to eliminate duplicates Z: 29 50.849 2.370 0.806 0.749 0.964 0.821 CB 1.863 29 residues pruned to eliminate duplicates Z: 17 48.565 2.271 1.178 0.889 1.000 0.875 CA 1.767 17 residues pruned to eliminate duplicates Z: 16 48.470 2.418 1.019 0.879 1.000 0.667 CA 1.860 16 residues pruned to eliminate duplicates Z: 44 36.861 2.422 0.744 0.456 0.860 0.465 CB 1.618 44 residues pruned to eliminate duplicates Z: 27 24.791 2.332 0.881 0.444 0.885 0.615 CB 1.327 27 residues pruned to eliminate duplicates Z: 6 16.075 2.307 0.502 0.764 1.000 0.800 CB 1.642 6 residues pruned to eliminate duplicates Z: 16 30.544 2.271 0.524 0.881 0.933 0.933 CA 1.767 16 residues pruned to eliminate duplicates Z: 29 42.614 2.325 0.638 0.727 0.964 0.786 CB 1.788 30 residues pruned to eliminate duplicates Z: 19 49.071 2.422 0.781 0.940 0.944 0.944 C 1.972 19 residues pruned to eliminate duplicates Z: 6 12.399 2.236 0.771 0.620 0.800 0.800 C 1.562 Z: 16 43.646 2.505 0.713 0.877 1.000 0.867 CA 1.908 16 residues pruned to eliminate duplicates Z: 38 48.978 2.288 0.896 0.668 0.919 0.649 CB 1.729 20 residues pruned to eliminate duplicates Z: 7 26.918 2.379 0.924 0.889 1.000 0.833 CB 1.728 7 residues pruned to eliminate duplicates Z: 15 52.386 2.626 0.974 0.928 1.000 0.786 C 1.891 15 residues pruned to eliminate duplicates Z: 16 46.111 2.263 1.221 0.852 0.933 0.933 C 1.876 16 residues pruned to eliminate duplicates Z: 17 18.795 2.076 0.747 0.527 0.875 0.438 CB 1.442 Z: 40 26.312 2.136 0.631 0.435 0.872 0.538 CB 1.483 Z: 19 54.154 2.412 1.100 0.938 0.944 0.944 C 1.856 19 residues pruned to eliminate duplicates Z: 13 30.039 2.196 0.594 0.872 1.000 0.833 CA 1.806 13 residues pruned to eliminate duplicates Z: 18 30.546 1.971 0.780 0.921 1.000 0.882 CA 1.485 18 residues pruned to eliminate duplicates Z: 30 37.373 2.318 0.399 0.743 0.966 0.655 CB 1.783 30 residues pruned to eliminate duplicates Z: 20 50.909 2.283 1.113 0.950 1.000 0.579 CB 1.670 20 residues pruned to eliminate duplicates Z: 9 19.091 2.221 0.553 0.797 1.000 0.625 CA 1.509 9 residues pruned to eliminate duplicates Z: 17 18.917 1.989 0.213 0.923 1.000 1.000 CA 1.378 17 residues pruned to eliminate duplicates Z: 22 57.485 2.526 1.132 0.732 0.952 0.714 C 1.985 15 residues pruned to eliminate duplicates Z: 16 29.904 2.215 0.413 0.902 1.000 1.000 CA 1.759 16 residues pruned to eliminate duplicates Z: 41 30.672 2.476 0.535 0.411 0.875 0.425 CB 1.601 41 residues pruned to eliminate duplicates Z: 18 58.445 2.472 1.032 0.951 1.000 0.765 C 1.945 18 residues pruned to eliminate duplicates Z: 7 9.727 1.999 0.029 0.723 1.000 1.000 CA 1.578 7 residues pruned to eliminate duplicates Z: 18 53.727 2.428 1.118 0.925 0.941 0.765 CB 1.889 18 residues pruned to eliminate duplicates Z: 12 29.679 2.317 0.600 0.901 1.000 0.818 CA 1.723 12 residues pruned to eliminate duplicates Z: 20 30.526 2.126 0.533 0.932 0.947 0.947 CB 1.584 20 residues pruned to eliminate duplicates Z: 18 62.382 2.449 1.257 0.931 1.000 0.824 C 1.913 18 residues pruned to eliminate duplicates Z: 16 29.612 2.273 0.404 0.898 0.933 0.800 C 1.836 16 residues pruned to eliminate duplicates Z: 17 31.087 2.085 0.653 0.932 1.000 0.875 CA 1.575 17 residues pruned to eliminate duplicates Z: 18 46.859 2.252 1.173 0.808 1.000 0.647 C 1.775 18 residues pruned to eliminate duplicates Z: 17 29.289 2.186 0.477 0.912 1.000 0.875 CA 1.605 17 residues pruned to eliminate duplicates Z: 19 39.293 2.107 0.905 0.938 1.000 0.889 CB 1.605 19 residues pruned to eliminate duplicates Z: 17 26.564 2.169 0.347 0.885 1.000 0.812 CA 1.642 17 residues pruned to eliminate duplicates Z: 24 43.061 2.157 1.030 0.933 1.000 0.739 CB 1.431 24 residues pruned to eliminate duplicates Z: 20 53.909 2.372 1.101 0.942 0.947 0.895 CB 1.817 20 residues pruned to eliminate duplicates Z: 82 48.549 2.180 0.673 0.519 0.901 0.654 CB 1.609 82 residues pruned to eliminate duplicates Z: 29 60.271 2.437 1.116 0.707 0.964 0.714 CB 1.897 29 residues pruned to eliminate duplicates Z: 19 42.460 2.221 0.826 0.932 1.000 1.000 CB 1.723 19 residues pruned to eliminate duplicates Z: 159 70.384 2.259 0.709 0.535 0.886 0.633 CB 1.582 146 residues pruned to eliminate duplicates Z: 6 8.460 1.838 0.847 0.512 0.800 0.600 CA 1.376 5 residues pruned to eliminate duplicates Z: 10 11.852 1.974 0.180 0.850 0.889 0.667 CB 1.413 10 residues pruned to eliminate duplicates Z: 107 55.297 2.216 0.752 0.503 0.877 0.623 CB 1.571 107 residues pruned to eliminate duplicates Z: 18 41.395 2.298 0.692 0.949 1.000 1.000 CB 1.782 18 residues pruned to eliminate duplicates Z: 7 14.027 2.229 1.058 0.644 0.833 0.833 CB 1.309 7 residues pruned to eliminate duplicates Z: 20 58.563 2.369 1.129 0.952 1.000 0.895 CB 1.834 22 residues pruned to eliminate duplicates Z: 32 59.595 2.430 1.064 0.708 0.935 0.677 CB 1.889 32 residues pruned to eliminate duplicates Z: 19 41.496 2.197 0.787 0.941 1.000 1.000 CB 1.729 19 residues pruned to eliminate duplicates Z: 17 29.478 2.170 0.660 0.841 0.938 0.875 CA 1.627 17 residues pruned to eliminate duplicates Z: 13 43.097 2.559 0.775 0.912 1.000 0.833 C 1.940 13 residues pruned to eliminate duplicates Z: 16 50.763 2.392 1.282 0.862 0.933 0.867 CA 1.890 16 residues pruned to eliminate duplicates Z: 31 27.614 2.391 0.835 0.439 0.900 0.500 CB 1.359 Z: 33 54.770 2.451 0.918 0.679 0.906 0.719 CB 1.927 33 residues pruned to eliminate duplicates Z: 18 31.311 2.107 0.982 0.859 0.941 0.765 C 1.422 18 residues pruned to eliminate duplicates Z: 25 45.871 2.131 1.195 0.897 1.000 0.792 CB 1.433 25 residues pruned to eliminate duplicates Z: 33 47.865 2.356 0.754 0.669 0.969 0.750 CB 1.809 33 residues pruned to eliminate duplicates Z: 34 26.674 2.228 0.582 0.427 0.909 0.606 CB 1.563 34 residues pruned to eliminate duplicates Z: 27 41.774 2.341 0.671 0.749 0.962 0.769 CB 1.744 27 residues pruned to eliminate duplicates Z: 19 35.520 2.209 0.616 0.913 1.000 0.889 CB 1.660 19 residues pruned to eliminate duplicates Z: 17 30.614 2.104 0.797 0.888 0.938 0.812 CA 1.555 17 residues pruned to eliminate duplicates Z: 7 15.700 2.248 0.195 0.859 1.000 1.000 CA 1.757 7 residues pruned to eliminate duplicates Z: 10 16.730 2.054 0.285 0.885 1.000 1.000 CB 1.526 10 residues pruned to eliminate duplicates Z: 8 16.472 2.163 0.282 0.910 1.000 1.000 CA 1.593 8 residues pruned to eliminate duplicates Z: 33 31.958 2.108 0.676 0.599 0.906 0.656 CB 1.606 33 residues pruned to eliminate duplicates Z: 19 44.859 2.211 1.122 0.918 0.944 0.889 CB 1.682 19 residues pruned to eliminate duplicates Z: 11 26.832 2.234 0.732 0.908 1.000 1.000 CA 1.557 11 residues pruned to eliminate duplicates Z: 32 56.241 2.401 0.867 0.710 0.968 0.774 CA 1.924 32 residues pruned to eliminate duplicates Z: 17 30.989 2.207 0.512 0.911 1.000 0.750 CA 1.646 17 residues pruned to eliminate duplicates Z: 10 17.470 2.015 0.398 0.877 1.000 0.778 CA 1.501 10 residues pruned to eliminate duplicates Z: 78 51.873 2.299 0.550 0.635 0.935 0.701 CB 1.563 76 residues pruned to eliminate duplicates Z: 17 50.487 2.481 0.802 0.923 1.000 1.000 CB 1.984 17 residues pruned to eliminate duplicates Z: 37 52.822 2.296 1.032 0.672 0.917 0.611 CB 1.756 37 residues pruned to eliminate duplicates Z: 40 45.047 2.324 0.896 0.610 0.872 0.590 CB 1.691 40 residues pruned to eliminate duplicates Z: 29 42.609 2.319 0.672 0.721 0.929 0.821 CB 1.832 29 residues pruned to eliminate duplicates Z: 18 55.871 2.493 0.929 0.948 1.000 0.941 CB 1.947 18 residues pruned to eliminate duplicates Z: 17 44.347 2.183 1.157 0.886 1.000 0.875 CA 1.699 17 residues pruned to eliminate duplicates Z: 39 30.091 2.210 0.731 0.511 0.868 0.711 CB 1.453 39 residues pruned to eliminate duplicates Z: 8 10.593 2.374 0.885 0.337 0.857 0.571 CB 1.247 Z: 11 9.095 2.114 0.248 0.426 0.800 0.400 CB 1.472 11 residues pruned to eliminate duplicates Z: 19 59.640 2.368 1.244 0.943 1.000 0.611 C 1.833 19 residues pruned to eliminate duplicates Z: 19 31.313 2.187 0.438 0.918 1.000 0.889 CB 1.655 19 residues pruned to eliminate duplicates Z: 64 68.402 2.392 0.806 0.688 0.952 0.762 CB 1.764 64 residues pruned to eliminate duplicates Z: 18 42.302 2.286 0.827 0.935 0.941 0.882 CB 1.819 18 residues pruned to eliminate duplicates Z: 17 30.379 2.251 0.697 0.808 0.875 0.688 C 1.736 17 residues pruned to eliminate duplicates Z: 16 22.332 2.071 0.287 0.914 1.000 1.000 CA 1.530 16 residues pruned to eliminate duplicates Z: 24 42.992 2.171 0.978 0.923 1.000 0.870 CB 1.467 24 residues pruned to eliminate duplicates Z: 17 40.156 2.225 0.941 0.923 1.000 0.875 CA 1.633 17 residues pruned to eliminate duplicates Z: 21 45.445 2.164 0.979 0.932 1.000 0.700 CB 1.657 21 residues pruned to eliminate duplicates Z: 13 30.765 2.264 0.550 0.886 1.000 0.833 CA 1.827 13 residues pruned to eliminate duplicates Z: 93 54.117 2.185 0.621 0.551 0.967 0.598 CB 1.566 101 residues pruned to eliminate duplicates Z: 77 53.128 2.288 0.645 0.608 0.947 0.750 CB 1.543 78 residues pruned to eliminate duplicates Z: 16 44.424 2.333 1.107 0.833 0.933 0.800 C 1.876 16 residues pruned to eliminate duplicates Z: 13 23.708 2.195 0.452 0.892 1.000 0.917 CA 1.543 13 residues pruned to eliminate duplicates Z: 19 45.722 2.281 1.067 0.939 0.944 0.667 CB 1.682 19 residues pruned to eliminate duplicates Z: 10 16.117 2.003 0.273 0.881 1.000 0.889 CA 1.526 10 residues pruned to eliminate duplicates Z: 123 71.734 2.241 0.775 0.577 0.926 0.639 CB 1.637 123 residues pruned to eliminate duplicates Z: 17 38.878 2.232 0.955 0.882 0.938 0.938 CA 1.719 17 residues pruned to eliminate duplicates Z: 41 71.538 2.585 1.011 0.639 0.925 0.700 C 2.065 39 residues pruned to eliminate duplicates Z: 20 53.383 2.268 1.176 0.950 1.000 0.737 C 1.711 20 residues pruned to eliminate duplicates Z: 19 42.610 2.221 0.842 0.930 1.000 1.000 CB 1.717 19 residues pruned to eliminate duplicates Z: 18 56.807 2.488 1.070 0.943 1.000 0.882 C 1.854 18 residues pruned to eliminate duplicates Z: 28 32.060 2.139 0.660 0.689 0.852 0.741 CB 1.715 28 residues pruned to eliminate duplicates Z: 17 30.363 2.102 0.846 0.881 0.938 0.812 CA 1.511 17 residues pruned to eliminate duplicates Z: 6 16.486 2.441 0.203 0.849 1.000 0.800 CB 1.861 6 residues pruned to eliminate duplicates Z: 17 29.016 2.148 0.525 0.829 1.000 0.875 CA 1.666 17 residues pruned to eliminate duplicates Z: 23 33.429 2.171 0.385 0.946 1.000 0.955 CB 1.640 23 residues pruned to eliminate duplicates Z: 25 47.538 2.137 1.178 0.935 1.000 0.875 CB 1.453 24 residues pruned to eliminate duplicates Z: 17 30.377 2.218 0.461 0.934 1.000 1.000 CA 1.635 17 residues pruned to eliminate duplicates Z: 9 17.011 1.997 0.374 0.922 1.000 1.000 CA 1.541 9 residues pruned to eliminate duplicates Z: 17 28.648 2.053 0.631 0.939 1.000 0.875 CA 1.486 17 residues pruned to eliminate duplicates Z: 6 12.876 2.162 0.273 0.783 1.000 0.800 C 1.631 6 residues pruned to eliminate duplicates Z: 9 21.902 2.099 0.546 0.920 1.000 1.000 CA 1.681 9 residues pruned to eliminate duplicates Z: 20 42.900 2.157 0.996 0.927 1.000 0.895 CB 1.602 20 residues pruned to eliminate duplicates Z: 11 36.202 2.288 0.981 0.932 1.000 1.000 CA 1.764 11 residues pruned to eliminate duplicates Z: 20 20.078 2.454 0.635 0.396 0.842 0.211 CB 1.522 10 residues pruned to eliminate duplicates Z: 17 23.788 2.054 0.494 0.893 0.938 0.875 CA 1.484 17 residues pruned to eliminate duplicates Z: 20 58.128 2.325 1.211 0.947 1.000 0.789 CB 1.793 20 residues pruned to eliminate duplicates Z: 29 45.955 2.374 0.747 0.745 0.929 0.786 CB 1.812 29 residues pruned to eliminate duplicates Z: 14 22.127 2.223 0.805 0.489 0.923 0.462 CB 1.675 17 residues pruned to eliminate duplicates Z: 42 48.797 2.182 0.877 0.632 0.976 0.610 CB 1.686 42 residues pruned to eliminate duplicates Z: 8 2.810 1.754 0.026 0.222 0.571 0.143 CB 1.430 Z: 14 32.965 2.426 0.652 0.913 0.846 0.846 CB 1.908 14 residues pruned to eliminate duplicates Z: 20 40.234 2.159 0.801 0.913 1.000 0.842 CB 1.680 20 residues pruned to eliminate duplicates Z: 24 46.592 2.085 1.146 0.907 1.000 0.870 CB 1.544 24 residues pruned to eliminate duplicates Z: 10 5.963 1.842 0.408 0.270 0.889 0.556 CB 1.120 10 residues pruned to eliminate duplicates Z: 7 11.179 2.071 0.135 0.816 1.000 0.833 CA 1.475 7 residues pruned to eliminate duplicates Z: 25 40.741 2.081 0.866 0.907 1.000 0.750 CB 1.523 25 residues pruned to eliminate duplicates Z: 26 21.763 2.105 0.470 0.448 0.880 0.720 CA 1.686 26 residues pruned to eliminate duplicates Z: 18 47.375 2.296 1.038 0.938 1.000 0.941 CB 1.708 18 residues pruned to eliminate duplicates Z: 19 43.153 2.229 0.853 0.932 1.000 0.944 CB 1.720 19 residues pruned to eliminate duplicates Z: 117 86.270 2.355 0.824 0.676 0.922 0.655 CB 1.719 110 residues pruned to eliminate duplicates Z: 9 13.034 2.288 0.280 0.464 1.000 0.500 CA 1.633 9 residues pruned to eliminate duplicates Z: 7 14.050 2.202 0.154 0.824 1.000 0.833 CA 1.703 7 residues pruned to eliminate duplicates Z: 64 53.338 2.270 0.780 0.637 0.905 0.730 CB 1.616 64 residues pruned to eliminate duplicates Z: 18 43.092 2.226 1.045 0.914 0.941 0.647 C 1.725 18 residues pruned to eliminate duplicates Z: 100 53.837 2.199 0.682 0.535 0.919 0.626 CB 1.537 99 residues pruned to eliminate duplicates Z: 24 36.104 2.100 0.659 0.908 0.957 0.739 CB 1.604 24 residues pruned to eliminate duplicates Z: 22 29.801 2.492 0.847 0.484 0.857 0.762 CB 1.675 22 residues pruned to eliminate duplicates Z: 9 15.454 2.116 0.225 0.907 1.000 0.875 CA 1.499 9 residues pruned to eliminate duplicates Z: 8 8.282 1.898 0.256 0.502 0.857 0.571 CA 1.530 8 residues pruned to eliminate duplicates Z: 24 44.552 2.139 1.180 0.910 1.000 0.870 CB 1.413 24 residues pruned to eliminate duplicates Z: 15 30.359 2.266 0.427 0.946 1.000 1.000 CA 1.735 15 residues pruned to eliminate duplicates Z: 22 43.965 2.198 0.738 0.952 1.000 0.905 CA 1.730 22 residues pruned to eliminate duplicates Z: 19 50.038 2.210 1.163 0.930 1.000 0.722 CB 1.725 19 residues pruned to eliminate duplicates Z: 7 21.997 2.389 0.790 0.836 1.000 0.833 CB 1.573 7 residues pruned to eliminate duplicates Z: 24 23.121 2.452 0.668 0.426 0.783 0.652 CB 1.627 24 residues pruned to eliminate duplicates Z: 26 18.402 2.111 0.450 0.507 0.880 0.600 CB 1.357 16 residues pruned to eliminate duplicates Z: 17 34.151 2.093 0.767 0.919 1.000 0.875 CA 1.627 17 residues pruned to eliminate duplicates Z: 17 41.105 2.205 1.014 0.915 1.000 0.875 CA 1.635 17 residues pruned to eliminate duplicates Z: 24 40.041 2.112 0.822 0.913 1.000 0.870 CB 1.535 24 residues pruned to eliminate duplicates Z: 37 55.637 2.334 1.017 0.676 0.944 0.722 CB 1.774 36 residues pruned to eliminate duplicates Z: 17 56.341 2.549 0.908 0.946 1.000 0.938 CB 2.003 17 residues pruned to eliminate duplicates Z: 58 51.373 2.289 0.846 0.580 0.895 0.667 CB 1.668 58 residues pruned to eliminate duplicates Z: 25 39.833 2.313 0.863 0.554 0.958 0.583 C 1.868 25 residues pruned to eliminate duplicates Z: 40 35.899 2.146 0.884 0.586 0.949 0.615 CB 1.380 12 residues pruned to eliminate duplicates Z: 23 51.827 2.153 1.220 0.948 1.000 0.818 CB 1.597 23 residues pruned to eliminate duplicates Z: 13 28.475 2.186 0.536 0.854 1.000 0.750 C 1.807 13 residues pruned to eliminate duplicates Z: 17 41.450 2.220 0.990 0.927 1.000 0.875 CA 1.643 17 residues pruned to eliminate duplicates Z: 60 43.092 2.182 0.849 0.588 0.881 0.593 CB 1.449 60 residues pruned to eliminate duplicates Z: 35 54.178 2.365 0.989 0.673 0.971 0.676 CB 1.735 35 residues pruned to eliminate duplicates Z: 9 15.204 2.002 0.469 0.891 0.875 0.750 CA 1.502 9 residues pruned to eliminate duplicates Z: 11 13.258 2.061 0.241 0.570 0.900 0.400 C 1.703 16 residues pruned to eliminate duplicates Z: 19 54.198 2.475 0.833 0.940 1.000 0.833 C 1.954 19 residues pruned to eliminate duplicates Z: 24 40.153 2.154 0.882 0.927 1.000 0.913 CB 1.448 24 residues pruned to eliminate duplicates Z: 25 34.028 2.093 0.602 0.868 1.000 0.750 CB 1.515 25 residues pruned to eliminate duplicates Z: 16 33.332 2.199 0.697 0.926 1.000 0.933 CA 1.617 16 residues pruned to eliminate duplicates Z: 26 22.375 2.159 0.639 0.431 0.880 0.520 CB 1.543 26 residues pruned to eliminate duplicates Z: 23 21.887 2.006 0.708 0.586 0.818 0.591 CB 1.533 23 residues pruned to eliminate duplicates Z: 18 50.538 2.256 1.253 0.937 1.000 0.706 CB 1.678 18 residues pruned to eliminate duplicates Z: 18 34.983 2.160 0.912 0.843 0.941 0.765 C 1.626 18 residues pruned to eliminate duplicates Z: 17 37.425 2.198 1.036 0.866 0.938 0.875 CA 1.632 17 residues pruned to eliminate duplicates Z: 13 25.718 2.115 0.624 0.884 1.000 0.917 CB 1.562 13 residues pruned to eliminate duplicates Z: 16 39.857 2.209 1.005 0.948 1.000 1.000 CA 1.605 16 residues pruned to eliminate duplicates Z: 16 36.437 2.136 0.844 0.932 1.000 1.000 CA 1.668 16 residues pruned to eliminate duplicates Z: 25 43.491 2.063 0.982 0.904 1.000 0.792 CB 1.547 31 residues pruned to eliminate duplicates Z: 29 16.429 2.052 0.619 0.367 0.750 0.500 CB 1.437 29 residues pruned to eliminate duplicates Z: 6 6.210 1.800 0.608 0.616 0.800 0.400 CB 1.074 6 residues pruned to eliminate duplicates Z: 27 29.000 2.348 0.993 0.453 0.846 0.538 CB 1.507 27 residues pruned to eliminate duplicates Z: 24 43.172 2.096 1.004 0.909 1.000 0.913 CB 1.521 24 residues pruned to eliminate duplicates Z: 16 36.796 2.357 0.660 0.903 1.000 0.800 C 1.731 16 residues pruned to eliminate duplicates Z: 17 44.609 2.298 1.084 0.908 0.938 0.875 C 1.764 17 residues pruned to eliminate duplicates Z: 19 32.806 2.165 0.802 0.915 0.944 0.833 CB 1.483 19 residues pruned to eliminate duplicates Z: 19 46.424 2.197 1.115 0.919 1.000 0.833 CB 1.659 19 residues pruned to eliminate duplicates Z: 7 12.030 1.864 0.322 0.836 1.000 1.000 C 1.492 7 residues pruned to eliminate duplicates Z: 36 45.309 2.316 0.914 0.617 0.886 0.514 CB 1.747 36 residues pruned to eliminate duplicates Z: 24 35.060 2.081 0.553 0.928 1.000 0.957 CB 1.584 24 residues pruned to eliminate duplicates Z: 42 37.559 2.140 0.948 0.586 0.902 0.585 CB 1.436 42 residues pruned to eliminate duplicates Z: 7 6.456 1.829 -0.043 0.744 1.000 0.833 CB 1.209 7 residues pruned to eliminate duplicates Z: 31 29.316 2.169 0.858 0.531 0.833 0.633 CB 1.546 31 residues pruned to eliminate duplicates Z: 22 44.722 2.257 0.823 0.960 1.000 0.905 CB 1.625 22 residues pruned to eliminate duplicates Z: 24 37.922 2.149 0.841 0.922 1.000 0.957 CB 1.406 24 residues pruned to eliminate duplicates Z: 8 32.522 2.438 0.964 0.872 1.000 1.000 CB 1.871 8 residues pruned to eliminate duplicates Z: 25 37.230 2.101 0.816 0.871 0.958 0.792 CB 1.516 25 residues pruned to eliminate duplicates Z: 32 58.817 2.391 1.033 0.719 0.935 0.774 CB 1.905 32 residues pruned to eliminate duplicates Z: 19 46.514 2.198 1.070 0.921 1.000 0.944 CB 1.695 19 residues pruned to eliminate duplicates Z: 16 42.067 2.343 1.086 0.940 0.933 0.800 C 1.653 16 residues pruned to eliminate duplicates Z: 19 42.569 2.185 0.996 0.909 1.000 0.889 CB 1.632 19 residues pruned to eliminate duplicates Z: 28 17.354 2.086 0.677 0.376 0.815 0.556 CB 1.338 25 residues pruned to eliminate duplicates Z: 23 49.085 2.205 1.264 0.930 1.000 0.909 CB 1.466 23 residues pruned to eliminate duplicates Z: 33 32.886 2.253 0.761 0.626 0.906 0.750 CB 1.436 33 residues pruned to eliminate duplicates Z: 17 23.387 2.027 0.368 0.926 1.000 1.000 CA 1.479 17 residues pruned to eliminate duplicates Z: 23 40.865 2.151 0.861 0.951 0.909 0.864 CB 1.650 23 residues pruned to eliminate duplicates Z: 36 59.017 2.290 1.012 0.677 1.000 0.686 CB 1.840 35 residues pruned to eliminate duplicates Z: 13 13.883 2.321 0.636 0.359 0.750 0.417 CB 1.638 13 residues pruned to eliminate duplicates Z: 17 50.828 2.367 1.181 0.941 0.938 0.750 C 1.822 19 residues pruned to eliminate duplicates Z: 39 52.616 2.349 1.063 0.634 0.921 0.684 CB 1.686 39 residues pruned to eliminate duplicates Z: 16 51.334 2.482 0.944 0.922 1.000 0.933 CA 1.932 16 residues pruned to eliminate duplicates Z: 19 31.104 2.164 0.580 0.901 1.000 0.833 CB 1.531 19 residues pruned to eliminate duplicates Z: 19 47.362 2.209 1.124 0.929 1.000 0.944 CB 1.665 19 residues pruned to eliminate duplicates Z: 15 32.878 2.390 0.577 0.894 0.929 0.429 CB 1.801 15 residues pruned to eliminate duplicates Z: 26 40.169 2.053 0.895 0.877 0.960 0.680 CB 1.562 26 residues pruned to eliminate duplicates Z: 15 15.271 2.302 0.852 0.401 0.786 0.429 CB 1.351 15 residues pruned to eliminate duplicates Z: 41 38.448 2.234 0.809 0.553 0.875 0.525 CB 1.634 41 residues pruned to eliminate duplicates Z: 17 37.639 2.344 0.684 0.940 0.938 0.875 CB 1.766 17 residues pruned to eliminate duplicates Z: 32 37.400 2.494 0.915 0.478 0.871 0.419 CB 1.652 32 residues pruned to eliminate duplicates Z: 16 33.043 2.184 0.726 0.917 1.000 0.867 CA 1.597 16 residues pruned to eliminate duplicates Z: 30 36.779 2.299 0.457 0.739 0.966 0.793 CB 1.704 30 residues pruned to eliminate duplicates Z: 58 54.434 2.364 0.963 0.559 0.895 0.614 CB 1.641 58 residues pruned to eliminate duplicates Z: 13 26.973 2.199 0.597 0.885 1.000 0.750 CB 1.601 13 residues pruned to eliminate duplicates Z: 12 24.736 2.253 0.322 0.905 1.000 0.818 CB 1.782 12 residues pruned to eliminate duplicates Z: 17 30.642 2.136 0.717 0.898 1.000 0.812 CA 1.495 17 residues pruned to eliminate duplicates Z: 19 47.468 2.195 1.180 0.927 0.944 0.833 CB 1.734 19 residues pruned to eliminate duplicates Z: 33 63.507 2.449 1.112 0.697 0.938 0.719 CB 1.934 33 residues pruned to eliminate duplicates Z: 6 12.312 2.147 0.354 0.641 1.000 0.400 CB 1.661 6 residues pruned to eliminate duplicates Z: 19 39.216 2.218 0.834 0.905 0.944 0.889 CB 1.713 19 residues pruned to eliminate duplicates Z: 24 39.326 2.098 0.884 0.949 1.000 0.913 CB 1.432 24 residues pruned to eliminate duplicates Z: 16 33.081 2.096 0.846 0.932 1.000 0.933 CA 1.541 16 residues pruned to eliminate duplicates Z: 12 26.953 2.301 0.416 0.918 1.000 1.000 CA 1.759 12 residues pruned to eliminate duplicates Z: 23 47.559 2.157 1.132 0.957 1.000 0.955 CB 1.513 23 residues pruned to eliminate duplicates Z: 6 4.281 1.542 0.324 0.620 0.800 0.800 CA 1.047 6 residues pruned to eliminate duplicates Z: 16 31.799 2.278 0.755 0.891 0.867 0.733 C 1.702 16 residues pruned to eliminate duplicates Z: 17 27.696 2.054 0.547 0.915 1.000 0.875 CA 1.540 17 residues pruned to eliminate duplicates Z: 29 43.678 2.294 0.643 0.706 1.000 0.786 CB 1.815 29 residues pruned to eliminate duplicates Z: 18 46.027 2.499 0.561 0.931 1.000 0.882 CA 1.999 18 residues pruned to eliminate duplicates Z: 8 14.420 1.951 0.568 0.905 0.857 0.857 CA 1.480 8 residues pruned to eliminate duplicates Z: 19 18.858 2.374 0.662 0.419 0.778 0.278 CB 1.576 19 residues pruned to eliminate duplicates Z: 36 24.049 2.139 0.417 0.443 0.857 0.629 CB 1.660 36 residues pruned to eliminate duplicates Z: 31 46.705 2.327 0.970 0.634 0.967 0.700 CB 1.697 31 residues pruned to eliminate duplicates Z: 9 12.656 2.059 0.343 0.917 0.875 0.875 CA 1.305 9 residues pruned to eliminate duplicates Z: 38 40.891 2.246 0.875 0.623 0.892 0.703 CB 1.593 38 residues pruned to eliminate duplicates Z: 9 19.353 2.039 0.725 0.894 1.000 0.625 CB 1.396 9 residues pruned to eliminate duplicates Z: 18 51.324 2.327 1.112 0.946 1.000 0.588 CB 1.751 18 residues pruned to eliminate duplicates Z: 23 26.070 2.400 0.814 0.457 0.818 0.773 CB 1.631 23 residues pruned to eliminate duplicates Z: 15 34.249 2.261 0.632 0.938 1.000 1.000 CA 1.725 15 residues pruned to eliminate duplicates Z: 19 40.126 2.157 0.771 0.933 1.000 0.944 CB 1.728 19 residues pruned to eliminate duplicates Z: 26 24.679 2.090 0.476 0.481 1.000 0.600 CB 1.630 26 residues pruned to eliminate duplicates Z: 7 33.440 2.380 1.195 0.899 1.000 1.000 CB 1.868 7 residues pruned to eliminate duplicates Z: 24 50.219 2.175 1.348 0.921 1.000 0.739 CB 1.443 24 residues pruned to eliminate duplicates Z: 25 46.255 2.103 1.237 0.922 1.000 0.917 CB 1.411 25 residues pruned to eliminate duplicates Z: 16 32.443 2.426 0.687 0.820 0.867 0.667 C 1.789 16 residues pruned to eliminate duplicates Z: 18 57.556 2.450 1.330 0.935 1.000 0.824 C 1.704 18 residues pruned to eliminate duplicates Z: 25 29.604 2.084 0.417 0.876 1.000 0.875 CB 1.488 25 residues pruned to eliminate duplicates Z: 16 28.380 2.126 0.556 0.911 1.000 0.933 CA 1.570 16 residues pruned to eliminate duplicates Z: 17 36.004 2.079 0.956 0.916 1.000 0.812 CA 1.563 17 residues pruned to eliminate duplicates Z: 15 17.076 2.158 0.809 0.299 0.929 0.571 CB 1.575 15 residues pruned to eliminate duplicates Z: 15 37.080 2.581 0.891 0.887 0.857 0.714 C 1.708 15 residues pruned to eliminate duplicates Z: 70 51.814 2.233 0.834 0.513 0.913 0.580 CB 1.647 38 residues pruned to eliminate duplicates Z: 91 51.703 2.202 0.662 0.536 0.911 0.622 CB 1.578 91 residues pruned to eliminate duplicates Z: 12 33.382 2.207 1.116 0.876 1.000 0.818 CB 1.567 12 residues pruned to eliminate duplicates Z: 65 53.985 2.239 0.730 0.638 0.953 0.719 CB 1.606 65 residues pruned to eliminate duplicates Z: 29 22.472 2.147 0.612 0.528 0.786 0.643 CB 1.518 29 residues pruned to eliminate duplicates Z: 6 6.596 1.930 0.228 0.687 0.800 0.800 CB 1.310 6 residues pruned to eliminate duplicates Z: 17 28.323 2.097 0.721 0.903 0.938 0.750 CA 1.492 17 residues pruned to eliminate duplicates Z: 20 38.974 2.116 0.898 0.906 0.947 0.737 CB 1.672 20 residues pruned to eliminate duplicates Z: 10 9.136 1.804 0.491 0.537 0.889 0.333 CB 1.228 8 residues pruned to eliminate duplicates Z: 29 31.019 2.356 0.933 0.482 0.893 0.571 CB 1.468 29 residues pruned to eliminate duplicates Z: 57 53.090 2.485 0.766 0.513 0.857 0.518 CB 1.862 57 residues pruned to eliminate duplicates Z: 6 10.212 2.023 0.561 0.569 1.000 0.600 CB 1.352 6 residues pruned to eliminate duplicates Z: 10 16.856 1.905 0.650 0.850 1.000 1.000 CB 1.324 10 residues pruned to eliminate duplicates Z: 59 43.837 2.168 0.769 0.579 0.879 0.621 CB 1.582 59 residues pruned to eliminate duplicates Z: 8 5.279 1.511 -0.145 0.820 1.000 0.571 CB 1.170 8 residues pruned to eliminate duplicates Z: 9 14.254 2.093 0.107 0.905 1.000 0.875 CA 1.548 9 residues pruned to eliminate duplicates Z: 23 40.522 2.446 0.905 0.604 0.909 0.682 C 1.846 25 residues pruned to eliminate duplicates Z: 15 20.889 2.151 0.645 0.592 0.929 0.714 CB 1.556 15 residues pruned to eliminate duplicates Z: 6 14.081 2.165 0.753 0.520 1.000 0.800 CA 1.627 6 residues pruned to eliminate duplicates Z: 6 6.329 1.820 -0.098 0.826 1.000 0.800 C 1.300 6 residues pruned to eliminate duplicates Z: 7 9.812 2.007 0.018 0.838 1.000 0.500 CB 1.466 7 residues pruned to eliminate duplicates Z: 27 26.013 2.355 0.914 0.474 0.769 0.538 CB 1.511 27 residues pruned to eliminate duplicates Z: 6 12.948 1.965 0.678 0.632 1.000 0.800 N 1.552 6 residues pruned to eliminate duplicates Z: 18 29.240 2.323 0.251 0.933 1.000 0.765 CB 1.704 18 residues pruned to eliminate duplicates Z: 24 47.462 2.106 1.044 0.926 1.000 0.957 CB 1.612 25 residues pruned to eliminate duplicates Z: 35 48.317 2.177 0.986 0.720 0.971 0.706 CB 1.618 35 residues pruned to eliminate duplicates Z: 9 6.781 1.898 0.370 0.393 0.875 0.375 CB 1.180 9 residues pruned to eliminate duplicates Z: 22 43.101 2.143 0.961 0.868 1.000 0.714 CB 1.636 22 residues pruned to eliminate duplicates Z: 11 17.863 1.841 0.711 0.841 1.000 0.800 CA 1.337 11 residues pruned to eliminate duplicates Z: 21 16.303 2.112 0.724 0.284 0.750 0.400 CB 1.702 21 residues pruned to eliminate duplicates Z: 18 46.396 2.284 1.035 0.937 0.941 0.824 CB 1.790 18 residues pruned to eliminate duplicates Z: 9 12.987 1.970 0.327 0.889 1.000 0.875 CB 1.265 9 residues pruned to eliminate duplicates Z: 77 51.214 2.303 0.790 0.513 0.882 0.618 CB 1.596 77 residues pruned to eliminate duplicates Z: 10 15.858 1.989 0.576 0.892 0.889 0.778 CA 1.363 10 residues pruned to eliminate duplicates Z: 12 14.782 2.094 0.932 0.441 0.909 0.545 CB 1.288 12 residues pruned to eliminate duplicates Z: 16 25.896 2.312 0.967 0.583 0.933 0.600 CB 1.455 16 residues pruned to eliminate duplicates Z: 7 12.264 1.884 0.350 0.816 1.000 0.833 C 1.497 7 residues pruned to eliminate duplicates Z: 7 7.530 1.865 0.449 0.645 0.833 0.500 CB 1.192 7 residues pruned to eliminate duplicates Z: 9 20.061 2.166 0.641 0.855 1.000 1.000 CA 1.473 9 residues pruned to eliminate duplicates Z: 19 49.252 2.208 1.159 0.929 1.000 0.889 CB 1.704 19 residues pruned to eliminate duplicates Z: 23 16.219 2.025 0.423 0.439 0.864 0.636 CA 1.480 23 residues pruned to eliminate duplicates Z: 28 49.188 2.400 0.779 0.754 0.963 0.704 CB 1.836 28 residues pruned to eliminate duplicates Z: 7 12.446 2.033 0.354 0.714 1.000 0.500 CB 1.520 7 residues pruned to eliminate duplicates Z: 22 19.881 2.178 0.649 0.461 0.857 0.714 CB 1.467 22 residues pruned to eliminate duplicates Z: 33 23.301 2.129 0.628 0.386 0.906 0.594 CB 1.479 33 residues pruned to eliminate duplicates Z: 17 32.462 2.230 0.897 0.836 0.812 0.562 C 1.767 17 residues pruned to eliminate duplicates Z: 6 3.799 1.480 0.149 0.713 0.800 0.800 CA 1.030 Z: 7 8.342 1.695 0.143 0.852 1.000 0.833 C 1.300 7 residues pruned to eliminate duplicates Z: 19 46.319 2.202 1.069 0.925 1.000 0.833 CB 1.682 19 residues pruned to eliminate duplicates Z: 24 48.358 2.151 1.326 0.927 1.000 0.783 CB 1.412 24 residues pruned to eliminate duplicates Z: 21 45.349 2.246 1.124 0.925 1.000 0.850 CB 1.491 21 residues pruned to eliminate duplicates Z: 28 26.094 2.302 0.894 0.449 0.852 0.556 CB 1.425 28 residues pruned to eliminate duplicates Z: 17 15.964 2.220 0.543 0.449 0.812 0.688 CB 1.510 17 residues pruned to eliminate duplicates Z: 8 7.587 1.521 0.312 0.852 1.000 0.429 C 1.063 9 residues pruned to eliminate duplicates Z: 18 61.589 2.514 1.165 0.956 1.000 1.000 C 1.885 18 residues pruned to eliminate duplicates Z: 23 48.525 2.187 1.243 0.929 1.000 0.682 CB 1.475 23 residues pruned to eliminate duplicates Z: 23 49.998 2.177 1.429 0.895 1.000 0.773 CB 1.445 23 residues pruned to eliminate duplicates Z: 23 35.664 2.135 0.738 0.910 1.000 0.909 CB 1.453 23 residues pruned to eliminate duplicates Z: 69 47.406 2.248 0.680 0.532 0.882 0.632 CB 1.672 69 residues pruned to eliminate duplicates Z: 17 28.607 2.113 0.688 0.836 0.938 0.625 CA 1.600 17 residues pruned to eliminate duplicates Z: 42 50.974 2.292 0.984 0.621 0.902 0.634 CB 1.731 42 residues pruned to eliminate duplicates Z: 19 12.869 1.910 0.514 0.408 0.889 0.444 CB 1.300 19 residues pruned to eliminate duplicates Z: 6 10.876 1.862 0.307 0.870 1.000 1.000 CA 1.458 6 residues pruned to eliminate duplicates Z: 29 27.468 2.188 0.618 0.494 0.929 0.750 CB 1.589 29 residues pruned to eliminate duplicates Z: 7 23.044 2.160 1.327 0.716 0.833 0.833 CB 1.847 7 residues pruned to eliminate duplicates Z: 38 41.396 2.119 0.834 0.676 0.919 0.676 CB 1.621 38 residues pruned to eliminate duplicates Z: 6 8.357 1.696 1.481 0.590 0.800 0.600 C 1.019 6 residues pruned to eliminate duplicates Z: 18 19.058 2.190 0.380 0.568 0.882 0.529 CA 1.623 18 residues pruned to eliminate duplicates Z: 40 51.499 2.313 1.005 0.640 0.897 0.590 CB 1.737 40 residues pruned to eliminate duplicates Z: 140 66.415 2.231 0.748 0.538 0.878 0.640 CB 1.585 140 residues pruned to eliminate duplicates Z: 8 5.943 1.835 0.555 0.364 0.714 0.571 CA 1.276 6 residues pruned to eliminate duplicates Z: 33 39.322 2.218 0.969 0.586 0.906 0.688 CB 1.617 33 residues pruned to eliminate duplicates Z: 156 80.628 2.285 0.742 0.602 0.923 0.710 CB 1.600 120 residues pruned to eliminate duplicates Z: 17 35.793 2.123 1.102 0.890 0.938 0.938 CA 1.539 17 residues pruned to eliminate duplicates Z: 7 10.952 1.889 0.269 0.734 1.000 0.500 CB 1.512 7 residues pruned to eliminate duplicates Z: 19 49.832 2.482 0.682 0.926 1.000 1.000 CB 1.972 19 residues pruned to eliminate duplicates Z: 23 40.713 2.438 0.911 0.591 0.909 0.636 C 1.877 23 residues pruned to eliminate duplicates Z: 36 56.751 2.300 1.065 0.695 0.971 0.743 CB 1.739 36 residues pruned to eliminate duplicates Z: 8 20.391 2.155 0.589 0.916 1.000 1.000 CA 1.590 8 residues pruned to eliminate duplicates Z: 20 35.479 2.065 0.962 0.908 0.947 0.895 CB 1.506 20 residues pruned to eliminate duplicates Z: 37 34.855 2.018 0.771 0.730 0.944 0.750 CB 1.399 37 residues pruned to eliminate duplicates Z: 24 36.585 2.085 0.691 0.917 1.000 0.783 CB 1.527 24 residues pruned to eliminate duplicates Z: 14 24.982 2.298 0.783 0.549 0.923 0.615 CB 1.747 14 residues pruned to eliminate duplicates Z: 10 13.851 2.073 0.243 0.522 1.000 0.889 CA 1.754 10 residues pruned to eliminate duplicates Z: 19 36.817 2.201 0.637 0.921 1.000 0.944 CB 1.694 19 residues pruned to eliminate duplicates Z: 42 45.383 2.213 0.922 0.588 0.902 0.659 CB 1.697 42 residues pruned to eliminate duplicates Z: 91 78.625 2.285 0.939 0.687 0.956 0.711 CB 1.649 96 residues pruned to eliminate duplicates Z: 9 18.206 2.109 0.728 0.855 1.000 1.000 CB 1.303 9 residues pruned to eliminate duplicates Z: 18 39.134 2.236 0.813 0.931 0.941 0.941 CB 1.738 18 residues pruned to eliminate duplicates Z: 17 14.373 2.098 0.753 0.365 0.875 0.562 CB 1.291 12 residues pruned to eliminate duplicates Z: 7 9.940 2.070 0.001 0.808 1.000 0.667 CA 1.497 7 residues pruned to eliminate duplicates Z: 16 42.630 2.339 1.108 0.882 0.867 0.600 CA 1.864 16 residues pruned to eliminate duplicates Z: 20 20.502 2.364 0.709 0.418 0.789 0.526 CB 1.607 20 residues pruned to eliminate duplicates Z: 6 9.775 1.930 0.695 0.795 1.000 0.600 CB 1.032 Z: 13 26.611 2.178 0.640 0.882 1.000 0.833 CB 1.557 13 residues pruned to eliminate duplicates Z: 103 55.258 2.171 0.719 0.523 0.931 0.578 CB 1.538 103 residues pruned to eliminate duplicates Z: 13 44.626 2.267 1.159 0.936 1.000 1.000 C 1.832 13 residues pruned to eliminate duplicates Z: 6 7.006 1.833 0.222 0.767 1.000 0.600 CB 1.104 6 residues pruned to eliminate duplicates Z: 27 15.442 1.976 0.700 0.389 0.731 0.615 CB 1.387 27 residues pruned to eliminate duplicates Z: 38 50.269 2.363 0.976 0.618 0.919 0.595 CB 1.723 38 residues pruned to eliminate duplicates Z: 6 20.680 2.456 0.564 0.858 1.000 0.800 CB 1.773 6 residues pruned to eliminate duplicates Z: 11 5.313 1.752 0.374 0.273 0.800 0.700 CB 1.129 6 residues pruned to eliminate duplicates Z: 29 24.562 2.353 0.788 0.419 0.821 0.571 CB 1.462 29 residues pruned to eliminate duplicates Z: 31 46.471 2.285 0.867 0.682 0.933 0.767 CB 1.803 31 residues pruned to eliminate duplicates Z: 7 11.073 1.723 0.545 0.786 1.000 0.667 CA 1.321 7 residues pruned to eliminate duplicates Z: 24 39.515 2.162 0.771 0.914 1.000 0.913 CB 1.522 24 residues pruned to eliminate duplicates Z: 10 17.948 1.919 0.384 0.919 1.000 0.889 CA 1.587 10 residues pruned to eliminate duplicates Z: 28 24.636 2.245 0.833 0.422 0.889 0.593 CB 1.406 28 residues pruned to eliminate duplicates Z: 8 15.768 2.127 0.541 0.852 1.000 0.857 CB 1.345 8 residues pruned to eliminate duplicates Z: 7 11.575 1.768 0.510 0.794 1.000 0.500 CA 1.368 Z: 7 6.569 1.781 0.219 0.565 0.833 0.500 CB 1.393 7 residues pruned to eliminate duplicates Z: 24 42.099 2.141 0.935 0.926 1.000 0.913 CB 1.485 24 residues pruned to eliminate duplicates Z: 7 7.952 1.702 0.482 0.854 0.833 0.833 CB 1.141 7 residues pruned to eliminate duplicates Z: 90 51.343 2.261 0.647 0.518 0.888 0.607 CB 1.618 90 residues pruned to eliminate duplicates Z: 39 37.441 2.344 0.598 0.578 0.895 0.605 CB 1.681 39 residues pruned to eliminate duplicates Z: 20 54.040 2.257 1.184 0.941 1.000 0.526 CB 1.746 20 residues pruned to eliminate duplicates Z: 39 45.322 2.333 0.784 0.580 0.947 0.605 CB 1.727 39 residues pruned to eliminate duplicates Z: 8 5.998 2.104 0.328 0.344 0.714 0.571 CB 1.347 8 residues pruned to eliminate duplicates Z: 15 12.984 2.106 0.456 0.509 0.857 0.714 CB 1.308 15 residues pruned to eliminate duplicates Z: 12 6.421 2.382 0.431 0.170 0.636 0.182 CB 1.331 12 residues pruned to eliminate duplicates Z: 24 37.596 2.098 0.931 0.921 1.000 0.783 CB 1.361 24 residues pruned to eliminate duplicates Z: 12 24.199 2.032 0.667 0.842 1.000 0.636 CA 1.606 12 residues pruned to eliminate duplicates Z: 120 61.523 2.178 0.726 0.564 0.924 0.655 CB 1.525 120 residues pruned to eliminate duplicates Z: 6 6.701 1.704 0.514 0.480 1.000 0.800 C 1.186 6 residues pruned to eliminate duplicates Z: 18 43.334 2.249 0.877 0.951 1.000 1.000 CB 1.716 19 residues pruned to eliminate duplicates Z: 12 11.690 2.119 0.684 0.427 0.818 0.545 CB 1.303 12 residues pruned to eliminate duplicates Z: 24 28.702 2.071 0.357 0.939 1.000 0.957 CB 1.481 24 residues pruned to eliminate duplicates Z: 8 12.140 2.017 0.229 0.753 1.000 0.857 CB 1.477 8 residues pruned to eliminate duplicates Z: 6 10.346 2.042 0.515 0.776 1.000 0.800 CB 1.172 6 residues pruned to eliminate duplicates Z: 12 12.352 1.793 0.648 0.434 1.000 0.455 CB 1.349 7 residues pruned to eliminate duplicates Z: 21 28.880 2.297 0.317 0.854 0.950 0.950 CB 1.659 21 residues pruned to eliminate duplicates Z: 34 25.984 2.313 0.783 0.447 0.879 0.455 CB 1.318 34 residues pruned to eliminate duplicates Z: 12 11.319 1.990 0.673 0.556 0.909 0.545 CB 1.068 12 residues pruned to eliminate duplicates Z: 7 35.434 2.453 1.257 0.891 1.000 1.000 CB 1.879 7 residues pruned to eliminate duplicates Z: 18 18.502 2.089 0.731 0.401 0.941 0.588 CB 1.463 18 residues pruned to eliminate duplicates Z: 11 12.535 2.103 0.668 0.509 0.900 0.800 CB 1.245 11 residues pruned to eliminate duplicates Z: 18 52.329 2.257 1.339 0.933 1.000 0.706 CB 1.678 17 residues pruned to eliminate duplicates Z: 40 26.903 2.385 0.655 0.417 0.821 0.410 CB 1.451 40 residues pruned to eliminate duplicates Z: 26 30.705 2.422 0.745 0.504 0.920 0.560 CB 1.574 26 residues pruned to eliminate duplicates Z: 101 60.434 2.188 0.734 0.633 0.940 0.720 CB 1.496 110 residues pruned to eliminate duplicates Z: 23 36.743 2.086 0.643 0.932 1.000 0.955 CB 1.596 23 residues pruned to eliminate duplicates Z: 24 49.666 2.163 1.318 0.929 1.000 0.696 CB 1.446 24 residues pruned to eliminate duplicates Z: 18 19.377 2.228 0.663 0.476 0.882 0.647 CB 1.473 18 residues pruned to eliminate duplicates Z: 33 51.987 2.296 0.902 0.735 0.969 0.719 CB 1.759 33 residues pruned to eliminate duplicates Z: 17 33.644 2.181 0.881 0.866 0.938 0.625 CA 1.601 17 residues pruned to eliminate duplicates Z: 16 40.455 2.280 0.946 0.919 1.000 0.800 C 1.658 16 residues pruned to eliminate duplicates Z: 9 8.329 1.701 0.111 0.793 1.000 0.500 CB 1.206 9 residues pruned to eliminate duplicates Z: 43 37.748 2.440 0.834 0.435 0.810 0.381 CB 1.720 43 residues pruned to eliminate duplicates Z: 6 9.856 1.837 0.340 0.844 1.000 0.600 CA 1.333 6 residues pruned to eliminate duplicates Z: 35 51.106 2.215 0.992 0.688 0.941 0.706 CB 1.777 35 residues pruned to eliminate duplicates Z: 34 24.597 2.286 0.587 0.414 0.818 0.515 CB 1.578 34 residues pruned to eliminate duplicates Z: 31 56.366 2.364 1.111 0.706 0.933 0.833 CB 1.831 31 residues pruned to eliminate duplicates Z: 19 48.409 2.194 1.119 0.944 1.000 0.889 CB 1.700 19 residues pruned to eliminate duplicates Z: 22 26.747 2.321 0.767 0.509 0.857 0.429 CB 1.645 22 residues pruned to eliminate duplicates Z: 87 56.062 2.208 0.777 0.554 0.919 0.651 CB 1.592 87 residues pruned to eliminate duplicates Z: 8 9.952 1.882 0.985 0.605 0.714 0.714 CB 1.276 8 residues pruned to eliminate duplicates Z: 17 27.732 2.119 0.693 0.851 0.875 0.875 CA 1.635 17 residues pruned to eliminate duplicates Z: 25 47.261 2.132 1.209 0.906 1.000 0.750 CB 1.457 25 residues pruned to eliminate duplicates Z: 20 44.033 2.549 0.825 0.656 0.947 0.684 C 1.982 20 residues pruned to eliminate duplicates Z: 22 37.519 2.442 0.538 0.717 0.952 0.714 C 1.880 22 residues pruned to eliminate duplicates Z: 12 21.688 2.293 1.213 0.626 0.909 0.727 CB 1.259 12 residues pruned to eliminate duplicates Z: 9 5.076 1.878 0.837 0.172 0.625 0.500 CB 1.238 9 residues pruned to eliminate duplicates Z: 25 41.864 2.050 1.001 0.876 1.000 0.667 CB 1.514 25 residues pruned to eliminate duplicates Z: 46 28.675 2.137 0.557 0.430 0.889 0.644 CB 1.553 46 residues pruned to eliminate duplicates Z: 24 32.791 2.075 0.501 0.933 1.000 0.957 CB 1.532 24 residues pruned to eliminate duplicates Z: 24 14.546 2.136 0.538 0.413 0.739 0.565 CB 1.369 24 residues pruned to eliminate duplicates Z: 18 19.855 2.029 0.570 0.483 0.941 0.529 CB 1.635 26 residues pruned to eliminate duplicates Z: 96 64.796 2.310 0.782 0.615 0.895 0.663 CB 1.619 96 residues pruned to eliminate duplicates Z: 36 26.678 2.061 0.295 0.711 0.914 0.800 CB 1.527 36 residues pruned to eliminate duplicates Z: 36 20.744 2.075 0.484 0.455 0.771 0.629 CB 1.545 36 residues pruned to eliminate duplicates Z: 6 8.055 1.995 0.121 0.706 0.800 0.600 CB 1.670 6 residues pruned to eliminate duplicates Z: 22 11.414 1.925 0.517 0.433 0.667 0.476 CB 1.372 22 residues pruned to eliminate duplicates Z: 8 17.909 2.138 0.418 0.918 1.000 1.000 CA 1.575 8 residues pruned to eliminate duplicates Z: 16 30.988 2.238 0.607 0.903 1.000 0.867 CB 1.586 16 residues pruned to eliminate duplicates Z: 36 26.643 2.363 0.603 0.417 0.914 0.629 CB 1.417 38 residues pruned to eliminate duplicates Z: 18 9.724 1.915 0.356 0.383 0.706 0.588 CB 1.456 18 residues pruned to eliminate duplicates Z: 17 31.967 2.149 0.754 0.899 1.000 0.938 CA 1.516 17 residues pruned to eliminate duplicates Z: 28 26.553 2.233 0.917 0.456 0.889 0.556 CB 1.405 28 residues pruned to eliminate duplicates Z: 7 22.503 2.426 0.647 0.898 1.000 0.833 CB 1.645 7 residues pruned to eliminate duplicates Z: 7 17.107 2.316 0.565 0.801 1.000 0.500 CB 1.481 7 residues pruned to eliminate duplicates Z: 24 46.205 2.124 1.021 0.918 1.000 0.870 CB 1.584 24 residues pruned to eliminate duplicates Z: 28 33.750 2.262 0.771 0.610 0.852 0.630 CB 1.715 27 residues pruned to eliminate duplicates Z: 40 40.933 2.301 0.880 0.564 0.923 0.615 CB 1.543 40 residues pruned to eliminate duplicates Z: 43 27.331 2.133 0.564 0.432 0.881 0.643 CB 1.540 43 residues pruned to eliminate duplicates Z: 40 41.524 2.257 0.724 0.568 0.923 0.667 CB 1.733 40 residues pruned to eliminate duplicates Z: 15 24.424 2.496 0.647 0.463 0.857 0.643 CB 1.924 15 residues pruned to eliminate duplicates Z: 15 62.410 2.471 1.301 0.946 1.000 0.786 C 2.029 15 residues pruned to eliminate duplicates Z: 6 6.882 1.895 0.752 0.459 0.800 0.600 CB 1.208 6 residues pruned to eliminate duplicates Z: 55 50.265 2.302 0.848 0.609 0.889 0.667 CB 1.630 55 residues pruned to eliminate duplicates Z: 45 38.544 2.238 0.629 0.571 0.886 0.705 CB 1.679 45 residues pruned to eliminate duplicates Z: 6 6.001 1.400 0.586 0.729 1.000 0.600 CB 0.983 Z: 14 20.994 2.104 0.965 0.521 0.846 0.538 CB 1.630 14 residues pruned to eliminate duplicates 6 1.167 1.179 0.243 0.690 0.800 0.400 N 0.374 ? Z: 29 54.368 2.272 0.957 0.769 1.000 0.786 CB 1.821 32 residues pruned to eliminate duplicates Z: 38 37.401 2.108 0.861 0.666 0.946 0.703 CB 1.421 38 residues pruned to eliminate duplicates Z: 19 42.624 2.209 1.102 0.943 0.944 0.889 CB 1.587 19 residues pruned to eliminate duplicates Z: 33 27.768 2.164 0.504 0.507 0.938 0.688 CB 1.598 33 residues pruned to eliminate duplicates Z: 17 17.436 1.967 0.571 0.512 0.875 0.688 CA 1.593 17 residues pruned to eliminate duplicates Z: 14 11.132 2.112 0.696 0.245 0.846 0.615 CB 1.368 14 residues pruned to eliminate duplicates Z: 29 47.449 2.422 0.558 0.744 1.000 0.821 CB 1.910 29 residues pruned to eliminate duplicates Z: 33 57.554 2.381 1.134 0.678 0.938 0.656 CB 1.813 33 residues pruned to eliminate duplicates Z: 92 69.817 2.297 0.764 0.626 0.934 0.714 CB 1.717 92 residues pruned to eliminate duplicates Z: 16 32.880 2.402 0.386 0.881 1.000 0.800 CA 1.848 16 residues pruned to eliminate duplicates Z: 13 16.404 1.959 0.603 0.526 1.000 0.583 CB 1.471 13 residues pruned to eliminate duplicates Z: 18 34.252 2.062 1.027 0.868 0.941 0.882 CA 1.543 18 residues pruned to eliminate duplicates Z: 51 56.969 2.347 0.899 0.609 0.940 0.640 CB 1.733 55 residues pruned to eliminate duplicates Z: 39 31.465 2.028 0.530 0.687 0.947 0.816 CB 1.463 39 residues pruned to eliminate duplicates Z: 19 27.616 2.326 0.175 0.943 1.000 0.944 CB 1.651 19 residues pruned to eliminate duplicates Z: 17 28.911 2.175 0.883 0.839 0.875 0.625 CB 1.507 17 residues pruned to eliminate duplicates Z: 11 13.749 2.007 0.546 0.554 0.900 0.700 CB 1.477 11 residues pruned to eliminate duplicates Z: 20 23.731 2.346 0.743 0.532 0.842 0.579 CB 1.532 20 residues pruned to eliminate duplicates Z: 40 40.851 2.429 0.921 0.465 0.821 0.487 CB 1.770 40 residues pruned to eliminate duplicates Z: 7 2.580 1.453 0.083 0.404 0.833 0.333 CB 0.889 7 residues pruned to eliminate duplicates Z: 7 3.780 1.572 0.563 0.505 0.667 0.500 CB 0.937 7 residues pruned to eliminate duplicates Z: 8 7.973 1.797 0.670 0.360 0.857 0.571 C 1.362 8 residues pruned to eliminate duplicates Z: 27 51.792 2.190 1.245 0.850 1.000 0.923 CB 1.531 27 residues pruned to eliminate duplicates Z: 20 43.458 2.637 1.036 0.606 0.895 0.737 C 1.876 20 residues pruned to eliminate duplicates Z: 24 25.262 2.311 0.688 0.525 0.826 0.565 CB 1.595 24 residues pruned to eliminate duplicates Z: 9 11.379 1.955 0.729 0.352 1.000 0.750 C 1.396 9 residues pruned to eliminate duplicates Z: 41 29.270 2.068 0.602 0.486 0.900 0.625 CB 1.574 29 residues pruned to eliminate duplicates Z: 32 48.929 2.251 0.993 0.769 0.968 0.581 CB 1.595 32 residues pruned to eliminate duplicates Z: 10 16.511 2.340 0.555 0.409 1.000 0.667 CB 1.664 10 residues pruned to eliminate duplicates Z: 58 49.350 2.244 0.708 0.672 0.947 0.825 CB 1.536 58 residues pruned to eliminate duplicates Z: 24 48.377 2.410 0.974 0.676 0.957 0.739 CB 1.885 24 residues pruned to eliminate duplicates Z: 17 40.223 2.209 0.983 0.913 1.000 1.000 CA 1.624 17 residues pruned to eliminate duplicates Z: 71 52.380 2.330 0.764 0.543 0.900 0.729 CB 1.623 71 residues pruned to eliminate duplicates Z: 24 45.895 2.175 1.189 0.904 1.000 0.783 CB 1.432 24 residues pruned to eliminate duplicates Z: 9 8.572 1.720 0.729 0.397 0.875 0.750 CB 1.298 9 residues pruned to eliminate duplicates Z: 25 45.794 2.354 0.878 0.674 1.000 0.708 CB 1.801 25 residues pruned to eliminate duplicates Z: 18 44.573 2.259 0.927 0.944 1.000 1.000 CB 1.720 18 residues pruned to eliminate duplicates Z: 38 26.163 2.194 0.453 0.423 0.892 0.703 CB 1.639 38 residues pruned to eliminate duplicates Z: 58 47.105 2.202 0.846 0.616 0.912 0.544 CB 1.507 58 residues pruned to eliminate duplicates Z: 8 9.333 1.801 0.286 0.744 1.000 0.429 CA 1.224 8 residues pruned to eliminate duplicates Z: 6 5.447 1.931 0.102 0.749 0.600 0.600 CB 1.528 6 residues pruned to eliminate duplicates Z: 29 23.986 2.332 0.613 0.458 0.821 0.571 CB 1.530 29 residues pruned to eliminate duplicates Z: 32 20.049 2.074 0.422 0.488 0.839 0.710 CB 1.473 32 residues pruned to eliminate duplicates Z: 6 12.717 2.695 0.654 0.297 1.000 0.800 CB 1.600 6 residues pruned to eliminate duplicates Z: 36 25.876 2.230 0.432 0.402 0.943 0.571 CB 1.610 36 residues pruned to eliminate duplicates Z: 12 7.646 1.861 0.486 0.437 0.909 0.545 CB 0.979 12 residues pruned to eliminate duplicates Z: 39 32.672 2.103 1.021 0.580 0.895 0.553 CB 1.291 39 residues pruned to eliminate duplicates Z: 7 6.925 1.801 0.328 0.513 0.833 0.500 CB 1.400 7 residues pruned to eliminate duplicates Z: 27 22.030 2.070 0.384 0.526 0.962 0.692 CB 1.528 27 residues pruned to eliminate duplicates Z: 32 24.504 2.105 0.533 0.434 0.935 0.516 CB 1.561 32 residues pruned to eliminate duplicates Z: 12 12.260 2.166 0.582 0.480 0.818 0.455 CB 1.346 12 residues pruned to eliminate duplicates Z: 20 13.379 2.124 0.494 0.325 0.895 0.421 CB 1.310 20 residues pruned to eliminate duplicates Z: 34 23.264 2.260 0.595 0.426 0.848 0.636 CB 1.430 34 residues pruned to eliminate duplicates Z: 18 46.429 2.464 0.871 0.766 0.941 0.706 C 2.049 18 residues pruned to eliminate duplicates Z: 30 28.272 2.375 0.718 0.424 0.862 0.483 CB 1.616 30 residues pruned to eliminate duplicates Z: 36 25.024 2.143 0.875 0.471 0.857 0.514 CB 1.265 40 residues pruned to eliminate duplicates Z: 41 34.542 2.303 0.869 0.497 0.875 0.600 CB 1.454 41 residues pruned to eliminate duplicates Z: 18 51.166 2.285 1.059 0.951 1.000 0.882 CB 1.817 18 residues pruned to eliminate duplicates Z: 8 20.842 2.120 0.638 0.908 1.000 1.000 CB 1.612 8 residues pruned to eliminate duplicates Z: 11 16.241 2.156 0.664 0.487 0.900 0.600 CB 1.611 11 residues pruned to eliminate duplicates Z: 37 43.284 2.253 0.733 0.599 0.917 0.611 CB 1.835 37 residues pruned to eliminate duplicates Z: 20 62.481 2.301 1.475 0.954 1.000 0.684 C 1.730 20 residues pruned to eliminate duplicates Z: 18 13.600 2.111 0.596 0.342 0.882 0.706 CB 1.318 18 residues pruned to eliminate duplicates Z: 11 8.555 2.053 0.659 0.212 0.700 0.300 CB 1.594 11 residues pruned to eliminate duplicates Z: 16 42.526 2.464 1.042 0.874 0.933 0.733 C 1.701 16 residues pruned to eliminate duplicates Z: 19 46.404 2.508 1.095 0.666 0.944 0.611 C 1.890 19 residues pruned to eliminate duplicates Z: 6 6.300 1.830 0.590 0.674 1.000 1.000 CA 0.824 6 residues pruned to eliminate duplicates Z: 24 38.474 2.092 1.197 0.825 0.913 0.783 CB 1.443 24 residues pruned to eliminate duplicates Z: 23 45.235 2.135 1.302 0.923 1.000 0.773 CB 1.379 23 residues pruned to eliminate duplicates Z: 7 4.990 1.476 0.112 0.825 1.000 0.833 CA 0.937 7 residues pruned to eliminate duplicates Z: 6 2.292 1.250 0.568 0.343 0.800 0.600 C 0.776 Z: 19 41.017 2.152 1.023 0.896 1.000 0.778 CB 1.590 19 residues pruned to eliminate duplicates Z: 79 60.420 2.261 1.006 0.620 0.910 0.692 CB 1.480 79 residues pruned to eliminate duplicates Z: 19 41.147 2.187 0.880 0.928 1.000 0.889 CB 1.652 19 residues pruned to eliminate duplicates Z: 7 6.532 1.667 0.214 0.794 1.000 0.833 CA 1.018 7 residues pruned to eliminate duplicates Z: 92 76.169 2.267 0.896 0.675 0.956 0.714 CB 1.653 92 residues pruned to eliminate duplicates Z: 48 36.412 2.433 0.694 0.464 0.809 0.489 CB 1.653 48 residues pruned to eliminate duplicates Z: 8 14.899 2.228 0.884 0.662 0.714 0.714 CB 1.616 8 residues pruned to eliminate duplicates Z: 29 28.152 2.218 0.744 0.451 0.929 0.607 CB 1.557 29 residues pruned to eliminate duplicates Z: 7 10.019 1.922 0.409 0.575 1.000 0.500 CB 1.405 7 residues pruned to eliminate duplicates Z: 47 53.873 2.256 0.957 0.660 0.935 0.674 CB 1.659 47 residues pruned to eliminate duplicates Z: 41 41.079 2.202 0.754 0.626 0.925 0.650 CB 1.615 41 residues pruned to eliminate duplicates Z: 16 18.475 2.079 1.252 0.519 0.800 0.400 CB 1.250 16 residues pruned to eliminate duplicates Z: 120 61.209 2.217 0.675 0.544 0.899 0.630 CB 1.611 120 residues pruned to eliminate duplicates Z: 7 9.837 1.715 0.664 0.851 0.833 0.833 CA 1.250 7 residues pruned to eliminate duplicates Z: 18 52.904 2.455 0.990 0.934 0.941 0.706 CA 1.945 18 residues pruned to eliminate duplicates Z: 7 12.011 1.935 0.500 0.666 1.000 0.667 CB 1.449 7 residues pruned to eliminate duplicates Z: 10 12.192 2.177 0.706 0.306 0.889 0.556 CB 1.527 10 residues pruned to eliminate duplicates Z: 18 53.098 2.502 0.861 0.944 1.000 0.882 C 1.916 18 residues pruned to eliminate duplicates Z: 16 57.054 2.448 1.283 0.942 0.933 0.867 CA 1.959 16 residues pruned to eliminate duplicates Z: 31 22.479 2.208 0.588 0.431 0.867 0.567 CB 1.451 31 residues pruned to eliminate duplicates Z: 15 10.241 1.779 0.462 0.508 0.857 0.429 CB 1.219 15 residues pruned to eliminate duplicates Z: 55 62.226 2.274 1.067 0.716 0.926 0.796 CB 1.599 55 residues pruned to eliminate duplicates Z: 18 46.194 2.466 0.777 0.901 0.941 0.882 C 1.940 18 residues pruned to eliminate duplicates Z: 88 72.202 2.309 0.812 0.636 0.954 0.713 CB 1.707 88 residues pruned to eliminate duplicates Z: 9 14.175 2.023 0.512 0.554 1.000 0.750 CB 1.554 9 residues pruned to eliminate duplicates Z: 9 5.135 2.112 0.671 0.391 0.875 0.375 CB 0.659 Z: 17 31.976 2.441 0.746 0.494 0.938 0.562 CB 2.013 17 residues pruned to eliminate duplicates Z: 20 39.790 2.494 0.596 0.764 0.947 0.842 CB 1.914 20 residues pruned to eliminate duplicates Z: 58 46.669 2.263 0.688 0.554 0.912 0.596 CB 1.682 58 residues pruned to eliminate duplicates Z: 38 33.838 2.305 0.787 0.491 0.838 0.405 CB 1.627 38 residues pruned to eliminate duplicates Z: 21 32.256 2.407 0.737 0.614 0.900 0.700 C 1.721 21 residues pruned to eliminate duplicates Z: 12 19.455 2.122 0.711 0.781 0.818 0.455 C 1.541 12 residues pruned to eliminate duplicates Z: 15 45.879 2.412 1.097 0.928 1.000 0.857 C 1.698 15 residues pruned to eliminate duplicates Z: 45 35.269 2.189 0.623 0.536 0.932 0.705 CB 1.550 45 residues pruned to eliminate duplicates Z: 48 32.597 2.104 0.997 0.501 0.851 0.553 CB 1.329 48 residues pruned to eliminate duplicates Z: 43 42.457 2.418 0.818 0.526 0.857 0.429 CB 1.693 43 residues pruned to eliminate duplicates Z: 16 40.275 2.367 0.734 0.934 1.000 0.933 CA 1.766 16 residues pruned to eliminate duplicates Z: 10 2.782 1.257 0.323 0.425 0.889 0.333 CB 0.678 Z: 84 52.130 2.253 0.568 0.595 0.916 0.723 CB 1.615 84 residues pruned to eliminate duplicates Z: 10 11.922 2.216 0.506 0.360 0.778 0.444 CB 1.781 10 residues pruned to eliminate duplicates Z: 18 8.541 1.819 0.392 0.358 0.765 0.471 CB 1.247 18 residues pruned to eliminate duplicates Z: 73 39.465 2.111 0.543 0.533 0.917 0.653 CB 1.509 73 residues pruned to eliminate duplicates Z: 19 22.039 2.406 0.616 0.449 0.833 0.611 CB 1.689 19 residues pruned to eliminate duplicates Z: 25 26.359 2.226 0.709 0.467 0.875 0.500 CB 1.671 25 residues pruned to eliminate duplicates Z: 24 37.302 2.102 0.594 0.942 1.000 0.913 CB 1.610 24 residues pruned to eliminate duplicates Z: 14 46.043 2.446 1.030 0.937 1.000 0.846 C 1.789 14 residues pruned to eliminate duplicates Z: 12 15.854 2.253 0.495 0.384 0.909 0.727 CA 1.765 12 residues pruned to eliminate duplicates Z: 42 25.233 2.108 0.517 0.452 0.854 0.610 CB 1.517 42 residues pruned to eliminate duplicates Z: 18 38.465 2.387 0.457 0.955 1.000 0.941 CB 1.844 18 residues pruned to eliminate duplicates Z: 68 45.653 2.185 0.677 0.562 0.910 0.642 CB 1.574 68 residues pruned to eliminate duplicates Z: 6 3.202 1.830 0.247 0.257 0.600 0.400 CB 1.382 6 residues pruned to eliminate duplicates Z: 136 90.493 2.361 0.874 0.636 0.933 0.681 CB 1.660 136 residues pruned to eliminate duplicates Z: 56 49.425 2.231 0.725 0.664 0.945 0.800 CB 1.573 56 residues pruned to eliminate duplicates Z: 38 40.268 2.403 0.861 0.522 0.946 0.568 CB 1.531 38 residues pruned to eliminate duplicates Z: 6 13.005 1.967 1.010 0.715 1.000 0.600 CB 1.210 6 residues pruned to eliminate duplicates Z: 9 20.882 2.062 0.743 0.925 1.000 0.875 CA 1.442 9 residues pruned to eliminate duplicates Z: 11 16.568 2.161 0.737 0.616 0.800 0.500 CB 1.563 11 residues pruned to eliminate duplicates Z: 7 3.274 1.398 0.492 0.423 0.833 0.667 CB 0.833 Z: 6 10.166 1.634 0.628 0.861 1.000 1.000 N 1.255 6 residues pruned to eliminate duplicates Z: 33 40.467 2.206 0.931 0.527 0.906 0.625 CB 1.805 33 residues pruned to eliminate duplicates Z: 46 38.657 2.455 0.682 0.421 0.889 0.467 CB 1.705 46 residues pruned to eliminate duplicates Z: 16 43.559 2.359 0.848 0.896 1.000 0.800 CA 1.847 16 residues pruned to eliminate duplicates Z: 23 49.424 2.195 1.269 0.923 1.000 0.727 CB 1.487 23 residues pruned to eliminate duplicates Z: 54 49.772 2.497 0.817 0.499 0.868 0.472 CB 1.738 54 residues pruned to eliminate duplicates Z: 20 43.700 2.573 0.962 0.598 0.947 0.579 C 1.909 20 residues pruned to eliminate duplicates Z: 6 9.452 1.841 0.364 0.812 1.000 0.800 CB 1.283 6 residues pruned to eliminate duplicates Z: 30 37.357 2.431 0.673 0.465 0.966 0.586 CB 1.831 30 residues pruned to eliminate duplicates Z: 12 17.597 2.205 0.459 0.643 0.909 0.455 CB 1.586 12 residues pruned to eliminate duplicates Z: 18 26.857 2.292 0.721 0.571 0.941 0.588 CB 1.638 19 residues pruned to eliminate duplicates Z: 13 40.353 2.611 0.579 0.921 1.000 1.000 C 1.988 13 residues pruned to eliminate duplicates Z: 24 41.634 2.427 0.891 0.597 0.913 0.696 C 1.888 24 residues pruned to eliminate duplicates Z: 26 23.499 2.051 0.579 0.510 0.920 0.680 CB 1.561 26 residues pruned to eliminate duplicates Z: 7 9.356 2.130 0.188 0.801 1.000 0.500 CB 1.160 7 residues pruned to eliminate duplicates Z: 54 53.781 2.205 0.953 0.601 0.925 0.660 CB 1.685 54 residues pruned to eliminate duplicates Z: 25 44.857 2.055 0.967 0.910 1.000 0.875 CB 1.607 25 residues pruned to eliminate duplicates Z: 25 36.999 2.045 0.639 0.909 1.000 0.875 CB 1.598 25 residues pruned to eliminate duplicates Z: 22 27.822 2.134 1.163 0.629 0.952 0.762 CB 1.223 22 residues pruned to eliminate duplicates Z: 22 45.045 2.587 0.933 0.644 0.905 0.857 CB 1.899 22 residues pruned to eliminate duplicates Z: 12 16.584 2.248 0.507 0.402 0.909 0.636 C 1.801 12 residues pruned to eliminate duplicates Z: 40 36.063 2.273 0.494 0.591 0.923 0.744 CB 1.688 40 residues pruned to eliminate duplicates Z: 9 14.216 1.631 0.745 0.793 1.000 0.750 CB 1.366 9 residues pruned to eliminate duplicates Z: 10 3.944 1.813 0.353 0.332 0.778 0.556 CB 0.827 10 residues pruned to eliminate duplicates Z: 16 11.168 1.785 0.547 0.477 0.867 0.667 CB 1.233 16 residues pruned to eliminate duplicates Z: 54 46.861 2.269 0.559 0.655 0.925 0.717 CB 1.704 54 residues pruned to eliminate duplicates Z: 40 33.687 2.141 0.752 0.552 0.872 0.641 CB 1.567 64 residues pruned to eliminate duplicates Z: 20 45.144 2.321 0.740 0.894 0.947 0.842 CB 1.942 20 residues pruned to eliminate duplicates Z: 12 14.116 2.138 0.568 0.451 0.818 0.545 CB 1.632 12 residues pruned to eliminate duplicates Z: 9 12.323 1.824 0.233 0.798 1.000 0.625 CA 1.494 9 residues pruned to eliminate duplicates Z: 8 20.891 2.286 0.488 0.875 1.000 1.000 CA 1.688 8 residues pruned to eliminate duplicates Z: 17 21.541 2.116 0.588 0.593 0.938 0.562 CB 1.564 17 residues pruned to eliminate duplicates Z: 18 40.704 2.387 0.594 0.906 1.000 0.765 CA 1.845 18 residues pruned to eliminate duplicates Z: 11 16.649 2.243 0.475 0.505 1.000 0.600 C 1.583 11 residues pruned to eliminate duplicates Z: 15 16.245 2.150 0.638 0.356 0.929 0.357 CB 1.551 15 residues pruned to eliminate duplicates Z: 47 50.109 2.296 0.880 0.589 0.870 0.609 CB 1.808 47 residues pruned to eliminate duplicates 6 1.745 1.458 0.018 0.299 0.800 0.400 C 0.823 ? Z: 14 25.227 1.859 0.969 0.904 1.000 0.769 CB 1.362 14 residues pruned to eliminate duplicates Z: 7 4.930 1.489 0.473 0.680 1.000 0.667 CB 0.777 Z: 35 48.304 2.376 0.916 0.654 0.912 0.647 CB 1.729 35 residues pruned to eliminate duplicates Z: 15 48.021 2.663 0.868 0.791 0.929 0.857 C 2.152 15 residues pruned to eliminate duplicates Z: 38 30.849 2.305 0.768 0.486 0.865 0.568 CB 1.459 38 residues pruned to eliminate duplicates Z: 9 5.554 1.915 0.578 0.373 0.875 0.500 CB 0.850 9 residues pruned to eliminate duplicates Z: 12 10.819 2.326 0.579 0.258 0.636 0.182 CB 1.841 12 residues pruned to eliminate duplicates Z: 24 40.796 2.101 0.758 0.949 1.000 0.957 CB 1.589 24 residues pruned to eliminate duplicates Z: 12 12.627 2.185 0.649 0.440 0.727 0.636 CB 1.546 12 residues pruned to eliminate duplicates Z: 7 14.726 2.065 0.330 0.868 1.000 0.667 CA 1.601 7 residues pruned to eliminate duplicates Z: 62 58.232 2.314 0.654 0.665 0.951 0.738 CB 1.759 62 residues pruned to eliminate duplicates Z: 51 26.121 2.103 0.445 0.473 0.820 0.600 CB 1.523 51 residues pruned to eliminate duplicates 7 1.226 1.315 -0.040 0.295 0.667 0.500 N 0.748 ? Z: 10 15.960 1.733 0.884 0.818 1.000 0.778 CA 1.236 10 residues pruned to eliminate duplicates Z: 26 37.895 2.400 1.019 0.531 0.840 0.640 CB 1.805 26 residues pruned to eliminate duplicates Z: 59 47.858 2.092 0.820 0.634 0.879 0.638 CB 1.655 59 residues pruned to eliminate duplicates Z: 19 35.185 2.393 1.030 0.513 0.889 0.667 C 1.895 19 residues pruned to eliminate duplicates Z: 54 45.407 2.298 0.800 0.560 0.887 0.585 CB 1.604 54 residues pruned to eliminate duplicates Z: 25 46.838 2.122 1.227 0.934 1.000 0.917 CB 1.411 25 residues pruned to eliminate duplicates Z: 17 40.819 2.390 0.990 0.668 1.000 0.688 C 1.838 17 residues pruned to eliminate duplicates Z: 7 2.332 1.325 0.156 0.414 0.833 0.667 N 0.816 Z: 23 14.137 1.934 0.771 0.486 0.909 0.545 CB 0.982 23 residues pruned to eliminate duplicates Z: 41 48.941 2.324 0.996 0.595 0.875 0.600 CB 1.741 41 residues pruned to eliminate duplicates Z: 15 34.203 2.356 1.064 0.535 1.000 0.643 CB 1.816 15 residues pruned to eliminate duplicates Z: 18 19.810 2.013 0.593 0.542 0.941 0.647 CA 1.528 18 residues pruned to eliminate duplicates Z: 33 48.594 2.347 0.939 0.672 0.875 0.688 CB 1.841 33 residues pruned to eliminate duplicates Z: 24 38.322 2.286 0.931 0.626 0.957 0.739 CB 1.682 24 residues pruned to eliminate duplicates Z: 7 9.667 1.854 0.307 0.735 1.000 0.500 CA 1.319 7 residues pruned to eliminate duplicates Z: 24 30.217 2.085 1.063 0.653 0.957 0.652 CB 1.329 24 residues pruned to eliminate duplicates Z: 17 25.602 1.892 0.789 0.825 0.938 0.625 CA 1.522 17 residues pruned to eliminate duplicates Z: 15 46.432 2.425 1.094 0.809 1.000 0.786 C 1.866 15 residues pruned to eliminate duplicates Z: 17 45.569 2.219 1.220 0.912 1.000 0.750 CB 1.638 17 residues pruned to eliminate duplicates Z: 13 30.733 2.525 0.889 0.593 1.000 0.667 C 1.702 13 residues pruned to eliminate duplicates Z: 8 11.898 1.933 0.438 0.689 1.000 0.571 CB 1.361 8 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 23 48.021 2.410 1.020 0.668 0.955 0.773 C 1.885 23 residues pruned to eliminate duplicates Z: 26 44.088 2.365 0.988 0.613 0.880 0.640 CA 1.916 26 residues pruned to eliminate duplicates Z: 25 38.615 2.411 0.819 0.641 0.833 0.583 C 1.890 25 residues pruned to eliminate duplicates Z: 21 47.640 2.521 0.823 0.732 0.950 0.700 C 1.980 21 residues pruned to eliminate duplicates Z: 26 43.104 2.396 0.857 0.653 0.920 0.760 CB 1.826 26 residues pruned to eliminate duplicates Z: 42 54.478 2.479 0.758 0.661 0.854 0.634 CB 1.970 42 residues pruned to eliminate duplicates Z: 20 55.520 2.580 0.975 0.775 0.947 0.842 CB 2.070 20 residues pruned to eliminate duplicates Z: 22 46.657 2.480 0.900 0.733 0.952 0.762 C 1.841 22 residues pruned to eliminate duplicates Z: 22 51.299 2.523 0.911 0.733 0.905 0.714 C 2.081 22 residues pruned to eliminate duplicates Z: 86 71.970 2.515 0.813 0.546 0.882 0.565 CB 1.854 86 residues pruned to eliminate duplicates Z: 69 61.029 2.282 0.801 0.614 0.941 0.676 CB 1.717 69 residues pruned to eliminate duplicates Z: 28 40.343 2.271 0.897 0.610 0.889 0.704 C 1.827 28 residues pruned to eliminate duplicates Z: 20 56.817 2.595 1.106 0.779 0.895 0.789 C 2.084 20 residues pruned to eliminate duplicates Z: 22 54.114 2.444 1.086 0.748 0.952 0.667 C 1.949 22 residues pruned to eliminate duplicates Z: 23 51.558 2.474 1.122 0.718 0.909 0.773 C 1.891 23 residues pruned to eliminate duplicates Z: 66 63.512 2.305 0.808 0.639 0.938 0.723 CB 1.768 121 residues pruned to eliminate duplicates Z: 19 24.842 2.151 0.469 0.766 0.889 0.889 CB 1.646 19 residues pruned to eliminate duplicates Z: 35 45.595 2.320 0.752 0.633 0.971 0.765 CB 1.749 35 residues pruned to eliminate duplicates Z: 29 58.917 2.449 1.130 0.650 0.964 0.750 CB 1.925 29 residues pruned to eliminate duplicates Z: 33 60.939 2.429 1.085 0.691 0.938 0.781 CB 1.905 33 residues pruned to eliminate duplicates Z: 29 62.442 2.425 1.249 0.710 0.929 0.786 CB 1.925 29 residues pruned to eliminate duplicates Z: 44 56.922 2.344 1.006 0.629 0.930 0.744 CB 1.757 33 residues pruned to eliminate duplicates Z: 17 36.276 2.231 0.724 0.923 1.000 0.875 CA 1.657 17 residues pruned to eliminate duplicates Z: 34 50.866 2.364 1.012 0.647 0.909 0.667 CB 1.785 34 residues pruned to eliminate duplicates Z: 37 54.710 2.390 1.180 0.634 0.861 0.583 CB 1.793 37 residues pruned to eliminate duplicates Z: 33 49.511 2.365 0.962 0.617 0.938 0.656 CB 1.801 33 residues pruned to eliminate duplicates Z: 33 60.678 2.428 0.994 0.693 0.938 0.812 CB 1.982 33 residues pruned to eliminate duplicates Z: 39 54.003 2.388 1.071 0.581 0.921 0.553 CB 1.779 39 residues pruned to eliminate duplicates Z: 34 52.738 2.298 1.052 0.638 0.939 0.788 CB 1.821 34 residues pruned to eliminate duplicates Z: 30 62.169 2.435 1.193 0.705 0.931 0.655 CB 1.927 30 residues pruned to eliminate duplicates Z: 33 62.398 2.408 1.135 0.650 0.969 0.781 CB 1.925 33 residues pruned to eliminate duplicates Z: 33 62.176 2.425 1.127 0.673 0.938 0.688 CB 1.937 33 residues pruned to eliminate duplicates Z: 33 61.354 2.412 1.066 0.684 0.969 0.719 CB 1.897 33 residues pruned to eliminate duplicates Z: 32 66.435 2.453 1.151 0.713 0.968 0.645 CB 1.927 32 residues pruned to eliminate duplicates Z: 28 57.880 2.435 0.999 0.691 1.000 0.667 CA 1.922 28 residues pruned to eliminate duplicates Z: 32 63.309 2.449 1.052 0.719 0.968 0.742 CB 1.917 32 residues pruned to eliminate duplicates Z: 15 30.321 2.298 1.109 0.503 0.929 0.500 CB 1.796 15 residues pruned to eliminate duplicates Z: 35 54.458 2.359 1.027 0.655 0.912 0.647 CB 1.854 35 residues pruned to eliminate duplicates Z: 37 55.317 2.420 1.091 0.653 0.861 0.611 CB 1.835 37 residues pruned to eliminate duplicates Z: 48 47.110 2.315 0.812 0.593 0.894 0.681 CB 1.678 48 residues pruned to eliminate duplicates Z: 66 51.698 2.240 0.788 0.537 0.908 0.662 CB 1.701 100 residues pruned to eliminate duplicates Z: 7 7.886 1.884 0.912 0.732 1.000 0.500 CB 0.726 7 residues pruned to eliminate duplicates Z: 33 57.849 2.435 0.990 0.695 0.906 0.688 CB 1.947 33 residues pruned to eliminate duplicates Z: 33 64.690 2.438 1.123 0.693 0.969 0.656 CB 1.912 33 residues pruned to eliminate duplicates Z: 20 14.137 1.732 0.690 0.414 0.895 0.368 CA 1.356 17 residues pruned to eliminate duplicates Z: 8 13.393 1.660 0.708 0.859 1.000 0.429 CB 1.313 8 residues pruned to eliminate duplicates Z: 13 14.793 2.003 0.547 0.484 0.917 0.667 CB 1.528 13 residues pruned to eliminate duplicates Z: 13 15.980 2.034 0.538 0.495 0.917 0.583 CB 1.616 13 residues pruned to eliminate duplicates Z: 9 8.538 1.900 0.292 0.507 0.875 0.625 CA 1.396 9 residues pruned to eliminate duplicates Z: 11 8.870 2.044 0.398 0.502 0.700 0.700 CB 1.400 11 residues pruned to eliminate duplicates Z: 13 14.247 1.980 0.486 0.520 0.917 0.500 CB 1.495 13 residues pruned to eliminate duplicates Z: 10 15.453 2.276 0.579 0.441 1.000 0.556 CB 1.522 10 residues pruned to eliminate duplicates Z: 12 13.957 2.100 0.637 0.442 0.818 0.455 CB 1.589 12 residues pruned to eliminate duplicates Z: 13 16.366 2.055 0.596 0.518 0.917 0.583 CB 1.544 13 residues pruned to eliminate duplicates Z: 40 34.512 2.342 0.747 0.430 0.923 0.436 CB 1.573 40 residues pruned to eliminate duplicates Z: 6 6.321 1.949 0.383 0.383 0.800 0.600 CB 1.485 6 residues pruned to eliminate duplicates Z: 33 28.291 2.365 0.791 0.442 0.844 0.469 CB 1.486 33 residues pruned to eliminate duplicates Z: 30 23.945 2.400 0.603 0.407 0.828 0.517 CB 1.540 30 residues pruned to eliminate duplicates Z: 35 27.791 2.314 0.783 0.436 0.824 0.529 CB 1.499 35 residues pruned to eliminate duplicates Z: 29 30.639 2.373 0.771 0.477 0.857 0.393 CB 1.646 29 residues pruned to eliminate duplicates Z: 30 26.413 2.287 0.769 0.364 0.862 0.414 CB 1.628 30 residues pruned to eliminate duplicates Z: 40 30.680 2.396 0.822 0.399 0.821 0.385 CB 1.526 40 residues pruned to eliminate duplicates Z: 30 30.249 2.412 0.834 0.441 0.862 0.483 CB 1.566 30 residues pruned to eliminate duplicates Z: 29 28.534 2.355 0.793 0.412 0.821 0.536 CB 1.706 29 residues pruned to eliminate duplicates Z: 30 31.650 2.452 0.726 0.460 0.897 0.414 CB 1.613 30 residues pruned to eliminate duplicates Z: 35 40.267 2.517 1.027 0.442 0.853 0.471 CB 1.685 35 residues pruned to eliminate duplicates Z: 33 26.720 2.403 0.608 0.430 0.875 0.594 CB 1.503 33 residues pruned to eliminate duplicates Z: 31 31.537 2.422 0.727 0.478 0.867 0.533 CB 1.624 31 residues pruned to eliminate duplicates Z: 31 30.708 2.430 0.643 0.477 0.867 0.500 CB 1.658 31 residues pruned to eliminate duplicates Z: 33 28.597 2.364 0.756 0.437 0.875 0.344 CB 1.485 33 residues pruned to eliminate duplicates Z: 35 29.736 2.367 0.779 0.406 0.853 0.412 CB 1.567 35 residues pruned to eliminate duplicates Z: 32 32.148 2.404 0.752 0.477 0.903 0.516 CB 1.554 32 residues pruned to eliminate duplicates Z: 29 29.364 2.454 0.812 0.449 0.786 0.429 CB 1.674 29 residues pruned to eliminate duplicates Z: 35 30.083 2.380 0.825 0.420 0.824 0.441 CB 1.567 35 residues pruned to eliminate duplicates Z: 38 33.524 2.373 0.797 0.429 0.892 0.568 CB 1.559 38 residues pruned to eliminate duplicates Z: 58 51.438 2.523 0.860 0.468 0.842 0.544 CB 1.782 58 residues pruned to eliminate duplicates Z: 67 58.365 2.497 0.852 0.481 0.864 0.485 CB 1.833 67 residues pruned to eliminate duplicates Z: 30 25.686 2.384 0.752 0.403 0.862 0.483 CB 1.467 30 residues pruned to eliminate duplicates Z: 37 34.959 2.436 0.861 0.440 0.861 0.472 CB 1.587 37 residues pruned to eliminate duplicates Z: 23 20.756 2.401 0.666 0.406 0.773 0.273 CB 1.580 23 residues pruned to eliminate duplicates Z: 74 63.426 2.454 0.875 0.522 0.890 0.548 CB 1.773 74 residues pruned to eliminate duplicates Z: 33 31.798 2.375 0.758 0.454 0.906 0.469 CB 1.556 33 residues pruned to eliminate duplicates Z: 38 33.530 2.459 0.871 0.421 0.811 0.432 CB 1.603 38 residues pruned to eliminate duplicates Z: 60 50.539 2.494 0.764 0.452 0.847 0.475 CB 1.854 60 residues pruned to eliminate duplicates Z: 38 31.370 2.392 0.814 0.419 0.865 0.405 CB 1.496 38 residues pruned to eliminate duplicates Z: 18 21.859 2.468 0.739 0.442 0.824 0.235 CB 1.593 18 residues pruned to eliminate duplicates Z: 30 34.934 2.411 1.050 0.375 0.793 0.552 C 1.890 30 residues pruned to eliminate duplicates Z: 64 47.023 2.409 0.810 0.425 0.825 0.556 CB 1.779 64 residues pruned to eliminate duplicates Z: 59 51.127 2.508 0.847 0.446 0.862 0.500 CB 1.777 59 residues pruned to eliminate duplicates Z: 54 49.745 2.556 0.782 0.461 0.849 0.472 CB 1.838 54 residues pruned to eliminate duplicates Z: 58 50.792 2.532 0.809 0.467 0.825 0.544 CB 1.841 58 residues pruned to eliminate duplicates Z: 24 34.415 2.456 0.776 0.536 0.913 0.652 C 1.740 24 residues pruned to eliminate duplicates Z: 59 53.920 2.510 0.908 0.458 0.845 0.534 CB 1.827 59 residues pruned to eliminate duplicates Z: 20 29.168 2.357 0.849 0.638 0.842 0.684 C 1.602 20 residues pruned to eliminate duplicates Z: 47 58.469 2.479 0.965 0.516 0.891 0.587 CB 1.954 47 residues pruned to eliminate duplicates Z: 103 70.949 2.394 0.659 0.608 0.922 0.686 CB 1.732 103 residues pruned to eliminate duplicates Z: 22 38.966 2.582 0.978 0.541 0.857 0.619 C 1.865 22 residues pruned to eliminate duplicates Z: 39 47.753 2.519 0.822 0.500 0.868 0.526 CB 1.944 39 residues pruned to eliminate duplicates Z: 94 58.516 2.347 0.787 0.491 0.860 0.527 CB 1.698 94 residues pruned to eliminate duplicates Z: 28 41.315 2.559 0.825 0.452 0.926 0.481 C 1.932 28 residues pruned to eliminate duplicates Z: 44 48.276 2.505 0.787 0.490 0.884 0.488 CB 1.880 44 residues pruned to eliminate duplicates Z: 42 63.874 2.600 0.893 0.635 0.902 0.634 C 1.979 42 residues pruned to eliminate duplicates Z: 71 46.751 2.391 0.712 0.460 0.843 0.486 CB 1.687 71 residues pruned to eliminate duplicates Z: 59 49.350 2.475 0.741 0.445 0.879 0.483 CB 1.810 59 residues pruned to eliminate duplicates Z: 23 40.658 2.396 0.879 0.542 1.000 0.682 C 1.847 23 residues pruned to eliminate duplicates Z: 23 40.767 2.553 0.867 0.543 0.955 0.636 C 1.830 23 residues pruned to eliminate duplicates Z: 23 38.738 2.582 0.738 0.520 0.909 0.636 C 1.986 23 residues pruned to eliminate duplicates Z: 47 53.304 2.524 0.779 0.553 0.848 0.630 C 1.961 47 residues pruned to eliminate duplicates Z: 59 49.309 2.510 0.815 0.460 0.845 0.466 CB 1.753 59 residues pruned to eliminate duplicates Z: 58 45.329 2.433 0.739 0.423 0.842 0.526 CB 1.827 58 residues pruned to eliminate duplicates Z: 67 54.098 2.451 0.828 0.470 0.864 0.500 CB 1.774 67 residues pruned to eliminate duplicates Z: 61 49.150 2.215 0.594 0.694 0.983 0.767 CB 1.530 61 residues pruned to eliminate duplicates Z: 32 34.507 2.425 0.612 0.613 0.871 0.742 CB 1.636 32 residues pruned to eliminate duplicates Z: 118 65.028 2.270 0.691 0.599 0.906 0.692 CB 1.573 118 residues pruned to eliminate duplicates Z: 62 50.800 2.412 0.795 0.501 0.902 0.721 CB 1.664 62 residues pruned to eliminate duplicates Z: 121 71.181 2.303 0.745 0.612 0.908 0.725 CB 1.600 121 residues pruned to eliminate duplicates Z: 29 33.432 2.383 0.573 0.622 0.929 0.714 CB 1.617 29 residues pruned to eliminate duplicates Z: 28 37.955 2.413 0.795 0.613 0.926 0.704 CB 1.637 28 residues pruned to eliminate duplicates Z: 58 48.240 2.260 0.524 0.702 0.947 0.754 CB 1.630 58 residues pruned to eliminate duplicates Z: 59 46.534 2.258 0.464 0.706 0.948 0.759 CB 1.616 59 residues pruned to eliminate duplicates Z: 74 49.277 2.241 0.616 0.614 0.904 0.712 CB 1.580 74 residues pruned to eliminate duplicates Z: 34 34.689 2.246 0.657 0.597 0.909 0.606 CB 1.626 34 residues pruned to eliminate duplicates Z: 59 43.535 2.161 0.721 0.619 0.948 0.707 CB 1.449 59 residues pruned to eliminate duplicates Z: 50 52.010 2.312 0.601 0.768 0.918 0.735 CB 1.724 50 residues pruned to eliminate duplicates Z: 115 56.698 2.243 0.628 0.598 0.912 0.702 CB 1.453 115 residues pruned to eliminate duplicates Z: 54 57.014 2.283 0.767 0.714 0.962 0.792 CB 1.662 54 residues pruned to eliminate duplicates Z: 55 47.648 2.217 0.634 0.690 0.926 0.704 CB 1.624 55 residues pruned to eliminate duplicates Z: 42 40.478 2.375 0.816 0.523 0.878 0.610 CB 1.631 42 residues pruned to eliminate duplicates Z: 54 52.563 2.263 0.731 0.716 0.943 0.755 CB 1.607 54 residues pruned to eliminate duplicates Z: 60 51.320 2.268 0.644 0.685 0.949 0.746 CB 1.594 60 residues pruned to eliminate duplicates Z: 53 50.172 2.277 0.721 0.724 0.904 0.808 CB 1.605 53 residues pruned to eliminate duplicates Z: 31 35.566 2.337 0.911 0.570 0.833 0.633 CB 1.630 31 residues pruned to eliminate duplicates Z: 57 53.241 2.266 0.705 0.692 0.946 0.768 CB 1.633 57 residues pruned to eliminate duplicates Z: 77 52.407 2.263 0.588 0.616 0.961 0.763 CB 1.561 77 residues pruned to eliminate duplicates Z: 52 56.366 2.329 0.705 0.724 0.961 0.804 CB 1.690 52 residues pruned to eliminate duplicates Z: 77 53.268 2.261 0.642 0.628 0.934 0.697 CB 1.562 77 residues pruned to eliminate duplicates Z: 53 53.088 2.261 0.680 0.714 0.942 0.808 CB 1.694 53 residues pruned to eliminate duplicates Z: 64 47.966 2.243 0.634 0.655 0.921 0.794 CB 1.551 64 residues pruned to eliminate duplicates Z: 59 49.505 2.238 0.710 0.679 0.914 0.776 CB 1.577 59 residues pruned to eliminate duplicates Z: 60 49.814 2.251 0.633 0.674 0.932 0.797 CB 1.612 60 residues pruned to eliminate duplicates Z: 58 53.144 2.252 0.728 0.690 0.947 0.789 CB 1.605 58 residues pruned to eliminate duplicates Z: 59 48.755 2.213 0.685 0.655 0.914 0.690 CB 1.627 59 residues pruned to eliminate duplicates Z: 30 32.288 2.150 0.440 0.756 0.966 0.931 CB 1.597 30 residues pruned to eliminate duplicates Z: 50 60.368 2.267 0.735 0.756 0.980 0.878 CB 1.782 50 residues pruned to eliminate duplicates Z: 33 32.230 2.083 0.630 0.714 0.938 0.781 CB 1.475 33 residues pruned to eliminate duplicates Z: 79 54.999 2.291 0.707 0.617 0.923 0.718 CB 1.544 79 residues pruned to eliminate duplicates Z: 55 57.738 2.290 0.800 0.707 0.963 0.815 CB 1.640 55 residues pruned to eliminate duplicates Z: 50 63.731 2.294 0.836 0.761 0.959 0.755 CB 1.787 50 residues pruned to eliminate duplicates Z: 48 62.095 2.261 0.927 0.776 0.936 0.766 CB 1.740 48 residues pruned to eliminate duplicates Z: 49 61.736 2.305 0.819 0.760 0.958 0.875 CB 1.760 49 residues pruned to eliminate duplicates Z: 72 54.449 2.233 0.796 0.622 0.901 0.648 CB 1.592 72 residues pruned to eliminate duplicates Z: 33 35.323 2.044 0.782 0.731 0.938 0.844 CB 1.486 33 residues pruned to eliminate duplicates Z: 60 59.785 2.261 0.846 0.699 0.966 0.780 CB 1.611 60 residues pruned to eliminate duplicates Z: 59 56.367 2.233 0.892 0.681 0.948 0.741 CB 1.565 59 residues pruned to eliminate duplicates Z: 32 38.688 2.069 0.823 0.734 0.968 0.774 CB 1.543 32 residues pruned to eliminate duplicates Z: 59 61.211 2.254 1.111 0.683 0.914 0.707 CB 1.563 59 residues pruned to eliminate duplicates Z: 31 40.775 2.074 0.928 0.742 0.967 0.900 CB 1.551 31 residues pruned to eliminate duplicates Z: 60 60.971 2.229 0.970 0.680 0.966 0.695 CB 1.586 60 residues pruned to eliminate duplicates Z: 49 65.120 2.257 1.007 0.748 0.938 0.771 CB 1.774 49 residues pruned to eliminate duplicates Z: 57 54.277 2.189 1.074 0.647 0.929 0.732 CB 1.500 57 residues pruned to eliminate duplicates Z: 60 60.427 2.253 0.994 0.675 0.949 0.746 CB 1.571 60 residues pruned to eliminate duplicates Z: 76 59.125 2.269 0.835 0.613 0.933 0.680 CB 1.579 76 residues pruned to eliminate duplicates Z: 59 63.380 2.249 1.052 0.698 0.948 0.707 CB 1.588 59 residues pruned to eliminate duplicates Z: 51 65.387 2.257 1.084 0.734 0.900 0.760 CB 1.771 51 residues pruned to eliminate duplicates Z: 33 40.168 2.023 0.974 0.714 0.969 0.781 CB 1.512 33 residues pruned to eliminate duplicates Z: 36 36.945 2.057 0.918 0.731 0.914 0.800 CB 1.406 36 residues pruned to eliminate duplicates Z: 79 58.815 2.258 0.918 0.611 0.910 0.667 CB 1.520 79 residues pruned to eliminate duplicates Z: 118 60.362 2.216 0.740 0.589 0.932 0.658 CB 1.426 118 residues pruned to eliminate duplicates Z: 118 62.985 2.204 0.860 0.571 0.897 0.667 CB 1.477 118 residues pruned to eliminate duplicates Z: 45 31.993 2.157 0.695 0.550 0.909 0.591 CB 1.382 45 residues pruned to eliminate duplicates Z: 61 44.198 2.242 0.675 0.587 0.917 0.617 CB 1.526 61 residues pruned to eliminate duplicates Z: 62 50.122 2.293 0.729 0.651 0.885 0.721 CB 1.589 62 residues pruned to eliminate duplicates Z: 6 2.409 1.182 0.847 0.375 0.800 0.800 CB 0.705 6 residues pruned to eliminate duplicates Z: 31 36.900 2.246 0.878 0.638 0.933 0.733 CB 1.504 31 residues pruned to eliminate duplicates Z: 32 32.146 2.196 0.529 0.618 1.000 0.710 CB 1.538 32 residues pruned to eliminate duplicates Z: 34 32.992 2.232 0.818 0.577 0.909 0.727 CB 1.446 34 residues pruned to eliminate duplicates Z: 62 51.399 2.300 0.754 0.639 0.885 0.689 CB 1.618 62 residues pruned to eliminate duplicates Z: 38 30.649 2.195 0.826 0.566 0.865 0.568 CB 1.364 38 residues pruned to eliminate duplicates Z: 26 29.277 2.177 0.708 0.675 0.960 0.680 CB 1.396 26 residues pruned to eliminate duplicates Z: 33 33.294 2.254 0.776 0.611 0.906 0.781 CB 1.460 33 residues pruned to eliminate duplicates Z: 62 51.383 2.306 0.722 0.649 0.902 0.721 CB 1.599 62 residues pruned to eliminate duplicates Z: 35 31.988 2.211 0.768 0.604 0.912 0.676 CB 1.394 35 residues pruned to eliminate duplicates Z: 64 54.673 2.315 0.747 0.651 0.921 0.698 CB 1.608 64 residues pruned to eliminate duplicates Z: 32 34.194 2.182 0.870 0.574 0.903 0.742 CB 1.551 32 residues pruned to eliminate duplicates Z: 68 52.420 2.264 0.712 0.653 0.925 0.731 CB 1.548 68 residues pruned to eliminate duplicates Z: 33 31.872 2.140 0.765 0.525 0.969 0.594 CB 1.502 33 residues pruned to eliminate duplicates Z: 26 33.490 2.168 1.121 0.657 0.920 0.760 CB 1.369 26 residues pruned to eliminate duplicates Z: 40 33.874 2.201 0.769 0.562 0.923 0.590 CB 1.421 40 residues pruned to eliminate duplicates Z: 41 34.808 2.167 0.878 0.555 0.925 0.550 CB 1.386 41 residues pruned to eliminate duplicates Z: 47 34.434 2.118 0.915 0.539 0.870 0.543 CB 1.386 47 residues pruned to eliminate duplicates Z: 34 35.044 2.122 0.960 0.584 0.909 0.606 CB 1.489 34 residues pruned to eliminate duplicates Z: 123 82.719 2.275 0.976 0.665 0.926 0.697 CB 1.544 123 residues pruned to eliminate duplicates Z: 34 36.628 2.205 1.100 0.606 0.879 0.576 CB 1.417 34 residues pruned to eliminate duplicates Z: 40 40.201 2.132 1.000 0.610 0.923 0.641 CB 1.473 40 residues pruned to eliminate duplicates Z: 38 35.356 2.166 0.934 0.588 0.919 0.568 CB 1.388 38 residues pruned to eliminate duplicates Z: 37 36.338 2.198 0.962 0.599 0.917 0.556 CB 1.395 37 residues pruned to eliminate duplicates Z: 34 36.925 2.208 1.053 0.588 0.909 0.606 CB 1.433 34 residues pruned to eliminate duplicates Z: 35 33.586 2.136 1.056 0.615 0.882 0.647 CB 1.333 35 residues pruned to eliminate duplicates Z: 40 46.819 2.347 0.582 0.645 1.000 0.718 CB 1.764 40 residues pruned to eliminate duplicates Z: 42 43.034 2.322 0.608 0.604 0.927 0.707 CB 1.760 42 residues pruned to eliminate duplicates Z: 53 44.084 2.290 0.599 0.562 0.923 0.750 CB 1.703 53 residues pruned to eliminate duplicates Z: 35 43.848 2.357 0.631 0.672 0.941 0.765 CB 1.773 35 residues pruned to eliminate duplicates Z: 42 45.717 2.302 0.718 0.598 0.927 0.683 CB 1.774 42 residues pruned to eliminate duplicates Z: 55 39.430 2.202 0.674 0.551 0.833 0.630 CB 1.663 55 residues pruned to eliminate duplicates Z: 37 45.740 2.272 0.796 0.686 0.917 0.722 CB 1.718 37 residues pruned to eliminate duplicates Z: 37 47.728 2.325 0.747 0.650 0.972 0.806 CB 1.752 37 residues pruned to eliminate duplicates Z: 43 47.480 2.309 0.801 0.609 0.929 0.714 CB 1.711 43 residues pruned to eliminate duplicates Z: 42 47.924 2.288 0.786 0.581 0.951 0.659 CB 1.782 42 residues pruned to eliminate duplicates Z: 42 47.291 2.196 0.900 0.613 0.927 0.610 CB 1.717 42 residues pruned to eliminate duplicates Z: 37 51.487 2.368 0.930 0.653 0.917 0.694 CB 1.777 37 residues pruned to eliminate duplicates Z: 35 56.305 2.340 0.984 0.703 0.941 0.706 CB 1.837 35 residues pruned to eliminate duplicates Z: 38 57.705 2.296 1.117 0.658 0.973 0.784 CB 1.732 38 residues pruned to eliminate duplicates Z: 36 52.295 2.355 0.912 0.673 0.914 0.686 CB 1.830 36 residues pruned to eliminate duplicates Z: 38 56.149 2.365 0.970 0.647 0.973 0.703 CB 1.776 38 residues pruned to eliminate duplicates Z: 40 54.481 2.346 0.906 0.633 0.923 0.718 CB 1.866 40 residues pruned to eliminate duplicates Z: 27 48.458 2.327 1.023 0.724 0.962 0.615 CB 1.716 27 residues pruned to eliminate duplicates Z: 37 53.864 2.303 1.066 0.663 0.944 0.583 CB 1.718 37 residues pruned to eliminate duplicates Z: 37 51.094 2.304 0.948 0.661 0.944 0.667 CB 1.731 37 residues pruned to eliminate duplicates Z: 40 55.749 2.372 0.921 0.628 0.949 0.718 CB 1.830 40 residues pruned to eliminate duplicates Z: 38 57.528 2.336 1.032 0.659 0.973 0.730 CB 1.766 38 residues pruned to eliminate duplicates Z: 41 54.510 2.330 0.958 0.613 0.925 0.700 CB 1.836 41 residues pruned to eliminate duplicates Z: 38 57.274 2.321 1.060 0.650 0.973 0.703 CB 1.759 38 residues pruned to eliminate duplicates Z: 38 56.552 2.346 1.040 0.660 0.946 0.676 CB 1.770 38 residues pruned to eliminate duplicates Z: 35 50.071 2.267 1.165 0.653 0.882 0.735 CB 1.719 35 residues pruned to eliminate duplicates Z: 37 56.399 2.310 1.127 0.666 0.944 0.639 CB 1.737 37 residues pruned to eliminate duplicates Z: 41 57.427 2.360 1.047 0.644 0.900 0.700 CB 1.826 41 residues pruned to eliminate duplicates Z: 40 51.351 2.301 0.988 0.639 0.923 0.641 CB 1.709 40 residues pruned to eliminate duplicates Z: 42 55.876 2.356 0.996 0.635 0.927 0.683 CB 1.765 42 residues pruned to eliminate duplicates Z: 42 53.702 2.308 1.038 0.625 0.902 0.634 CB 1.757 42 residues pruned to eliminate duplicates Z: 37 57.785 2.345 1.104 0.669 0.917 0.667 CB 1.821 37 residues pruned to eliminate duplicates Z: 42 58.576 2.346 0.998 0.643 0.951 0.634 CB 1.794 42 residues pruned to eliminate duplicates Z: 44 48.731 2.232 0.942 0.618 0.884 0.581 CB 1.735 44 residues pruned to eliminate duplicates Z: 37 45.746 2.178 0.949 0.592 0.944 0.611 CB 1.741 37 residues pruned to eliminate duplicates Z: 37 41.955 2.159 0.898 0.611 0.917 0.694 CB 1.674 37 residues pruned to eliminate duplicates Z: 53 51.904 2.292 0.825 0.620 0.923 0.692 CB 1.664 53 residues pruned to eliminate duplicates Z: 36 26.883 2.167 0.551 0.397 0.914 0.486 CB 1.649 36 residues pruned to eliminate duplicates Z: 26 17.206 2.061 0.585 0.412 0.880 0.520 CB 1.312 26 residues pruned to eliminate duplicates Z: 52 62.521 2.307 0.977 0.635 0.980 0.667 CB 1.725 52 residues pruned to eliminate duplicates Z: 46 60.702 2.380 0.962 0.650 0.933 0.711 CB 1.805 46 residues pruned to eliminate duplicates Z: 14 18.568 2.239 0.721 0.553 0.923 0.538 CB 1.375 14 residues pruned to eliminate duplicates Z: 23 17.259 2.136 0.530 0.423 0.773 0.409 CB 1.579 23 residues pruned to eliminate duplicates Z: 59 56.736 2.312 0.848 0.597 0.914 0.638 CB 1.740 59 residues pruned to eliminate duplicates Z: 58 49.682 2.276 0.740 0.570 0.947 0.632 CB 1.640 58 residues pruned to eliminate duplicates Z: 20 19.438 2.121 0.471 0.536 0.895 0.421 CB 1.543 20 residues pruned to eliminate duplicates Z: 58 54.530 2.326 0.867 0.577 0.877 0.649 CB 1.761 58 residues pruned to eliminate duplicates Z: 18 20.673 2.103 0.686 0.485 0.882 0.529 CB 1.628 18 residues pruned to eliminate duplicates Z: 8 4.833 1.805 0.258 0.521 0.571 0.429 CA 1.379 8 residues pruned to eliminate duplicates Z: 11 5.806 1.798 0.121 0.456 0.800 0.500 CB 1.191 11 residues pruned to eliminate duplicates Z: 59 55.782 2.289 0.855 0.579 0.948 0.655 CB 1.686 59 residues pruned to eliminate duplicates Z: 34 28.150 2.211 0.583 0.452 0.879 0.545 CB 1.674 34 residues pruned to eliminate duplicates Z: 22 21.649 2.015 0.618 0.482 0.952 0.524 CB 1.550 22 residues pruned to eliminate duplicates Z: 6 6.895 1.739 0.809 0.378 1.000 0.400 CB 1.115 6 residues pruned to eliminate duplicates Z: 42 22.655 2.168 0.446 0.388 0.854 0.561 CB 1.489 42 residues pruned to eliminate duplicates Z: 16 5.847 1.859 0.326 0.253 0.667 0.400 CB 1.221 16 residues pruned to eliminate duplicates Z: 38 21.806 2.154 0.446 0.366 0.892 0.595 CB 1.490 38 residues pruned to eliminate duplicates Z: 48 28.869 2.193 0.464 0.480 0.872 0.617 CB 1.534 48 residues pruned to eliminate duplicates Z: 39 30.084 2.190 0.572 0.443 0.895 0.579 CB 1.680 39 residues pruned to eliminate duplicates Z: 37 26.332 2.212 0.467 0.417 0.944 0.611 CB 1.562 37 residues pruned to eliminate duplicates Z: 64 34.538 2.179 0.474 0.437 0.905 0.540 CB 1.598 64 residues pruned to eliminate duplicates Z: 36 28.354 2.228 0.631 0.418 0.914 0.629 CB 1.572 36 residues pruned to eliminate duplicates Z: 32 23.864 2.089 0.583 0.469 0.968 0.677 CB 1.383 32 residues pruned to eliminate duplicates Z: 38 26.571 2.145 0.570 0.429 0.892 0.595 CB 1.564 38 residues pruned to eliminate duplicates Z: 40 26.298 2.185 0.484 0.398 0.897 0.487 CB 1.613 40 residues pruned to eliminate duplicates Z: 32 31.100 2.240 0.680 0.456 0.935 0.677 CB 1.660 32 residues pruned to eliminate duplicates Z: 32 27.156 2.245 0.456 0.467 0.903 0.645 CB 1.707 32 residues pruned to eliminate duplicates Z: 33 32.132 2.252 0.575 0.488 0.938 0.719 CB 1.728 33 residues pruned to eliminate duplicates Z: 31 31.093 2.265 0.730 0.460 0.900 0.667 CB 1.677 31 residues pruned to eliminate duplicates Z: 34 28.776 2.232 0.613 0.436 0.909 0.576 CB 1.636 34 residues pruned to eliminate duplicates Z: 26 23.679 2.185 0.438 0.440 0.920 0.560 CB 1.743 26 residues pruned to eliminate duplicates Z: 32 27.879 2.160 0.684 0.444 0.935 0.742 CB 1.558 32 residues pruned to eliminate duplicates Z: 34 30.406 2.257 0.592 0.451 0.939 0.545 CB 1.649 34 residues pruned to eliminate duplicates Z: 64 49.124 2.243 0.526 0.561 0.984 0.651 CB 1.733 64 residues pruned to eliminate duplicates Z: 34 27.332 2.241 0.505 0.451 0.909 0.636 CB 1.632 34 residues pruned to eliminate duplicates Z: 45 26.935 2.085 0.599 0.434 0.886 0.568 CB 1.472 45 residues pruned to eliminate duplicates Z: 37 24.297 2.164 0.470 0.398 0.917 0.722 CB 1.547 37 residues pruned to eliminate duplicates Z: 64 49.255 2.263 0.630 0.560 0.921 0.714 CB 1.724 64 residues pruned to eliminate duplicates Z: 38 24.549 2.154 0.459 0.406 0.892 0.622 CB 1.589 38 residues pruned to eliminate duplicates Z: 31 24.415 2.087 0.602 0.436 0.967 0.667 CB 1.473 31 residues pruned to eliminate duplicates Z: 33 27.188 2.211 0.492 0.485 0.906 0.719 CB 1.633 33 residues pruned to eliminate duplicates Z: 33 30.898 2.287 0.609 0.484 0.875 0.656 CB 1.724 33 residues pruned to eliminate duplicates Z: 28 23.731 2.198 0.565 0.421 0.852 0.556 CB 1.692 28 residues pruned to eliminate duplicates Z: 33 29.406 2.234 0.586 0.438 0.906 0.625 CB 1.726 33 residues pruned to eliminate duplicates Z: 32 23.267 2.179 0.458 0.460 0.871 0.710 CB 1.573 32 residues pruned to eliminate duplicates Z: 29 21.236 2.059 0.485 0.386 0.929 0.679 CB 1.596 29 residues pruned to eliminate duplicates Z: 32 29.579 2.259 0.560 0.476 0.935 0.742 CB 1.651 32 residues pruned to eliminate duplicates Z: 61 30.064 2.161 0.463 0.430 0.883 0.600 CB 1.495 61 residues pruned to eliminate duplicates Z: 57 31.143 2.192 0.464 0.470 0.875 0.643 CB 1.527 57 residues pruned to eliminate duplicates Z: 31 20.632 2.169 0.405 0.397 0.900 0.567 CB 1.531 31 residues pruned to eliminate duplicates Z: 37 30.308 2.161 0.751 0.468 0.917 0.667 CB 1.504 37 residues pruned to eliminate duplicates Z: 44 50.462 2.280 0.853 0.604 0.930 0.651 CB 1.773 44 residues pruned to eliminate duplicates Z: 29 42.835 2.396 0.600 0.741 0.929 0.714 CB 1.833 29 residues pruned to eliminate duplicates Z: 28 49.419 2.426 0.636 0.774 1.000 0.815 CB 1.880 28 residues pruned to eliminate duplicates Z: 29 44.134 2.376 0.578 0.761 0.964 0.821 CB 1.830 29 residues pruned to eliminate duplicates Z: 30 44.616 2.308 0.675 0.738 0.931 0.759 CB 1.859 30 residues pruned to eliminate duplicates Z: 29 44.418 2.397 0.552 0.726 1.000 0.750 CB 1.840 29 residues pruned to eliminate duplicates Z: 29 43.203 2.367 0.591 0.705 0.964 0.786 CB 1.866 29 residues pruned to eliminate duplicates Z: 28 46.334 2.427 0.576 0.715 1.000 0.741 CB 1.919 28 residues pruned to eliminate duplicates Z: 29 46.413 2.406 0.648 0.738 0.964 0.679 CB 1.853 29 residues pruned to eliminate duplicates Z: 29 42.926 2.370 0.642 0.710 0.929 0.643 CB 1.855 29 residues pruned to eliminate duplicates Z: 29 49.124 2.398 0.764 0.766 0.929 0.786 CB 1.867 29 residues pruned to eliminate duplicates Z: 29 53.238 2.405 0.776 0.742 1.000 0.643 CB 1.896 29 residues pruned to eliminate duplicates Z: 29 48.732 2.369 0.801 0.747 0.929 0.750 CB 1.865 29 residues pruned to eliminate duplicates Z: 28 48.819 2.447 0.760 0.734 0.926 0.704 CB 1.910 28 residues pruned to eliminate duplicates Z: 28 52.155 2.456 0.817 0.739 0.926 0.778 CB 1.960 28 residues pruned to eliminate duplicates Z: 27 60.184 2.498 0.814 0.777 1.000 0.808 CB 2.040 27 residues pruned to eliminate duplicates Z: 30 49.036 2.312 0.792 0.727 0.966 0.828 CB 1.856 30 residues pruned to eliminate duplicates Z: 64 61.047 2.311 0.980 0.645 0.905 0.683 CB 1.622 64 residues pruned to eliminate duplicates Z: 19 47.340 2.220 1.067 0.925 1.000 0.889 CB 1.706 19 residues pruned to eliminate duplicates Z: 18 48.031 2.295 0.967 0.947 1.000 0.882 CB 1.784 18 residues pruned to eliminate duplicates Z: 29 53.725 2.413 0.873 0.731 0.964 0.643 CB 1.892 29 residues pruned to eliminate duplicates Z: 26 58.478 2.482 1.034 0.767 0.920 0.720 CB 1.988 27 residues pruned to eliminate duplicates Z: 19 47.452 2.192 1.083 0.941 1.000 0.722 CB 1.701 18 residues pruned to eliminate duplicates Z: 20 42.628 2.149 1.141 0.918 0.947 0.789 CB 1.583 20 residues pruned to eliminate duplicates Z: 27 56.032 2.392 1.052 0.725 0.962 0.731 CB 1.901 27 residues pruned to eliminate duplicates Z: 18 52.212 2.283 1.215 0.949 1.000 0.882 CB 1.728 18 residues pruned to eliminate duplicates Z: 19 46.186 2.210 0.986 0.938 1.000 0.944 CB 1.725 19 residues pruned to eliminate duplicates Z: 42 40.613 2.287 0.564 0.638 0.902 0.707 CB 1.728 42 residues pruned to eliminate duplicates Z: 37 35.814 2.139 0.570 0.730 0.972 0.750 CB 1.486 37 residues pruned to eliminate duplicates Z: 44 39.280 2.260 0.567 0.589 0.907 0.651 CB 1.713 44 residues pruned to eliminate duplicates Z: 43 41.729 2.236 0.673 0.610 0.929 0.738 CB 1.669 43 residues pruned to eliminate duplicates Z: 29 37.569 2.300 0.547 0.743 0.964 0.893 CB 1.664 29 residues pruned to eliminate duplicates Z: 42 41.240 2.281 0.656 0.618 0.927 0.756 CB 1.646 42 residues pruned to eliminate duplicates Z: 36 39.317 2.237 0.684 0.684 0.943 0.771 CB 1.580 36 residues pruned to eliminate duplicates Z: 38 39.219 2.219 0.645 0.663 0.946 0.730 CB 1.606 38 residues pruned to eliminate duplicates Z: 36 44.197 2.253 0.818 0.696 0.943 0.771 CB 1.618 36 residues pruned to eliminate duplicates Z: 49 39.080 2.155 0.704 0.581 0.917 0.646 CB 1.549 49 residues pruned to eliminate duplicates Z: 56 45.306 2.225 0.741 0.604 0.927 0.618 CB 1.541 56 residues pruned to eliminate duplicates Z: 42 46.880 2.272 0.892 0.616 0.927 0.610 CB 1.647 42 residues pruned to eliminate duplicates Z: 39 41.237 2.150 0.960 0.632 0.921 0.500 CB 1.522 39 residues pruned to eliminate duplicates Z: 31 41.484 2.167 0.962 0.694 0.967 0.733 CB 1.543 31 residues pruned to eliminate duplicates Z: 19 58.270 2.378 1.289 0.897 1.000 0.556 CB 1.806 19 residues pruned to eliminate duplicates Z: 20 51.159 2.328 1.134 0.910 1.000 0.737 CB 1.675 20 residues pruned to eliminate duplicates Z: 38 45.772 2.224 1.004 0.656 0.946 0.676 CB 1.544 38 residues pruned to eliminate duplicates Z: 26 47.418 2.282 1.056 0.769 0.960 0.600 CB 1.660 26 residues pruned to eliminate duplicates Z: 36 48.585 2.275 0.946 0.692 0.943 0.743 CB 1.651 36 residues pruned to eliminate duplicates Z: 39 42.705 2.187 0.832 0.669 0.921 0.579 CB 1.605 39 residues pruned to eliminate duplicates Z: 43 49.397 2.221 0.907 0.611 0.952 0.619 CB 1.701 43 residues pruned to eliminate duplicates Z: 24 42.250 2.372 0.827 0.738 0.913 0.783 CB 1.799 24 residues pruned to eliminate duplicates Z: 51 46.615 2.137 1.024 0.623 0.880 0.520 CB 1.543 57 residues pruned to eliminate duplicates Z: 18 14.673 2.044 0.603 0.361 0.882 0.529 CB 1.430 18 residues pruned to eliminate duplicates Z: 7 3.736 1.749 0.345 0.261 0.833 0.500 CB 1.023 7 residues pruned to eliminate duplicates Z: 44 43.070 2.216 0.885 0.595 0.930 0.651 CB 1.543 44 residues pruned to eliminate duplicates Z: 42 46.030 2.287 0.875 0.630 0.927 0.659 CB 1.600 42 residues pruned to eliminate duplicates Z: 43 45.616 2.171 0.934 0.591 0.952 0.667 CB 1.613 43 residues pruned to eliminate duplicates Z: 36 49.702 2.235 1.009 0.681 0.943 0.600 CB 1.681 36 residues pruned to eliminate duplicates Z: 62 47.700 2.205 0.762 0.570 0.918 0.590 CB 1.601 62 residues pruned to eliminate duplicates Z: 36 48.018 2.226 0.972 0.680 0.943 0.629 CB 1.663 36 residues pruned to eliminate duplicates Z: 42 46.413 2.250 0.976 0.617 0.902 0.561 CB 1.616 42 residues pruned to eliminate duplicates Z: 42 48.423 2.266 0.913 0.630 0.951 0.634 CB 1.623 42 residues pruned to eliminate duplicates Z: 37 48.158 2.244 0.979 0.672 0.972 0.583 CB 1.586 37 residues pruned to eliminate duplicates Z: 37 47.754 2.215 0.946 0.667 0.972 0.583 CB 1.627 37 residues pruned to eliminate duplicates Z: 44 49.550 2.284 0.911 0.627 0.930 0.605 CB 1.653 44 residues pruned to eliminate duplicates Z: 36 45.711 2.218 0.872 0.707 0.943 0.743 CB 1.636 36 residues pruned to eliminate duplicates Z: 36 45.075 2.212 0.860 0.711 0.943 0.600 CB 1.622 36 residues pruned to eliminate duplicates Z: 63 45.116 2.229 0.732 0.571 0.871 0.597 CB 1.591 63 residues pruned to eliminate duplicates Z: 58 46.922 2.238 0.792 0.571 0.947 0.561 CB 1.527 58 residues pruned to eliminate duplicates Z: 59 46.560 2.215 0.775 0.574 0.931 0.586 CB 1.556 59 residues pruned to eliminate duplicates Z: 18 21.678 2.221 0.605 0.577 0.882 0.529 CB 1.552 18 residues pruned to eliminate duplicates Z: 59 51.562 2.267 0.815 0.598 0.914 0.586 CB 1.641 59 residues pruned to eliminate duplicates Z: 20 21.153 2.217 0.649 0.525 0.947 0.316 CB 1.367 20 residues pruned to eliminate duplicates Z: 58 39.586 2.163 0.703 0.515 0.930 0.579 CB 1.508 58 residues pruned to eliminate duplicates Z: 51 50.745 2.265 0.843 0.650 0.960 0.660 CB 1.557 51 residues pruned to eliminate duplicates Z: 19 17.117 2.209 0.552 0.476 0.833 0.500 CB 1.447 19 residues pruned to eliminate duplicates Z: 46 52.717 2.288 0.980 0.660 0.933 0.733 CB 1.602 46 residues pruned to eliminate duplicates Z: 36 25.834 2.157 0.622 0.431 0.943 0.600 CB 1.422 36 residues pruned to eliminate duplicates Z: 18 13.961 2.143 0.378 0.508 0.824 0.529 CB 1.382 18 residues pruned to eliminate duplicates Z: 60 44.555 2.219 0.815 0.550 0.915 0.475 CB 1.499 60 residues pruned to eliminate duplicates Z: 63 48.785 2.209 0.886 0.574 0.887 0.565 CB 1.561 63 residues pruned to eliminate duplicates Z: 62 57.792 2.269 0.890 0.608 0.967 0.557 CB 1.609 62 residues pruned to eliminate duplicates Z: 21 22.514 2.172 0.661 0.503 1.000 0.500 CB 1.392 21 residues pruned to eliminate duplicates Z: 24 22.748 2.190 0.803 0.452 0.913 0.304 CB 1.382 24 residues pruned to eliminate duplicates Z: 21 22.469 2.165 0.683 0.521 0.950 0.300 CB 1.420 21 residues pruned to eliminate duplicates Z: 22 15.429 2.072 0.551 0.465 0.905 0.524 CB 1.200 22 residues pruned to eliminate duplicates Z: 72 47.362 2.189 0.780 0.569 0.901 0.549 CB 1.497 72 residues pruned to eliminate duplicates Z: 99 54.029 2.212 0.704 0.517 0.908 0.633 CB 1.568 99 residues pruned to eliminate duplicates Z: 26 20.129 2.100 0.430 0.532 0.920 0.520 CB 1.411 26 residues pruned to eliminate duplicates Z: 43 29.252 2.154 0.555 0.513 0.881 0.524 CB 1.510 43 residues pruned to eliminate duplicates Z: 93 53.120 2.189 0.656 0.543 0.924 0.587 CB 1.585 93 residues pruned to eliminate duplicates Z: 65 54.283 2.238 0.868 0.593 0.953 0.562 CB 1.558 65 residues pruned to eliminate duplicates Z: 41 25.301 2.166 0.447 0.431 0.875 0.625 CB 1.566 41 residues pruned to eliminate duplicates Z: 175 80.905 2.277 0.801 0.514 0.902 0.609 CB 1.635 175 residues pruned to eliminate duplicates Z: 31 20.588 2.138 0.385 0.410 0.867 0.633 CB 1.610 31 residues pruned to eliminate duplicates Z: 47 24.904 2.133 0.376 0.410 0.913 0.609 CB 1.506 47 residues pruned to eliminate duplicates Z: 41 22.530 2.132 0.417 0.393 0.875 0.625 CB 1.510 41 residues pruned to eliminate duplicates Z: 68 42.242 2.224 0.469 0.549 0.881 0.716 CB 1.710 68 residues pruned to eliminate duplicates Z: 60 36.545 2.210 0.625 0.429 0.915 0.559 CB 1.558 60 residues pruned to eliminate duplicates Z: 71 44.591 2.255 0.588 0.515 0.886 0.671 CB 1.655 71 residues pruned to eliminate duplicates Z: 31 29.996 2.259 0.589 0.446 0.933 0.733 CB 1.728 31 residues pruned to eliminate duplicates Z: 149 72.502 2.292 0.754 0.540 0.892 0.669 CB 1.597 149 residues pruned to eliminate duplicates Z: 71 37.366 2.180 0.582 0.426 0.914 0.557 CB 1.530 71 residues pruned to eliminate duplicates Z: 29 24.093 2.172 0.487 0.460 0.893 0.643 CB 1.646 29 residues pruned to eliminate duplicates Z: 38 28.503 2.213 0.526 0.435 0.865 0.595 CB 1.715 38 residues pruned to eliminate duplicates Z: 88 48.665 2.241 0.613 0.532 0.885 0.621 CB 1.581 88 residues pruned to eliminate duplicates Z: 40 25.467 2.169 0.530 0.373 0.872 0.590 CB 1.615 40 residues pruned to eliminate duplicates Z: 65 37.756 2.171 0.617 0.517 0.828 0.656 CB 1.596 65 residues pruned to eliminate duplicates Z: 45 22.207 2.075 0.498 0.392 0.818 0.477 CB 1.476 45 residues pruned to eliminate duplicates Z: 37 22.136 2.147 0.376 0.384 0.889 0.500 CB 1.589 37 residues pruned to eliminate duplicates Z: 75 49.287 2.247 0.696 0.521 0.892 0.581 CB 1.651 75 residues pruned to eliminate duplicates Z: 70 45.953 2.283 0.589 0.525 0.884 0.667 CB 1.683 70 residues pruned to eliminate duplicates Z: 48 25.863 2.134 0.438 0.400 0.851 0.596 CB 1.604 48 residues pruned to eliminate duplicates Z: 33 26.014 2.188 0.453 0.426 0.906 0.656 CB 1.724 33 residues pruned to eliminate duplicates Z: 88 50.214 2.230 0.618 0.520 0.908 0.655 CB 1.612 88 residues pruned to eliminate duplicates Z: 103 55.759 2.186 0.729 0.533 0.912 0.569 CB 1.551 103 residues pruned to eliminate duplicates Z: 95 53.789 2.243 0.672 0.533 0.904 0.596 CB 1.583 95 residues pruned to eliminate duplicates Z: 59 33.545 2.175 0.604 0.455 0.879 0.586 CB 1.503 59 residues pruned to eliminate duplicates Z: 38 26.004 2.224 0.568 0.426 0.811 0.703 CB 1.633 38 residues pruned to eliminate duplicates Z: 70 47.261 2.279 0.704 0.525 0.826 0.652 CB 1.730 70 residues pruned to eliminate duplicates Z: 111 54.306 2.223 0.701 0.507 0.882 0.627 CB 1.542 111 residues pruned to eliminate duplicates Z: 37 24.250 2.208 0.408 0.423 0.861 0.694 CB 1.636 37 residues pruned to eliminate duplicates Z: 31 36.009 2.135 0.826 0.634 0.900 0.767 CB 1.652 31 residues pruned to eliminate duplicates Z: 90 52.269 2.237 0.679 0.520 0.876 0.596 CB 1.649 90 residues pruned to eliminate duplicates Z: 99 52.723 2.209 0.743 0.508 0.878 0.622 CB 1.564 99 residues pruned to eliminate duplicates Z: 69 51.753 2.293 0.676 0.527 0.912 0.721 CB 1.744 69 residues pruned to eliminate duplicates Z: 152 72.908 2.275 0.768 0.522 0.881 0.609 CB 1.638 152 residues pruned to eliminate duplicates Z: 61 42.259 2.208 0.617 0.516 0.883 0.750 CB 1.703 61 residues pruned to eliminate duplicates Z: 33 49.104 2.362 0.890 0.701 0.906 0.719 CB 1.786 33 residues pruned to eliminate duplicates Z: 24 38.019 2.289 0.656 0.751 0.913 0.870 CB 1.831 24 residues pruned to eliminate duplicates Z: 32 52.596 2.375 0.946 0.669 0.968 0.677 CB 1.806 32 residues pruned to eliminate duplicates Z: 32 45.948 2.347 0.789 0.675 0.935 0.677 CB 1.789 32 residues pruned to eliminate duplicates Z: 40 43.234 2.267 0.955 0.591 0.872 0.615 CB 1.642 40 residues pruned to eliminate duplicates Z: 24 41.153 2.280 0.850 0.736 0.913 0.826 CB 1.803 24 residues pruned to eliminate duplicates Z: 25 40.277 2.255 0.819 0.716 0.917 0.667 CB 1.798 25 residues pruned to eliminate duplicates Z: 122 67.361 2.256 0.689 0.555 0.909 0.636 CB 1.675 122 residues pruned to eliminate duplicates Z: 138 66.395 2.189 0.773 0.542 0.891 0.628 CB 1.576 138 residues pruned to eliminate duplicates Z: 24 42.886 2.283 0.873 0.721 0.957 0.783 CB 1.791 24 residues pruned to eliminate duplicates Z: 31 53.613 2.388 0.932 0.700 0.967 0.733 CB 1.828 31 residues pruned to eliminate duplicates Z: 97 53.026 2.236 0.755 0.509 0.865 0.594 CB 1.580 97 residues pruned to eliminate duplicates Z: 34 48.247 2.301 1.014 0.642 0.939 0.697 CB 1.690 34 residues pruned to eliminate duplicates Z: 34 44.531 2.260 1.090 0.650 0.848 0.576 CB 1.682 34 residues pruned to eliminate duplicates Z: 28 35.426 2.145 0.857 0.639 0.889 0.704 CB 1.691 28 residues pruned to eliminate duplicates Z: 33 48.091 2.339 0.930 0.671 0.938 0.656 CB 1.716 33 residues pruned to eliminate duplicates Z: 55 58.715 2.416 0.958 0.575 0.926 0.685 CB 1.697 55 residues pruned to eliminate duplicates Z: 34 50.286 2.327 1.065 0.657 0.939 0.697 CB 1.676 34 residues pruned to eliminate duplicates Z: 132 72.964 2.244 0.767 0.565 0.908 0.634 CB 1.661 132 residues pruned to eliminate duplicates Z: 70 51.331 2.264 0.720 0.504 0.928 0.696 CB 1.705 70 residues pruned to eliminate duplicates Z: 40 35.859 2.398 0.988 0.428 0.846 0.538 CB 1.534 40 residues pruned to eliminate duplicates Z: 32 50.959 2.393 0.949 0.708 0.903 0.710 CB 1.799 32 residues pruned to eliminate duplicates Z: 129 70.701 2.247 0.803 0.559 0.891 0.641 CB 1.635 129 residues pruned to eliminate duplicates Z: 33 49.507 2.343 0.996 0.681 0.906 0.594 CB 1.749 33 residues pruned to eliminate duplicates Z: 110 61.864 2.290 0.719 0.525 0.890 0.633 CB 1.651 110 residues pruned to eliminate duplicates Z: 36 47.089 2.332 1.047 0.652 0.857 0.657 CB 1.689 36 residues pruned to eliminate duplicates Z: 33 48.620 2.362 0.952 0.690 0.875 0.688 CB 1.790 33 residues pruned to eliminate duplicates Z: 32 54.182 2.395 0.930 0.717 0.968 0.710 CB 1.788 32 residues pruned to eliminate duplicates Z: 34 46.233 2.314 0.903 0.662 0.909 0.576 CB 1.730 34 residues pruned to eliminate duplicates Z: 23 33.270 2.514 0.934 0.457 0.909 0.727 CB 1.677 23 residues pruned to eliminate duplicates Z: 46 30.117 2.356 0.680 0.389 0.867 0.556 CB 1.473 46 residues pruned to eliminate duplicates Z: 30 21.538 2.263 0.647 0.416 0.828 0.483 CB 1.416 30 residues pruned to eliminate duplicates Z: 30 29.671 2.377 0.829 0.440 0.828 0.621 CB 1.629 30 residues pruned to eliminate duplicates Z: 24 28.777 2.428 0.930 0.437 0.826 0.652 CB 1.654 24 residues pruned to eliminate duplicates Z: 21 28.390 2.439 0.922 0.431 0.900 0.650 CB 1.616 21 residues pruned to eliminate duplicates Z: 40 32.520 2.310 0.734 0.428 0.872 0.615 CB 1.607 40 residues pruned to eliminate duplicates Z: 24 28.493 2.465 0.864 0.444 0.826 0.652 CB 1.657 24 residues pruned to eliminate duplicates Z: 33 36.070 2.379 0.740 0.454 0.938 0.656 CB 1.723 33 residues pruned to eliminate duplicates Z: 115 59.168 2.256 0.760 0.505 0.868 0.605 CB 1.600 115 residues pruned to eliminate duplicates Z: 22 25.587 2.444 0.669 0.448 0.857 0.667 CB 1.684 22 residues pruned to eliminate duplicates Z: 22 27.911 2.490 0.827 0.471 0.857 0.762 CB 1.609 22 residues pruned to eliminate duplicates Z: 60 52.471 2.338 0.962 0.585 0.864 0.695 CB 1.588 60 residues pruned to eliminate duplicates Z: 25 23.729 2.389 0.579 0.398 0.875 0.583 CB 1.635 25 residues pruned to eliminate duplicates Z: 20 25.311 2.451 0.719 0.464 0.842 0.737 CB 1.699 20 residues pruned to eliminate duplicates Z: 23 26.414 2.364 0.748 0.463 0.909 0.773 CB 1.556 23 residues pruned to eliminate duplicates Z: 26 20.625 2.396 0.757 0.408 0.720 0.600 CB 1.499 26 residues pruned to eliminate duplicates Z: 26 24.254 2.393 0.757 0.424 0.760 0.600 CB 1.642 26 residues pruned to eliminate duplicates Z: 43 30.633 2.294 0.773 0.390 0.857 0.643 CB 1.523 43 residues pruned to eliminate duplicates Z: 26 26.180 2.448 0.779 0.437 0.800 0.720 CB 1.603 26 residues pruned to eliminate duplicates Z: 97 60.325 2.311 0.694 0.572 0.917 0.708 CB 1.599 97 residues pruned to eliminate duplicates Z: 28 31.483 2.400 0.761 0.444 0.889 0.667 CB 1.708 28 residues pruned to eliminate duplicates Z: 40 34.148 2.377 0.681 0.432 0.897 0.692 CB 1.637 40 residues pruned to eliminate duplicates Z: 96 56.708 2.325 0.599 0.562 0.916 0.663 CB 1.609 96 residues pruned to eliminate duplicates Z: 75 57.154 2.313 0.618 0.656 0.946 0.730 CB 1.624 75 residues pruned to eliminate duplicates Z: 25 18.041 2.106 0.514 0.482 0.917 0.500 CB 1.284 25 residues pruned to eliminate duplicates Z: 13 22.349 2.274 0.772 0.520 0.917 0.583 CB 1.712 13 residues pruned to eliminate duplicates Z: 20 24.704 2.295 0.581 0.486 0.947 0.526 CB 1.672 20 residues pruned to eliminate duplicates Z: 30 18.774 2.285 0.617 0.404 0.828 0.517 CB 1.261 30 residues pruned to eliminate duplicates Z: 24 18.919 2.183 0.518 0.436 0.913 0.652 CB 1.393 24 residues pruned to eliminate duplicates Z: 28 16.649 2.196 0.709 0.365 0.815 0.481 CB 1.211 28 residues pruned to eliminate duplicates Z: 67 46.192 2.250 0.551 0.600 0.939 0.697 CB 1.577 67 residues pruned to eliminate duplicates Z: 27 14.463 2.224 0.628 0.375 0.731 0.423 CB 1.225 27 residues pruned to eliminate duplicates Z: 24 14.563 2.229 0.321 0.364 0.913 0.478 CB 1.308 24 residues pruned to eliminate duplicates Z: 17 20.415 2.198 0.626 0.442 0.938 0.562 CB 1.616 17 residues pruned to eliminate duplicates Z: 15 9.755 1.926 0.326 0.243 0.857 0.429 N 1.601 15 residues pruned to eliminate duplicates Z: 19 14.807 2.123 0.439 0.356 0.889 0.556 CB 1.502 19 residues pruned to eliminate duplicates Z: 6 8.263 2.087 0.731 0.427 0.800 0.600 CB 1.379 6 residues pruned to eliminate duplicates Z: 76 47.586 2.377 0.873 0.396 0.853 0.493 CB 1.615 76 residues pruned to eliminate duplicates Z: 31 26.391 2.388 0.727 0.455 0.867 0.533 CB 1.411 31 residues pruned to eliminate duplicates Z: 29 24.053 2.383 0.636 0.401 0.893 0.500 CB 1.450 29 residues pruned to eliminate duplicates Z: 68 47.827 2.403 0.851 0.465 0.851 0.552 CB 1.600 68 residues pruned to eliminate duplicates Z: 31 28.128 2.365 0.915 0.476 0.867 0.533 CB 1.340 31 residues pruned to eliminate duplicates Z: 56 49.825 2.432 0.928 0.504 0.891 0.527 CB 1.602 56 residues pruned to eliminate duplicates Z: 31 26.385 2.384 0.790 0.416 0.833 0.467 CB 1.479 31 residues pruned to eliminate duplicates Z: 28 29.666 2.417 0.865 0.432 0.926 0.556 CB 1.467 28 residues pruned to eliminate duplicates Z: 48 32.910 2.281 0.758 0.465 0.872 0.617 CB 1.423 48 residues pruned to eliminate duplicates Z: 28 32.062 2.460 0.904 0.453 0.889 0.667 CB 1.556 28 residues pruned to eliminate duplicates Z: 26 34.872 2.424 1.067 0.463 0.960 0.480 CB 1.506 26 residues pruned to eliminate duplicates Z: 31 30.304 2.387 0.948 0.471 0.833 0.567 CB 1.471 31 residues pruned to eliminate duplicates Z: 18 17.252 2.392 0.572 0.429 0.765 0.588 CB 1.566 18 residues pruned to eliminate duplicates Z: 62 50.385 2.419 1.046 0.458 0.820 0.508 CB 1.659 62 residues pruned to eliminate duplicates Z: 39 27.279 2.310 0.745 0.439 0.868 0.500 CB 1.347 39 residues pruned to eliminate duplicates Z: 36 24.881 2.226 0.739 0.436 0.857 0.514 CB 1.355 36 residues pruned to eliminate duplicates Z: 62 43.420 2.410 0.763 0.475 0.836 0.525 CB 1.605 62 residues pruned to eliminate duplicates Z: 77 49.993 2.396 0.742 0.448 0.842 0.513 CB 1.721 77 residues pruned to eliminate duplicates Z: 26 21.899 2.324 0.687 0.389 0.880 0.520 CB 1.428 26 residues pruned to eliminate duplicates Z: 31 26.402 2.355 0.804 0.428 0.867 0.433 CB 1.410 31 residues pruned to eliminate duplicates Z: 35 25.468 2.353 0.759 0.435 0.794 0.324 CB 1.421 35 residues pruned to eliminate duplicates Z: 31 23.837 2.374 0.813 0.438 0.800 0.633 CB 1.348 31 residues pruned to eliminate duplicates Z: 39 45.410 2.499 0.750 0.485 0.921 0.500 CB 1.857 39 residues pruned to eliminate duplicates Z: 48 43.341 2.484 0.835 0.452 0.851 0.383 CB 1.712 48 residues pruned to eliminate duplicates Z: 33 23.806 2.315 0.730 0.452 0.750 0.531 CB 1.472 33 residues pruned to eliminate duplicates Z: 56 42.232 2.449 0.768 0.477 0.855 0.509 CB 1.576 56 residues pruned to eliminate duplicates Z: 21 20.994 2.332 0.774 0.415 0.800 0.400 CB 1.550 21 residues pruned to eliminate duplicates Z: 40 35.635 2.477 0.914 0.434 0.846 0.487 CB 1.522 48 residues pruned to eliminate duplicates Z: 7 4.620 1.846 0.962 0.411 0.667 0.167 CB 0.857 7 residues pruned to eliminate duplicates Z: 26 21.555 2.233 0.729 0.453 0.800 0.320 CB 1.465 26 residues pruned to eliminate duplicates Z: 60 47.069 2.448 0.882 0.474 0.814 0.492 CB 1.680 60 residues pruned to eliminate duplicates Z: 63 28.922 2.203 0.699 0.387 0.742 0.484 CB 1.491 63 residues pruned to eliminate duplicates Z: 44 43.994 2.334 0.960 0.482 0.860 0.512 CB 1.737 44 residues pruned to eliminate duplicates Z: 55 39.640 2.431 0.785 0.429 0.815 0.481 CB 1.643 55 residues pruned to eliminate duplicates Z: 27 25.035 2.275 0.866 0.379 0.885 0.462 CB 1.487 27 residues pruned to eliminate duplicates Z: 60 46.674 2.469 0.813 0.456 0.847 0.492 CB 1.676 60 residues pruned to eliminate duplicates Z: 27 30.469 2.354 0.886 0.375 0.846 0.577 CB 1.818 27 residues pruned to eliminate duplicates Z: 22 33.430 2.381 0.982 0.423 0.905 0.524 C 1.851 22 residues pruned to eliminate duplicates Z: 39 36.881 2.388 0.782 0.410 0.868 0.447 CB 1.779 39 residues pruned to eliminate duplicates Z: 75 44.258 2.331 0.899 0.379 0.851 0.473 CB 1.553 75 residues pruned to eliminate duplicates Z: 24 40.395 2.445 0.852 0.551 0.957 0.609 CB 1.849 24 residues pruned to eliminate duplicates Z: 40 45.011 2.470 0.838 0.479 0.923 0.410 CB 1.757 40 residues pruned to eliminate duplicates Z: 23 40.356 2.421 0.834 0.618 0.955 0.591 C 1.815 23 residues pruned to eliminate duplicates Z: 60 43.016 2.446 0.812 0.457 0.831 0.492 CB 1.591 60 residues pruned to eliminate duplicates Z: 31 36.341 2.486 0.932 0.458 0.833 0.467 CB 1.730 31 residues pruned to eliminate duplicates Z: 29 47.501 2.563 1.110 0.511 0.893 0.429 CB 1.839 29 residues pruned to eliminate duplicates Z: 39 43.569 2.503 0.784 0.503 0.868 0.500 CB 1.817 39 residues pruned to eliminate duplicates Z: 60 50.023 2.450 0.911 0.470 0.864 0.542 CB 1.659 60 residues pruned to eliminate duplicates Z: 23 36.899 2.507 0.826 0.517 0.909 0.727 C 1.859 23 residues pruned to eliminate duplicates Z: 30 38.573 2.509 0.806 0.457 0.897 0.483 CB 1.841 30 residues pruned to eliminate duplicates Z: 58 40.714 2.391 0.900 0.387 0.860 0.386 CB 1.557 58 residues pruned to eliminate duplicates Z: 65 55.517 2.400 0.811 0.532 0.906 0.594 CB 1.708 65 residues pruned to eliminate duplicates Z: 44 63.228 2.505 0.949 0.612 0.907 0.605 C 1.958 44 residues pruned to eliminate duplicates Z: 43 73.228 2.557 1.030 0.622 0.952 0.667 CB 2.038 43 residues pruned to eliminate duplicates Z: 29 51.668 2.359 1.099 0.642 0.929 0.571 CB 1.859 29 residues pruned to eliminate duplicates Z: 28 48.781 2.400 1.014 0.666 0.889 0.667 C 1.874 28 residues pruned to eliminate duplicates Z: 22 56.987 2.528 1.091 0.726 0.952 0.810 CB 2.014 22 residues pruned to eliminate duplicates Z: 29 42.987 2.377 0.939 0.651 0.857 0.643 CB 1.786 29 residues pruned to eliminate duplicates Z: 44 66.786 2.532 0.993 0.606 0.907 0.628 C 2.011 44 residues pruned to eliminate duplicates Z: 27 50.524 2.433 1.007 0.623 0.923 0.654 C 1.958 27 residues pruned to eliminate duplicates Z: 28 50.956 2.420 1.090 0.638 0.889 0.593 CB 1.916 28 residues pruned to eliminate duplicates Z: 23 57.472 2.519 1.131 0.698 0.909 0.682 C 2.096 23 residues pruned to eliminate duplicates Z: 23 53.583 2.445 1.170 0.654 0.955 0.682 C 1.954 23 residues pruned to eliminate duplicates Z: 65 65.833 2.493 0.934 0.558 0.859 0.547 CB 1.877 65 residues pruned to eliminate duplicates Z: 22 61.000 2.549 1.236 0.727 0.952 0.667 C 2.000 22 residues pruned to eliminate duplicates Z: 21 60.378 2.562 1.246 0.734 0.950 0.700 C 2.001 21 residues pruned to eliminate duplicates Z: 48 59.583 2.449 1.000 0.577 0.872 0.553 C 1.889 48 residues pruned to eliminate duplicates Z: 29 45.193 2.352 1.096 0.608 0.893 0.500 CB 1.751 29 residues pruned to eliminate duplicates Z: 23 54.788 2.485 1.130 0.694 0.955 0.727 CA 1.936 23 residues pruned to eliminate duplicates Z: 27 52.100 2.436 1.098 0.626 0.923 0.577 C 1.923 27 residues pruned to eliminate duplicates Z: 27 49.466 2.381 1.135 0.624 0.923 0.577 CB 1.839 27 residues pruned to eliminate duplicates Z: 28 57.003 2.417 1.157 0.672 0.926 0.704 C 1.939 28 residues pruned to eliminate duplicates Z: 21 62.008 2.594 1.272 0.727 0.950 0.750 C 2.019 21 residues pruned to eliminate duplicates Z: 27 47.974 2.379 1.012 0.665 0.885 0.615 C 1.907 27 residues pruned to eliminate duplicates Z: 67 66.120 2.390 0.813 0.638 0.924 0.697 CB 1.786 67 residues pruned to eliminate duplicates Z: 18 13.820 2.050 0.613 0.360 0.824 0.412 CB 1.432 18 residues pruned to eliminate duplicates Z: 72 60.299 2.305 0.870 0.651 0.901 0.690 CB 1.600 72 residues pruned to eliminate duplicates Z: 12 20.461 2.339 0.666 0.478 0.909 0.545 CB 1.781 Z: 6 9.741 1.830 0.857 0.373 1.000 0.800 CB 1.468 4 residues pruned to eliminate duplicates Z: 8 12.788 1.945 0.627 0.561 1.000 0.429 CA 1.440 8 residues pruned to eliminate duplicates Z: 16 22.842 2.203 0.847 0.578 0.933 0.533 CB 1.441 14 residues pruned to eliminate duplicates Z: 6 14.555 2.288 0.558 0.657 0.800 0.600 C 1.973 6 residues pruned to eliminate duplicates Z: 47 41.341 2.338 0.703 0.561 0.913 0.543 CB 1.581 63 residues pruned to eliminate duplicates Z: 23 22.671 2.226 0.811 0.465 0.909 0.591 CB 1.367 23 residues pruned to eliminate duplicates Z: 28 21.522 2.204 0.684 0.437 0.852 0.481 CB 1.398 Z: 6 11.258 2.262 0.643 0.593 1.000 0.400 CB 1.239 5 residues pruned to eliminate duplicates Z: 20 45.998 2.498 0.802 0.775 0.947 0.842 C 1.940 20 residues pruned to eliminate duplicates Z: 77 61.261 2.302 0.876 0.601 0.947 0.671 CB 1.559 106 residues pruned to eliminate duplicates Z: 28 35.029 2.409 0.692 0.609 0.926 0.852 CB 1.611 28 residues pruned to eliminate duplicates Z: 108 67.467 2.301 0.706 0.610 0.925 0.701 CB 1.619 108 residues pruned to eliminate duplicates Z: 49 41.635 2.308 0.722 0.517 0.917 0.604 CB 1.623 49 residues pruned to eliminate duplicates Z: 45 49.685 2.441 0.886 0.567 0.932 0.750 CB 1.638 45 residues pruned to eliminate duplicates Z: 109 83.745 2.353 0.709 0.685 0.954 0.796 CB 1.773 109 residues pruned to eliminate duplicates Z: 27 36.331 2.440 0.765 0.603 0.923 0.654 CB 1.625 27 residues pruned to eliminate duplicates Z: 25 41.648 2.549 0.782 0.645 0.917 0.750 CB 1.782 25 residues pruned to eliminate duplicates Z: 77 61.873 2.305 0.870 0.629 0.934 0.737 CB 1.560 77 residues pruned to eliminate duplicates Z: 112 84.838 2.363 0.772 0.681 0.910 0.712 CB 1.790 112 residues pruned to eliminate duplicates Z: 105 72.838 2.340 0.762 0.606 0.933 0.731 CB 1.679 105 residues pruned to eliminate duplicates Z: 40 38.277 2.242 0.932 0.544 0.872 0.718 CB 1.554 40 residues pruned to eliminate duplicates Z: 104 68.377 2.316 0.718 0.599 0.932 0.709 CB 1.652 104 residues pruned to eliminate duplicates Z: 75 61.984 2.290 0.905 0.622 0.932 0.716 CB 1.579 75 residues pruned to eliminate duplicates Z: 78 56.680 2.301 0.782 0.604 0.922 0.688 CB 1.547 78 residues pruned to eliminate duplicates Z: 85 71.534 2.331 0.821 0.650 0.917 0.750 CB 1.744 85 residues pruned to eliminate duplicates Z: 55 62.827 2.360 0.857 0.722 0.963 0.778 CB 1.658 55 residues pruned to eliminate duplicates Z: 61 55.568 2.297 0.881 0.652 0.917 0.717 CB 1.572 61 residues pruned to eliminate duplicates Z: 77 58.384 2.300 0.817 0.617 0.921 0.711 CB 1.558 77 residues pruned to eliminate duplicates Z: 56 58.008 2.334 0.756 0.715 0.945 0.800 CB 1.661 56 residues pruned to eliminate duplicates Z: 96 75.124 2.290 0.742 0.675 0.958 0.695 CB 1.717 96 residues pruned to eliminate duplicates Z: 59 59.968 2.309 0.928 0.677 0.948 0.759 CB 1.586 59 residues pruned to eliminate duplicates Z: 82 71.014 2.319 0.870 0.668 0.914 0.716 CB 1.705 82 residues pruned to eliminate duplicates Z: 76 59.134 2.272 0.884 0.602 0.920 0.760 CB 1.573 76 residues pruned to eliminate duplicates Z: 88 73.079 2.284 0.791 0.671 0.943 0.770 CB 1.734 88 residues pruned to eliminate duplicates Z: 90 71.824 2.261 0.721 0.683 0.966 0.719 CB 1.711 90 residues pruned to eliminate duplicates Z: 30 46.658 2.103 1.143 0.784 0.966 0.690 CB 1.550 30 residues pruned to eliminate duplicates Z: 85 73.734 2.341 0.855 0.652 0.940 0.738 CB 1.709 85 residues pruned to eliminate duplicates Z: 105 78.280 2.346 0.833 0.616 0.942 0.663 CB 1.698 105 residues pruned to eliminate duplicates Z: 59 60.201 2.281 1.026 0.685 0.931 0.810 CB 1.550 59 residues pruned to eliminate duplicates Z: 84 76.802 2.346 0.875 0.649 0.964 0.663 CB 1.731 84 residues pruned to eliminate duplicates Z: 134 88.070 2.338 0.805 0.633 0.940 0.692 CB 1.699 134 residues pruned to eliminate duplicates Z: 75 61.522 2.287 0.891 0.613 0.932 0.689 CB 1.593 75 residues pruned to eliminate duplicates Z: 88 76.766 2.310 0.825 0.678 0.943 0.724 CB 1.759 88 residues pruned to eliminate duplicates Z: 76 68.500 2.310 1.051 0.623 0.933 0.720 CB 1.593 76 residues pruned to eliminate duplicates Z: 95 72.536 2.283 0.832 0.665 0.926 0.734 CB 1.660 95 residues pruned to eliminate duplicates Z: 56 65.187 2.314 1.053 0.702 0.945 0.691 CB 1.627 56 residues pruned to eliminate duplicates Z: 29 45.767 2.152 1.152 0.788 1.000 0.821 CB 1.449 29 residues pruned to eliminate duplicates Z: 31 43.506 2.106 1.167 0.725 0.967 0.600 CB 1.471 31 residues pruned to eliminate duplicates Z: 88 80.303 2.302 0.841 0.693 0.966 0.690 CB 1.764 88 residues pruned to eliminate duplicates Z: 127 84.429 2.327 0.777 0.624 0.937 0.683 CB 1.728 127 residues pruned to eliminate duplicates Z: 34 39.695 2.109 1.152 0.660 0.939 0.576 CB 1.397 34 residues pruned to eliminate duplicates Z: 76 63.096 2.287 0.957 0.623 0.947 0.653 CB 1.532 76 residues pruned to eliminate duplicates Z: 111 71.806 2.318 0.988 0.560 0.900 0.564 CB 1.558 111 residues pruned to eliminate duplicates Z: 67 57.570 2.238 0.826 0.609 0.939 0.606 CB 1.665 67 residues pruned to eliminate duplicates Z: 32 47.302 2.169 1.287 0.755 0.968 0.645 CB 1.410 32 residues pruned to eliminate duplicates Z: 95 79.790 2.289 1.048 0.651 0.926 0.660 CB 1.648 95 residues pruned to eliminate duplicates Z: 59 67.786 2.304 1.080 0.696 0.983 0.603 CB 1.580 59 residues pruned to eliminate duplicates Z: 115 74.938 2.333 0.852 0.612 0.921 0.658 CB 1.586 115 residues pruned to eliminate duplicates Z: 38 38.688 2.376 0.839 0.560 0.838 0.622 CB 1.639 38 residues pruned to eliminate duplicates Z: 67 57.374 2.329 0.628 0.628 0.955 0.682 CB 1.730 67 residues pruned to eliminate duplicates Z: 62 68.944 2.397 0.763 0.678 0.967 0.738 CB 1.834 62 residues pruned to eliminate duplicates Z: 40 50.125 2.388 0.821 0.610 0.949 0.718 CB 1.753 40 residues pruned to eliminate duplicates Z: 39 40.011 2.304 0.651 0.541 0.921 0.711 CB 1.780 39 residues pruned to eliminate duplicates Z: 123 89.027 2.347 0.860 0.674 0.951 0.713 CB 1.655 123 residues pruned to eliminate duplicates Z: 39 40.393 2.303 0.658 0.568 0.895 0.684 CB 1.795 39 residues pruned to eliminate duplicates Z: 40 33.142 2.263 0.618 0.543 0.821 0.667 CB 1.693 40 residues pruned to eliminate duplicates Z: 44 39.795 2.284 0.668 0.571 0.884 0.628 CB 1.683 44 residues pruned to eliminate duplicates Z: 64 57.487 2.352 0.725 0.629 0.905 0.667 CB 1.748 64 residues pruned to eliminate duplicates Z: 40 46.001 2.366 0.807 0.569 0.923 0.769 CB 1.745 40 residues pruned to eliminate duplicates Z: 63 63.256 2.395 0.721 0.662 0.935 0.694 CB 1.793 63 residues pruned to eliminate duplicates Z: 37 43.644 2.401 0.733 0.559 0.944 0.639 CB 1.748 37 residues pruned to eliminate duplicates Z: 64 63.795 2.345 0.739 0.661 0.952 0.714 CB 1.782 64 residues pruned to eliminate duplicates Z: 96 73.123 2.299 0.772 0.670 0.958 0.684 CB 1.643 96 residues pruned to eliminate duplicates Z: 63 68.690 2.407 0.804 0.680 0.952 0.710 CB 1.789 63 residues pruned to eliminate duplicates Z: 39 38.831 2.331 0.701 0.542 0.895 0.632 CB 1.705 39 residues pruned to eliminate duplicates Z: 42 39.685 2.295 0.761 0.520 0.951 0.537 CB 1.580 42 residues pruned to eliminate duplicates Z: 73 70.088 2.298 1.000 0.663 0.944 0.653 CB 1.637 73 residues pruned to eliminate duplicates Z: 63 69.681 2.386 0.822 0.669 0.952 0.694 CB 1.830 63 residues pruned to eliminate duplicates Z: 64 62.119 2.393 0.753 0.640 0.937 0.683 CB 1.748 64 residues pruned to eliminate duplicates Z: 42 39.268 2.283 0.815 0.560 0.878 0.561 CB 1.590 42 residues pruned to eliminate duplicates Z: 99 75.643 2.319 0.956 0.634 0.918 0.704 CB 1.618 99 residues pruned to eliminate duplicates Z: 37 47.998 2.416 0.863 0.592 0.917 0.667 CB 1.775 37 residues pruned to eliminate duplicates Z: 63 66.762 2.365 0.788 0.678 0.952 0.742 CB 1.789 63 residues pruned to eliminate duplicates Z: 39 41.649 2.323 0.902 0.551 0.868 0.553 CB 1.675 39 residues pruned to eliminate duplicates Z: 64 71.384 2.392 0.957 0.647 0.937 0.698 CB 1.789 64 residues pruned to eliminate duplicates Z: 64 65.466 2.407 0.757 0.656 0.937 0.683 CB 1.802 64 residues pruned to eliminate duplicates Z: 60 64.900 2.325 0.830 0.672 0.966 0.695 CB 1.753 60 residues pruned to eliminate duplicates Z: 64 70.346 2.408 0.860 0.663 0.937 0.730 CB 1.816 64 residues pruned to eliminate duplicates Z: 63 60.723 2.378 0.838 0.621 0.871 0.629 CB 1.807 63 residues pruned to eliminate duplicates Z: 96 81.705 2.306 0.951 0.676 0.958 0.674 CB 1.654 96 residues pruned to eliminate duplicates Z: 41 41.641 2.278 0.771 0.568 0.900 0.625 CB 1.697 41 residues pruned to eliminate duplicates Z: 65 67.196 2.365 0.863 0.662 0.906 0.688 CB 1.810 65 residues pruned to eliminate duplicates Z: 63 68.724 2.381 0.908 0.675 0.919 0.677 CB 1.779 63 residues pruned to eliminate duplicates Z: 43 50.760 2.293 0.930 0.591 0.952 0.595 CB 1.703 43 residues pruned to eliminate duplicates Z: 65 60.700 2.305 0.796 0.632 0.922 0.719 CB 1.756 65 residues pruned to eliminate duplicates Z: 42 48.679 2.263 0.951 0.586 0.927 0.659 CB 1.710 42 residues pruned to eliminate duplicates Z: 64 71.532 2.384 0.870 0.678 0.968 0.683 CB 1.772 59 residues pruned to eliminate duplicates Z: 6 17.177 2.613 0.342 0.569 1.000 0.200 CA 2.048 6 residues pruned to eliminate duplicates Z: 29 43.175 2.325 0.604 0.726 0.964 0.679 CB 1.851 29 residues pruned to eliminate duplicates Z: 64 61.422 2.322 0.846 0.638 0.937 0.698 CB 1.694 64 residues pruned to eliminate duplicates Z: 21 40.432 2.311 0.736 0.845 0.950 0.900 CB 1.763 21 residues pruned to eliminate duplicates Z: 28 37.690 2.246 0.672 0.671 0.926 0.778 CB 1.781 28 residues pruned to eliminate duplicates Z: 29 39.909 2.330 0.579 0.735 0.929 0.714 CB 1.788 29 residues pruned to eliminate duplicates Z: 31 34.641 2.202 0.528 0.659 0.933 0.700 CB 1.738 31 residues pruned to eliminate duplicates Z: 30 42.487 2.301 0.594 0.717 1.000 0.724 CB 1.767 30 residues pruned to eliminate duplicates Z: 19 32.431 2.201 0.480 0.902 1.000 0.889 CB 1.674 19 residues pruned to eliminate duplicates Z: 137 89.688 2.335 0.981 0.638 0.926 0.654 CB 1.577 137 residues pruned to eliminate duplicates Z: 29 42.445 2.354 0.585 0.743 0.929 0.714 CB 1.863 29 residues pruned to eliminate duplicates Z: 28 46.984 2.307 0.780 0.743 1.000 0.778 CB 1.771 28 residues pruned to eliminate duplicates Z: 29 44.905 2.334 0.755 0.730 0.929 0.786 CB 1.814 29 residues pruned to eliminate duplicates Z: 19 33.084 2.218 0.606 0.927 0.889 0.833 CB 1.725 19 residues pruned to eliminate duplicates Z: 30 44.164 2.304 0.782 0.695 0.931 0.655 CB 1.795 30 residues pruned to eliminate duplicates Z: 63 72.788 2.350 1.004 0.674 0.903 0.694 CB 1.851 63 residues pruned to eliminate duplicates Z: 29 53.471 2.348 0.892 0.733 0.964 0.786 C 1.913 29 residues pruned to eliminate duplicates Z: 18 48.478 2.285 1.151 0.927 0.941 0.706 CB 1.782 18 residues pruned to eliminate duplicates Z: 29 55.860 2.356 1.000 0.743 0.964 0.714 CB 1.868 29 residues pruned to eliminate duplicates Z: 19 47.831 2.224 1.192 0.895 0.944 0.611 CB 1.756 19 residues pruned to eliminate duplicates Z: 29 57.858 2.343 1.160 0.749 0.929 0.607 CB 1.863 29 residues pruned to eliminate duplicates Z: 27 59.245 2.384 1.140 0.763 0.962 0.769 CB 1.875 27 residues pruned to eliminate duplicates 731 residues left after pruning, divided into chains as follows: A: 381 B: 350 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.09 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.495, Connect. = 0.771 for dens.mod. cycle 1 = 0.300, Contrast = 0.566, Connect. = 0.794 for dens.mod. cycle 2 = 0.300, Contrast = 0.692, Connect. = 0.826 for dens.mod. cycle 3 = 0.300, Contrast = 0.702, Connect. = 0.829 for dens.mod. cycle 4 = 0.300, Contrast = 0.716, Connect. = 0.831 for dens.mod. cycle 5 = 0.300, Contrast = 0.722, Connect. = 0.833 for dens.mod. cycle 6 = 0.300, Contrast = 0.729, Connect. = 0.834 for dens.mod. cycle 7 = 0.300, Contrast = 0.733, Connect. = 0.835 for dens.mod. cycle 8 = 0.300, Contrast = 0.738, Connect. = 0.836 for dens.mod. cycle 9 = 0.300, Contrast = 0.741, Connect. = 0.836 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4899 peaks > 0.5 sigma used to seed fragment search Space for about 918 unique residues taking solvent into account 1081 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 18 50.334 2.482 0.760 0.910 1.000 0.824 CB 1.982 B: 20 37.199 2.379 0.412 0.945 1.000 0.895 CB 1.759 C: 8 22.977 2.598 0.398 0.908 1.000 0.857 CB 1.698 8 residues pruned to eliminate duplicates D: 20 44.399 2.390 0.684 0.931 1.000 0.895 CB 1.769 20 residues pruned to eliminate duplicates E: 17 52.278 2.546 0.742 0.923 1.000 0.875 CB 2.070 F: 19 49.106 2.483 0.665 0.923 1.000 1.000 CB 1.967 18 residues pruned to eliminate duplicates G: 22 39.985 2.244 0.576 0.928 1.000 0.857 CB 1.728 21 residues pruned to eliminate duplicates H: 16 48.422 2.498 0.900 0.916 1.000 0.867 CA 1.859 I: 22 35.819 2.271 0.530 0.910 1.000 0.905 CB 1.594 J: 19 35.325 2.383 0.323 0.936 1.000 0.944 CB 1.839 21 residues pruned to eliminate duplicates K: 18 40.565 2.452 0.469 0.905 1.000 0.941 C 1.945 18 residues pruned to eliminate duplicates L: 20 38.248 2.348 0.540 0.941 1.000 0.789 CB 1.684 19 residues pruned to eliminate duplicates M: 21 36.441 2.296 0.554 0.938 1.000 0.850 CB 1.588 21 residues pruned to eliminate duplicates N: 16 41.212 2.371 0.705 0.927 1.000 0.933 CA 1.844 16 residues pruned to eliminate duplicates O: 59 50.304 2.518 0.863 0.464 0.845 0.483 CB 1.728 P: 18 28.377 2.105 0.817 0.856 0.824 0.824 C 1.611 18 residues pruned to eliminate duplicates Q: 18 40.157 2.318 0.715 0.941 0.941 0.882 CB 1.807 R: 18 54.272 2.488 0.912 0.928 1.000 0.824 C 1.937 18 residues pruned to eliminate duplicates S: 19 32.094 2.188 0.573 0.929 0.944 0.889 CB 1.628 19 residues pruned to eliminate duplicates T: 18 43.688 2.440 0.634 0.915 1.000 0.882 CB 1.877 18 residues pruned to eliminate duplicates U: 16 50.401 2.499 0.918 0.900 1.000 0.867 CA 1.939 16 residues pruned to eliminate duplicates V: 19 37.683 2.214 0.662 0.931 1.000 0.944 CB 1.686 18 residues pruned to eliminate duplicates W: 59 49.841 2.267 0.890 0.582 0.897 0.672 CB 1.575 X: 19 50.067 2.461 0.794 0.910 1.000 0.833 C 1.895 19 residues pruned to eliminate duplicates Y: 44 45.143 2.329 0.553 0.637 0.977 0.744 CB 1.715 21 residues pruned to eliminate duplicates Z: 18 51.347 2.440 0.932 0.934 1.000 0.941 C 1.843 17 residues pruned to eliminate duplicates Z: 19 52.496 2.424 0.848 0.922 1.000 0.889 C 1.942 18 residues pruned to eliminate duplicates Z: 15 46.908 2.506 0.832 0.924 1.000 0.929 CA 1.918 16 residues pruned to eliminate duplicates Z: 19 50.547 2.445 0.744 0.910 1.000 0.722 CB 1.982 19 residues pruned to eliminate duplicates Z: 17 53.767 2.462 1.048 0.939 0.938 0.750 C 1.976 19 residues pruned to eliminate duplicates Z: 14 45.679 2.569 0.663 0.925 1.000 0.769 CA 2.081 Z: 14 49.174 2.623 0.664 0.932 1.000 0.846 CA 2.182 14 residues pruned to eliminate duplicates Z: 20 41.351 2.379 0.666 0.924 0.947 0.895 CB 1.774 20 residues pruned to eliminate duplicates Z: 18 50.158 2.427 1.043 0.939 0.941 0.765 C 1.812 18 residues pruned to eliminate duplicates Z: 17 38.458 2.335 0.853 0.880 0.938 0.938 C 1.717 14 residues pruned to eliminate duplicates Z: 17 44.425 2.230 1.176 0.921 0.938 0.812 CA 1.717 Z: 19 29.392 2.347 0.381 0.943 0.889 0.833 CB 1.666 19 residues pruned to eliminate duplicates Z: 20 36.232 2.363 0.394 0.942 1.000 0.895 CB 1.750 20 residues pruned to eliminate duplicates Z: 19 52.606 2.504 0.911 0.934 1.000 0.778 C 1.808 19 residues pruned to eliminate duplicates Z: 147 75.046 2.285 0.785 0.540 0.897 0.637 CB 1.632 80 residues pruned to eliminate duplicates Z: 21 26.430 2.470 0.833 0.447 0.850 0.450 CB 1.623 21 residues pruned to eliminate duplicates Z: 19 51.420 2.503 0.696 0.923 1.000 0.944 C 2.006 19 residues pruned to eliminate duplicates Z: 14 33.716 2.234 0.705 0.905 1.000 0.846 CB 1.747 Z: 20 36.166 2.334 0.425 0.917 1.000 1.000 CB 1.760 20 residues pruned to eliminate duplicates Z: 19 51.349 2.450 0.829 0.951 1.000 0.889 CB 1.861 27 residues pruned to eliminate duplicates Z: 16 47.027 2.480 0.872 0.871 1.000 0.733 CA 1.909 16 residues pruned to eliminate duplicates Z: 16 38.556 2.377 0.722 0.926 0.933 0.867 CA 1.827 17 residues pruned to eliminate duplicates Z: 19 34.000 2.230 0.493 0.924 1.000 0.944 CB 1.691 19 residues pruned to eliminate duplicates Z: 16 35.464 2.420 0.690 0.868 0.933 0.800 CA 1.753 16 residues pruned to eliminate duplicates Z: 18 41.597 2.306 0.710 0.949 1.000 1.000 CB 1.765 18 residues pruned to eliminate duplicates Z: 20 33.936 2.360 0.324 0.951 1.000 0.895 CB 1.717 20 residues pruned to eliminate duplicates Z: 18 33.626 2.178 0.742 0.825 0.941 0.765 C 1.724 18 residues pruned to eliminate duplicates Z: 14 36.704 2.261 0.750 0.912 1.000 1.000 CA 1.822 14 residues pruned to eliminate duplicates Z: 16 36.882 2.405 0.765 0.888 0.867 0.733 C 1.865 16 residues pruned to eliminate duplicates Z: 18 36.044 2.274 0.520 0.929 1.000 0.882 CB 1.770 Z: 19 36.955 2.311 0.597 0.925 0.889 0.833 CB 1.863 19 residues pruned to eliminate duplicates Z: 20 49.313 2.404 0.880 0.889 0.947 0.947 C 1.902 20 residues pruned to eliminate duplicates Z: 16 47.273 2.362 1.101 0.849 0.933 0.867 CA 1.953 16 residues pruned to eliminate duplicates Z: 35 46.298 2.342 0.920 0.604 0.853 0.676 CB 1.874 14 residues pruned to eliminate duplicates Z: 37 30.406 2.423 0.825 0.401 0.833 0.500 CB 1.526 37 residues pruned to eliminate duplicates Z: 14 41.369 2.712 0.633 0.895 0.923 0.846 C 2.013 14 residues pruned to eliminate duplicates Z: 21 41.742 2.265 0.758 0.910 1.000 0.850 CB 1.662 21 residues pruned to eliminate duplicates Z: 15 49.030 2.624 0.762 0.936 1.000 0.929 C 1.974 17 residues pruned to eliminate duplicates Z: 17 42.220 2.323 0.811 0.936 1.000 0.750 CB 1.747 18 residues pruned to eliminate duplicates Z: 16 39.908 2.401 0.862 0.880 0.933 0.733 C 1.790 16 residues pruned to eliminate duplicates Z: 20 30.619 2.297 0.365 0.946 1.000 0.947 CB 1.549 20 residues pruned to eliminate duplicates Z: 16 49.309 2.525 0.907 0.868 1.000 0.867 CA 1.932 16 residues pruned to eliminate duplicates Z: 19 48.322 2.416 0.768 0.941 1.000 0.833 CB 1.851 19 residues pruned to eliminate duplicates Z: 19 43.852 2.167 1.161 0.854 1.000 0.778 C 1.631 23 residues pruned to eliminate duplicates Z: 18 52.830 2.500 0.901 0.924 1.000 0.941 C 1.894 18 residues pruned to eliminate duplicates Z: 15 55.811 2.501 1.070 0.930 1.000 0.929 CA 2.014 16 residues pruned to eliminate duplicates Z: 15 51.214 2.645 0.805 0.922 1.000 0.786 C 2.015 15 residues pruned to eliminate duplicates Z: 16 41.078 2.492 0.616 0.894 1.000 0.867 CA 1.889 15 residues pruned to eliminate duplicates Z: 15 53.459 2.488 0.991 0.921 1.000 0.857 C 2.030 16 residues pruned to eliminate duplicates Z: 15 33.136 2.588 0.444 0.902 0.857 0.714 C 1.972 15 residues pruned to eliminate duplicates Z: 24 33.667 2.115 0.508 0.914 1.000 0.913 CB 1.556 Z: 18 45.483 2.305 1.000 0.935 0.941 0.882 CB 1.772 19 residues pruned to eliminate duplicates Z: 24 21.961 2.417 0.574 0.443 0.783 0.652 CB 1.632 24 residues pruned to eliminate duplicates Z: 57 42.539 2.463 0.957 0.441 0.839 0.446 CB 1.493 57 residues pruned to eliminate duplicates Z: 8 22.270 2.223 0.549 0.808 1.000 0.571 CA 1.868 Z: 17 42.353 2.305 1.108 0.817 0.938 0.812 CA 1.765 17 residues pruned to eliminate duplicates Z: 20 47.021 2.373 0.857 0.950 0.947 0.737 CB 1.782 20 residues pruned to eliminate duplicates Z: 16 43.302 2.461 0.736 0.875 1.000 0.800 CA 1.904 16 residues pruned to eliminate duplicates Z: 29 40.128 2.348 0.424 0.762 0.964 0.821 CB 1.865 18 residues pruned to eliminate duplicates Z: 19 41.125 2.449 0.419 0.919 1.000 1.000 CB 1.966 19 residues pruned to eliminate duplicates Z: 16 44.953 2.434 0.988 0.896 0.933 0.800 CA 1.841 16 residues pruned to eliminate duplicates Z: 13 15.254 2.144 0.046 0.822 0.917 0.750 CB 1.620 13 residues pruned to eliminate duplicates Z: 16 42.638 2.309 0.907 0.889 1.000 0.933 CA 1.800 16 residues pruned to eliminate duplicates Z: 24 42.781 2.448 0.828 0.661 0.870 0.652 CA 1.974 16 residues pruned to eliminate duplicates Z: 19 40.046 2.332 0.716 0.942 0.944 0.778 CB 1.732 19 residues pruned to eliminate duplicates Z: 13 42.869 2.703 0.706 0.928 0.917 0.833 C 2.050 13 residues pruned to eliminate duplicates Z: 20 50.160 2.410 0.686 0.906 1.000 0.895 C 2.015 19 residues pruned to eliminate duplicates Z: 17 50.645 2.501 0.819 0.938 1.000 1.000 C 1.935 17 residues pruned to eliminate duplicates Z: 17 42.117 2.344 0.779 0.940 1.000 0.938 CB 1.754 17 residues pruned to eliminate duplicates Z: 13 35.507 2.346 0.628 0.912 1.000 0.917 CB 1.901 13 residues pruned to eliminate duplicates Z: 21 40.726 2.311 0.608 0.932 1.000 0.950 CB 1.711 21 residues pruned to eliminate duplicates Z: 16 48.181 2.439 1.200 0.886 0.933 0.667 CA 1.792 16 residues pruned to eliminate duplicates Z: 12 23.924 2.414 0.282 0.903 0.909 0.818 CB 1.828 12 residues pruned to eliminate duplicates Z: 7 25.283 2.446 0.675 0.815 1.000 0.833 CA 1.916 6 residues pruned to eliminate duplicates Z: 44 40.386 2.270 0.639 0.605 0.907 0.721 CB 1.651 44 residues pruned to eliminate duplicates Z: 15 44.126 2.496 0.817 0.895 1.000 0.857 C 1.864 15 residues pruned to eliminate duplicates Z: 15 40.715 2.444 0.668 0.922 1.000 1.000 CA 1.877 15 residues pruned to eliminate duplicates Z: 15 37.979 2.489 0.716 0.892 0.929 0.929 C 1.839 14 residues pruned to eliminate duplicates Z: 20 33.030 2.307 0.377 0.941 1.000 0.842 CB 1.656 20 residues pruned to eliminate duplicates Z: 12 14.537 2.321 0.546 0.526 0.818 0.273 CB 1.455 Z: 14 41.483 2.706 0.656 0.905 0.923 0.846 C 1.980 14 residues pruned to eliminate duplicates Z: 30 34.535 2.300 0.552 0.669 0.897 0.724 CB 1.714 18 residues pruned to eliminate duplicates Z: 17 47.294 2.489 0.714 0.911 1.000 0.812 CA 1.964 17 residues pruned to eliminate duplicates Z: 16 41.321 2.362 0.835 0.904 1.000 0.800 CB 1.753 16 residues pruned to eliminate duplicates Z: 37 36.829 2.257 0.930 0.571 0.917 0.639 CB 1.435 Z: 63 59.998 2.368 0.683 0.659 0.919 0.694 CB 1.794 66 residues pruned to eliminate duplicates Z: 8 19.971 2.255 0.541 0.797 1.000 0.857 C 1.674 8 residues pruned to eliminate duplicates Z: 18 50.760 2.417 0.902 0.937 1.000 0.824 CB 1.865 18 residues pruned to eliminate duplicates Z: 16 50.495 2.397 1.324 0.873 0.933 0.800 CA 1.826 16 residues pruned to eliminate duplicates Z: 86 80.102 2.439 0.895 0.610 0.918 0.682 CB 1.846 69 residues pruned to eliminate duplicates Z: 15 37.829 2.499 0.680 0.902 0.929 0.857 C 1.849 15 residues pruned to eliminate duplicates Z: 19 53.858 2.433 0.949 0.945 1.000 0.944 C 1.854 19 residues pruned to eliminate duplicates Z: 18 52.099 2.542 0.924 0.929 1.000 0.765 C 1.807 18 residues pruned to eliminate duplicates Z: 15 42.111 2.507 0.869 0.901 0.929 0.714 C 1.846 15 residues pruned to eliminate duplicates Z: 39 43.770 2.292 0.557 0.682 1.000 0.763 CB 1.682 39 residues pruned to eliminate duplicates Z: 21 23.045 2.351 0.744 0.430 0.850 0.650 CB 1.590 Z: 15 46.231 2.537 1.017 0.935 0.857 0.786 C 1.964 16 residues pruned to eliminate duplicates Z: 15 37.211 2.505 0.750 0.879 0.929 0.929 C 1.772 15 residues pruned to eliminate duplicates Z: 16 51.911 2.411 1.042 0.877 1.000 0.800 C 1.978 16 residues pruned to eliminate duplicates Z: 23 46.236 2.462 0.754 0.694 0.955 0.727 CB 2.002 24 residues pruned to eliminate duplicates Z: 13 36.507 2.341 0.667 0.904 1.000 1.000 CA 1.924 13 residues pruned to eliminate duplicates Z: 19 46.219 2.288 0.858 0.915 0.944 0.889 CA 1.918 19 residues pruned to eliminate duplicates Z: 17 49.139 2.201 1.225 0.904 1.000 0.875 C 1.786 17 residues pruned to eliminate duplicates Z: 16 59.325 2.438 1.269 0.895 1.000 0.867 CA 1.985 16 residues pruned to eliminate duplicates Z: 17 46.745 2.343 0.990 0.951 1.000 0.938 CB 1.727 17 residues pruned to eliminate duplicates Z: 19 58.116 2.413 1.180 0.953 1.000 0.833 CB 1.792 19 residues pruned to eliminate duplicates Z: 18 52.391 2.432 0.919 0.952 1.000 0.824 CB 1.875 18 residues pruned to eliminate duplicates Z: 27 46.778 2.469 0.536 0.760 1.000 0.808 CB 1.920 29 residues pruned to eliminate duplicates Z: 8 21.267 2.438 0.652 0.835 0.857 0.714 CB 1.743 8 residues pruned to eliminate duplicates Z: 18 49.441 2.477 0.891 0.948 0.941 0.882 C 1.878 18 residues pruned to eliminate duplicates Z: 15 44.492 2.487 0.881 0.888 1.000 0.786 C 1.831 15 residues pruned to eliminate duplicates Z: 21 44.026 2.272 0.777 0.919 1.000 0.850 C 1.718 21 residues pruned to eliminate duplicates Z: 16 56.872 2.447 1.314 0.909 1.000 0.733 CA 1.841 16 residues pruned to eliminate duplicates Z: 19 41.982 2.354 0.714 0.945 1.000 0.833 CB 1.697 19 residues pruned to eliminate duplicates Z: 18 52.567 2.440 1.096 0.937 0.941 0.765 C 1.843 18 residues pruned to eliminate duplicates Z: 57 58.338 2.338 0.836 0.662 0.875 0.643 CB 1.786 57 residues pruned to eliminate duplicates Z: 16 44.797 2.456 0.970 0.861 0.933 0.867 CA 1.882 16 residues pruned to eliminate duplicates Z: 20 18.780 2.148 0.668 0.361 0.895 0.526 CB 1.562 20 residues pruned to eliminate duplicates Z: 19 50.738 2.482 0.848 0.939 1.000 0.833 C 1.811 19 residues pruned to eliminate duplicates Z: 8 20.721 2.222 0.645 0.826 1.000 0.857 C 1.616 8 residues pruned to eliminate duplicates Z: 60 55.081 2.490 0.878 0.471 0.881 0.525 CB 1.791 27 residues pruned to eliminate duplicates Z: 17 42.166 2.217 0.998 0.912 1.000 0.875 CA 1.685 17 residues pruned to eliminate duplicates Z: 16 58.281 2.420 1.312 0.873 1.000 0.667 C 1.958 16 residues pruned to eliminate duplicates Z: 16 50.544 2.472 0.965 0.910 1.000 0.667 CA 1.905 16 residues pruned to eliminate duplicates Z: 13 47.465 2.629 1.109 0.924 0.917 0.917 C 1.894 13 residues pruned to eliminate duplicates Z: 43 52.215 2.321 0.980 0.625 0.881 0.643 CB 1.770 43 residues pruned to eliminate duplicates Z: 13 30.030 2.237 0.524 0.932 1.000 0.917 CB 1.775 13 residues pruned to eliminate duplicates Z: 54 51.512 2.564 0.872 0.487 0.849 0.509 CB 1.760 54 residues pruned to eliminate duplicates Z: 18 52.452 2.531 0.785 0.933 1.000 1.000 C 1.964 18 residues pruned to eliminate duplicates Z: 17 56.397 2.615 0.854 0.926 1.000 0.938 C 2.040 17 residues pruned to eliminate duplicates Z: 7 13.426 2.078 0.076 0.830 1.000 1.000 CA 1.843 7 residues pruned to eliminate duplicates Z: 18 53.499 2.526 0.909 0.933 1.000 0.647 C 1.877 18 residues pruned to eliminate duplicates Z: 17 51.359 2.422 1.023 0.905 1.000 0.875 CA 1.865 17 residues pruned to eliminate duplicates Z: 15 30.081 2.222 0.494 0.885 1.000 0.929 CA 1.749 15 residues pruned to eliminate duplicates Z: 10 21.622 2.024 0.713 0.814 1.000 0.778 CA 1.582 9 residues pruned to eliminate duplicates Z: 14 38.331 2.514 0.566 0.925 0.923 0.846 CA 2.053 14 residues pruned to eliminate duplicates Z: 20 40.697 2.296 0.586 0.953 1.000 0.895 C 1.765 20 residues pruned to eliminate duplicates Z: 16 47.675 2.464 0.996 0.927 1.000 0.800 C 1.754 16 residues pruned to eliminate duplicates Z: 62 56.189 2.318 0.735 0.651 0.902 0.672 CB 1.723 62 residues pruned to eliminate duplicates Z: 22 24.190 2.440 0.629 0.442 0.810 0.619 CB 1.742 22 residues pruned to eliminate duplicates Z: 16 32.332 2.258 0.504 0.886 1.000 0.933 CA 1.772 Z: 15 48.061 2.512 1.156 0.881 0.857 0.714 CA 2.003 15 residues pruned to eliminate duplicates Z: 7 29.405 2.434 0.841 0.899 1.000 0.833 CB 1.915 8 residues pruned to eliminate duplicates Z: 24 15.699 2.096 0.671 0.379 0.913 0.565 CB 1.165 Z: 19 44.233 2.418 0.604 0.908 1.000 1.000 CB 1.909 19 residues pruned to eliminate duplicates Z: 38 28.369 2.359 0.786 0.416 0.811 0.405 CB 1.491 38 residues pruned to eliminate duplicates Z: 40 44.825 2.353 0.752 0.636 0.846 0.641 CB 1.811 40 residues pruned to eliminate duplicates Z: 9 20.384 2.236 0.443 0.717 1.000 0.750 CB 1.836 9 residues pruned to eliminate duplicates Z: 29 43.478 2.385 0.542 0.739 0.964 0.643 CB 1.870 28 residues pruned to eliminate duplicates Z: 17 46.710 2.569 0.541 0.910 1.000 0.875 C 2.092 17 residues pruned to eliminate duplicates Z: 13 40.518 2.308 0.969 0.921 1.000 0.917 C 1.811 13 residues pruned to eliminate duplicates Z: 9 12.074 2.085 0.613 0.603 0.750 0.500 CA 1.534 Z: 15 41.200 2.547 0.871 0.908 0.929 0.857 C 1.767 15 residues pruned to eliminate duplicates Z: 18 52.072 2.386 1.021 0.945 1.000 0.824 CB 1.813 18 residues pruned to eliminate duplicates Z: 20 39.077 2.144 0.824 0.933 1.000 0.895 CB 1.600 20 residues pruned to eliminate duplicates Z: 15 52.710 2.508 1.077 0.869 1.000 0.500 CA 1.975 15 residues pruned to eliminate duplicates Z: 45 40.102 2.279 0.709 0.562 0.864 0.682 CB 1.693 16 residues pruned to eliminate duplicates Z: 20 50.870 2.341 0.957 0.959 1.000 0.789 C 1.746 20 residues pruned to eliminate duplicates Z: 13 35.589 2.352 0.631 0.889 1.000 0.917 CB 1.928 13 residues pruned to eliminate duplicates Z: 91 49.219 2.245 0.671 0.518 0.844 0.600 CB 1.609 91 residues pruned to eliminate duplicates Z: 17 54.603 2.612 0.759 0.917 1.000 0.812 C 2.097 17 residues pruned to eliminate duplicates Z: 30 34.175 2.336 0.344 0.722 0.931 0.690 CB 1.776 30 residues pruned to eliminate duplicates Z: 37 29.894 2.246 0.602 0.434 0.917 0.583 CB 1.618 12 residues pruned to eliminate duplicates Z: 14 62.027 2.641 1.137 0.934 1.000 0.846 C 2.126 14 residues pruned to eliminate duplicates Z: 30 52.241 2.356 0.991 0.655 0.966 0.621 CB 1.855 30 residues pruned to eliminate duplicates Z: 16 35.086 2.190 0.861 0.891 0.933 0.867 CA 1.712 16 residues pruned to eliminate duplicates Z: 16 36.299 2.228 0.824 0.914 1.000 0.933 CA 1.631 16 residues pruned to eliminate duplicates Z: 17 32.190 2.216 0.565 0.909 1.000 0.875 CA 1.646 17 residues pruned to eliminate duplicates Z: 42 49.355 2.306 0.826 0.644 0.927 0.683 CB 1.727 45 residues pruned to eliminate duplicates Z: 20 55.410 2.396 0.984 0.962 1.000 0.842 C 1.828 20 residues pruned to eliminate duplicates Z: 19 49.850 2.298 1.150 0.888 1.000 0.889 C 1.713 19 residues pruned to eliminate duplicates Z: 13 34.368 2.238 0.954 0.858 1.000 0.750 CB 1.671 13 residues pruned to eliminate duplicates Z: 69 51.151 2.280 0.733 0.532 0.882 0.721 CB 1.724 69 residues pruned to eliminate duplicates Z: 41 45.177 2.225 0.769 0.617 0.950 0.775 CB 1.710 41 residues pruned to eliminate duplicates Z: 32 23.767 2.152 0.517 0.422 0.871 0.516 CB 1.628 32 residues pruned to eliminate duplicates Z: 6 6.419 1.831 0.646 0.577 0.600 0.600 C 1.474 6 residues pruned to eliminate duplicates Z: 12 29.833 2.345 0.515 0.914 1.000 0.818 CB 1.791 12 residues pruned to eliminate duplicates Z: 16 53.911 2.352 1.331 0.890 1.000 0.800 CA 1.826 16 residues pruned to eliminate duplicates Z: 10 18.869 1.991 0.601 0.895 1.000 0.778 CA 1.414 10 residues pruned to eliminate duplicates Z: 7 12.779 2.103 0.249 0.841 1.000 0.833 CA 1.481 7 residues pruned to eliminate duplicates Z: 16 55.915 2.590 0.891 0.940 1.000 0.867 C 2.047 16 residues pruned to eliminate duplicates Z: 9 7.935 2.095 0.143 0.257 0.875 0.500 CB 1.769 9 residues pruned to eliminate duplicates Z: 14 30.766 2.220 0.561 0.906 1.000 0.923 CA 1.752 14 residues pruned to eliminate duplicates Z: 16 54.339 2.441 1.144 0.915 1.000 0.800 CA 1.895 16 residues pruned to eliminate duplicates Z: 16 35.386 2.269 0.603 0.910 1.000 0.933 CA 1.781 16 residues pruned to eliminate duplicates Z: 35 38.190 2.116 0.870 0.617 0.912 0.588 CB 1.625 35 residues pruned to eliminate duplicates Z: 18 37.164 2.267 0.673 0.928 0.941 0.941 CB 1.769 18 residues pruned to eliminate duplicates Z: 6 7.892 1.941 0.369 0.495 0.800 0.600 CB 1.668 Z: 16 31.132 2.219 0.534 0.936 1.000 0.933 CA 1.645 16 residues pruned to eliminate duplicates Z: 27 40.030 2.254 0.832 0.666 0.885 0.769 CB 1.843 27 residues pruned to eliminate duplicates Z: 42 36.286 2.441 0.769 0.400 0.878 0.415 CB 1.661 42 residues pruned to eliminate duplicates Z: 19 57.013 2.402 1.196 0.955 1.000 0.778 C 1.751 19 residues pruned to eliminate duplicates Z: 20 59.227 2.408 1.124 0.954 1.000 0.842 CB 1.827 20 residues pruned to eliminate duplicates Z: 18 43.979 2.325 0.753 0.937 1.000 0.941 CB 1.822 18 residues pruned to eliminate duplicates Z: 24 38.627 2.160 0.793 0.924 1.000 0.870 CB 1.461 Z: 10 21.738 2.038 0.565 0.928 1.000 0.778 CB 1.591 10 residues pruned to eliminate duplicates Z: 18 41.259 2.271 0.907 0.920 0.941 0.941 CB 1.728 18 residues pruned to eliminate duplicates Z: 133 69.489 2.238 0.735 0.546 0.902 0.652 CB 1.652 133 residues pruned to eliminate duplicates Z: 17 50.032 2.404 0.972 0.958 1.000 0.875 CB 1.810 17 residues pruned to eliminate duplicates Z: 17 32.215 2.234 0.681 0.895 0.938 0.938 CA 1.639 17 residues pruned to eliminate duplicates Z: 16 29.522 2.213 0.460 0.916 1.000 0.933 CA 1.666 16 residues pruned to eliminate duplicates Z: 23 47.252 2.197 1.031 0.939 1.000 0.909 CB 1.568 24 residues pruned to eliminate duplicates Z: 14 32.868 2.255 0.618 0.897 1.000 0.846 CB 1.789 14 residues pruned to eliminate duplicates Z: 13 30.044 2.256 0.733 0.851 1.000 0.833 CB 1.642 13 residues pruned to eliminate duplicates Z: 6 11.974 2.088 0.305 0.871 1.000 0.800 CB 1.434 6 residues pruned to eliminate duplicates Z: 17 37.622 2.226 0.920 0.872 0.938 0.812 CA 1.710 17 residues pruned to eliminate duplicates Z: 17 26.066 2.191 0.405 0.867 0.938 0.938 CA 1.651 17 residues pruned to eliminate duplicates Z: 16 36.445 2.281 0.667 0.909 1.000 0.933 CA 1.756 16 residues pruned to eliminate duplicates Z: 23 36.717 2.172 0.642 0.955 0.955 0.909 CB 1.581 23 residues pruned to eliminate duplicates Z: 11 11.802 1.992 1.020 0.537 0.900 0.400 CB 0.994 6 residues pruned to eliminate duplicates Z: 24 23.162 2.361 0.770 0.397 0.826 0.609 CB 1.560 22 residues pruned to eliminate duplicates Z: 9 18.217 2.074 0.533 0.887 1.000 0.875 CB 1.461 9 residues pruned to eliminate duplicates Z: 24 44.153 2.153 1.149 0.929 1.000 0.913 CB 1.393 24 residues pruned to eliminate duplicates Z: 8 11.511 1.978 0.071 0.826 1.000 0.714 C 1.548 8 residues pruned to eliminate duplicates Z: 10 16.900 2.036 0.317 0.906 1.000 0.889 CA 1.494 10 residues pruned to eliminate duplicates Z: 18 55.421 2.300 1.244 0.942 1.000 0.941 CB 1.806 18 residues pruned to eliminate duplicates Z: 16 39.082 2.387 0.856 0.840 0.933 0.800 CA 1.823 16 residues pruned to eliminate duplicates Z: 38 32.973 2.287 0.790 0.500 0.919 0.568 CB 1.440 29 residues pruned to eliminate duplicates Z: 12 34.234 2.375 0.683 0.919 1.000 1.000 CA 1.820 12 residues pruned to eliminate duplicates Z: 12 14.090 2.332 0.325 0.524 0.818 0.273 CB 1.641 12 residues pruned to eliminate duplicates Z: 18 52.132 2.502 0.967 0.937 1.000 0.941 C 1.788 18 residues pruned to eliminate duplicates Z: 19 52.995 2.470 0.849 0.919 1.000 0.722 C 1.927 19 residues pruned to eliminate duplicates Z: 19 44.398 2.210 1.131 0.929 0.889 0.833 CB 1.750 19 residues pruned to eliminate duplicates Z: 8 6.760 1.874 0.129 0.697 0.714 0.571 C 1.413 8 residues pruned to eliminate duplicates Z: 19 62.847 2.437 1.259 0.952 1.000 0.667 C 1.852 19 residues pruned to eliminate duplicates Z: 7 15.243 2.175 0.223 0.910 1.000 1.000 CB 1.660 7 residues pruned to eliminate duplicates Z: 16 41.118 2.287 0.979 0.894 0.933 0.867 CA 1.803 16 residues pruned to eliminate duplicates Z: 43 55.083 2.353 0.862 0.656 0.952 0.714 CB 1.762 43 residues pruned to eliminate duplicates Z: 18 8.363 1.805 0.357 0.378 0.765 0.412 CB 1.233 18 residues pruned to eliminate duplicates Z: 13 32.268 2.269 0.755 0.889 1.000 0.833 CB 1.684 13 residues pruned to eliminate duplicates Z: 24 36.620 2.129 0.772 0.899 1.000 0.870 CB 1.448 24 residues pruned to eliminate duplicates Z: 24 41.766 2.155 1.010 0.928 1.000 0.913 CB 1.408 24 residues pruned to eliminate duplicates Z: 24 39.511 2.048 0.931 0.928 0.957 0.913 CB 1.525 24 residues pruned to eliminate duplicates Z: 43 29.387 2.236 0.605 0.460 0.881 0.500 CB 1.493 43 residues pruned to eliminate duplicates Z: 28 41.166 2.402 0.428 0.727 1.000 0.741 CB 1.882 28 residues pruned to eliminate duplicates Z: 17 36.294 2.113 0.914 0.932 1.000 0.938 CA 1.567 17 residues pruned to eliminate duplicates Z: 9 12.869 2.085 0.213 0.913 0.875 0.875 CB 1.456 9 residues pruned to eliminate duplicates Z: 21 42.212 2.308 0.723 0.956 1.000 0.900 CB 1.631 21 residues pruned to eliminate duplicates Z: 17 38.814 2.181 1.030 0.864 0.938 0.750 CA 1.713 17 residues pruned to eliminate duplicates Z: 8 9.057 1.916 -0.108 0.798 1.000 0.714 CA 1.542 8 residues pruned to eliminate duplicates Z: 18 38.638 2.299 0.596 0.932 1.000 1.000 CB 1.783 18 residues pruned to eliminate duplicates Z: 17 33.703 2.209 0.619 0.901 1.000 0.750 CA 1.681 17 residues pruned to eliminate duplicates Z: 16 39.046 2.229 0.829 0.942 1.000 0.867 CA 1.715 16 residues pruned to eliminate duplicates Z: 9 9.154 1.906 0.657 0.489 0.750 0.625 CB 1.382 9 residues pruned to eliminate duplicates Z: 24 41.616 2.116 0.874 0.921 1.000 0.913 CB 1.541 24 residues pruned to eliminate duplicates Z: 16 61.287 2.638 1.023 0.945 1.000 1.000 C 2.052 19 residues pruned to eliminate duplicates Z: 19 26.296 2.442 0.842 0.473 0.889 0.667 CB 1.593 19 residues pruned to eliminate duplicates Z: 20 58.286 2.370 1.173 0.951 1.000 0.895 C 1.788 20 residues pruned to eliminate duplicates Z: 24 44.822 2.092 1.115 0.905 1.000 0.739 CB 1.503 24 residues pruned to eliminate duplicates Z: 25 42.835 2.042 0.888 0.949 1.000 0.833 CB 1.565 25 residues pruned to eliminate duplicates Z: 24 44.432 2.155 1.114 0.919 1.000 0.870 CB 1.433 24 residues pruned to eliminate duplicates Z: 17 46.039 2.443 0.752 0.934 1.000 0.938 CB 1.875 18 residues pruned to eliminate duplicates Z: 17 33.091 2.193 0.594 0.902 1.000 0.938 CA 1.688 17 residues pruned to eliminate duplicates Z: 16 47.639 2.574 0.567 0.944 1.000 1.000 CB 2.112 16 residues pruned to eliminate duplicates Z: 6 16.301 2.027 0.669 0.771 1.000 0.800 C 1.695 6 residues pruned to eliminate duplicates Z: 16 54.095 2.315 1.255 0.922 1.000 1.000 CA 1.882 16 residues pruned to eliminate duplicates Z: 27 37.654 2.481 0.715 0.529 0.885 0.577 CB 1.907 27 residues pruned to eliminate duplicates Z: 31 43.553 2.369 0.632 0.683 0.933 0.767 CB 1.864 31 residues pruned to eliminate duplicates Z: 40 48.961 2.346 0.945 0.593 0.897 0.641 CB 1.752 38 residues pruned to eliminate duplicates Z: 18 44.336 2.298 0.790 0.942 1.000 0.941 CB 1.814 18 residues pruned to eliminate duplicates Z: 9 22.839 2.116 0.519 0.922 1.000 1.000 CA 1.767 9 residues pruned to eliminate duplicates Z: 19 38.736 2.208 0.743 0.907 1.000 0.944 CB 1.685 18 residues pruned to eliminate duplicates Z: 22 44.008 2.231 0.984 0.957 0.952 0.762 CB 1.563 22 residues pruned to eliminate duplicates Z: 16 22.191 2.129 0.390 0.943 0.933 0.933 CA 1.437 16 residues pruned to eliminate duplicates Z: 16 46.085 2.331 1.040 0.930 1.000 0.800 CA 1.750 16 residues pruned to eliminate duplicates Z: 18 43.118 2.426 0.632 0.913 1.000 0.941 CA 1.869 17 residues pruned to eliminate duplicates Z: 6 13.002 2.137 0.205 0.773 1.000 0.600 CB 1.774 6 residues pruned to eliminate duplicates Z: 17 35.238 2.196 0.731 0.866 1.000 0.812 CA 1.696 17 residues pruned to eliminate duplicates Z: 6 9.423 2.069 0.160 0.796 0.800 0.800 CA 1.694 6 residues pruned to eliminate duplicates Z: 19 48.233 2.210 1.136 0.942 1.000 0.944 CB 1.670 19 residues pruned to eliminate duplicates Z: 17 51.705 2.293 1.300 0.852 1.000 0.812 C 1.812 17 residues pruned to eliminate duplicates Z: 18 43.939 2.311 0.751 0.942 1.000 1.000 CB 1.826 18 residues pruned to eliminate duplicates Z: 6 14.796 2.190 0.309 0.809 1.000 0.400 CA 1.763 6 residues pruned to eliminate duplicates Z: 13 31.095 2.319 0.461 0.893 1.000 0.917 CA 1.901 13 residues pruned to eliminate duplicates Z: 22 49.159 2.217 1.132 0.959 1.000 0.857 CB 1.555 22 residues pruned to eliminate duplicates Z: 9 7.839 2.049 0.788 0.508 0.750 0.625 CB 1.001 9 residues pruned to eliminate duplicates Z: 33 53.572 2.355 0.783 0.714 1.000 0.688 CB 1.858 33 residues pruned to eliminate duplicates Z: 13 25.848 2.296 0.537 0.585 1.000 0.500 C 1.950 13 residues pruned to eliminate duplicates Z: 17 30.540 2.145 0.755 0.893 0.938 0.875 CA 1.554 17 residues pruned to eliminate duplicates Z: 12 23.777 2.182 0.482 0.863 0.909 0.818 CA 1.788 12 residues pruned to eliminate duplicates Z: 30 22.624 2.023 0.619 0.397 0.931 0.621 CB 1.535 30 residues pruned to eliminate duplicates Z: 8 16.927 2.104 0.384 0.919 1.000 1.000 CA 1.548 8 residues pruned to eliminate duplicates Z: 31 32.713 2.237 0.695 0.509 0.933 0.600 CB 1.673 31 residues pruned to eliminate duplicates Z: 12 27.078 2.180 0.650 0.877 1.000 0.727 CA 1.649 12 residues pruned to eliminate duplicates Z: 8 22.096 2.319 0.584 0.806 1.000 0.714 CB 1.742 8 residues pruned to eliminate duplicates Z: 58 50.734 2.416 0.721 0.567 0.842 0.702 CB 1.798 58 residues pruned to eliminate duplicates Z: 9 9.373 1.819 0.014 0.815 1.000 0.500 CB 1.366 9 residues pruned to eliminate duplicates Z: 19 38.883 2.159 0.863 0.925 1.000 0.722 CB 1.599 19 residues pruned to eliminate duplicates Z: 9 3.174 2.007 -0.113 0.374 0.875 0.625 CB 0.824 6 residues pruned to eliminate duplicates Z: 24 41.190 2.090 0.883 0.927 1.000 1.000 CB 1.529 24 residues pruned to eliminate duplicates Z: 92 50.613 2.201 0.630 0.503 0.912 0.637 CB 1.618 92 residues pruned to eliminate duplicates Z: 8 20.204 2.158 0.744 0.883 1.000 1.000 C 1.467 7 residues pruned to eliminate duplicates Z: 23 44.735 2.425 0.846 0.695 0.909 0.545 CB 1.962 23 residues pruned to eliminate duplicates Z: 19 48.744 2.214 1.161 0.927 1.000 0.889 CB 1.683 19 residues pruned to eliminate duplicates Z: 38 30.895 2.343 0.637 0.455 0.865 0.486 CB 1.604 38 residues pruned to eliminate duplicates Z: 10 14.672 2.006 0.238 0.879 1.000 1.000 CA 1.428 10 residues pruned to eliminate duplicates Z: 17 33.574 2.154 0.867 0.809 0.938 0.625 C 1.700 17 residues pruned to eliminate duplicates Z: 18 48.775 2.405 0.892 0.922 1.000 0.765 C 1.828 18 residues pruned to eliminate duplicates Z: 9 18.961 2.479 0.376 0.535 1.000 0.500 CB 1.898 9 residues pruned to eliminate duplicates Z: 17 26.631 2.186 0.445 0.933 0.938 0.938 CA 1.570 17 residues pruned to eliminate duplicates Z: 25 41.324 2.084 0.847 0.894 1.000 0.875 CB 1.572 24 residues pruned to eliminate duplicates Z: 12 27.123 2.304 0.460 0.886 1.000 0.909 CB 1.754 12 residues pruned to eliminate duplicates Z: 20 20.293 2.310 0.647 0.472 0.842 0.684 CB 1.494 20 residues pruned to eliminate duplicates Z: 9 9.788 1.920 0.830 0.533 0.750 0.625 CB 1.271 9 residues pruned to eliminate duplicates Z: 7 11.460 2.112 0.663 0.444 0.833 0.667 CB 1.693 7 residues pruned to eliminate duplicates Z: 23 45.875 2.179 1.168 0.919 1.000 0.864 CB 1.459 23 residues pruned to eliminate duplicates Z: 29 27.159 2.181 0.616 0.493 0.929 0.607 CB 1.580 29 residues pruned to eliminate duplicates Z: 16 50.322 2.462 0.950 0.894 1.000 0.933 CA 1.941 16 residues pruned to eliminate duplicates Z: 21 25.424 2.449 0.728 0.437 0.850 0.750 CB 1.686 21 residues pruned to eliminate duplicates Z: 14 21.486 2.155 0.223 0.941 1.000 0.923 CB 1.569 14 residues pruned to eliminate duplicates Z: 18 47.013 2.295 0.843 0.942 1.000 0.882 C 1.870 18 residues pruned to eliminate duplicates Z: 17 36.234 2.084 0.992 0.921 1.000 0.562 CA 1.536 17 residues pruned to eliminate duplicates Z: 29 41.976 2.327 0.713 0.739 0.893 0.786 CB 1.800 29 residues pruned to eliminate duplicates Z: 18 46.419 2.420 0.835 0.926 1.000 0.824 C 1.778 18 residues pruned to eliminate duplicates Z: 17 35.591 2.208 0.884 0.871 0.938 0.750 CA 1.664 17 residues pruned to eliminate duplicates Z: 20 36.889 2.546 0.709 0.634 0.895 0.684 C 1.917 20 residues pruned to eliminate duplicates Z: 29 22.746 2.255 0.572 0.423 0.893 0.607 CB 1.472 56 residues pruned to eliminate duplicates Z: 64 62.805 2.349 0.804 0.667 0.905 0.698 CB 1.769 63 residues pruned to eliminate duplicates Z: 63 46.869 2.207 0.828 0.484 0.903 0.629 CB 1.659 63 residues pruned to eliminate duplicates Z: 23 43.723 2.107 0.917 0.934 1.000 0.909 CB 1.609 23 residues pruned to eliminate duplicates Z: 10 19.974 1.958 0.851 0.891 1.000 0.778 CA 1.321 10 residues pruned to eliminate duplicates Z: 13 29.039 2.241 0.775 0.854 0.917 0.667 CB 1.697 13 residues pruned to eliminate duplicates Z: 16 29.690 2.188 0.568 0.917 0.933 0.800 CA 1.690 16 residues pruned to eliminate duplicates Z: 9 8.877 2.033 0.439 0.372 0.875 0.500 CB 1.405 9 residues pruned to eliminate duplicates Z: 6 6.117 2.091 0.217 0.426 0.800 0.600 CB 1.451 6 residues pruned to eliminate duplicates Z: 7 17.732 2.129 0.588 0.829 1.000 1.000 C 1.611 7 residues pruned to eliminate duplicates Z: 17 30.102 2.120 0.626 0.934 1.000 0.875 CA 1.523 17 residues pruned to eliminate duplicates Z: 29 29.725 2.431 0.822 0.477 0.893 0.571 CB 1.453 29 residues pruned to eliminate duplicates Z: 15 45.115 2.543 0.846 0.940 0.929 0.786 C 1.921 15 residues pruned to eliminate duplicates Z: 12 37.612 2.354 0.822 0.923 1.000 0.909 CB 1.858 12 residues pruned to eliminate duplicates Z: 20 52.103 2.369 0.912 0.946 1.000 0.895 CB 1.825 20 residues pruned to eliminate duplicates Z: 11 14.054 2.141 1.151 0.436 0.700 0.400 CB 1.473 11 residues pruned to eliminate duplicates Z: 7 9.260 2.081 -0.226 0.843 1.000 1.000 C 1.748 7 residues pruned to eliminate duplicates Z: 63 53.850 2.334 0.601 0.687 0.935 0.758 CB 1.647 65 residues pruned to eliminate duplicates Z: 24 41.973 2.077 0.882 0.926 1.000 0.783 CB 1.571 24 residues pruned to eliminate duplicates Z: 113 61.050 2.252 0.630 0.621 0.929 0.661 CB 1.510 77 residues pruned to eliminate duplicates Z: 19 44.726 2.206 0.991 0.934 1.000 0.889 CB 1.673 19 residues pruned to eliminate duplicates Z: 11 29.233 2.359 0.501 0.928 1.000 0.900 CB 1.829 11 residues pruned to eliminate duplicates Z: 6 8.439 1.887 0.052 0.883 1.000 1.000 CB 1.375 6 residues pruned to eliminate duplicates Z: 9 18.523 2.094 0.418 0.908 1.000 1.000 CA 1.566 9 residues pruned to eliminate duplicates Z: 31 29.825 2.208 0.529 0.456 1.000 0.633 CB 1.688 31 residues pruned to eliminate duplicates Z: 75 53.639 2.235 0.577 0.651 0.946 0.703 CB 1.626 75 residues pruned to eliminate duplicates Z: 16 37.829 2.239 0.832 0.907 1.000 0.933 CA 1.693 16 residues pruned to eliminate duplicates Z: 9 22.655 2.251 0.696 0.859 1.000 0.875 CB 1.544 9 residues pruned to eliminate duplicates Z: 45 36.287 2.120 0.863 0.585 0.932 0.614 CB 1.370 45 residues pruned to eliminate duplicates Z: 38 48.292 2.265 0.917 0.659 0.919 0.784 CB 1.717 38 residues pruned to eliminate duplicates Z: 35 22.604 2.123 0.467 0.384 0.912 0.647 CB 1.544 35 residues pruned to eliminate duplicates Z: 24 45.377 2.170 1.153 0.928 1.000 0.783 CB 1.418 23 residues pruned to eliminate duplicates Z: 6 8.437 1.929 -0.054 0.800 1.000 0.800 N 1.590 6 residues pruned to eliminate duplicates Z: 37 38.093 2.261 0.922 0.604 0.917 0.694 CB 1.444 37 residues pruned to eliminate duplicates Z: 6 5.447 1.794 -0.010 0.628 0.800 0.600 C 1.521 6 residues pruned to eliminate duplicates Z: 24 45.701 2.153 1.196 0.924 1.000 0.783 CB 1.415 24 residues pruned to eliminate duplicates Z: 16 53.539 2.456 1.294 0.852 0.933 0.667 CA 1.944 16 residues pruned to eliminate duplicates Z: 23 43.503 2.164 0.822 0.944 1.000 0.955 CB 1.629 23 residues pruned to eliminate duplicates Z: 38 25.785 2.114 0.579 0.412 0.919 0.486 CB 1.515 38 residues pruned to eliminate duplicates Z: 20 55.328 2.349 1.111 0.940 1.000 0.737 CB 1.778 20 residues pruned to eliminate duplicates Z: 28 32.204 2.170 0.622 0.746 0.815 0.704 CB 1.735 28 residues pruned to eliminate duplicates Z: 25 42.785 2.134 1.070 0.910 1.000 0.875 CB 1.402 24 residues pruned to eliminate duplicates Z: 7 14.488 2.206 0.152 0.819 1.000 0.833 CB 1.765 7 residues pruned to eliminate duplicates Z: 32 54.731 2.369 1.009 0.696 0.903 0.710 CB 1.912 32 residues pruned to eliminate duplicates Z: 9 18.983 2.118 0.736 0.786 0.875 0.875 CB 1.622 9 residues pruned to eliminate duplicates Z: 9 8.399 1.610 0.850 0.555 0.750 0.625 CA 1.259 9 residues pruned to eliminate duplicates Z: 24 33.415 2.112 0.511 0.903 1.000 0.870 CB 1.556 24 residues pruned to eliminate duplicates Z: 24 42.945 2.158 1.024 0.927 1.000 0.957 CB 1.437 25 residues pruned to eliminate duplicates Z: 173 75.283 2.260 0.599 0.563 0.924 0.663 CB 1.617 179 residues pruned to eliminate duplicates Z: 18 41.533 2.240 0.981 0.907 0.882 0.765 CA 1.828 18 residues pruned to eliminate duplicates Z: 17 24.513 2.101 0.360 0.919 1.000 0.812 CA 1.512 17 residues pruned to eliminate duplicates Z: 19 48.527 2.417 0.776 0.906 1.000 0.944 CB 1.894 19 residues pruned to eliminate duplicates Z: 21 50.100 2.241 1.250 0.950 0.950 0.750 CB 1.613 21 residues pruned to eliminate duplicates Z: 79 50.149 2.222 0.729 0.513 0.910 0.641 CB 1.604 79 residues pruned to eliminate duplicates Z: 55 48.480 2.444 0.772 0.499 0.870 0.593 CB 1.752 55 residues pruned to eliminate duplicates Z: 29 39.716 2.294 0.927 0.657 0.857 0.750 CB 1.712 29 residues pruned to eliminate duplicates Z: 34 49.991 2.348 1.079 0.625 0.939 0.788 CB 1.686 35 residues pruned to eliminate duplicates Z: 25 38.054 2.063 0.972 0.914 1.000 0.833 CB 1.350 25 residues pruned to eliminate duplicates Z: 24 38.222 2.137 0.783 0.877 0.957 0.783 CB 1.588 24 residues pruned to eliminate duplicates Z: 30 39.609 2.506 0.744 0.490 0.897 0.621 C 1.897 34 residues pruned to eliminate duplicates Z: 8 12.538 2.077 0.213 0.909 1.000 1.000 CB 1.336 8 residues pruned to eliminate duplicates Z: 24 42.072 2.125 0.771 0.948 1.000 0.957 CB 1.610 24 residues pruned to eliminate duplicates Z: 9 15.022 2.048 0.295 0.917 1.000 0.875 CB 1.413 9 residues pruned to eliminate duplicates Z: 12 40.369 2.293 1.080 0.929 1.000 0.818 CB 1.786 12 residues pruned to eliminate duplicates Z: 24 26.046 2.367 0.829 0.436 0.870 0.696 CB 1.541 24 residues pruned to eliminate duplicates Z: 16 43.049 2.431 1.170 0.923 0.867 0.733 C 1.709 16 residues pruned to eliminate duplicates Z: 37 49.766 2.362 0.831 0.672 0.889 0.722 CB 1.841 37 residues pruned to eliminate duplicates Z: 62 69.616 2.356 0.838 0.685 0.934 0.738 CB 1.858 62 residues pruned to eliminate duplicates Z: 24 37.406 2.136 0.762 0.908 1.000 0.957 CB 1.472 24 residues pruned to eliminate duplicates Z: 30 23.935 2.289 0.814 0.409 0.793 0.586 CB 1.485 30 residues pruned to eliminate duplicates Z: 19 44.870 2.185 1.106 0.922 1.000 0.889 CB 1.616 19 residues pruned to eliminate duplicates Z: 23 23.065 2.368 0.673 0.435 0.773 0.682 CB 1.717 20 residues pruned to eliminate duplicates Z: 8 15.371 2.165 0.835 0.648 0.714 0.714 CB 1.783 8 residues pruned to eliminate duplicates Z: 63 58.094 2.360 0.664 0.642 0.935 0.726 CB 1.759 63 residues pruned to eliminate duplicates Z: 16 47.192 2.302 1.078 0.929 1.000 0.867 CA 1.783 16 residues pruned to eliminate duplicates Z: 9 8.918 2.311 -0.149 0.580 0.875 0.500 CA 1.696 9 residues pruned to eliminate duplicates Z: 22 19.945 2.406 0.691 0.435 0.857 0.619 CB 1.334 22 residues pruned to eliminate duplicates Z: 38 24.684 2.143 0.480 0.429 0.892 0.730 CB 1.544 38 residues pruned to eliminate duplicates Z: 7 18.654 2.393 0.420 0.870 1.000 0.667 C 1.635 7 residues pruned to eliminate duplicates Z: 19 41.932 2.187 0.884 0.923 1.000 0.889 CB 1.686 19 residues pruned to eliminate duplicates Z: 17 29.987 2.173 0.665 0.852 0.938 0.938 CA 1.634 17 residues pruned to eliminate duplicates Z: 33 41.660 2.184 0.987 0.670 0.938 0.719 CB 1.547 33 residues pruned to eliminate duplicates Z: 34 25.195 2.167 0.483 0.435 0.909 0.667 CB 1.606 34 residues pruned to eliminate duplicates Z: 12 8.177 2.281 0.198 0.191 0.909 0.455 CB 1.436 12 residues pruned to eliminate duplicates Z: 41 33.777 2.115 0.919 0.581 0.925 0.525 CB 1.316 41 residues pruned to eliminate duplicates Z: 9 23.354 2.084 0.641 0.930 1.000 1.000 CA 1.689 9 residues pruned to eliminate duplicates Z: 37 24.764 2.196 0.472 0.399 0.889 0.528 CB 1.599 37 residues pruned to eliminate duplicates Z: 29 25.682 2.454 0.729 0.417 0.821 0.536 CB 1.519 29 residues pruned to eliminate duplicates Z: 8 18.164 2.136 0.448 0.908 1.000 1.000 CA 1.576 8 residues pruned to eliminate duplicates Z: 94 52.264 2.208 0.628 0.517 0.935 0.570 CB 1.585 94 residues pruned to eliminate duplicates Z: 35 27.467 2.222 0.757 0.414 0.882 0.412 CB 1.496 35 residues pruned to eliminate duplicates Z: 7 8.585 1.822 0.862 0.622 0.833 0.667 CA 1.105 Z: 16 19.748 2.125 0.578 0.530 0.933 0.533 CB 1.583 16 residues pruned to eliminate duplicates Z: 9 16.160 2.065 0.331 0.909 1.000 1.000 CA 1.475 9 residues pruned to eliminate duplicates Z: 29 41.058 2.309 0.670 0.710 0.929 0.714 CB 1.791 29 residues pruned to eliminate duplicates Z: 17 35.567 2.232 0.800 0.872 0.938 0.812 CA 1.721 17 residues pruned to eliminate duplicates Z: 24 43.452 2.097 0.943 0.906 1.000 0.826 CB 1.581 24 residues pruned to eliminate duplicates Z: 7 12.239 2.046 1.217 0.594 1.000 0.500 CB 1.006 Z: 100 55.632 2.245 0.597 0.536 0.909 0.616 CB 1.655 100 residues pruned to eliminate duplicates Z: 8 6.457 1.813 0.621 0.408 0.714 0.714 C 1.280 8 residues pruned to eliminate duplicates Z: 37 26.048 2.161 0.411 0.455 0.889 0.722 CB 1.677 37 residues pruned to eliminate duplicates Z: 21 38.219 2.138 1.106 0.886 0.950 0.750 CB 1.441 21 residues pruned to eliminate duplicates Z: 18 49.633 2.288 1.104 0.930 0.941 0.706 CB 1.857 18 residues pruned to eliminate duplicates Z: 18 49.303 2.445 0.855 0.938 1.000 0.824 C 1.833 18 residues pruned to eliminate duplicates Z: 8 9.451 1.750 0.521 0.763 1.000 0.571 CB 1.063 8 residues pruned to eliminate duplicates Z: 19 48.452 2.270 1.032 0.951 1.000 0.722 CB 1.706 19 residues pruned to eliminate duplicates Z: 24 39.493 2.138 0.930 0.924 1.000 0.957 CB 1.402 24 residues pruned to eliminate duplicates Z: 22 21.296 2.324 0.891 0.420 0.857 0.667 CB 1.340 22 residues pruned to eliminate duplicates Z: 6 8.212 1.872 0.507 0.837 1.000 1.000 CA 0.974 6 residues pruned to eliminate duplicates Z: 21 49.579 2.221 1.226 0.935 1.000 0.550 CB 1.563 21 residues pruned to eliminate duplicates Z: 16 36.936 2.184 0.861 0.927 1.000 0.867 CA 1.644 16 residues pruned to eliminate duplicates Z: 71 52.939 2.268 0.711 0.551 0.914 0.714 CB 1.697 71 residues pruned to eliminate duplicates Z: 18 35.929 2.186 0.619 0.909 1.000 0.941 CB 1.748 19 residues pruned to eliminate duplicates Z: 17 32.532 2.222 0.695 0.889 0.938 0.938 CA 1.657 17 residues pruned to eliminate duplicates Z: 18 29.412 2.096 0.709 0.836 1.000 0.588 C 1.491 18 residues pruned to eliminate duplicates Z: 23 17.136 2.092 0.662 0.383 0.864 0.591 CB 1.378 23 residues pruned to eliminate duplicates Z: 19 37.172 2.191 0.876 0.931 0.889 0.833 CB 1.675 19 residues pruned to eliminate duplicates Z: 14 17.444 2.028 0.814 0.488 0.923 0.538 CB 1.442 13 residues pruned to eliminate duplicates Z: 9 9.979 1.946 0.160 0.800 0.875 0.875 CA 1.374 9 residues pruned to eliminate duplicates Z: 8 6.429 2.002 0.591 0.249 0.857 0.571 CB 1.189 8 residues pruned to eliminate duplicates Z: 17 27.173 2.171 0.630 0.799 0.938 0.875 CA 1.576 17 residues pruned to eliminate duplicates Z: 6 4.749 1.646 -0.003 0.838 0.800 0.800 CB 1.209 6 residues pruned to eliminate duplicates Z: 26 17.702 2.273 0.641 0.402 0.760 0.680 CB 1.384 26 residues pruned to eliminate duplicates Z: 36 55.544 2.311 0.994 0.691 0.971 0.686 CB 1.761 36 residues pruned to eliminate duplicates Z: 15 35.220 2.307 0.599 0.923 1.000 0.857 CA 1.792 15 residues pruned to eliminate duplicates Z: 29 45.223 2.351 0.915 0.609 0.929 0.679 CB 1.844 29 residues pruned to eliminate duplicates Z: 16 27.989 2.194 0.437 0.939 1.000 1.000 CA 1.593 16 residues pruned to eliminate duplicates Z: 95 52.465 2.201 0.684 0.530 0.904 0.585 CB 1.566 95 residues pruned to eliminate duplicates Z: 9 11.333 1.879 0.580 0.692 0.875 0.875 CA 1.294 8 residues pruned to eliminate duplicates Z: 41 33.161 2.242 0.746 0.482 0.900 0.575 CB 1.515 38 residues pruned to eliminate duplicates Z: 21 38.407 2.274 0.702 0.934 1.000 0.750 CB 1.548 21 residues pruned to eliminate duplicates Z: 17 15.445 2.338 0.541 0.444 0.750 0.625 CB 1.514 17 residues pruned to eliminate duplicates Z: 6 8.253 1.803 0.446 0.775 1.000 0.800 CA 1.111 6 residues pruned to eliminate duplicates Z: 13 27.469 2.409 0.968 0.562 0.917 0.583 CB 1.718 13 residues pruned to eliminate duplicates Z: 17 33.343 2.182 0.698 0.915 1.000 0.938 CA 1.591 17 residues pruned to eliminate duplicates Z: 6 9.881 1.897 0.287 0.841 1.000 0.600 CB 1.350 6 residues pruned to eliminate duplicates Z: 16 38.005 2.287 0.852 0.924 0.933 0.933 CB 1.744 16 residues pruned to eliminate duplicates Z: 40 39.170 2.157 0.709 0.648 0.923 0.692 CB 1.605 40 residues pruned to eliminate duplicates Z: 8 36.917 2.429 1.227 0.887 1.000 0.571 C 1.860 9 residues pruned to eliminate duplicates Z: 42 51.048 2.324 0.836 0.630 0.951 0.683 CB 1.738 42 residues pruned to eliminate duplicates Z: 7 4.467 1.871 0.238 0.313 0.833 0.667 CB 1.161 7 residues pruned to eliminate duplicates Z: 50 46.812 2.182 0.855 0.633 0.918 0.694 CB 1.588 44 residues pruned to eliminate duplicates Z: 8 12.938 2.069 1.005 0.617 0.714 0.714 CB 1.478 11 residues pruned to eliminate duplicates Z: 24 47.557 2.091 1.104 0.917 1.000 0.783 CB 1.590 24 residues pruned to eliminate duplicates Z: 10 10.419 1.827 0.404 0.662 0.889 0.556 CA 1.311 10 residues pruned to eliminate duplicates Z: 35 25.812 2.198 0.471 0.430 0.941 0.588 CB 1.565 35 residues pruned to eliminate duplicates Z: 6 11.176 1.833 1.105 0.666 0.800 0.800 C 1.389 6 residues pruned to eliminate duplicates Z: 23 54.504 2.214 1.336 0.961 1.000 0.818 CB 1.538 25 residues pruned to eliminate duplicates Z: 98 54.979 2.233 0.679 0.514 0.907 0.629 CB 1.619 102 residues pruned to eliminate duplicates Z: 15 10.564 1.781 0.483 0.467 0.929 0.571 CB 1.190 14 residues pruned to eliminate duplicates Z: 24 52.626 2.130 1.400 0.955 1.000 0.696 CB 1.476 23 residues pruned to eliminate duplicates Z: 26 15.700 1.989 0.633 0.411 0.880 0.680 CB 1.206 14 residues pruned to eliminate duplicates Z: 12 14.773 2.078 0.552 0.551 0.909 0.545 CB 1.447 12 residues pruned to eliminate duplicates Z: 19 54.774 2.397 1.006 0.911 1.000 0.722 C 1.903 19 residues pruned to eliminate duplicates Z: 17 36.259 2.371 0.553 0.924 0.938 0.875 CB 1.844 17 residues pruned to eliminate duplicates Z: 18 53.089 2.297 1.115 0.945 1.000 0.941 CB 1.834 18 residues pruned to eliminate duplicates Z: 40 40.861 2.467 0.766 0.450 0.846 0.538 CB 1.870 40 residues pruned to eliminate duplicates Z: 17 18.742 1.998 0.538 0.575 1.000 0.688 CB 1.418 16 residues pruned to eliminate duplicates Z: 45 40.442 2.299 0.622 0.558 0.932 0.614 CB 1.657 44 residues pruned to eliminate duplicates Z: 8 11.786 2.062 0.485 0.603 0.857 0.714 CB 1.538 8 residues pruned to eliminate duplicates Z: 43 27.424 2.258 0.595 0.447 0.857 0.500 CB 1.449 43 residues pruned to eliminate duplicates Z: 12 15.252 2.203 0.443 0.519 0.909 0.636 CB 1.562 12 residues pruned to eliminate duplicates Z: 17 36.652 2.063 0.996 0.946 1.000 0.625 CA 1.539 17 residues pruned to eliminate duplicates Z: 30 50.248 2.259 0.934 0.773 1.000 0.724 CB 1.677 30 residues pruned to eliminate duplicates Z: 17 47.287 2.453 0.871 0.919 1.000 0.688 C 1.816 17 residues pruned to eliminate duplicates Z: 8 22.418 2.157 0.694 0.918 1.000 0.857 CA 1.634 8 residues pruned to eliminate duplicates Z: 6 9.916 1.907 0.178 0.874 1.000 0.600 CB 1.436 6 residues pruned to eliminate duplicates Z: 25 35.950 2.065 0.726 0.870 1.000 0.875 CB 1.502 25 residues pruned to eliminate duplicates Z: 14 33.198 2.371 0.762 0.869 0.923 0.923 C 1.744 14 residues pruned to eliminate duplicates Z: 39 59.109 2.318 0.983 0.663 1.000 0.737 CB 1.794 36 residues pruned to eliminate duplicates Z: 15 54.320 2.443 1.135 0.943 1.000 0.857 CA 1.929 15 residues pruned to eliminate duplicates Z: 8 20.265 2.156 0.548 0.917 1.000 1.000 CB 1.621 8 residues pruned to eliminate duplicates Z: 42 54.483 2.305 1.020 0.646 0.927 0.610 CB 1.719 42 residues pruned to eliminate duplicates Z: 94 55.323 2.261 0.641 0.543 0.903 0.710 CB 1.641 94 residues pruned to eliminate duplicates Z: 24 48.950 2.156 1.326 0.931 1.000 0.826 CB 1.422 24 residues pruned to eliminate duplicates Z: 10 5.887 1.747 -0.069 0.759 0.889 0.778 CB 1.078 Z: 6 7.521 1.835 0.659 0.734 0.800 0.600 CA 1.119 6 residues pruned to eliminate duplicates Z: 18 35.666 2.251 0.557 0.926 1.000 0.824 CB 1.730 18 residues pruned to eliminate duplicates Z: 7 9.616 1.884 0.306 0.745 1.000 0.333 CB 1.282 7 residues pruned to eliminate duplicates Z: 35 18.448 2.086 0.346 0.443 0.824 0.706 CB 1.450 35 residues pruned to eliminate duplicates Z: 10 8.242 1.753 0.116 0.772 1.000 0.778 CB 1.105 10 residues pruned to eliminate duplicates Z: 14 36.308 2.406 0.832 0.908 0.923 0.923 C 1.757 14 residues pruned to eliminate duplicates Z: 6 8.235 1.703 0.325 0.859 1.000 0.400 CA 1.201 6 residues pruned to eliminate duplicates Z: 6 13.456 1.989 1.059 0.830 1.000 0.800 CB 1.105 6 residues pruned to eliminate duplicates Z: 8 6.415 1.969 0.156 0.382 0.857 0.571 CB 1.408 8 residues pruned to eliminate duplicates Z: 20 48.204 2.273 1.044 0.929 1.000 0.842 CB 1.667 20 residues pruned to eliminate duplicates Z: 35 47.467 2.270 0.910 0.663 0.912 0.735 CB 1.771 35 residues pruned to eliminate duplicates Z: 32 22.410 2.200 0.265 0.411 0.935 0.613 CB 1.698 32 residues pruned to eliminate duplicates Z: 51 47.508 2.342 0.769 0.602 0.900 0.660 CB 1.635 51 residues pruned to eliminate duplicates Z: 29 36.901 2.328 0.734 0.597 0.821 0.571 C 1.916 29 residues pruned to eliminate duplicates Z: 6 9.576 1.955 0.501 0.767 0.800 0.600 CB 1.439 6 residues pruned to eliminate duplicates Z: 6 9.228 1.674 0.461 0.864 1.000 0.600 CB 1.237 5 residues pruned to eliminate duplicates Z: 20 43.754 2.135 1.229 0.927 0.947 0.947 CB 1.560 20 residues pruned to eliminate duplicates Z: 7 12.415 2.024 0.487 0.713 1.000 0.833 CB 1.388 7 residues pruned to eliminate duplicates Z: 10 4.616 1.830 0.423 0.303 0.778 0.444 CB 0.947 10 residues pruned to eliminate duplicates Z: 16 32.352 2.205 0.655 0.917 1.000 0.867 CA 1.616 16 residues pruned to eliminate duplicates Z: 11 6.379 1.577 0.447 0.502 0.700 0.500 C 1.260 11 residues pruned to eliminate duplicates Z: 27 30.786 2.436 0.874 0.408 0.885 0.654 CB 1.648 27 residues pruned to eliminate duplicates Z: 25 26.083 2.284 0.720 0.528 0.875 0.542 CB 1.507 25 residues pruned to eliminate duplicates Z: 19 23.654 2.290 0.966 0.409 0.889 0.611 CB 1.533 19 residues pruned to eliminate duplicates Z: 26 37.899 2.091 0.876 0.882 0.960 0.840 CB 1.456 26 residues pruned to eliminate duplicates Z: 18 56.624 2.610 1.026 0.802 0.941 0.765 CA 2.119 18 residues pruned to eliminate duplicates Z: 13 42.992 2.249 1.072 0.930 1.000 0.583 CA 1.863 13 residues pruned to eliminate duplicates Z: 31 23.631 2.247 0.684 0.389 0.900 0.567 CB 1.425 31 residues pruned to eliminate duplicates Z: 24 42.526 2.124 0.991 0.911 1.000 0.870 CB 1.486 24 residues pruned to eliminate duplicates Z: 19 55.754 2.333 1.178 0.946 1.000 0.722 C 1.789 19 residues pruned to eliminate duplicates Z: 8 9.897 1.843 0.261 0.679 1.000 0.571 CB 1.365 9 residues pruned to eliminate duplicates Z: 18 45.729 2.311 0.849 0.943 1.000 1.000 CB 1.798 18 residues pruned to eliminate duplicates Z: 28 40.323 2.434 0.488 0.769 0.926 0.741 CB 1.823 28 residues pruned to eliminate duplicates Z: 15 15.027 2.105 0.734 0.436 0.857 0.714 CB 1.371 17 residues pruned to eliminate duplicates Z: 34 27.143 2.179 0.585 0.480 0.909 0.818 CB 1.536 34 residues pruned to eliminate duplicates Z: 18 34.369 2.149 0.709 0.912 1.000 0.765 CB 1.608 18 residues pruned to eliminate duplicates Z: 155 73.349 2.284 0.715 0.533 0.909 0.630 CB 1.607 155 residues pruned to eliminate duplicates Z: 45 25.924 1.976 0.566 0.466 0.886 0.636 CB 1.475 45 residues pruned to eliminate duplicates Z: 9 19.424 2.117 0.646 0.796 1.000 0.625 CB 1.520 9 residues pruned to eliminate duplicates Z: 19 47.167 2.130 1.178 0.899 1.000 0.722 CB 1.713 18 residues pruned to eliminate duplicates Z: 94 74.192 2.306 0.960 0.648 0.914 0.656 CB 1.623 90 residues pruned to eliminate duplicates Z: 6 10.567 1.995 0.413 0.758 1.000 0.600 CA 1.332 6 residues pruned to eliminate duplicates Z: 14 11.631 2.351 0.068 0.460 0.846 0.615 CB 1.581 14 residues pruned to eliminate duplicates Z: 14 31.254 2.094 0.814 0.867 1.000 0.769 CB 1.670 14 residues pruned to eliminate duplicates Z: 17 25.996 2.198 0.314 0.911 1.000 0.938 CA 1.595 17 residues pruned to eliminate duplicates Z: 10 10.893 2.044 0.703 0.483 0.889 0.444 CB 1.194 10 residues pruned to eliminate duplicates Z: 40 30.488 2.433 0.685 0.441 0.846 0.513 CB 1.496 40 residues pruned to eliminate duplicates Z: 19 35.885 2.196 0.646 0.911 1.000 0.944 CB 1.659 19 residues pruned to eliminate duplicates Z: 18 51.677 2.274 1.109 0.925 1.000 0.824 CB 1.835 18 residues pruned to eliminate duplicates Z: 22 43.052 2.569 0.751 0.631 1.000 0.667 C 1.847 22 residues pruned to eliminate duplicates Z: 24 35.526 2.048 0.718 0.892 1.000 0.783 CB 1.512 24 residues pruned to eliminate duplicates Z: 37 30.766 2.262 0.717 0.517 0.861 0.583 CB 1.509 37 residues pruned to eliminate duplicates Z: 8 21.680 2.151 0.647 0.922 1.000 1.000 CB 1.627 8 residues pruned to eliminate duplicates Z: 7 4.108 1.568 0.434 0.619 0.667 0.500 CB 0.999 7 residues pruned to eliminate duplicates Z: 36 36.170 2.420 0.886 0.493 0.829 0.543 CB 1.628 36 residues pruned to eliminate duplicates Z: 18 47.674 2.210 1.103 0.927 1.000 0.706 C 1.744 18 residues pruned to eliminate duplicates Z: 13 10.682 2.146 0.511 0.358 0.833 0.333 CB 1.330 13 residues pruned to eliminate duplicates Z: 10 9.357 2.215 0.388 0.247 0.889 0.556 CA 1.528 10 residues pruned to eliminate duplicates Z: 19 26.396 2.398 -0.003 0.954 1.000 1.000 CB 1.790 19 residues pruned to eliminate duplicates Z: 38 42.911 2.300 0.688 0.660 0.946 0.784 CB 1.655 38 residues pruned to eliminate duplicates Z: 34 49.163 2.209 0.875 0.719 0.970 0.727 C 1.747 34 residues pruned to eliminate duplicates Z: 7 9.057 1.721 0.417 0.860 1.000 0.667 CB 1.114 7 residues pruned to eliminate duplicates Z: 32 24.779 1.923 0.677 0.632 0.903 0.774 CB 1.349 32 residues pruned to eliminate duplicates Z: 10 21.595 2.037 0.711 0.842 1.000 0.667 CB 1.539 10 residues pruned to eliminate duplicates Z: 19 47.143 2.194 1.112 0.934 1.000 0.833 CB 1.673 19 residues pruned to eliminate duplicates Z: 71 50.408 2.184 0.791 0.612 0.929 0.729 CB 1.491 71 residues pruned to eliminate duplicates Z: 12 3.684 1.679 0.291 0.287 0.545 0.364 CB 1.193 12 residues pruned to eliminate duplicates Z: 24 38.473 2.314 0.845 0.613 0.913 0.652 C 1.849 24 residues pruned to eliminate duplicates Z: 30 37.375 2.234 0.920 0.668 0.931 0.724 CB 1.488 30 residues pruned to eliminate duplicates Z: 21 19.319 2.317 0.639 0.461 0.750 0.650 CB 1.579 21 residues pruned to eliminate duplicates Z: 19 36.170 2.219 0.599 0.912 1.000 1.000 CB 1.702 19 residues pruned to eliminate duplicates Z: 8 11.175 1.851 0.548 0.690 1.000 0.857 CA 1.238 8 residues pruned to eliminate duplicates Z: 9 3.696 2.051 0.024 0.297 0.625 0.250 CB 1.249 9 residues pruned to eliminate duplicates Z: 6 6.133 1.549 0.243 0.578 1.000 0.600 N 1.322 Z: 56 51.136 2.349 0.733 0.587 0.891 0.691 CB 1.750 56 residues pruned to eliminate duplicates Z: 18 46.730 2.243 1.093 0.934 1.000 0.941 CB 1.684 18 residues pruned to eliminate duplicates Z: 19 35.638 2.203 0.670 0.908 0.944 0.889 CB 1.717 19 residues pruned to eliminate duplicates Z: 19 44.593 2.199 0.978 0.940 1.000 0.944 CB 1.678 19 residues pruned to eliminate duplicates Z: 18 46.389 2.296 0.957 0.927 1.000 0.824 CB 1.755 18 residues pruned to eliminate duplicates Z: 8 7.061 1.847 0.477 0.316 0.857 0.571 CB 1.400 8 residues pruned to eliminate duplicates Z: 9 9.173 2.090 0.615 0.373 0.750 0.625 CB 1.467 9 residues pruned to eliminate duplicates Z: 37 53.463 2.442 1.108 0.652 0.833 0.667 CB 1.803 37 residues pruned to eliminate duplicates Z: 50 57.149 2.218 1.084 0.746 0.939 0.673 CB 1.510 50 residues pruned to eliminate duplicates Z: 25 24.452 2.396 0.560 0.474 0.792 0.500 CB 1.731 25 residues pruned to eliminate duplicates Z: 25 40.933 2.262 0.656 0.751 0.958 0.792 CB 1.860 25 residues pruned to eliminate duplicates Z: 6 7.506 2.014 0.072 0.855 1.000 1.000 CA 1.148 6 residues pruned to eliminate duplicates Z: 8 25.562 2.379 0.651 0.906 1.000 1.000 CB 1.750 8 residues pruned to eliminate duplicates Z: 27 50.304 2.279 0.902 0.730 1.000 0.846 CA 1.850 27 residues pruned to eliminate duplicates Z: 22 22.372 2.398 0.582 0.398 0.810 0.619 CB 1.771 22 residues pruned to eliminate duplicates Z: 67 44.324 2.214 0.563 0.638 0.909 0.727 CB 1.524 67 residues pruned to eliminate duplicates Z: 28 43.346 2.396 0.519 0.752 0.963 0.778 CB 1.900 28 residues pruned to eliminate duplicates Z: 24 44.998 2.164 1.210 0.927 0.957 0.870 CB 1.438 24 residues pruned to eliminate duplicates Z: 29 49.974 2.288 0.859 0.760 0.964 0.821 CB 1.827 29 residues pruned to eliminate duplicates Z: 25 44.847 2.284 0.883 0.758 0.917 0.750 CB 1.845 25 residues pruned to eliminate duplicates Z: 10 7.115 1.761 0.913 0.457 0.667 0.667 CB 1.104 10 residues pruned to eliminate duplicates Z: 9 23.710 2.198 0.908 0.841 1.000 0.625 CB 1.490 9 residues pruned to eliminate duplicates Z: 48 51.373 2.333 0.895 0.572 0.894 0.617 CB 1.770 48 residues pruned to eliminate duplicates Z: 7 9.630 1.848 0.952 0.502 0.833 0.500 CA 1.305 7 residues pruned to eliminate duplicates Z: 6 5.268 1.387 0.670 0.725 1.000 0.600 CB 0.831 Z: 7 11.836 2.008 0.327 0.718 1.000 0.833 CB 1.489 8 residues pruned to eliminate duplicates Z: 36 45.000 2.326 0.805 0.698 0.829 0.686 CB 1.825 36 residues pruned to eliminate duplicates Z: 15 27.814 2.461 0.557 0.626 0.929 0.857 C 1.855 15 residues pruned to eliminate duplicates Z: 8 20.033 2.105 0.665 0.909 1.000 0.857 CB 1.533 8 residues pruned to eliminate duplicates Z: 22 24.202 2.381 0.614 0.458 0.857 0.667 CB 1.673 22 residues pruned to eliminate duplicates Z: 51 39.125 2.232 0.637 0.479 0.900 0.700 CB 1.720 51 residues pruned to eliminate duplicates Z: 16 29.300 2.233 0.809 0.607 0.933 0.800 C 1.812 16 residues pruned to eliminate duplicates Z: 29 29.519 2.141 0.666 0.531 0.964 0.679 CB 1.573 29 residues pruned to eliminate duplicates Z: 11 17.774 2.198 0.986 0.670 0.900 0.700 CB 1.222 11 residues pruned to eliminate duplicates Z: 18 21.370 2.230 0.545 0.577 0.882 0.353 CB 1.583 18 residues pruned to eliminate duplicates Z: 14 35.214 2.487 0.862 0.910 0.846 0.615 C 1.768 14 residues pruned to eliminate duplicates Z: 34 50.151 2.300 1.107 0.635 0.939 0.667 CB 1.689 34 residues pruned to eliminate duplicates Z: 10 27.307 2.201 1.143 0.747 0.889 0.889 CB 1.742 10 residues pruned to eliminate duplicates Z: 16 53.366 2.411 1.263 0.938 0.933 0.867 CA 1.882 16 residues pruned to eliminate duplicates Z: 28 43.137 2.424 0.815 0.645 0.963 0.778 CB 1.710 28 residues pruned to eliminate duplicates Z: 21 30.904 2.214 0.585 0.926 0.950 0.850 CB 1.454 21 residues pruned to eliminate duplicates Z: 29 41.046 2.105 1.217 0.775 0.964 0.643 CB 1.353 29 residues pruned to eliminate duplicates Z: 20 39.189 2.377 0.507 0.946 1.000 0.842 CB 1.737 20 residues pruned to eliminate duplicates Z: 43 53.513 2.302 0.872 0.620 0.929 0.643 C 1.842 43 residues pruned to eliminate duplicates Z: 10 16.004 2.627 0.451 0.371 0.889 0.778 CB 1.806 10 residues pruned to eliminate duplicates Z: 19 31.480 2.237 0.950 0.584 0.889 0.667 CB 1.765 19 residues pruned to eliminate duplicates Z: 6 2.425 1.464 0.232 0.341 0.800 0.400 CB 0.893 6 1.778 1.251 0.093 0.441 0.800 0.600 C 0.772 ? Z: 66 61.072 2.381 0.700 0.623 0.938 0.692 CB 1.776 66 residues pruned to eliminate duplicates Z: 24 46.549 2.112 1.248 0.936 1.000 0.870 CB 1.424 24 residues pruned to eliminate duplicates Z: 18 46.852 2.259 1.060 0.943 0.941 0.824 CB 1.799 18 residues pruned to eliminate duplicates Z: 13 13.115 1.913 0.632 0.485 0.917 0.583 CB 1.343 13 residues pruned to eliminate duplicates Z: 24 21.620 2.115 0.407 0.557 0.913 0.696 CB 1.570 24 residues pruned to eliminate duplicates Z: 20 30.994 2.237 0.513 0.921 1.000 0.842 CB 1.479 20 residues pruned to eliminate duplicates Z: 36 20.450 2.162 0.497 0.428 0.800 0.486 CB 1.438 36 residues pruned to eliminate duplicates Z: 17 55.681 2.323 1.237 0.948 1.000 0.812 CB 1.851 17 residues pruned to eliminate duplicates Z: 41 33.889 2.412 0.718 0.417 0.850 0.525 CB 1.660 41 residues pruned to eliminate duplicates Z: 6 6.241 1.728 0.487 0.794 1.000 0.800 N 0.839 Z: 29 27.334 2.341 0.885 0.451 0.821 0.607 CB 1.498 29 residues pruned to eliminate duplicates Z: 7 21.398 2.582 0.980 0.359 1.000 0.833 CA 1.990 7 residues pruned to eliminate duplicates Z: 25 25.162 2.251 0.528 0.463 0.917 0.583 CB 1.692 25 residues pruned to eliminate duplicates Z: 17 17.037 2.405 0.320 0.502 0.812 0.375 CB 1.648 17 residues pruned to eliminate duplicates Z: 8 28.414 2.466 0.771 0.896 1.000 1.000 C 1.762 8 residues pruned to eliminate duplicates Z: 36 51.380 2.238 1.082 0.691 0.914 0.600 CB 1.711 36 residues pruned to eliminate duplicates Z: 7 9.793 1.715 0.520 0.775 1.000 0.500 CB 1.204 7 residues pruned to eliminate duplicates Z: 46 32.084 2.370 0.631 0.431 0.822 0.511 CB 1.617 46 residues pruned to eliminate duplicates Z: 13 18.742 2.175 0.666 0.576 0.917 0.667 CB 1.514 16 residues pruned to eliminate duplicates Z: 7 9.515 1.696 0.786 0.794 1.000 0.500 CB 0.991 7 residues pruned to eliminate duplicates Z: 31 48.301 2.332 0.786 0.694 0.967 0.767 CB 1.834 31 residues pruned to eliminate duplicates Z: 20 44.338 2.625 1.020 0.616 0.947 0.684 C 1.814 20 residues pruned to eliminate duplicates Z: 9 21.500 2.063 0.748 0.927 1.000 1.000 CA 1.477 9 residues pruned to eliminate duplicates Z: 7 9.346 2.036 0.224 0.559 1.000 0.500 CB 1.446 7 residues pruned to eliminate duplicates Z: 60 58.893 2.342 0.664 0.659 0.932 0.695 CB 1.820 60 residues pruned to eliminate duplicates Z: 66 50.681 2.436 0.756 0.495 0.831 0.554 CB 1.779 66 residues pruned to eliminate duplicates Z: 10 18.746 2.163 0.607 0.791 0.889 0.444 C 1.566 10 residues pruned to eliminate duplicates Z: 20 33.457 2.069 0.856 0.955 1.000 0.947 CB 1.374 20 residues pruned to eliminate duplicates Z: 105 85.121 2.330 0.778 0.682 0.933 0.760 CB 1.828 105 residues pruned to eliminate duplicates Z: 24 35.975 2.080 0.640 0.909 1.000 0.913 CB 1.559 24 residues pruned to eliminate duplicates Z: 62 55.046 2.301 0.613 0.642 0.951 0.705 CB 1.748 62 residues pruned to eliminate duplicates Z: 10 9.537 1.793 0.593 0.518 0.889 0.667 CB 1.230 10 residues pruned to eliminate duplicates Z: 6 6.609 1.701 0.361 0.533 1.000 0.600 C 1.236 6 residues pruned to eliminate duplicates Z: 7 7.285 1.643 0.307 0.803 1.000 0.500 CB 1.064 7 residues pruned to eliminate duplicates Z: 43 48.837 2.368 0.634 0.624 0.952 0.738 CB 1.818 43 residues pruned to eliminate duplicates Z: 8 5.325 1.750 0.147 0.335 1.000 0.857 CA 1.202 8 residues pruned to eliminate duplicates Z: 19 28.720 2.146 0.613 0.679 0.944 0.778 CA 1.756 19 residues pruned to eliminate duplicates Z: 34 28.992 2.329 0.666 0.431 0.939 0.606 CB 1.487 34 residues pruned to eliminate duplicates Z: 108 69.808 2.223 0.891 0.647 0.935 0.738 CB 1.497 108 residues pruned to eliminate duplicates Z: 23 39.590 2.128 1.150 0.907 1.000 0.773 CB 1.311 23 residues pruned to eliminate duplicates Z: 22 20.232 2.191 0.707 0.482 0.810 0.714 CB 1.485 22 residues pruned to eliminate duplicates Z: 32 25.577 2.314 0.667 0.402 0.871 0.484 CB 1.515 32 residues pruned to eliminate duplicates Z: 32 27.279 2.204 0.500 0.447 0.935 0.645 CB 1.672 32 residues pruned to eliminate duplicates Z: 6 4.208 1.669 -0.140 0.711 1.000 0.800 N 1.083 Z: 7 9.595 1.757 0.409 0.795 1.000 0.833 CB 1.222 7 residues pruned to eliminate duplicates Z: 14 9.598 1.943 0.627 0.380 0.846 0.769 CB 1.131 14 residues pruned to eliminate duplicates Z: 18 8.177 1.689 0.135 0.424 0.882 0.647 CB 1.269 18 residues pruned to eliminate duplicates Z: 9 10.138 2.380 0.201 0.312 0.875 0.625 CB 1.765 9 residues pruned to eliminate duplicates Z: 29 33.114 2.393 0.701 0.502 0.857 0.607 C 1.789 29 residues pruned to eliminate duplicates Z: 7 7.502 1.817 0.232 0.732 1.000 0.667 CA 1.110 7 residues pruned to eliminate duplicates Z: 17 43.239 2.565 0.873 0.705 1.000 0.750 C 1.867 17 residues pruned to eliminate duplicates Z: 8 4.012 1.420 -0.085 0.822 0.857 0.714 CA 1.030 8 residues pruned to eliminate duplicates Z: 51 44.234 2.422 0.803 0.455 0.880 0.500 CB 1.704 51 residues pruned to eliminate duplicates Z: 28 27.081 2.136 0.546 0.470 0.926 0.667 CB 1.756 28 residues pruned to eliminate duplicates Z: 8 12.203 1.776 0.455 0.744 1.000 0.286 CB 1.435 8 residues pruned to eliminate duplicates Z: 13 27.230 2.577 0.592 0.531 0.917 0.583 CB 2.026 13 residues pruned to eliminate duplicates Z: 20 63.549 2.363 1.355 0.952 1.000 0.684 C 1.804 20 residues pruned to eliminate duplicates Z: 35 41.389 2.025 1.128 0.711 0.971 0.676 CB 1.402 35 residues pruned to eliminate duplicates Z: 105 66.168 2.239 0.909 0.607 0.923 0.615 CB 1.485 105 residues pruned to eliminate duplicates Z: 30 17.762 2.053 0.855 0.454 0.828 0.552 CB 1.097 36 residues pruned to eliminate duplicates Z: 16 49.398 2.420 1.068 0.928 1.000 0.800 C 1.784 16 residues pruned to eliminate duplicates Z: 17 35.072 2.433 0.437 0.892 0.938 0.812 CB 1.920 17 residues pruned to eliminate duplicates Z: 10 6.565 1.651 0.410 0.289 0.889 0.333 C 1.340 10 residues pruned to eliminate duplicates Z: 19 23.421 2.439 0.542 0.391 0.889 0.556 C 1.852 19 residues pruned to eliminate duplicates Z: 8 26.688 2.445 0.795 0.805 1.000 0.714 C 1.761 8 residues pruned to eliminate duplicates Z: 26 23.297 2.139 0.405 0.509 0.920 0.600 CB 1.671 26 residues pruned to eliminate duplicates Z: 9 10.181 1.854 0.708 0.595 1.000 0.625 CA 1.038 9 residues pruned to eliminate duplicates Z: 24 20.439 2.301 0.566 0.459 0.826 0.609 CB 1.493 24 residues pruned to eliminate duplicates Z: 15 26.838 2.632 0.453 0.475 0.929 0.714 CA 2.071 15 residues pruned to eliminate duplicates Z: 39 48.558 2.210 0.881 0.688 0.947 0.737 CB 1.684 39 residues pruned to eliminate duplicates Z: 14 39.098 2.435 1.169 0.600 1.000 0.692 C 1.867 14 residues pruned to eliminate duplicates Z: 29 37.160 2.275 0.899 0.608 0.929 0.714 CB 1.580 29 residues pruned to eliminate duplicates Z: 12 11.633 1.915 0.436 0.467 0.818 0.636 C 1.612 12 residues pruned to eliminate duplicates Z: 11 18.864 2.232 0.584 0.616 0.900 0.600 C 1.680 11 residues pruned to eliminate duplicates Z: 58 52.569 2.441 0.827 0.492 0.895 0.526 CB 1.759 58 residues pruned to eliminate duplicates Z: 33 25.910 2.221 0.585 0.456 0.875 0.625 CB 1.554 38 residues pruned to eliminate duplicates Z: 8 13.490 1.897 0.278 0.802 1.000 0.857 CA 1.616 8 residues pruned to eliminate duplicates Z: 23 30.272 2.195 1.027 0.638 0.955 0.773 CB 1.335 23 residues pruned to eliminate duplicates Z: 71 54.307 2.252 0.618 0.629 0.986 0.729 CB 1.601 71 residues pruned to eliminate duplicates Z: 18 34.809 2.488 0.811 0.547 0.882 0.588 CB 2.028 18 residues pruned to eliminate duplicates Z: 23 51.676 2.183 1.310 0.956 1.000 0.591 CB 1.500 23 residues pruned to eliminate duplicates Z: 7 6.143 1.401 0.448 0.735 1.000 0.500 C 1.001 5 residues pruned to eliminate duplicates Z: 57 47.217 2.257 0.497 0.697 0.982 0.804 CB 1.588 57 residues pruned to eliminate duplicates Z: 17 21.029 2.194 0.715 0.603 0.875 0.438 CB 1.448 17 residues pruned to eliminate duplicates Z: 16 26.931 2.523 0.455 0.546 0.867 0.733 CB 2.090 16 residues pruned to eliminate duplicates Z: 21 6.922 2.067 0.249 0.194 0.600 0.400 CB 1.441 21 residues pruned to eliminate duplicates Z: 6 3.313 1.125 0.468 0.742 1.000 0.600 CB 0.722 Z: 9 5.693 1.809 0.396 0.360 0.875 0.375 CB 1.060 9 residues pruned to eliminate duplicates Z: 53 30.904 2.127 0.589 0.465 0.885 0.558 CB 1.486 53 residues pruned to eliminate duplicates Z: 14 10.114 2.015 0.461 0.346 0.769 0.769 CB 1.463 14 residues pruned to eliminate duplicates Z: 15 50.921 2.360 1.125 0.884 1.000 0.714 CA 1.961 15 residues pruned to eliminate duplicates Z: 8 11.188 1.893 0.419 0.829 1.000 0.714 CA 1.185 8 residues pruned to eliminate duplicates Z: 28 27.411 2.285 0.577 0.601 0.852 0.630 CB 1.560 28 residues pruned to eliminate duplicates Z: 18 41.772 2.198 1.076 0.916 0.941 0.529 CB 1.666 18 residues pruned to eliminate duplicates Z: 19 49.540 2.485 0.671 0.931 1.000 1.000 C 1.966 19 residues pruned to eliminate duplicates Z: 21 26.317 2.287 0.722 0.522 0.950 0.750 CB 1.539 21 residues pruned to eliminate duplicates Z: 51 50.769 2.249 0.656 0.738 0.960 0.760 CB 1.622 51 residues pruned to eliminate duplicates Z: 8 9.594 1.565 0.619 0.802 1.000 0.714 C 1.099 8 residues pruned to eliminate duplicates Z: 7 6.541 1.722 0.482 0.783 0.667 0.667 CB 1.223 7 residues pruned to eliminate duplicates Z: 18 55.269 2.283 1.220 0.941 1.000 0.765 CB 1.835 18 residues pruned to eliminate duplicates Z: 11 6.183 1.781 0.791 0.326 0.700 0.500 CB 1.061 11 residues pruned to eliminate duplicates Z: 7 12.039 2.001 0.487 0.706 1.000 0.500 CB 1.370 7 residues pruned to eliminate duplicates Z: 9 3.190 1.330 0.159 0.426 0.875 0.375 N 0.902 Z: 27 32.927 2.252 0.842 0.491 0.885 0.538 CB 1.775 27 residues pruned to eliminate duplicates Z: 36 17.211 1.956 0.379 0.430 0.857 0.486 CB 1.353 45 residues pruned to eliminate duplicates Z: 13 18.590 2.248 0.932 0.525 0.833 0.667 CB 1.447 13 residues pruned to eliminate duplicates Z: 32 25.360 2.176 0.621 0.467 0.871 0.710 CB 1.532 32 residues pruned to eliminate duplicates Z: 19 36.818 2.430 0.913 0.582 0.889 0.778 CB 1.941 19 residues pruned to eliminate duplicates Z: 68 59.220 2.238 0.813 0.670 0.955 0.716 CB 1.596 68 residues pruned to eliminate duplicates Z: 7 19.777 2.741 0.301 0.566 1.000 0.833 CA 2.125 7 residues pruned to eliminate duplicates Z: 8 4.888 1.537 0.358 0.320 1.000 0.857 CB 1.079 8 residues pruned to eliminate duplicates Z: 6 12.718 1.951 0.526 0.840 1.000 0.800 CB 1.426 6 residues pruned to eliminate duplicates Z: 56 29.198 2.208 0.432 0.430 0.855 0.582 CB 1.567 56 residues pruned to eliminate duplicates Z: 12 30.844 2.320 1.055 0.859 0.909 0.727 C 1.579 12 residues pruned to eliminate duplicates Z: 12 23.333 2.247 0.445 0.845 1.000 0.818 CB 1.611 12 residues pruned to eliminate duplicates Z: 32 20.412 2.247 0.649 0.342 0.710 0.484 C 1.657 32 residues pruned to eliminate duplicates Z: 22 50.884 2.229 1.328 0.958 0.952 0.810 CB 1.541 22 residues pruned to eliminate duplicates Z: 34 37.591 2.318 0.722 0.602 0.848 0.667 CB 1.753 34 residues pruned to eliminate duplicates Z: 40 46.792 2.564 0.693 0.503 0.872 0.564 CB 1.974 40 residues pruned to eliminate duplicates Z: 16 17.953 2.088 0.426 0.539 0.933 0.800 CA 1.605 16 residues pruned to eliminate duplicates Z: 6 10.844 1.871 0.487 0.767 1.000 0.600 CB 1.376 6 residues pruned to eliminate duplicates Z: 53 53.494 2.294 0.865 0.627 0.904 0.635 CB 1.702 53 residues pruned to eliminate duplicates Z: 33 26.144 2.240 0.513 0.472 0.875 0.656 CB 1.603 33 residues pruned to eliminate duplicates Z: 43 42.561 2.223 0.788 0.618 0.905 0.690 CB 1.633 43 residues pruned to eliminate duplicates Z: 33 34.681 2.138 0.635 0.608 0.938 0.750 CB 1.689 33 residues pruned to eliminate duplicates Z: 8 24.613 2.402 0.646 0.894 1.000 0.429 CB 1.688 8 residues pruned to eliminate duplicates Z: 20 52.801 2.381 0.974 0.957 1.000 0.947 CB 1.769 20 residues pruned to eliminate duplicates Z: 10 17.798 2.367 0.538 0.414 1.000 0.778 C 1.782 10 residues pruned to eliminate duplicates 8 1.849 1.270 -0.403 0.484 1.000 0.571 CA 0.936 ? Z: 19 33.321 2.058 0.761 0.867 1.000 0.833 CB 1.585 19 residues pruned to eliminate duplicates Z: 10 13.648 1.698 0.731 0.792 1.000 0.778 CA 1.197 10 residues pruned to eliminate duplicates Z: 13 33.776 2.562 0.848 0.588 1.000 0.667 C 1.893 13 residues pruned to eliminate duplicates Z: 25 32.430 2.047 0.984 0.857 0.958 0.792 CB 1.253 25 residues pruned to eliminate duplicates Z: 32 42.984 2.375 0.752 0.635 0.935 0.839 CB 1.747 32 residues pruned to eliminate duplicates Z: 21 8.039 1.710 0.533 0.281 0.850 0.450 CB 1.034 21 residues pruned to eliminate duplicates Z: 29 34.000 2.308 0.850 0.511 0.929 0.607 CB 1.603 31 residues pruned to eliminate duplicates Z: 17 15.048 2.223 0.291 0.477 0.938 0.500 CB 1.431 17 residues pruned to eliminate duplicates Z: 34 27.538 2.487 0.677 0.479 0.788 0.455 CB 1.491 34 residues pruned to eliminate duplicates Z: 17 11.684 2.038 0.540 0.308 0.812 0.312 CB 1.418 17 residues pruned to eliminate duplicates Z: 11 25.189 2.401 0.887 0.600 0.900 0.800 CA 1.776 11 residues pruned to eliminate duplicates Z: 8 2.032 1.478 -0.108 0.212 0.714 0.571 CB 1.146 Z: 15 30.084 2.664 0.402 0.602 0.929 0.786 C 2.103 15 residues pruned to eliminate duplicates Z: 12 18.059 2.370 0.533 0.442 0.909 0.545 CA 1.750 12 residues pruned to eliminate duplicates Z: 19 54.534 2.408 0.993 0.958 1.000 0.889 CB 1.837 19 residues pruned to eliminate duplicates Z: 7 6.221 1.785 0.600 0.255 0.833 0.333 N 1.413 7 residues pruned to eliminate duplicates Z: 56 23.668 2.047 0.406 0.415 0.818 0.473 CB 1.480 56 residues pruned to eliminate duplicates Z: 12 26.932 2.176 1.180 0.761 0.818 0.636 C 1.659 12 residues pruned to eliminate duplicates Z: 6 2.390 1.417 0.353 0.213 0.800 0.200 O 0.978 Z: 36 49.404 2.342 0.838 0.623 0.943 0.657 CB 1.832 36 residues pruned to eliminate duplicates Z: 22 37.095 2.563 0.787 0.506 0.905 0.571 C 1.942 22 residues pruned to eliminate duplicates Z: 33 25.891 2.327 0.489 0.465 0.906 0.625 CB 1.509 33 residues pruned to eliminate duplicates Z: 16 34.471 2.199 0.803 0.920 1.000 0.933 CA 1.581 16 residues pruned to eliminate duplicates Z: 31 37.985 2.272 0.633 0.707 0.933 0.700 CB 1.659 31 residues pruned to eliminate duplicates Z: 9 13.163 2.409 0.142 0.545 0.875 0.125 CA 1.850 9 residues pruned to eliminate duplicates Z: 20 26.558 2.474 0.673 0.464 0.895 0.789 CB 1.707 20 residues pruned to eliminate duplicates Z: 36 27.001 2.183 0.743 0.411 0.857 0.514 CB 1.536 36 residues pruned to eliminate duplicates Z: 12 22.665 1.956 0.784 0.883 1.000 0.818 C 1.416 12 residues pruned to eliminate duplicates Z: 12 27.909 2.254 0.833 0.744 1.000 0.909 CA 1.638 12 residues pruned to eliminate duplicates Z: 26 16.771 2.345 0.498 0.408 0.680 0.400 CB 1.546 26 residues pruned to eliminate duplicates Z: 9 14.613 1.932 0.899 0.836 0.875 0.625 CB 1.205 9 residues pruned to eliminate duplicates Z: 48 37.479 2.304 0.622 0.531 0.872 0.681 CB 1.627 48 residues pruned to eliminate duplicates Z: 9 24.423 2.148 0.757 0.840 1.000 0.750 CB 1.706 9 residues pruned to eliminate duplicates Z: 30 30.815 2.432 0.714 0.430 0.897 0.655 CB 1.647 30 residues pruned to eliminate duplicates Z: 13 42.018 2.425 0.896 0.903 1.000 0.500 C 1.881 13 residues pruned to eliminate duplicates Z: 14 28.964 2.426 0.858 0.644 0.846 0.615 CB 1.841 14 residues pruned to eliminate duplicates Z: 62 66.296 2.355 0.709 0.685 0.951 0.705 CB 1.872 62 residues pruned to eliminate duplicates Z: 11 16.554 2.172 0.630 0.522 0.900 0.700 C 1.607 11 residues pruned to eliminate duplicates Z: 36 39.694 2.284 0.609 0.584 0.914 0.686 CB 1.842 36 residues pruned to eliminate duplicates Z: 87 56.779 2.163 0.728 0.610 0.872 0.709 CB 1.692 87 residues pruned to eliminate duplicates Z: 23 48.498 2.104 1.256 0.938 0.955 0.818 CB 1.587 23 residues pruned to eliminate duplicates Z: 6 3.401 1.779 0.406 0.252 0.800 0.600 CB 1.011 6 residues pruned to eliminate duplicates Z: 6 5.641 1.886 0.175 0.497 0.800 0.400 C 1.427 6 residues pruned to eliminate duplicates Z: 41 40.323 2.457 0.703 0.466 0.850 0.425 CB 1.857 41 residues pruned to eliminate duplicates Z: 21 34.653 2.370 0.622 0.569 1.000 0.650 CA 1.885 21 residues pruned to eliminate duplicates Z: 30 29.410 2.364 0.795 0.416 0.897 0.586 CB 1.568 30 residues pruned to eliminate duplicates Z: 6 3.583 1.818 0.318 0.459 0.600 0.600 CB 1.162 Using tripeptides from previous cycle as seeds Z: 11 10.401 1.640 0.502 0.718 1.000 0.600 CB 1.096 8 residues pruned to eliminate duplicates Z: 11 13.471 1.712 0.535 0.764 1.000 0.400 CB 1.283 11 residues pruned to eliminate duplicates Z: 8 9.598 1.607 0.655 0.869 0.857 0.714 C 1.163 8 residues pruned to eliminate duplicates Z: 13 11.663 2.081 0.616 0.324 0.833 0.500 CB 1.459 13 residues pruned to eliminate duplicates Z: 13 16.473 2.118 0.705 0.434 0.917 0.333 CB 1.537 13 residues pruned to eliminate duplicates Z: 12 8.425 1.880 0.570 0.371 0.727 0.545 CB 1.359 12 residues pruned to eliminate duplicates Z: 15 13.133 2.026 0.528 0.386 0.857 0.571 CB 1.492 15 residues pruned to eliminate duplicates Z: 16 12.698 1.921 0.302 0.536 0.867 0.533 CB 1.460 16 residues pruned to eliminate duplicates Z: 12 16.530 2.021 0.604 0.518 1.000 0.636 CB 1.509 12 residues pruned to eliminate duplicates Z: 16 14.810 1.894 0.544 0.434 1.000 0.533 CB 1.401 16 residues pruned to eliminate duplicates Z: 6 5.827 1.767 0.574 0.405 0.800 0.800 CA 1.294 6 residues pruned to eliminate duplicates Z: 17 18.646 2.015 0.572 0.473 0.938 0.562 CB 1.613 17 residues pruned to eliminate duplicates Z: 33 28.668 2.285 0.829 0.406 0.875 0.469 CB 1.529 33 residues pruned to eliminate duplicates Z: 29 28.579 2.425 0.738 0.424 0.857 0.571 CB 1.618 29 residues pruned to eliminate duplicates Z: 36 34.581 2.425 0.760 0.452 0.857 0.371 CB 1.677 36 residues pruned to eliminate duplicates Z: 28 29.664 2.399 0.754 0.464 0.852 0.519 CB 1.653 28 residues pruned to eliminate duplicates Z: 11 12.793 2.217 0.541 0.318 0.800 0.600 CB 1.809 11 residues pruned to eliminate duplicates Z: 21 24.748 2.393 0.831 0.431 0.950 0.650 CB 1.427 21 residues pruned to eliminate duplicates Z: 55 48.377 2.437 0.932 0.409 0.870 0.481 CB 1.768 55 residues pruned to eliminate duplicates Z: 31 28.674 2.348 0.824 0.463 0.833 0.533 CB 1.523 31 residues pruned to eliminate duplicates Z: 31 29.226 2.426 0.817 0.469 0.867 0.467 CB 1.441 31 residues pruned to eliminate duplicates Z: 29 31.465 2.478 0.685 0.461 0.929 0.500 CB 1.596 29 residues pruned to eliminate duplicates Z: 32 34.221 2.404 0.802 0.471 0.903 0.548 CB 1.618 32 residues pruned to eliminate duplicates Z: 33 31.195 2.391 0.731 0.464 0.875 0.562 CB 1.580 33 residues pruned to eliminate duplicates Z: 29 28.147 2.409 0.768 0.436 0.857 0.536 CB 1.557 29 residues pruned to eliminate duplicates Z: 21 22.692 2.294 0.827 0.394 0.900 0.350 CB 1.505 21 residues pruned to eliminate duplicates Z: 39 32.990 2.427 0.852 0.423 0.816 0.421 CB 1.581 39 residues pruned to eliminate duplicates Z: 31 29.968 2.305 0.779 0.436 0.867 0.500 CB 1.645 31 residues pruned to eliminate duplicates Z: 71 37.474 2.216 0.603 0.473 0.814 0.614 CB 1.591 71 residues pruned to eliminate duplicates Z: 36 34.528 2.486 0.702 0.443 0.857 0.486 CB 1.706 36 residues pruned to eliminate duplicates Z: 32 29.721 2.401 0.782 0.451 0.839 0.419 CB 1.564 32 residues pruned to eliminate duplicates Z: 30 30.556 2.455 0.788 0.443 0.862 0.517 CB 1.590 30 residues pruned to eliminate duplicates Z: 26 27.075 2.350 0.751 0.440 0.760 0.400 CB 1.841 26 residues pruned to eliminate duplicates Z: 16 10.994 2.184 0.193 0.368 0.800 0.333 CB 1.569 16 residues pruned to eliminate duplicates Z: 33 24.583 2.353 0.671 0.412 0.812 0.500 CB 1.491 33 residues pruned to eliminate duplicates Z: 31 30.712 2.444 0.697 0.476 0.867 0.500 CB 1.598 31 residues pruned to eliminate duplicates Z: 30 27.955 2.464 0.657 0.472 0.793 0.483 CB 1.650 30 residues pruned to eliminate duplicates Z: 41 32.166 2.358 0.629 0.483 0.850 0.500 CB 1.585 41 residues pruned to eliminate duplicates Z: 18 19.861 2.322 0.432 0.482 0.882 0.412 CB 1.672 18 residues pruned to eliminate duplicates Z: 41 31.994 2.410 0.721 0.392 0.825 0.450 CB 1.658 41 residues pruned to eliminate duplicates Z: 39 35.543 2.478 0.840 0.421 0.842 0.421 CB 1.632 39 residues pruned to eliminate duplicates Z: 9 8.423 2.219 0.778 0.113 0.875 0.250 CB 1.407 9 residues pruned to eliminate duplicates Z: 39 33.183 2.451 0.719 0.399 0.868 0.500 CB 1.637 39 residues pruned to eliminate duplicates Z: 9 9.635 2.226 0.562 0.141 0.875 0.250 CB 1.746 9 residues pruned to eliminate duplicates Z: 58 54.882 2.513 0.917 0.464 0.860 0.509 CB 1.821 58 residues pruned to eliminate duplicates Z: 61 47.457 2.463 0.763 0.455 0.850 0.533 CB 1.738 61 residues pruned to eliminate duplicates Z: 76 69.620 2.532 0.855 0.505 0.880 0.573 CB 1.935 76 residues pruned to eliminate duplicates Z: 58 54.042 2.545 0.835 0.460 0.860 0.561 CB 1.857 58 residues pruned to eliminate duplicates Z: 19 34.790 2.559 0.689 0.620 0.889 0.778 C 1.904 19 residues pruned to eliminate duplicates Z: 58 57.339 2.541 0.874 0.468 0.877 0.596 CB 1.879 58 residues pruned to eliminate duplicates Z: 26 39.234 2.504 0.959 0.452 0.840 0.560 CB 1.999 26 residues pruned to eliminate duplicates Z: 25 35.737 2.458 0.759 0.496 0.958 0.583 C 1.767 25 residues pruned to eliminate duplicates Z: 23 38.878 2.602 0.809 0.547 0.864 0.682 C 1.948 23 residues pruned to eliminate duplicates Z: 24 47.397 2.519 1.017 0.540 1.000 0.696 C 1.871 24 residues pruned to eliminate duplicates Z: 59 54.109 2.526 0.799 0.479 0.879 0.534 CB 1.816 59 residues pruned to eliminate duplicates Z: 25 30.616 2.325 0.697 0.507 0.875 0.667 CB 1.797 25 residues pruned to eliminate duplicates Z: 58 51.073 2.560 0.827 0.476 0.807 0.544 CB 1.836 58 residues pruned to eliminate duplicates Z: 24 39.277 2.504 0.778 0.534 0.957 0.696 C 1.859 24 residues pruned to eliminate duplicates Z: 55 51.360 2.525 0.856 0.467 0.870 0.556 CB 1.773 55 residues pruned to eliminate duplicates Z: 27 45.455 2.580 0.985 0.478 0.885 0.538 CB 2.012 27 residues pruned to eliminate duplicates Z: 59 56.159 2.498 0.865 0.468 0.879 0.500 CB 1.859 59 residues pruned to eliminate duplicates Z: 74 53.739 2.427 0.732 0.460 0.904 0.493 CB 1.723 74 residues pruned to eliminate duplicates Z: 60 49.850 2.501 0.802 0.453 0.831 0.525 CB 1.819 60 residues pruned to eliminate duplicates Z: 25 34.992 2.411 0.804 0.560 0.875 0.667 C 1.771 25 residues pruned to eliminate duplicates Z: 58 54.942 2.540 0.818 0.465 0.877 0.509 CB 1.862 58 residues pruned to eliminate duplicates Z: 26 35.334 2.429 0.867 0.501 0.920 0.640 C 1.692 26 residues pruned to eliminate duplicates Z: 49 60.828 2.443 0.893 0.587 0.896 0.583 C 1.948 48 residues pruned to eliminate duplicates Z: 7 10.928 2.181 0.806 0.424 0.833 0.333 CA 1.472 7 residues pruned to eliminate duplicates Z: 22 55.598 2.536 1.067 0.719 0.952 0.714 C 1.993 22 residues pruned to eliminate duplicates Z: 20 58.168 2.617 1.087 0.778 0.895 0.737 CA 2.136 20 residues pruned to eliminate duplicates Z: 78 73.565 2.557 0.897 0.516 0.870 0.636 CB 1.956 78 residues pruned to eliminate duplicates Z: 22 51.597 2.535 1.001 0.709 0.952 0.762 C 1.928 22 residues pruned to eliminate duplicates Z: 51 59.080 2.561 0.776 0.520 0.880 0.600 C 2.047 51 residues pruned to eliminate duplicates Z: 23 54.459 2.525 1.023 0.712 0.909 0.591 C 2.063 23 residues pruned to eliminate duplicates Z: 20 59.423 2.596 1.085 0.774 0.947 0.789 C 2.087 20 residues pruned to eliminate duplicates Z: 22 52.324 2.511 1.052 0.729 0.905 0.571 C 1.992 22 residues pruned to eliminate duplicates Z: 24 47.511 2.426 1.041 0.667 0.913 0.565 C 1.878 24 residues pruned to eliminate duplicates Z: 42 66.066 2.621 0.861 0.648 0.927 0.732 C 1.989 42 residues pruned to eliminate duplicates Z: 21 53.966 2.551 0.999 0.741 0.900 0.750 CA 2.118 21 residues pruned to eliminate duplicates Z: 21 56.827 2.591 1.026 0.734 0.950 0.800 C 2.065 21 residues pruned to eliminate duplicates Z: 22 54.896 2.578 1.044 0.741 0.905 0.762 C 2.026 22 residues pruned to eliminate duplicates Z: 21 60.615 2.580 1.172 0.754 0.950 0.700 C 2.030 21 residues pruned to eliminate duplicates Z: 42 62.771 2.506 0.913 0.655 0.902 0.634 C 1.962 42 residues pruned to eliminate duplicates Z: 22 51.412 2.510 0.955 0.736 0.952 0.810 C 1.942 22 residues pruned to eliminate duplicates Z: 23 53.516 2.488 0.976 0.735 0.955 0.682 C 1.969 23 residues pruned to eliminate duplicates Z: 77 71.675 2.526 0.863 0.543 0.895 0.579 CB 1.873 77 residues pruned to eliminate duplicates Z: 22 55.894 2.547 1.007 0.743 0.952 0.810 C 2.014 22 residues pruned to eliminate duplicates Z: 66 63.551 2.365 0.674 0.634 0.938 0.708 CB 1.872 66 residues pruned to eliminate duplicates Z: 28 45.469 2.405 0.866 0.631 0.889 0.741 CB 1.939 28 residues pruned to eliminate duplicates Z: 44 45.199 2.295 0.625 0.626 0.953 0.698 CB 1.723 44 residues pruned to eliminate duplicates Z: 8 8.472 1.827 0.291 0.456 1.000 0.857 CB 1.420 8 residues pruned to eliminate duplicates Z: 26 41.448 2.371 0.538 0.784 1.000 0.880 CB 1.770 26 residues pruned to eliminate duplicates Z: 12 13.240 2.023 0.547 0.482 0.818 0.636 CA 1.587 12 residues pruned to eliminate duplicates Z: 47 42.083 2.261 0.521 0.585 0.978 0.717 CB 1.700 47 residues pruned to eliminate duplicates Z: 44 41.388 2.251 0.619 0.592 0.930 0.721 CB 1.705 44 residues pruned to eliminate duplicates Z: 44 40.550 2.274 0.590 0.606 0.907 0.628 CB 1.705 44 residues pruned to eliminate duplicates Z: 45 39.451 2.262 0.538 0.607 0.886 0.682 CB 1.742 45 residues pruned to eliminate duplicates Z: 42 40.631 2.289 0.634 0.597 0.902 0.756 CB 1.715 42 residues pruned to eliminate duplicates Z: 38 44.755 2.319 0.725 0.631 0.946 0.676 CB 1.719 38 residues pruned to eliminate duplicates Z: 39 40.941 2.336 0.567 0.617 0.947 0.711 CB 1.714 39 residues pruned to eliminate duplicates Z: 42 40.381 2.306 0.497 0.642 0.951 0.707 CB 1.683 42 residues pruned to eliminate duplicates Z: 39 38.058 2.321 0.515 0.635 0.921 0.711 CB 1.679 39 residues pruned to eliminate duplicates Z: 44 39.034 2.305 0.473 0.597 0.930 0.721 CB 1.717 44 residues pruned to eliminate duplicates Z: 47 37.981 2.195 0.614 0.589 0.848 0.674 CB 1.712 47 residues pruned to eliminate duplicates Z: 42 42.964 2.301 0.680 0.615 0.927 0.707 CB 1.680 42 residues pruned to eliminate duplicates Z: 44 44.210 2.271 0.692 0.612 0.930 0.744 CB 1.696 44 residues pruned to eliminate duplicates Z: 44 47.352 2.288 0.746 0.634 0.953 0.721 CB 1.672 44 residues pruned to eliminate duplicates Z: 25 41.986 2.371 0.695 0.763 0.958 0.792 CB 1.762 25 residues pruned to eliminate duplicates Z: 42 40.140 2.278 0.651 0.606 0.927 0.756 CB 1.626 42 residues pruned to eliminate duplicates Z: 25 46.194 2.370 0.824 0.735 0.958 0.792 CB 1.843 25 residues pruned to eliminate duplicates Z: 36 43.286 2.282 0.730 0.664 0.943 0.771 CB 1.689 36 residues pruned to eliminate duplicates Z: 38 45.468 2.317 0.820 0.636 0.946 0.730 CB 1.649 38 residues pruned to eliminate duplicates Z: 44 44.220 2.260 0.710 0.632 0.953 0.698 CB 1.617 44 residues pruned to eliminate duplicates Z: 36 52.122 2.262 1.004 0.687 0.971 0.714 CB 1.686 36 residues pruned to eliminate duplicates Z: 46 48.590 2.241 0.924 0.591 0.911 0.578 CB 1.690 46 residues pruned to eliminate duplicates Z: 38 43.801 2.267 0.794 0.644 0.973 0.649 CB 1.590 38 residues pruned to eliminate duplicates Z: 41 48.676 2.287 0.934 0.623 0.900 0.575 CB 1.722 41 residues pruned to eliminate duplicates Z: 37 33.664 2.069 0.993 0.524 0.861 0.583 CB 1.544 37 residues pruned to eliminate duplicates Z: 42 49.989 2.312 0.843 0.639 0.927 0.732 CB 1.735 42 residues pruned to eliminate duplicates Z: 44 47.952 2.233 0.870 0.612 0.907 0.674 CB 1.737 44 residues pruned to eliminate duplicates Z: 39 49.436 2.292 0.922 0.637 0.947 0.632 CB 1.690 39 residues pruned to eliminate duplicates Z: 38 40.608 2.104 0.940 0.576 0.919 0.676 CB 1.655 38 residues pruned to eliminate duplicates Z: 43 44.006 2.183 0.929 0.575 0.905 0.667 CB 1.657 43 residues pruned to eliminate duplicates Z: 42 42.125 2.260 0.790 0.586 0.902 0.659 CB 1.659 42 residues pruned to eliminate duplicates Z: 39 45.308 2.319 0.817 0.634 0.921 0.684 CB 1.670 39 residues pruned to eliminate duplicates Z: 39 34.441 2.038 0.834 0.583 0.921 0.605 CB 1.499 39 residues pruned to eliminate duplicates Z: 45 48.130 2.269 0.872 0.600 0.932 0.659 CB 1.666 45 residues pruned to eliminate duplicates Z: 16 20.980 2.186 0.790 0.477 0.867 0.533 CB 1.635 16 residues pruned to eliminate duplicates Z: 43 54.007 2.299 0.965 0.656 0.929 0.738 CB 1.719 43 residues pruned to eliminate duplicates Z: 47 44.342 2.211 0.899 0.593 0.891 0.674 CB 1.598 47 residues pruned to eliminate duplicates Z: 62 48.441 2.237 0.833 0.554 0.934 0.623 CB 1.536 62 residues pruned to eliminate duplicates Z: 45 54.027 2.373 0.799 0.652 0.955 0.682 CB 1.735 45 residues pruned to eliminate duplicates Z: 54 48.081 2.230 0.843 0.590 0.925 0.604 CB 1.595 54 residues pruned to eliminate duplicates Z: 19 21.082 2.152 0.621 0.521 0.889 0.611 CB 1.570 19 residues pruned to eliminate duplicates Z: 61 54.510 2.304 0.853 0.583 0.933 0.583 CB 1.630 61 residues pruned to eliminate duplicates Z: 51 57.421 2.329 0.866 0.621 0.940 0.700 CB 1.774 51 residues pruned to eliminate duplicates Z: 60 46.289 2.257 0.631 0.574 0.915 0.576 CB 1.664 60 residues pruned to eliminate duplicates Z: 58 51.082 2.271 0.796 0.585 0.930 0.579 CB 1.645 58 residues pruned to eliminate duplicates Z: 18 20.400 2.227 0.702 0.481 0.882 0.529 CB 1.509 18 residues pruned to eliminate duplicates Z: 25 19.798 2.198 0.678 0.398 0.875 0.500 CB 1.394 25 residues pruned to eliminate duplicates Z: 23 20.627 2.203 0.568 0.415 0.909 0.409 CB 1.531 23 residues pruned to eliminate duplicates Z: 34 28.227 2.221 0.756 0.440 0.879 0.606 CB 1.526 34 residues pruned to eliminate duplicates Z: 33 27.044 2.213 0.582 0.451 0.906 0.625 CB 1.584 33 residues pruned to eliminate duplicates Z: 54 45.016 2.206 0.868 0.511 0.943 0.642 CB 1.572 54 residues pruned to eliminate duplicates Z: 11 5.448 1.797 0.345 0.307 0.800 0.400 CB 1.104 11 residues pruned to eliminate duplicates Z: 64 53.502 2.211 0.822 0.562 0.968 0.651 CB 1.628 64 residues pruned to eliminate duplicates Z: 37 31.558 2.192 0.672 0.502 0.972 0.500 CB 1.473 37 residues pruned to eliminate duplicates Z: 6 5.740 1.898 0.722 0.477 1.000 0.600 CB 0.804 6 residues pruned to eliminate duplicates Z: 43 24.334 2.135 0.395 0.428 0.857 0.595 CB 1.586 43 residues pruned to eliminate duplicates Z: 40 27.274 2.165 0.476 0.427 0.897 0.641 CB 1.643 40 residues pruned to eliminate duplicates Z: 98 57.152 2.237 0.658 0.516 0.938 0.629 CB 1.640 98 residues pruned to eliminate duplicates Z: 45 30.069 2.173 0.601 0.437 0.886 0.591 CB 1.569 45 residues pruned to eliminate duplicates Z: 41 25.483 2.161 0.440 0.422 0.850 0.575 CB 1.653 41 residues pruned to eliminate duplicates Z: 30 24.253 2.205 0.398 0.468 0.897 0.724 CB 1.684 30 residues pruned to eliminate duplicates Z: 89 53.318 2.267 0.614 0.516 0.920 0.625 CB 1.662 89 residues pruned to eliminate duplicates Z: 39 23.920 2.166 0.410 0.388 0.895 0.711 CB 1.599 39 residues pruned to eliminate duplicates Z: 96 51.652 2.241 0.602 0.515 0.884 0.589 CB 1.646 96 residues pruned to eliminate duplicates Z: 28 21.073 2.127 0.312 0.455 0.963 0.593 CB 1.579 28 residues pruned to eliminate duplicates Z: 37 19.843 2.124 0.223 0.419 0.861 0.667 CB 1.609 37 residues pruned to eliminate duplicates Z: 35 25.883 2.164 0.483 0.411 0.882 0.618 CB 1.721 35 residues pruned to eliminate duplicates Z: 41 20.113 2.083 0.315 0.389 0.875 0.575 CB 1.494 41 residues pruned to eliminate duplicates Z: 38 27.461 2.198 0.407 0.417 0.946 0.595 CB 1.683 38 residues pruned to eliminate duplicates Z: 169 77.130 2.281 0.701 0.540 0.899 0.607 CB 1.640 169 residues pruned to eliminate duplicates Z: 68 32.070 2.161 0.482 0.439 0.866 0.627 CB 1.505 68 residues pruned to eliminate duplicates Z: 44 26.325 2.117 0.510 0.439 0.884 0.558 CB 1.513 44 residues pruned to eliminate duplicates Z: 71 35.692 2.201 0.481 0.449 0.900 0.600 CB 1.532 71 residues pruned to eliminate duplicates Z: 67 45.734 2.270 0.666 0.540 0.848 0.667 CB 1.687 67 residues pruned to eliminate duplicates Z: 74 37.836 2.197 0.590 0.431 0.877 0.658 CB 1.553 74 residues pruned to eliminate duplicates Z: 58 30.847 2.194 0.433 0.437 0.877 0.596 CB 1.582 58 residues pruned to eliminate duplicates Z: 94 56.737 2.252 0.694 0.528 0.914 0.624 CB 1.641 94 residues pruned to eliminate duplicates Z: 93 56.707 2.250 0.713 0.529 0.913 0.696 CB 1.632 93 residues pruned to eliminate duplicates Z: 37 24.808 2.149 0.395 0.429 0.917 0.611 CB 1.619 37 residues pruned to eliminate duplicates Z: 90 54.755 2.254 0.663 0.539 0.899 0.640 CB 1.658 90 residues pruned to eliminate duplicates Z: 58 32.539 2.220 0.548 0.398 0.895 0.579 CB 1.560 58 residues pruned to eliminate duplicates Z: 98 57.687 2.241 0.711 0.519 0.918 0.619 CB 1.634 98 residues pruned to eliminate duplicates Z: 37 24.205 2.189 0.430 0.413 0.833 0.667 CB 1.693 37 residues pruned to eliminate duplicates Z: 41 23.926 2.139 0.456 0.428 0.850 0.700 CB 1.540 41 residues pruned to eliminate duplicates Z: 130 70.581 2.277 0.729 0.551 0.899 0.651 CB 1.670 130 residues pruned to eliminate duplicates Z: 40 23.746 2.111 0.451 0.424 0.846 0.615 CB 1.588 40 residues pruned to eliminate duplicates Z: 65 30.703 2.121 0.495 0.400 0.875 0.531 CB 1.537 65 residues pruned to eliminate duplicates Z: 39 25.275 2.147 0.407 0.429 0.868 0.605 CB 1.681 39 residues pruned to eliminate duplicates Z: 98 54.670 2.211 0.723 0.527 0.887 0.639 CB 1.601 98 residues pruned to eliminate duplicates Z: 37 23.840 2.052 0.642 0.430 0.861 0.583 CB 1.472 37 residues pruned to eliminate duplicates Z: 99 54.032 2.229 0.667 0.510 0.908 0.653 CB 1.601 99 residues pruned to eliminate duplicates Z: 90 53.319 2.263 0.680 0.519 0.888 0.697 CB 1.643 90 residues pruned to eliminate duplicates Z: 115 52.645 2.251 0.585 0.491 0.886 0.667 CB 1.575 115 residues pruned to eliminate duplicates Z: 78 46.117 2.202 0.607 0.538 0.870 0.688 CB 1.645 78 residues pruned to eliminate duplicates Z: 82 45.501 2.191 0.645 0.497 0.877 0.642 CB 1.605 82 residues pruned to eliminate duplicates Z: 41 40.595 2.252 0.738 0.564 0.875 0.625 CB 1.761 41 residues pruned to eliminate duplicates Z: 36 43.601 2.283 0.707 0.644 0.914 0.657 CB 1.808 36 residues pruned to eliminate duplicates Z: 60 52.393 2.390 0.813 0.572 0.898 0.644 CB 1.635 60 residues pruned to eliminate duplicates Z: 32 49.963 2.392 0.860 0.679 0.935 0.742 CB 1.830 32 residues pruned to eliminate duplicates Z: 27 37.859 2.220 0.871 0.671 0.846 0.808 CA 1.803 27 residues pruned to eliminate duplicates Z: 37 40.417 2.282 0.742 0.597 0.889 0.528 CB 1.738 37 residues pruned to eliminate duplicates Z: 129 73.903 2.271 0.756 0.554 0.922 0.656 CB 1.686 129 residues pruned to eliminate duplicates Z: 33 49.072 2.354 0.856 0.685 0.938 0.750 CB 1.786 33 residues pruned to eliminate duplicates Z: 59 47.104 2.375 0.671 0.543 0.879 0.655 CB 1.700 59 residues pruned to eliminate duplicates Z: 33 44.427 2.355 0.798 0.652 0.906 0.719 CB 1.776 33 residues pruned to eliminate duplicates Z: 26 38.359 2.253 0.838 0.658 0.880 0.720 CB 1.818 26 residues pruned to eliminate duplicates Z: 33 45.409 2.314 0.903 0.642 0.906 0.625 CB 1.762 33 residues pruned to eliminate duplicates Z: 99 47.199 2.254 0.707 0.479 0.806 0.582 CB 1.570 99 residues pruned to eliminate duplicates Z: 34 48.617 2.342 0.991 0.660 0.879 0.636 CB 1.781 34 residues pruned to eliminate duplicates Z: 124 72.863 2.269 0.739 0.584 0.927 0.724 CB 1.658 124 residues pruned to eliminate duplicates Z: 56 48.805 2.391 0.868 0.549 0.836 0.636 CB 1.679 56 residues pruned to eliminate duplicates Z: 115 61.192 2.280 0.709 0.512 0.877 0.605 CB 1.656 115 residues pruned to eliminate duplicates Z: 32 54.410 2.380 0.937 0.705 0.968 0.677 CB 1.818 32 residues pruned to eliminate duplicates Z: 73 50.340 2.277 0.780 0.514 0.861 0.681 CB 1.677 73 residues pruned to eliminate duplicates Z: 32 52.921 2.396 0.956 0.698 0.935 0.774 CB 1.810 32 residues pruned to eliminate duplicates Z: 38 41.562 2.242 0.873 0.607 0.865 0.649 CB 1.699 38 residues pruned to eliminate duplicates Z: 39 43.951 2.242 0.882 0.627 0.895 0.632 CB 1.675 39 residues pruned to eliminate duplicates Z: 94 53.129 2.293 0.614 0.495 0.882 0.699 CB 1.697 94 residues pruned to eliminate duplicates Z: 70 54.783 2.266 0.797 0.613 0.928 0.696 CB 1.569 70 residues pruned to eliminate duplicates Z: 34 50.147 2.275 0.998 0.669 0.909 0.667 CB 1.807 34 residues pruned to eliminate duplicates Z: 149 80.357 2.288 0.820 0.554 0.905 0.635 CB 1.662 149 residues pruned to eliminate duplicates Z: 140 69.509 2.242 0.792 0.530 0.892 0.633 CB 1.597 140 residues pruned to eliminate duplicates Z: 88 57.947 2.255 0.737 0.527 0.920 0.655 CB 1.679 88 residues pruned to eliminate duplicates Z: 35 51.654 2.349 0.970 0.680 0.912 0.559 CB 1.779 35 residues pruned to eliminate duplicates Z: 31 59.183 2.413 0.989 0.714 0.967 0.700 CB 1.919 31 residues pruned to eliminate duplicates Z: 170 82.299 2.291 0.786 0.537 0.905 0.651 CB 1.649 170 residues pruned to eliminate duplicates Z: 56 55.162 2.385 0.806 0.583 0.927 0.709 CB 1.719 56 residues pruned to eliminate duplicates Z: 29 23.629 2.323 0.649 0.405 0.857 0.571 CB 1.502 29 residues pruned to eliminate duplicates Z: 22 25.901 2.420 0.678 0.463 0.905 0.714 CB 1.598 22 residues pruned to eliminate duplicates Z: 27 25.375 2.327 0.696 0.451 0.846 0.692 CB 1.566 27 residues pruned to eliminate duplicates Z: 59 50.451 2.368 0.814 0.595 0.879 0.672 CB 1.602 59 residues pruned to eliminate duplicates Z: 22 27.356 2.402 0.778 0.478 0.857 0.571 CB 1.667 22 residues pruned to eliminate duplicates Z: 24 25.776 2.337 0.817 0.444 0.826 0.652 CB 1.623 24 residues pruned to eliminate duplicates Z: 24 25.793 2.406 0.676 0.431 0.870 0.609 CB 1.647 24 residues pruned to eliminate duplicates Z: 22 26.575 2.440 0.756 0.471 0.857 0.667 CB 1.627 22 residues pruned to eliminate duplicates Z: 24 25.389 2.426 0.856 0.421 0.783 0.652 CB 1.631 24 residues pruned to eliminate duplicates Z: 24 25.054 2.414 0.769 0.434 0.826 0.609 CB 1.585 24 residues pruned to eliminate duplicates Z: 24 21.443 2.329 0.682 0.454 0.739 0.522 CB 1.619 24 residues pruned to eliminate duplicates Z: 40 30.557 2.322 0.659 0.406 0.872 0.615 CB 1.608 40 residues pruned to eliminate duplicates Z: 64 50.201 2.401 0.696 0.539 0.905 0.651 CB 1.652 64 residues pruned to eliminate duplicates Z: 91 56.923 2.301 0.720 0.525 0.878 0.667 CB 1.685 91 residues pruned to eliminate duplicates Z: 22 25.303 2.475 0.671 0.476 0.810 0.667 CB 1.688 22 residues pruned to eliminate duplicates Z: 23 22.774 2.441 0.575 0.463 0.818 0.727 CB 1.603 23 residues pruned to eliminate duplicates Z: 20 24.203 2.448 0.576 0.483 0.842 0.684 CB 1.738 20 residues pruned to eliminate duplicates Z: 35 28.501 2.301 0.595 0.457 0.882 0.588 CB 1.577 35 residues pruned to eliminate duplicates Z: 23 27.671 2.464 0.825 0.459 0.864 0.773 CB 1.584 23 residues pruned to eliminate duplicates Z: 27 20.545 2.236 0.765 0.371 0.846 0.615 CB 1.384 27 residues pruned to eliminate duplicates Z: 46 29.221 2.263 0.598 0.408 0.867 0.556 CB 1.532 46 residues pruned to eliminate duplicates Z: 24 30.001 2.307 0.700 0.505 0.913 0.696 CB 1.739 24 residues pruned to eliminate duplicates Z: 49 26.494 2.268 0.513 0.384 0.833 0.604 CB 1.514 49 residues pruned to eliminate duplicates Z: 77 48.957 2.270 0.527 0.616 0.934 0.763 CB 1.553 77 residues pruned to eliminate duplicates Z: 67 45.103 2.400 0.595 0.510 0.879 0.667 CB 1.634 67 residues pruned to eliminate duplicates Z: 74 51.873 2.229 0.683 0.594 0.904 0.740 CB 1.637 74 residues pruned to eliminate duplicates Z: 17 17.008 2.187 0.453 0.524 0.875 0.500 CB 1.492 17 residues pruned to eliminate duplicates Z: 17 18.387 2.227 0.533 0.441 0.938 0.625 CB 1.527 17 residues pruned to eliminate duplicates Z: 75 49.651 2.231 0.561 0.612 0.946 0.703 CB 1.575 75 residues pruned to eliminate duplicates Z: 26 18.206 2.163 0.586 0.383 0.920 0.480 CB 1.306 26 residues pruned to eliminate duplicates Z: 80 48.710 2.143 0.600 0.602 0.924 0.684 CB 1.570 80 residues pruned to eliminate duplicates Z: 31 18.134 2.161 0.578 0.367 0.867 0.467 CB 1.291 31 residues pruned to eliminate duplicates Z: 26 13.705 2.173 0.550 0.342 0.720 0.520 CB 1.343 26 residues pruned to eliminate duplicates Z: 50 39.052 2.371 0.540 0.528 0.898 0.653 CB 1.654 50 residues pruned to eliminate duplicates Z: 29 20.150 2.154 0.526 0.378 0.893 0.536 CB 1.479 29 residues pruned to eliminate duplicates Z: 75 53.652 2.258 0.539 0.647 0.959 0.757 CB 1.630 75 residues pruned to eliminate duplicates Z: 130 70.797 2.289 0.590 0.617 0.938 0.698 CB 1.635 130 residues pruned to eliminate duplicates Z: 81 50.826 2.202 0.615 0.589 0.938 0.713 CB 1.565 81 residues pruned to eliminate duplicates Z: 72 45.803 2.268 0.479 0.607 0.915 0.789 CB 1.599 72 residues pruned to eliminate duplicates Z: 47 33.824 2.354 0.567 0.494 0.870 0.609 CB 1.564 47 residues pruned to eliminate duplicates Z: 41 36.026 2.319 0.548 0.532 0.925 0.700 CB 1.662 41 residues pruned to eliminate duplicates Z: 113 53.497 2.224 0.534 0.584 0.902 0.723 CB 1.515 113 residues pruned to eliminate duplicates Z: 25 39.135 2.482 0.747 0.683 0.917 0.792 CB 1.698 25 residues pruned to eliminate duplicates Z: 21 42.891 2.516 0.766 0.697 0.950 0.800 CB 1.899 21 residues pruned to eliminate duplicates Z: 54 48.977 2.296 0.632 0.701 0.925 0.755 CB 1.616 54 residues pruned to eliminate duplicates Z: 49 54.207 2.304 0.583 0.768 0.958 0.812 CB 1.766 49 residues pruned to eliminate duplicates Z: 79 48.151 2.222 0.575 0.614 0.923 0.654 CB 1.515 79 residues pruned to eliminate duplicates Z: 57 45.434 2.271 0.520 0.676 0.929 0.732 CB 1.610 57 residues pruned to eliminate duplicates Z: 57 47.653 2.265 0.467 0.711 0.964 0.768 CB 1.641 57 residues pruned to eliminate duplicates Z: 26 40.115 2.463 0.676 0.652 0.960 0.800 CB 1.758 26 residues pruned to eliminate duplicates Z: 78 47.058 2.253 0.513 0.625 0.922 0.753 CB 1.516 78 residues pruned to eliminate duplicates Z: 30 39.332 2.467 0.563 0.672 0.931 0.724 CB 1.736 30 residues pruned to eliminate duplicates Z: 59 44.792 2.235 0.561 0.665 0.931 0.759 CB 1.554 59 residues pruned to eliminate duplicates Z: 74 44.113 2.179 0.480 0.588 0.918 0.726 CB 1.603 74 residues pruned to eliminate duplicates Z: 70 48.955 2.231 0.548 0.659 0.928 0.681 CB 1.588 70 residues pruned to eliminate duplicates Z: 56 46.418 2.235 0.565 0.688 0.945 0.764 CB 1.593 56 residues pruned to eliminate duplicates Z: 59 45.787 2.220 0.527 0.665 0.931 0.741 CB 1.635 59 residues pruned to eliminate duplicates Z: 51 56.043 2.300 0.704 0.734 0.980 0.840 CB 1.673 51 residues pruned to eliminate duplicates Z: 78 59.590 2.305 0.633 0.685 0.922 0.766 CB 1.650 78 residues pruned to eliminate duplicates Z: 72 54.486 2.277 0.670 0.625 0.930 0.732 CB 1.626 72 residues pruned to eliminate duplicates Z: 57 51.379 2.290 0.673 0.688 0.946 0.714 CB 1.594 57 residues pruned to eliminate duplicates Z: 74 53.488 2.219 0.654 0.611 0.918 0.699 CB 1.673 74 residues pruned to eliminate duplicates Z: 31 31.683 2.083 0.462 0.760 0.967 0.900 CB 1.559 31 residues pruned to eliminate duplicates Z: 46 60.015 2.329 0.724 0.802 0.956 0.844 CB 1.790 46 residues pruned to eliminate duplicates Z: 35 30.044 2.050 0.440 0.697 0.941 0.853 CB 1.549 35 residues pruned to eliminate duplicates Z: 32 32.404 2.069 0.490 0.735 0.968 0.774 CB 1.580 32 residues pruned to eliminate duplicates Z: 55 50.245 2.259 0.573 0.718 0.963 0.833 CB 1.641 55 residues pruned to eliminate duplicates Z: 34 31.764 2.096 0.442 0.696 0.970 0.758 CB 1.577 34 residues pruned to eliminate duplicates Z: 72 53.030 2.245 0.626 0.618 0.944 0.718 CB 1.634 72 residues pruned to eliminate duplicates Z: 37 25.665 1.960 0.378 0.703 0.944 0.722 CB 1.393 37 residues pruned to eliminate duplicates Z: 32 33.693 2.134 0.534 0.757 0.968 0.839 CB 1.520 32 residues pruned to eliminate duplicates Z: 33 33.650 2.120 0.506 0.741 1.000 0.875 CB 1.501 33 residues pruned to eliminate duplicates Z: 60 53.933 2.200 0.794 0.689 0.932 0.729 CB 1.606 60 residues pruned to eliminate duplicates Z: 61 51.392 2.212 0.772 0.675 0.950 0.767 CB 1.516 61 residues pruned to eliminate duplicates Z: 59 55.664 2.210 0.861 0.680 0.966 0.810 CB 1.559 59 residues pruned to eliminate duplicates Z: 54 57.843 2.275 0.868 0.705 0.925 0.755 CB 1.678 54 residues pruned to eliminate duplicates Z: 55 54.850 2.251 0.852 0.688 0.926 0.759 CB 1.628 55 residues pruned to eliminate duplicates Z: 55 57.063 2.273 0.816 0.714 0.963 0.796 CB 1.608 55 residues pruned to eliminate duplicates Z: 51 59.161 2.304 0.900 0.748 0.920 0.740 CB 1.664 51 residues pruned to eliminate duplicates Z: 60 55.078 2.243 1.005 0.680 0.898 0.678 CB 1.505 60 residues pruned to eliminate duplicates Z: 109 62.891 2.238 0.788 0.591 0.907 0.657 CB 1.528 109 residues pruned to eliminate duplicates Z: 56 62.108 2.265 0.974 0.715 0.945 0.782 CB 1.631 56 residues pruned to eliminate duplicates Z: 72 57.375 2.207 0.830 0.620 0.915 0.648 CB 1.644 72 residues pruned to eliminate duplicates Z: 60 55.170 2.214 0.904 0.686 0.949 0.814 CB 1.513 60 residues pruned to eliminate duplicates Z: 30 42.141 2.076 0.962 0.752 1.000 0.793 CB 1.535 30 residues pruned to eliminate duplicates Z: 52 61.025 2.282 0.847 0.763 0.961 0.784 CB 1.671 52 residues pruned to eliminate duplicates Z: 32 45.233 2.101 0.907 0.762 1.000 0.839 CB 1.607 32 residues pruned to eliminate duplicates Z: 29 45.713 2.139 0.965 0.779 1.000 0.893 CB 1.607 29 residues pruned to eliminate duplicates Z: 32 40.199 2.066 0.876 0.735 1.000 0.677 CB 1.509 32 residues pruned to eliminate duplicates Z: 79 59.611 2.260 0.767 0.632 0.936 0.731 CB 1.596 79 residues pruned to eliminate duplicates Z: 80 55.895 2.221 0.855 0.601 0.911 0.646 CB 1.522 80 residues pruned to eliminate duplicates Z: 62 55.296 2.219 0.929 0.685 0.918 0.754 CB 1.521 62 residues pruned to eliminate duplicates Z: 61 57.343 2.226 0.890 0.683 0.967 0.750 CB 1.539 61 residues pruned to eliminate duplicates Z: 7 4.728 1.665 0.148 0.477 0.833 0.333 C 1.241 7 residues pruned to eliminate duplicates Z: 108 67.891 2.246 0.847 0.609 0.925 0.701 CB 1.541 108 residues pruned to eliminate duplicates Z: 73 50.124 2.179 0.720 0.644 0.931 0.653 CB 1.480 73 residues pruned to eliminate duplicates Z: 62 56.284 2.344 0.720 0.682 0.918 0.754 CB 1.647 62 residues pruned to eliminate duplicates Z: 45 27.336 2.097 0.683 0.526 0.841 0.591 CB 1.353 45 residues pruned to eliminate duplicates Z: 34 32.107 2.260 0.698 0.591 0.909 0.667 CB 1.469 34 residues pruned to eliminate duplicates Z: 26 26.022 2.176 0.693 0.649 0.920 0.640 CB 1.336 26 residues pruned to eliminate duplicates Z: 63 59.690 2.349 0.758 0.672 0.952 0.710 CB 1.646 63 residues pruned to eliminate duplicates Z: 11 13.265 2.149 1.106 0.499 0.900 0.800 CB 1.031 11 residues pruned to eliminate duplicates Z: 35 36.159 2.256 0.788 0.568 0.941 0.765 CB 1.529 35 residues pruned to eliminate duplicates Z: 34 34.867 2.267 0.819 0.611 0.909 0.697 CB 1.457 34 residues pruned to eliminate duplicates Z: 43 38.113 2.207 0.721 0.589 0.952 0.643 CB 1.493 43 residues pruned to eliminate duplicates Z: 34 33.598 2.269 0.765 0.610 0.909 0.697 CB 1.447 34 residues pruned to eliminate duplicates Z: 83 71.863 2.303 0.928 0.696 0.927 0.768 CB 1.612 83 residues pruned to eliminate duplicates Z: 27 26.255 2.141 0.780 0.671 0.923 0.731 CB 1.250 27 residues pruned to eliminate duplicates Z: 35 34.663 2.218 0.888 0.564 0.912 0.676 CB 1.463 35 residues pruned to eliminate duplicates Z: 41 38.368 2.262 0.855 0.567 0.900 0.550 CB 1.505 41 residues pruned to eliminate duplicates Z: 35 34.885 2.256 0.856 0.571 0.912 0.647 CB 1.463 35 residues pruned to eliminate duplicates Z: 42 33.243 2.197 0.864 0.535 0.878 0.610 CB 1.395 42 residues pruned to eliminate duplicates Z: 62 61.426 2.321 0.819 0.686 0.951 0.689 CB 1.652 62 residues pruned to eliminate duplicates Z: 33 40.992 2.242 1.051 0.626 0.938 0.719 CB 1.493 33 residues pruned to eliminate duplicates Z: 25 35.552 2.188 1.193 0.683 0.958 0.667 CB 1.335 25 residues pruned to eliminate duplicates Z: 24 33.588 2.243 0.890 0.593 0.913 0.652 CB 1.655 24 residues pruned to eliminate duplicates Z: 41 38.986 2.202 0.916 0.573 0.950 0.600 CB 1.434 41 residues pruned to eliminate duplicates Z: 38 40.965 2.236 1.025 0.579 0.946 0.649 CB 1.457 38 residues pruned to eliminate duplicates Z: 40 38.799 2.221 0.984 0.568 0.923 0.590 CB 1.430 40 residues pruned to eliminate duplicates Z: 72 68.520 2.249 0.992 0.694 0.915 0.676 CB 1.660 72 residues pruned to eliminate duplicates Z: 67 57.228 2.180 1.047 0.661 0.924 0.773 CB 1.471 67 residues pruned to eliminate duplicates Z: 35 38.818 2.246 1.070 0.576 0.912 0.676 CB 1.459 35 residues pruned to eliminate duplicates Z: 40 32.783 2.151 0.977 0.553 0.872 0.641 CB 1.344 40 residues pruned to eliminate duplicates Z: 66 56.788 2.344 0.788 0.644 0.908 0.662 CB 1.618 66 residues pruned to eliminate duplicates Z: 11 8.822 1.959 0.382 0.312 0.800 0.400 C 1.586 11 residues pruned to eliminate duplicates Z: 63 65.878 2.357 0.836 0.696 0.968 0.677 CB 1.671 63 residues pruned to eliminate duplicates Z: 15 9.107 1.751 0.347 0.381 0.929 0.357 CB 1.261 15 residues pruned to eliminate duplicates Z: 39 39.801 2.293 1.012 0.618 0.868 0.632 CB 1.441 39 residues pruned to eliminate duplicates Z: 29 44.539 2.397 0.547 0.762 1.000 0.821 CB 1.798 29 residues pruned to eliminate duplicates Z: 28 39.607 2.448 0.463 0.743 0.926 0.815 CB 1.849 28 residues pruned to eliminate duplicates Z: 28 45.569 2.439 0.598 0.743 0.926 0.741 CB 1.956 28 residues pruned to eliminate duplicates Z: 27 47.410 2.459 0.587 0.754 0.962 0.808 CB 1.977 27 residues pruned to eliminate duplicates Z: 59 59.868 2.339 0.855 0.663 0.914 0.672 CB 1.704 59 residues pruned to eliminate duplicates Z: 28 44.289 2.442 0.450 0.761 0.963 0.704 CB 1.982 28 residues pruned to eliminate duplicates Z: 58 66.440 2.333 0.879 0.681 0.965 0.684 CB 1.761 58 residues pruned to eliminate duplicates Z: 28 43.673 2.431 0.431 0.734 1.000 0.741 CB 1.958 28 residues pruned to eliminate duplicates Z: 67 58.239 2.324 0.775 0.634 0.955 0.667 CB 1.606 67 residues pruned to eliminate duplicates Z: 29 42.688 2.412 0.608 0.754 0.893 0.750 CB 1.858 29 residues pruned to eliminate duplicates Z: 28 43.950 2.471 0.460 0.751 0.963 0.741 CB 1.947 28 residues pruned to eliminate duplicates Z: 28 48.963 2.470 0.626 0.752 0.963 0.778 CB 1.946 28 residues pruned to eliminate duplicates Z: 29 44.782 2.402 0.593 0.735 0.964 0.786 CB 1.857 29 residues pruned to eliminate duplicates Z: 28 55.621 2.475 0.818 0.754 0.963 0.741 CB 1.970 28 residues pruned to eliminate duplicates Z: 29 48.499 2.437 0.762 0.719 0.893 0.714 CB 1.961 29 residues pruned to eliminate duplicates Z: 28 53.654 2.432 0.732 0.752 1.000 0.815 CB 1.958 28 residues pruned to eliminate duplicates Z: 29 49.933 2.397 0.801 0.732 0.964 0.750 CB 1.840 29 residues pruned to eliminate duplicates Z: 28 53.583 2.464 0.845 0.726 0.963 0.741 CB 1.921 28 residues pruned to eliminate duplicates Z: 29 51.892 2.404 0.774 0.718 1.000 0.750 CB 1.888 29 residues pruned to eliminate duplicates Z: 20 60.268 2.463 1.167 0.845 1.000 0.895 CB 1.926 20 residues pruned to eliminate duplicates Z: 29 54.497 2.411 0.928 0.723 0.964 0.643 CB 1.878 29 residues pruned to eliminate duplicates Z: 57 72.576 2.371 1.036 0.673 0.964 0.625 CB 1.776 58 residues pruned to eliminate duplicates Z: 18 51.335 2.295 1.211 0.934 0.941 0.882 CB 1.817 18 residues pruned to eliminate duplicates Z: 29 50.812 2.376 1.034 0.703 0.893 0.643 CB 1.851 29 residues pruned to eliminate duplicates Z: 27 60.316 2.465 1.053 0.739 0.962 0.654 CB 1.962 27 residues pruned to eliminate duplicates Z: 26 56.378 2.518 0.885 0.760 0.920 0.760 CB 2.049 26 residues pruned to eliminate duplicates Z: 30 50.974 2.294 0.958 0.689 0.931 0.621 CB 1.903 30 residues pruned to eliminate duplicates Z: 29 51.100 2.389 0.870 0.749 0.929 0.714 CB 1.863 29 residues pruned to eliminate duplicates Z: 38 23.432 2.278 0.644 0.386 0.838 0.541 CB 1.386 38 residues pruned to eliminate duplicates Z: 31 26.496 2.394 0.817 0.372 0.833 0.533 CB 1.530 31 residues pruned to eliminate duplicates Z: 7 4.479 1.993 0.126 0.352 0.667 0.667 CA 1.435 7 residues pruned to eliminate duplicates Z: 34 23.767 2.412 0.574 0.412 0.848 0.485 CB 1.407 34 residues pruned to eliminate duplicates Z: 49 28.113 2.300 0.703 0.410 0.833 0.583 CB 1.366 182 residues pruned to eliminate duplicates Z: 6 7.446 1.906 0.505 0.454 1.000 0.600 CB 1.216 6 residues pruned to eliminate duplicates Z: 54 54.177 2.577 0.874 0.478 0.887 0.472 CB 1.777 54 residues pruned to eliminate duplicates Z: 44 31.200 2.401 0.721 0.407 0.860 0.442 CB 1.476 44 residues pruned to eliminate duplicates Z: 30 32.618 2.512 0.785 0.442 0.897 0.586 CB 1.600 30 residues pruned to eliminate duplicates Z: 31 31.552 2.435 0.874 0.493 0.867 0.467 CB 1.467 31 residues pruned to eliminate duplicates Z: 33 31.166 2.411 0.816 0.462 0.844 0.531 CB 1.551 33 residues pruned to eliminate duplicates Z: 29 28.466 2.334 0.898 0.470 0.857 0.464 CB 1.460 29 residues pruned to eliminate duplicates Z: 34 28.386 2.405 0.685 0.437 0.848 0.576 CB 1.533 34 residues pruned to eliminate duplicates Z: 30 26.703 2.418 0.783 0.414 0.828 0.655 CB 1.521 30 residues pruned to eliminate duplicates Z: 57 45.283 2.446 0.877 0.438 0.857 0.482 CB 1.641 57 residues pruned to eliminate duplicates Z: 31 31.398 2.447 0.879 0.471 0.867 0.467 CB 1.482 31 residues pruned to eliminate duplicates Z: 86 69.823 2.490 0.923 0.507 0.882 0.553 CB 1.780 86 residues pruned to eliminate duplicates Z: 13 18.769 2.164 0.623 0.527 0.917 0.583 CB 1.638 13 residues pruned to eliminate duplicates Z: 34 26.512 2.327 0.847 0.441 0.818 0.485 CB 1.395 34 residues pruned to eliminate duplicates Z: 51 28.411 2.258 0.693 0.445 0.840 0.560 CB 1.323 51 residues pruned to eliminate duplicates Z: 31 27.316 2.433 0.665 0.442 0.900 0.467 CB 1.453 31 residues pruned to eliminate duplicates Z: 33 32.336 2.417 0.810 0.467 0.875 0.438 CB 1.545 33 residues pruned to eliminate duplicates Z: 31 29.169 2.477 0.649 0.438 0.900 0.533 CB 1.545 31 residues pruned to eliminate duplicates Z: 59 52.024 2.538 0.849 0.465 0.862 0.534 CB 1.751 59 residues pruned to eliminate duplicates Z: 32 28.470 2.433 0.739 0.446 0.871 0.548 CB 1.466 32 residues pruned to eliminate duplicates Z: 57 42.391 2.464 0.855 0.420 0.804 0.482 CB 1.676 57 residues pruned to eliminate duplicates Z: 28 22.984 2.492 0.672 0.410 0.741 0.407 CB 1.575 28 residues pruned to eliminate duplicates Z: 49 54.229 2.526 0.944 0.537 0.812 0.542 CB 1.892 49 residues pruned to eliminate duplicates Z: 46 49.160 2.566 0.881 0.479 0.844 0.489 CB 1.836 46 residues pruned to eliminate duplicates Z: 40 43.137 2.530 0.834 0.494 0.795 0.410 CB 1.885 40 residues pruned to eliminate duplicates Z: 60 49.558 2.538 0.847 0.450 0.831 0.458 CB 1.744 60 residues pruned to eliminate duplicates Z: 27 38.903 2.549 0.803 0.469 0.923 0.462 CB 1.856 27 residues pruned to eliminate duplicates Z: 59 52.049 2.531 0.845 0.459 0.879 0.483 CB 1.735 59 residues pruned to eliminate duplicates Z: 23 41.654 2.540 0.996 0.566 0.909 0.455 C 1.807 23 residues pruned to eliminate duplicates Z: 54 51.111 2.369 0.877 0.492 0.849 0.434 CB 1.875 54 residues pruned to eliminate duplicates Z: 23 43.819 2.568 0.834 0.558 0.955 0.591 C 1.963 23 residues pruned to eliminate duplicates Z: 60 45.766 2.488 0.789 0.433 0.881 0.407 CB 1.628 60 residues pruned to eliminate duplicates Z: 32 36.487 2.562 0.754 0.494 0.774 0.452 CB 1.894 32 residues pruned to eliminate duplicates Z: 62 47.446 2.417 0.856 0.415 0.869 0.557 CB 1.704 62 residues pruned to eliminate duplicates Z: 52 55.411 2.468 0.853 0.523 0.863 0.588 CB 1.922 52 residues pruned to eliminate duplicates Z: 57 47.059 2.508 0.780 0.471 0.857 0.518 CB 1.692 57 residues pruned to eliminate duplicates Z: 29 35.656 2.424 0.841 0.447 0.857 0.536 C 1.860 29 residues pruned to eliminate duplicates Z: 24 42.475 2.505 1.007 0.566 0.870 0.609 C 1.900 24 residues pruned to eliminate duplicates Z: 30 39.742 2.595 0.841 0.488 0.828 0.517 CB 1.890 30 residues pruned to eliminate duplicates Z: 26 27.706 2.427 0.613 0.463 0.840 0.520 C 1.750 26 residues pruned to eliminate duplicates Z: 36 42.347 2.511 0.807 0.489 0.886 0.514 CB 1.801 36 residues pruned to eliminate duplicates Z: 30 43.720 2.448 0.932 0.457 0.931 0.448 CB 1.927 30 residues pruned to eliminate duplicates Z: 53 43.083 2.423 0.834 0.460 0.827 0.481 CB 1.693 43 residues pruned to eliminate duplicates Z: 19 37.160 2.374 0.809 0.770 0.889 0.611 C 1.807 21 residues pruned to eliminate duplicates Z: 19 38.922 2.375 0.864 0.726 0.944 0.667 C 1.789 Z: 7 9.643 1.945 0.677 0.333 1.000 0.333 C 1.449 4 residues pruned to eliminate duplicates Z: 7 6.037 2.148 0.500 0.328 0.833 0.167 CA 1.108 29 residues pruned to eliminate duplicates Z: 47 64.629 2.454 0.899 0.628 0.935 0.674 C 1.940 47 residues pruned to eliminate duplicates Z: 109 67.895 2.440 0.851 0.495 0.833 0.537 CB 1.745 109 residues pruned to eliminate duplicates Z: 22 60.526 2.547 1.135 0.729 0.952 0.714 C 2.075 22 residues pruned to eliminate duplicates Z: 28 52.529 2.399 1.066 0.655 0.926 0.630 C 1.909 28 residues pruned to eliminate duplicates Z: 66 72.703 2.413 0.808 0.651 0.969 0.662 CB 1.853 66 residues pruned to eliminate duplicates Z: 68 72.137 2.408 0.828 0.609 0.955 0.672 CB 1.890 68 residues pruned to eliminate duplicates Z: 28 51.850 2.425 1.080 0.645 0.963 0.667 CB 1.795 28 residues pruned to eliminate duplicates Z: 30 50.884 2.362 1.079 0.627 0.966 0.621 CB 1.768 30 residues pruned to eliminate duplicates Z: 29 49.473 2.357 1.092 0.628 0.929 0.643 C 1.810 29 residues pruned to eliminate duplicates Z: 68 64.994 2.369 0.809 0.611 0.925 0.701 CB 1.802 68 residues pruned to eliminate duplicates Z: 22 60.626 2.539 1.208 0.726 0.952 0.762 C 2.020 22 residues pruned to eliminate duplicates Z: 33 44.531 2.244 0.933 0.586 0.906 0.594 CB 1.843 33 residues pruned to eliminate duplicates Z: 28 49.090 2.386 1.065 0.602 0.926 0.630 CB 1.878 28 residues pruned to eliminate duplicates Z: 66 61.772 2.393 0.758 0.615 0.877 0.692 CB 1.863 66 residues pruned to eliminate duplicates Z: 32 43.120 2.297 0.895 0.609 0.903 0.645 CB 1.777 32 residues pruned to eliminate duplicates Z: 35 41.120 2.215 0.959 0.548 0.853 0.529 CB 1.817 35 residues pruned to eliminate duplicates Z: 29 56.498 2.401 1.107 0.639 0.964 0.607 CB 1.922 29 residues pruned to eliminate duplicates Z: 25 51.253 2.422 1.080 0.640 0.917 0.750 CA 1.987 25 residues pruned to eliminate duplicates Z: 48 69.756 2.532 1.026 0.604 0.915 0.617 C 1.965 48 residues pruned to eliminate duplicates Z: 28 50.060 2.454 1.002 0.632 0.889 0.630 CB 1.949 28 residues pruned to eliminate duplicates Z: 26 46.855 2.395 1.034 0.613 0.920 0.640 CB 1.879 26 residues pruned to eliminate duplicates Z: 37 43.375 2.396 0.863 0.499 0.861 0.583 CB 1.882 37 residues pruned to eliminate duplicates Z: 6 4.930 1.970 0.389 0.582 0.600 0.400 CA 1.241 6 residues pruned to eliminate duplicates Z: 43 45.481 2.384 0.558 0.633 0.929 0.667 CB 1.797 43 residues pruned to eliminate duplicates Z: 44 46.892 2.347 0.568 0.631 0.977 0.721 CB 1.760 44 residues pruned to eliminate duplicates Z: 29 45.016 2.391 0.907 0.608 0.893 0.679 C 1.886 29 residues pruned to eliminate duplicates Z: 43 45.946 2.357 0.703 0.608 0.905 0.738 CB 1.763 43 residues pruned to eliminate duplicates Z: 35 37.340 2.220 0.547 0.693 0.912 0.706 CB 1.715 35 residues pruned to eliminate duplicates Z: 58 53.932 2.362 0.671 0.595 0.930 0.684 CB 1.777 58 residues pruned to eliminate duplicates Z: 42 44.860 2.301 0.664 0.617 0.951 0.707 CB 1.722 42 residues pruned to eliminate duplicates Z: 42 50.815 2.386 0.721 0.624 0.951 0.732 CB 1.808 42 residues pruned to eliminate duplicates Z: 34 44.337 2.339 0.647 0.695 0.970 0.727 CB 1.729 34 residues pruned to eliminate duplicates Z: 43 44.762 2.311 0.668 0.584 0.929 0.690 CB 1.781 43 residues pruned to eliminate duplicates Z: 34 52.566 2.342 0.774 0.737 1.000 0.788 CB 1.781 34 residues pruned to eliminate duplicates Z: 28 41.603 2.306 0.790 0.684 0.926 0.741 C 1.769 28 residues pruned to eliminate duplicates Z: 48 44.433 2.230 0.728 0.608 0.915 0.723 CB 1.659 48 residues pruned to eliminate duplicates Z: 42 52.349 2.308 0.766 0.630 0.976 0.756 CB 1.819 42 residues pruned to eliminate duplicates Z: 35 41.847 2.213 0.714 0.610 0.971 0.676 CB 1.756 35 residues pruned to eliminate duplicates Z: 41 60.052 2.388 0.954 0.637 0.950 0.700 CB 1.884 41 residues pruned to eliminate duplicates Z: 28 54.212 2.383 0.975 0.739 0.963 0.815 C 1.858 28 residues pruned to eliminate duplicates Z: 45 53.937 2.367 0.972 0.577 0.909 0.750 CB 1.779 45 residues pruned to eliminate duplicates Z: 41 55.913 2.340 0.951 0.632 0.925 0.725 CB 1.850 41 residues pruned to eliminate duplicates Z: 43 50.735 2.288 0.924 0.603 0.929 0.714 CB 1.736 43 residues pruned to eliminate duplicates Z: 37 48.550 2.254 0.831 0.626 0.972 0.639 CB 1.791 37 residues pruned to eliminate duplicates Z: 37 51.472 2.276 0.934 0.686 0.944 0.611 CB 1.740 37 residues pruned to eliminate duplicates Z: 43 57.213 2.347 0.895 0.619 0.976 0.690 CB 1.818 43 residues pruned to eliminate duplicates Z: 38 54.597 2.347 0.993 0.640 0.946 0.757 CB 1.778 38 residues pruned to eliminate duplicates Z: 38 53.599 2.339 0.968 0.642 0.946 0.757 CB 1.771 38 residues pruned to eliminate duplicates Z: 43 51.489 2.307 0.863 0.623 0.929 0.714 CB 1.773 43 residues pruned to eliminate duplicates Z: 40 49.937 2.360 0.776 0.604 0.974 0.590 CB 1.774 40 residues pruned to eliminate duplicates Z: 36 59.721 2.303 1.049 0.711 1.000 0.771 CB 1.766 36 residues pruned to eliminate duplicates Z: 42 53.037 2.390 0.854 0.637 0.927 0.707 CB 1.774 42 residues pruned to eliminate duplicates Z: 47 47.014 2.214 0.782 0.630 0.913 0.717 CB 1.702 47 residues pruned to eliminate duplicates Z: 39 54.863 2.374 0.915 0.633 0.947 0.526 CB 1.825 39 residues pruned to eliminate duplicates Z: 17 18.981 2.164 0.637 0.405 0.875 0.688 CB 1.692 17 residues pruned to eliminate duplicates Z: 63 69.687 2.397 0.824 0.681 0.935 0.726 CB 1.832 63 residues pruned to eliminate duplicates Z: 41 65.195 2.413 1.004 0.660 0.975 0.725 CB 1.884 41 residues pruned to eliminate duplicates Z: 34 58.049 2.358 0.962 0.736 1.000 0.697 CB 1.767 34 residues pruned to eliminate duplicates Z: 37 45.343 2.205 0.961 0.582 0.917 0.611 CB 1.762 37 residues pruned to eliminate duplicates Z: 42 51.980 2.335 0.919 0.621 0.927 0.683 CB 1.744 42 residues pruned to eliminate duplicates Z: 36 51.300 2.319 0.866 0.691 0.943 0.714 CB 1.784 36 residues pruned to eliminate duplicates Z: 37 61.658 2.409 0.942 0.690 1.000 0.778 CB 1.847 37 residues pruned to eliminate duplicates Z: 46 53.602 2.360 0.884 0.615 0.933 0.711 CB 1.727 46 residues pruned to eliminate duplicates Z: 60 55.286 2.287 0.875 0.586 0.915 0.644 CB 1.689 60 residues pruned to eliminate duplicates Z: 54 54.428 2.335 0.832 0.612 0.906 0.642 CB 1.735 54 residues pruned to eliminate duplicates Z: 22 17.887 2.123 0.536 0.482 0.810 0.476 CB 1.506 22 residues pruned to eliminate duplicates Z: 19 19.499 2.173 0.725 0.517 0.889 0.444 CB 1.357 19 residues pruned to eliminate duplicates Z: 59 54.281 2.295 0.777 0.592 0.914 0.586 CB 1.752 59 residues pruned to eliminate duplicates Z: 58 55.559 2.327 0.777 0.609 0.912 0.632 CB 1.759 58 residues pruned to eliminate duplicates Z: 53 52.823 2.304 0.761 0.637 0.923 0.654 CB 1.721 53 residues pruned to eliminate duplicates Z: 62 57.461 2.314 0.871 0.568 0.918 0.525 CB 1.733 62 residues pruned to eliminate duplicates Z: 56 60.871 2.349 0.815 0.621 0.982 0.618 CB 1.748 56 residues pruned to eliminate duplicates Z: 18 20.196 2.211 0.535 0.522 0.941 0.588 CB 1.500 18 residues pruned to eliminate duplicates Z: 20 19.042 2.144 0.655 0.447 0.842 0.368 CB 1.544 20 residues pruned to eliminate duplicates Z: 22 21.022 2.166 0.436 0.492 0.905 0.476 CB 1.643 22 residues pruned to eliminate duplicates Z: 56 54.259 2.283 0.783 0.612 0.945 0.636 CB 1.710 56 residues pruned to eliminate duplicates Z: 19 18.080 2.218 0.423 0.549 0.833 0.444 CB 1.545 19 residues pruned to eliminate duplicates Z: 62 50.910 2.276 0.633 0.570 0.951 0.689 CB 1.724 62 residues pruned to eliminate duplicates Z: 21 22.336 2.183 0.451 0.541 0.950 0.650 CB 1.594 21 residues pruned to eliminate duplicates Z: 22 22.594 2.227 0.493 0.485 0.952 0.429 CB 1.581 22 residues pruned to eliminate duplicates Z: 21 16.625 2.091 0.420 0.534 0.800 0.500 CB 1.515 21 residues pruned to eliminate duplicates Z: 47 23.787 2.112 0.449 0.387 0.891 0.543 CB 1.451 47 residues pruned to eliminate duplicates Z: 42 24.447 2.164 0.467 0.380 0.878 0.512 CB 1.556 42 residues pruned to eliminate duplicates Z: 60 32.449 2.164 0.468 0.472 0.881 0.508 CB 1.553 51 residues pruned to eliminate duplicates Z: 6 3.691 1.578 0.415 0.298 0.800 0.600 CA 1.158 6 residues pruned to eliminate duplicates Z: 34 28.270 2.246 0.678 0.424 0.879 0.545 CB 1.607 34 residues pruned to eliminate duplicates Z: 38 27.459 2.150 0.629 0.422 0.892 0.541 CB 1.566 38 residues pruned to eliminate duplicates Z: 35 26.061 2.153 0.593 0.481 0.853 0.529 CB 1.558 35 residues pruned to eliminate duplicates Z: 32 29.870 2.212 0.639 0.440 0.935 0.581 CB 1.682 32 residues pruned to eliminate duplicates Z: 38 27.956 2.177 0.659 0.425 0.892 0.568 CB 1.542 38 residues pruned to eliminate duplicates Z: 33 28.938 2.225 0.634 0.438 0.906 0.594 CB 1.655 33 residues pruned to eliminate duplicates Z: 33 26.112 2.193 0.493 0.435 0.938 0.656 CB 1.609 33 residues pruned to eliminate duplicates Z: 30 24.444 2.129 0.623 0.428 0.897 0.621 CB 1.578 30 residues pruned to eliminate duplicates Z: 32 29.522 2.226 0.525 0.497 0.935 0.613 CB 1.675 32 residues pruned to eliminate duplicates Z: 35 25.907 2.203 0.517 0.460 0.882 0.588 CB 1.569 35 residues pruned to eliminate duplicates Z: 59 28.898 2.121 0.492 0.421 0.879 0.655 CB 1.480 59 residues pruned to eliminate duplicates Z: 35 21.306 2.092 0.423 0.390 0.912 0.647 CB 1.512 35 residues pruned to eliminate duplicates Z: 33 28.786 2.158 0.500 0.494 0.969 0.562 CB 1.633 33 residues pruned to eliminate duplicates Z: 38 26.386 2.225 0.422 0.441 0.892 0.622 CB 1.634 38 residues pruned to eliminate duplicates Z: 34 21.039 2.070 0.617 0.401 0.818 0.636 CB 1.485 34 residues pruned to eliminate duplicates Z: 26 26.090 2.171 0.445 0.475 1.000 0.760 CB 1.705 26 residues pruned to eliminate duplicates Z: 33 27.254 2.244 0.611 0.457 0.844 0.719 CB 1.650 33 residues pruned to eliminate duplicates Z: 25 23.199 2.166 0.466 0.435 0.958 0.708 CA 1.664 25 residues pruned to eliminate duplicates Z: 37 25.069 2.185 0.454 0.434 0.889 0.667 CB 1.584 37 residues pruned to eliminate duplicates Z: 31 29.255 2.215 0.590 0.465 0.933 0.667 CB 1.685 31 residues pruned to eliminate duplicates Z: 34 25.863 2.193 0.562 0.448 0.879 0.667 CB 1.578 34 residues pruned to eliminate duplicates Z: 17 15.151 2.165 0.621 0.301 0.938 0.750 CB 1.437 17 residues pruned to eliminate duplicates Z: 41 25.359 2.084 0.571 0.402 0.875 0.625 CB 1.552 41 residues pruned to eliminate duplicates Z: 37 27.574 2.191 0.615 0.439 0.889 0.694 CB 1.556 37 residues pruned to eliminate duplicates Z: 29 20.625 2.040 0.472 0.438 0.893 0.643 CB 1.550 29 residues pruned to eliminate duplicates Z: 34 25.451 2.150 0.593 0.463 0.879 0.636 CB 1.528 34 residues pruned to eliminate duplicates Z: 10 10.756 2.171 1.193 0.386 0.667 0.556 CB 1.274 10 residues pruned to eliminate duplicates Z: 38 25.939 2.164 0.631 0.407 0.892 0.676 CB 1.493 38 residues pruned to eliminate duplicates Z: 35 54.726 2.392 0.915 0.655 0.912 0.647 C 1.946 35 residues pruned to eliminate duplicates Z: 34 53.537 2.420 0.905 0.645 0.909 0.667 CB 1.943 34 residues pruned to eliminate duplicates Z: 33 55.733 2.454 0.880 0.694 0.906 0.688 CB 1.974 33 residues pruned to eliminate duplicates Z: 32 62.834 2.449 1.016 0.699 0.968 0.677 CB 1.970 32 residues pruned to eliminate duplicates Z: 32 51.013 2.391 0.742 0.700 0.968 0.645 CB 1.894 32 residues pruned to eliminate duplicates Z: 33 52.076 2.376 0.859 0.678 0.938 0.688 CB 1.887 33 residues pruned to eliminate duplicates Z: 40 39.841 2.324 0.619 0.581 0.872 0.692 CB 1.799 40 residues pruned to eliminate duplicates Z: 33 55.322 2.397 0.884 0.691 0.938 0.594 CB 1.938 33 residues pruned to eliminate duplicates Z: 33 54.746 2.424 0.900 0.695 0.906 0.625 CB 1.940 33 residues pruned to eliminate duplicates Z: 32 54.870 2.428 0.931 0.717 0.871 0.677 CB 1.984 32 residues pruned to eliminate duplicates Z: 34 50.032 2.347 0.802 0.676 0.939 0.636 CA 1.864 34 residues pruned to eliminate duplicates Z: 70 48.488 2.265 0.714 0.528 0.884 0.594 CB 1.654 70 residues pruned to eliminate duplicates Z: 34 52.590 2.363 0.933 0.664 0.909 0.636 C 1.895 34 residues pruned to eliminate duplicates Z: 33 54.444 2.414 0.919 0.672 0.938 0.656 CB 1.891 33 residues pruned to eliminate duplicates Z: 55 56.526 2.441 0.911 0.549 0.852 0.648 CB 1.844 55 residues pruned to eliminate duplicates Z: 37 50.836 2.437 1.015 0.650 0.833 0.667 CB 1.800 37 residues pruned to eliminate duplicates Z: 34 54.587 2.386 0.915 0.661 0.939 0.606 C 1.907 34 residues pruned to eliminate duplicates Z: 25 50.319 2.299 0.908 0.738 1.000 0.833 CA 1.891 25 residues pruned to eliminate duplicates Z: 34 57.987 2.411 0.982 0.673 0.939 0.727 CB 1.916 34 residues pruned to eliminate duplicates Z: 37 53.079 2.354 1.032 0.655 0.889 0.667 CB 1.802 37 residues pruned to eliminate duplicates Z: 39 57.898 2.324 1.065 0.668 0.921 0.711 CB 1.819 39 residues pruned to eliminate duplicates Z: 34 58.090 2.413 1.018 0.666 0.909 0.667 C 1.959 34 residues pruned to eliminate duplicates Z: 33 51.990 2.363 0.851 0.672 0.938 0.719 CA 1.912 33 residues pruned to eliminate duplicates Z: 111 67.625 2.351 0.829 0.549 0.864 0.591 CB 1.656 117 residues pruned to eliminate duplicates Z: 35 54.801 2.360 0.956 0.684 0.912 0.618 C 1.887 35 residues pruned to eliminate duplicates Z: 31 68.308 2.468 1.152 0.746 0.933 0.800 CB 2.019 31 residues pruned to eliminate duplicates Z: 34 42.617 2.218 1.043 0.582 0.879 0.545 CB 1.721 34 residues pruned to eliminate duplicates Z: 35 54.663 2.369 1.059 0.669 0.882 0.588 CB 1.864 35 residues pruned to eliminate duplicates Z: 32 58.176 2.398 0.914 0.717 0.968 0.677 CB 1.934 32 residues pruned to eliminate duplicates Z: 34 51.824 2.365 0.887 0.711 0.879 0.697 C 1.900 34 residues pruned to eliminate duplicates Z: 39 31.653 2.287 0.979 0.428 0.711 0.474 CB 1.720 39 residues pruned to eliminate duplicates Z: 38 51.154 2.322 0.977 0.666 0.892 0.622 CB 1.762 38 residues pruned to eliminate duplicates Z: 37 54.483 2.399 1.033 0.646 0.889 0.611 CB 1.828 37 residues pruned to eliminate duplicates Z: 40 34.740 2.367 0.821 0.436 0.846 0.462 CB 1.629 40 residues pruned to eliminate duplicates Z: 57 58.478 2.398 0.960 0.597 0.857 0.607 CB 1.769 57 residues pruned to eliminate duplicates Z: 37 48.874 2.387 0.880 0.678 0.861 0.583 CB 1.789 37 residues pruned to eliminate duplicates Z: 6 2.398 2.184 0.404 0.297 0.600 0.400 CB 0.731 6 residues pruned to eliminate duplicates Z: 29 23.542 2.359 0.724 0.374 0.786 0.607 CB 1.593 29 residues pruned to eliminate duplicates Z: 22 24.801 2.452 0.619 0.444 0.810 0.619 CB 1.785 22 residues pruned to eliminate duplicates Z: 24 23.312 2.427 0.643 0.421 0.783 0.609 CB 1.692 24 residues pruned to eliminate duplicates Z: 25 21.775 2.298 0.681 0.387 0.833 0.458 CB 1.555 25 residues pruned to eliminate duplicates Z: 30 22.293 2.284 0.751 0.383 0.724 0.552 CB 1.620 30 residues pruned to eliminate duplicates Z: 25 18.462 2.301 0.524 0.399 0.750 0.542 CB 1.595 25 residues pruned to eliminate duplicates Z: 21 22.942 2.378 0.535 0.422 0.850 0.600 CB 1.793 21 residues pruned to eliminate duplicates Z: 20 23.754 2.425 0.586 0.455 0.842 0.737 CB 1.762 20 residues pruned to eliminate duplicates Z: 22 28.536 2.336 0.666 0.469 0.905 0.571 CB 1.825 22 residues pruned to eliminate duplicates Z: 29 28.880 2.238 0.672 0.522 0.893 0.607 CB 1.599 29 residues pruned to eliminate duplicates Z: 20 21.352 2.484 0.534 0.457 0.789 0.737 CB 1.702 20 residues pruned to eliminate duplicates Z: 18 16.243 2.272 0.600 0.341 0.824 0.647 CB 1.566 18 residues pruned to eliminate duplicates Z: 10 22.693 2.372 1.096 0.522 0.889 0.778 CB 1.674 10 residues pruned to eliminate duplicates Z: 50 37.469 2.373 0.716 0.425 0.796 0.571 CB 1.786 50 residues pruned to eliminate duplicates Z: 19 24.779 2.494 0.519 0.507 0.833 0.778 CB 1.837 19 residues pruned to eliminate duplicates Z: 22 12.427 2.196 0.508 0.283 0.762 0.571 CB 1.373 22 residues pruned to eliminate duplicates Z: 27 24.972 2.373 0.632 0.447 0.808 0.538 CB 1.653 27 residues pruned to eliminate duplicates Z: 20 24.992 2.402 0.640 0.479 0.895 0.737 CB 1.663 20 residues pruned to eliminate duplicates Z: 13 5.648 1.895 0.623 0.303 0.667 0.333 CB 0.990 13 residues pruned to eliminate duplicates Z: 32 25.175 2.285 0.672 0.436 0.839 0.581 CB 1.508 32 residues pruned to eliminate duplicates Z: 35 26.682 2.289 0.764 0.437 0.882 0.706 CB 1.371 35 residues pruned to eliminate duplicates Z: 35 23.774 2.193 0.670 0.415 0.853 0.588 CB 1.427 35 residues pruned to eliminate duplicates Z: 6 5.226 1.969 0.561 0.100 0.800 0.400 CA 1.584 Z: 17 32.428 2.440 0.587 0.759 0.875 0.812 CB 1.900 23 residues pruned to eliminate duplicates Z: 55 43.615 2.184 0.775 0.679 0.889 0.704 CB 1.461 55 residues pruned to eliminate duplicates Z: 30 32.371 2.264 0.655 0.599 0.931 0.690 CB 1.568 30 residues pruned to eliminate duplicates Z: 92 66.480 2.270 0.768 0.644 0.923 0.703 CB 1.644 92 residues pruned to eliminate duplicates Z: 46 32.618 2.197 0.550 0.568 0.956 0.622 CB 1.399 46 residues pruned to eliminate duplicates Z: 138 79.906 2.296 0.683 0.618 0.927 0.686 CB 1.705 138 residues pruned to eliminate duplicates Z: 24 31.495 2.366 0.600 0.642 0.870 0.739 CB 1.747 24 residues pruned to eliminate duplicates Z: 73 47.966 2.180 0.740 0.620 0.889 0.736 CB 1.497 73 residues pruned to eliminate duplicates Z: 134 77.255 2.257 0.712 0.631 0.917 0.722 CB 1.672 134 residues pruned to eliminate duplicates Z: 61 50.952 2.210 0.790 0.661 0.933 0.683 CB 1.535 61 residues pruned to eliminate duplicates Z: 90 66.778 2.277 0.788 0.649 0.899 0.742 CB 1.684 90 residues pruned to eliminate duplicates Z: 73 54.692 2.201 0.796 0.647 0.944 0.778 CB 1.505 73 residues pruned to eliminate duplicates Z: 28 38.722 2.312 0.863 0.611 0.963 0.704 CB 1.618 28 residues pruned to eliminate duplicates Z: 58 52.959 2.242 0.727 0.691 0.947 0.825 CB 1.605 58 residues pruned to eliminate duplicates Z: 60 52.960 2.184 0.825 0.665 0.949 0.780 CB 1.564 60 residues pruned to eliminate duplicates Z: 56 58.203 2.275 0.932 0.699 0.945 0.764 CB 1.575 56 residues pruned to eliminate duplicates Z: 114 83.183 2.321 0.789 0.665 0.929 0.743 CB 1.741 114 residues pruned to eliminate duplicates Z: 54 55.593 2.260 0.890 0.708 0.925 0.811 CB 1.601 54 residues pruned to eliminate duplicates Z: 61 59.028 2.261 0.812 0.650 0.917 0.767 CB 1.765 61 residues pruned to eliminate duplicates Z: 59 60.217 2.239 1.044 0.693 0.931 0.707 CB 1.555 59 residues pruned to eliminate duplicates Z: 54 54.563 2.248 0.860 0.701 0.962 0.755 CB 1.551 54 residues pruned to eliminate duplicates Z: 51 61.752 2.262 1.002 0.741 0.960 0.700 CB 1.619 51 residues pruned to eliminate duplicates Z: 53 57.045 2.278 0.917 0.700 0.923 0.692 CB 1.637 53 residues pruned to eliminate duplicates Z: 32 44.690 2.108 1.040 0.751 0.968 0.742 CB 1.542 32 residues pruned to eliminate duplicates Z: 31 40.406 2.085 1.064 0.748 1.000 0.800 CB 1.374 31 residues pruned to eliminate duplicates Z: 112 90.047 2.326 0.810 0.687 0.973 0.730 CB 1.758 112 residues pruned to eliminate duplicates Z: 55 60.123 2.247 0.966 0.713 0.963 0.870 CB 1.586 55 residues pruned to eliminate duplicates Z: 91 72.835 2.267 0.919 0.624 0.933 0.700 CB 1.682 91 residues pruned to eliminate duplicates Z: 58 63.535 2.230 1.106 0.707 0.947 0.702 CB 1.567 58 residues pruned to eliminate duplicates Z: 88 70.444 2.244 0.818 0.660 0.931 0.701 CB 1.714 88 residues pruned to eliminate duplicates Z: 117 90.198 2.357 0.885 0.686 0.931 0.741 CB 1.707 117 residues pruned to eliminate duplicates Z: 60 50.587 2.174 1.017 0.651 0.881 0.627 CB 1.481 60 residues pruned to eliminate duplicates Z: 78 54.550 2.184 0.934 0.607 0.948 0.714 CB 1.403 78 residues pruned to eliminate duplicates Z: 31 41.940 2.099 1.119 0.733 0.967 0.700 CB 1.445 31 residues pruned to eliminate duplicates Z: 32 42.017 2.063 1.121 0.740 0.968 0.742 CB 1.438 32 residues pruned to eliminate duplicates Z: 32 48.669 2.059 1.223 0.791 1.000 0.903 CB 1.478 32 residues pruned to eliminate duplicates Z: 55 60.687 2.260 1.064 0.709 0.944 0.704 CB 1.551 55 residues pruned to eliminate duplicates Z: 31 39.833 2.018 1.258 0.728 0.933 0.700 CB 1.393 31 residues pruned to eliminate duplicates Z: 58 61.031 2.256 1.024 0.691 0.965 0.719 CB 1.540 58 residues pruned to eliminate duplicates Z: 32 45.475 2.152 1.130 0.730 1.000 0.774 CB 1.449 32 residues pruned to eliminate duplicates Z: 113 86.516 2.284 0.892 0.671 0.946 0.723 CB 1.706 113 residues pruned to eliminate duplicates Z: 31 48.363 2.182 1.097 0.759 1.000 0.700 CB 1.533 31 residues pruned to eliminate duplicates Z: 59 63.070 2.289 1.102 0.690 0.948 0.690 CB 1.526 59 residues pruned to eliminate duplicates Z: 31 51.186 2.166 1.248 0.752 1.000 0.567 CB 1.533 31 residues pruned to eliminate duplicates Z: 72 58.987 2.268 0.907 0.631 0.915 0.662 CB 1.564 72 residues pruned to eliminate duplicates Z: 56 64.784 2.274 1.083 0.727 0.964 0.764 CB 1.560 56 residues pruned to eliminate duplicates Z: 123 84.182 2.318 0.851 0.664 0.910 0.705 CB 1.677 123 residues pruned to eliminate duplicates Z: 73 59.753 2.234 0.922 0.626 0.931 0.625 CB 1.565 73 residues pruned to eliminate duplicates Z: 54 41.016 2.291 0.620 0.528 0.906 0.660 CB 1.630 54 residues pruned to eliminate duplicates Z: 39 47.570 2.346 0.740 0.591 0.947 0.684 CB 1.830 39 residues pruned to eliminate duplicates Z: 98 74.335 2.290 0.905 0.658 0.897 0.711 CB 1.666 98 residues pruned to eliminate duplicates Z: 63 66.059 2.407 0.766 0.665 0.919 0.742 CB 1.844 63 residues pruned to eliminate duplicates Z: 61 65.337 2.379 0.735 0.669 0.933 0.700 CB 1.874 61 residues pruned to eliminate duplicates Z: 37 49.945 2.348 0.747 0.628 0.972 0.694 CB 1.849 37 residues pruned to eliminate duplicates Z: 95 79.988 2.302 0.862 0.673 0.968 0.606 CB 1.694 95 residues pruned to eliminate duplicates Z: 64 65.454 2.401 0.804 0.648 0.905 0.651 CB 1.833 64 residues pruned to eliminate duplicates Z: 39 43.476 2.270 0.714 0.578 0.921 0.632 CB 1.825 39 residues pruned to eliminate duplicates Z: 62 60.720 2.352 0.682 0.665 0.902 0.721 CB 1.871 62 residues pruned to eliminate duplicates Z: 63 64.611 2.385 0.765 0.648 0.935 0.677 CB 1.816 63 residues pruned to eliminate duplicates Z: 66 66.016 2.337 0.765 0.654 0.954 0.662 CB 1.803 66 residues pruned to eliminate duplicates Z: 66 64.964 2.393 0.777 0.655 0.923 0.708 CB 1.776 66 residues pruned to eliminate duplicates Z: 63 63.933 2.384 0.769 0.645 0.919 0.677 CB 1.829 63 residues pruned to eliminate duplicates Z: 62 71.092 2.383 0.830 0.676 0.951 0.705 CB 1.866 62 residues pruned to eliminate duplicates Z: 41 45.500 2.331 0.905 0.561 0.900 0.625 CB 1.696 41 residues pruned to eliminate duplicates Z: 32 43.349 2.279 0.842 0.626 0.935 0.710 CB 1.761 32 residues pruned to eliminate duplicates Z: 63 70.471 2.389 0.892 0.664 0.935 0.694 CB 1.818 63 residues pruned to eliminate duplicates Z: 97 78.578 2.285 0.960 0.661 0.927 0.688 CB 1.663 97 residues pruned to eliminate duplicates Z: 62 67.475 2.347 0.947 0.634 0.951 0.689 CB 1.753 62 residues pruned to eliminate duplicates Z: 74 61.011 2.224 0.929 0.630 0.945 0.630 CB 1.558 74 residues pruned to eliminate duplicates Z: 64 74.804 2.404 0.941 0.655 0.952 0.730 CB 1.836 63 residues pruned to eliminate duplicates Z: 15 38.423 2.115 1.097 0.884 1.000 0.643 C 1.672 15 residues pruned to eliminate duplicates Z: 34 47.356 2.365 1.040 0.599 0.909 0.636 CB 1.710 34 residues pruned to eliminate duplicates Z: 120 91.040 2.336 0.930 0.673 0.941 0.706 CB 1.676 120 residues pruned to eliminate duplicates Z: 61 64.261 2.370 0.756 0.689 0.917 0.717 CB 1.829 61 residues pruned to eliminate duplicates Z: 120 85.579 2.321 0.880 0.666 0.924 0.697 CB 1.668 120 residues pruned to eliminate duplicates Z: 35 48.444 2.393 1.034 0.602 0.882 0.618 CB 1.756 35 residues pruned to eliminate duplicates Z: 86 77.207 2.303 0.984 0.638 0.941 0.624 CB 1.711 86 residues pruned to eliminate duplicates Z: 39 38.382 2.214 0.913 0.541 0.868 0.579 CB 1.626 39 residues pruned to eliminate duplicates Z: 37 46.167 2.284 1.103 0.609 0.889 0.667 CB 1.626 37 residues pruned to eliminate duplicates Z: 53 53.841 2.319 0.821 0.566 0.981 0.654 CB 1.691 53 residues pruned to eliminate duplicates Z: 125 83.915 2.271 0.965 0.639 0.935 0.685 CB 1.585 125 residues pruned to eliminate duplicates Z: 63 72.348 2.379 0.931 0.676 0.935 0.677 CB 1.818 63 residues pruned to eliminate duplicates Z: 6 5.528 1.568 0.833 0.342 0.800 0.600 N 1.276 6 residues pruned to eliminate duplicates Z: 73 63.133 2.318 0.856 0.615 0.903 0.625 CB 1.718 73 residues pruned to eliminate duplicates Z: 67 57.904 2.298 0.866 0.619 0.909 0.667 CB 1.633 67 residues pruned to eliminate duplicates Z: 29 44.632 2.340 0.748 0.715 0.893 0.714 CB 1.901 29 residues pruned to eliminate duplicates Z: 29 43.097 2.340 0.761 0.693 0.929 0.714 CB 1.784 29 residues pruned to eliminate duplicates Z: 29 45.555 2.345 0.898 0.717 0.893 0.786 CB 1.781 29 residues pruned to eliminate duplicates Z: 6 10.464 1.806 0.797 0.528 1.000 0.000 C 1.403 6 residues pruned to eliminate duplicates Z: 61 65.861 2.366 0.904 0.656 0.917 0.683 CB 1.781 61 residues pruned to eliminate duplicates Z: 26 49.113 2.437 0.746 0.754 0.960 0.720 CB 1.919 26 residues pruned to eliminate duplicates Z: 28 42.337 2.301 0.629 0.692 0.963 0.667 CB 1.895 28 residues pruned to eliminate duplicates Z: 28 50.633 2.447 0.808 0.736 0.926 0.778 CB 1.925 28 residues pruned to eliminate duplicates Z: 136 93.527 2.311 0.968 0.650 0.941 0.719 CB 1.636 136 residues pruned to eliminate duplicates Z: 27 46.895 2.430 0.756 0.735 0.923 0.654 CB 1.890 27 residues pruned to eliminate duplicates Z: 29 52.677 2.322 0.962 0.712 0.964 0.679 C 1.870 30 residues pruned to eliminate duplicates Z: 18 53.799 2.285 1.159 0.930 1.000 0.706 CA 1.849 18 residues pruned to eliminate duplicates Z: 18 51.778 2.298 1.066 0.932 1.000 0.882 CB 1.847 18 residues pruned to eliminate duplicates Z: 28 57.107 2.418 1.084 0.736 0.926 0.741 C 1.906 28 residues pruned to eliminate duplicates Z: 19 45.801 2.202 1.013 0.904 1.000 0.722 CB 1.735 19 residues pruned to eliminate duplicates Z: 64 74.369 2.386 1.064 0.657 0.905 0.746 CB 1.819 64 residues pruned to eliminate duplicates Z: 28 54.265 2.366 1.013 0.708 1.000 0.667 CB 1.815 28 residues pruned to eliminate duplicates Z: 18 47.531 2.305 0.984 0.937 0.941 0.765 CB 1.863 18 residues pruned to eliminate duplicates Z: 28 52.789 2.421 0.985 0.723 0.889 0.704 CB 1.944 28 residues pruned to eliminate duplicates Z: 28 54.820 2.394 0.939 0.732 0.963 0.630 C 1.916 28 residues pruned to eliminate duplicates Z: 29 54.123 2.348 0.998 0.727 0.964 0.714 C 1.843 29 residues pruned to eliminate duplicates Z: 29 52.727 2.356 1.006 0.705 0.929 0.643 C 1.884 29 residues pruned to eliminate duplicates Z: 28 58.941 2.358 1.084 0.726 1.000 0.593 C 1.883 28 residues pruned to eliminate duplicates 618 residues left after pruning, divided into chains as follows: A: 6 B: 612 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 33.17 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.511, Connect. = 0.763 for dens.mod. cycle 1 = 0.300, Contrast = 0.584, Connect. = 0.790 for dens.mod. cycle 2 = 0.300, Contrast = 0.699, Connect. = 0.822 for dens.mod. cycle 3 = 0.300, Contrast = 0.708, Connect. = 0.826 for dens.mod. cycle 4 = 0.300, Contrast = 0.719, Connect. = 0.829 for dens.mod. cycle 5 = 0.300, Contrast = 0.724, Connect. = 0.831 for dens.mod. cycle 6 = 0.300, Contrast = 0.730, Connect. = 0.833 for dens.mod. cycle 7 = 0.300, Contrast = 0.734, Connect. = 0.834 for dens.mod. cycle 8 = 0.300, Contrast = 0.738, Connect. = 0.835 for dens.mod. cycle 9 = 0.300, Contrast = 0.741, Connect. = 0.835 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5024 peaks > 0.5 sigma used to seed fragment search Space for about 918 unique residues taking solvent into account 1083 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 22 42.166 2.307 0.596 0.915 1.000 0.810 CB 1.766 B: 13 30.634 2.434 0.464 0.868 0.917 0.833 CB 1.978 13 residues pruned to eliminate duplicates C: 21 39.876 2.372 0.431 0.937 1.000 0.850 CB 1.827 21 residues pruned to eliminate duplicates D: 19 44.490 2.470 0.504 0.928 1.000 1.000 CA 1.976 E: 21 41.039 2.361 0.541 0.935 1.000 0.850 CB 1.758 21 residues pruned to eliminate duplicates F: 21 40.818 2.350 0.563 0.941 1.000 0.900 CB 1.725 21 residues pruned to eliminate duplicates G: 15 57.039 2.553 0.998 0.927 1.000 0.857 CA 2.094 H: 20 39.828 2.404 0.491 0.954 1.000 0.895 CB 1.754 I: 18 56.827 2.576 0.875 0.907 1.000 0.824 C 2.028 19 residues pruned to eliminate duplicates J: 20 47.125 2.383 0.810 0.927 1.000 0.789 CB 1.756 20 residues pruned to eliminate duplicates K: 22 28.333 2.244 0.248 0.911 1.000 0.952 CB 1.565 22 residues pruned to eliminate duplicates L: 20 41.559 2.401 0.575 0.938 1.000 0.842 CB 1.753 20 residues pruned to eliminate duplicates M: 40 50.406 2.409 0.824 0.627 0.872 0.667 CB 1.869 N: 16 52.808 2.531 0.961 0.900 1.000 0.933 CA 1.962 15 residues pruned to eliminate duplicates O: 17 53.318 2.569 0.828 0.893 1.000 0.812 CB 2.038 17 residues pruned to eliminate duplicates P: 19 52.566 2.502 0.767 0.919 1.000 0.833 CA 1.976 19 residues pruned to eliminate duplicates Q: 21 42.165 2.372 0.557 0.935 1.000 0.950 CB 1.779 21 residues pruned to eliminate duplicates R: 16 42.277 2.570 0.646 0.874 0.933 0.733 C 2.012 S: 21 42.351 2.380 0.476 0.954 1.000 0.950 CB 1.855 22 residues pruned to eliminate duplicates T: 19 49.255 2.269 1.011 0.906 1.000 0.833 CB 1.809 19 residues pruned to eliminate duplicates U: 22 30.647 2.519 0.773 0.480 0.857 0.714 CB 1.784 V: 17 36.383 2.262 0.803 0.849 0.875 0.812 C 1.890 17 residues pruned to eliminate duplicates W: 21 39.882 2.351 0.573 0.929 0.950 0.950 CB 1.776 21 residues pruned to eliminate duplicates X: 17 47.083 2.419 0.876 0.915 1.000 0.875 CA 1.833 17 residues pruned to eliminate duplicates Y: 18 43.763 2.316 0.776 0.940 1.000 0.882 CB 1.793 18 residues pruned to eliminate duplicates Z: 19 51.832 2.420 0.896 0.909 0.944 0.889 CA 2.002 19 residues pruned to eliminate duplicates Z: 17 49.216 2.375 0.940 0.897 1.000 0.688 CA 1.912 17 residues pruned to eliminate duplicates Z: 19 57.893 2.462 0.931 0.910 1.000 0.833 C 2.036 18 residues pruned to eliminate duplicates Z: 21 30.242 2.326 0.229 0.949 1.000 0.900 CB 1.632 21 residues pruned to eliminate duplicates Z: 17 40.293 2.386 0.756 0.883 0.938 0.750 C 1.855 17 residues pruned to eliminate duplicates Z: 18 53.960 2.558 0.908 0.921 0.941 0.824 C 2.006 18 residues pruned to eliminate duplicates Z: 25 29.135 2.466 0.756 0.451 0.833 0.625 CB 1.733 25 residues pruned to eliminate duplicates Z: 17 44.035 2.413 0.869 0.897 0.938 0.875 CA 1.863 17 residues pruned to eliminate duplicates Z: 16 42.815 2.305 0.852 0.891 1.000 1.000 CA 1.863 Z: 19 47.157 2.260 0.960 0.912 1.000 0.889 CB 1.777 19 residues pruned to eliminate duplicates Z: 19 40.784 2.378 0.553 0.930 1.000 0.833 CB 1.821 19 residues pruned to eliminate duplicates Z: 15 52.427 2.546 0.815 0.939 1.000 0.786 CA 2.108 15 residues pruned to eliminate duplicates Z: 19 41.459 2.198 0.841 0.905 1.000 0.889 CB 1.719 19 residues pruned to eliminate duplicates Z: 18 42.486 2.468 0.491 0.926 1.000 0.941 CB 1.964 18 residues pruned to eliminate duplicates Z: 20 50.817 2.383 0.970 0.943 1.000 0.684 CB 1.721 20 residues pruned to eliminate duplicates Z: 16 48.159 2.383 0.995 0.924 1.000 1.000 CA 1.837 16 residues pruned to eliminate duplicates Z: 19 50.318 2.450 0.862 0.911 0.944 0.889 C 1.950 19 residues pruned to eliminate duplicates Z: 16 45.604 2.499 0.907 0.897 0.933 0.867 CA 1.896 16 residues pruned to eliminate duplicates Z: 18 45.552 2.502 0.578 0.954 1.000 0.941 CB 1.924 18 residues pruned to eliminate duplicates Z: 19 50.286 2.489 0.657 0.929 1.000 0.944 C 2.012 19 residues pruned to eliminate duplicates Z: 32 28.437 2.441 0.694 0.453 0.871 0.452 CB 1.488 Z: 18 47.755 2.360 0.760 0.935 1.000 1.000 CA 1.943 18 residues pruned to eliminate duplicates Z: 17 47.758 2.357 0.974 0.885 1.000 0.938 CA 1.853 17 residues pruned to eliminate duplicates Z: 18 43.469 2.286 0.892 0.917 1.000 0.882 CB 1.720 18 residues pruned to eliminate duplicates Z: 16 55.889 2.488 1.121 0.865 1.000 0.733 CA 2.002 16 residues pruned to eliminate duplicates Z: 18 43.362 2.299 0.746 0.874 1.000 0.824 CA 1.906 18 residues pruned to eliminate duplicates Z: 15 37.724 2.544 0.536 0.919 0.857 0.786 C 2.122 15 residues pruned to eliminate duplicates Z: 17 38.216 2.273 1.059 0.860 0.875 0.688 C 1.715 Z: 15 45.429 2.642 0.597 0.917 1.000 0.929 C 2.031 15 residues pruned to eliminate duplicates Z: 9 19.807 2.306 0.483 0.794 1.000 0.625 CA 1.582 Z: 15 49.536 2.649 0.864 0.913 0.929 0.786 C 2.044 16 residues pruned to eliminate duplicates Z: 21 40.317 2.331 0.614 0.917 1.000 0.800 CB 1.691 21 residues pruned to eliminate duplicates Z: 77 68.348 2.523 0.791 0.552 0.908 0.566 CB 1.818 31 residues pruned to eliminate duplicates Z: 17 61.803 2.602 0.975 0.951 1.000 0.875 C 2.071 17 residues pruned to eliminate duplicates Z: 16 46.442 2.423 0.989 0.914 0.933 0.867 CA 1.885 16 residues pruned to eliminate duplicates Z: 14 33.668 2.236 0.685 0.907 1.000 0.769 CA 1.762 Z: 17 36.693 2.221 0.863 0.830 1.000 0.750 CA 1.667 17 residues pruned to eliminate duplicates Z: 19 56.718 2.469 0.997 0.954 1.000 0.944 CB 1.866 20 residues pruned to eliminate duplicates Z: 23 27.845 2.479 0.742 0.451 0.818 0.682 CB 1.767 23 residues pruned to eliminate duplicates Z: 20 37.543 2.404 0.465 0.951 1.000 0.895 CB 1.686 20 residues pruned to eliminate duplicates Z: 64 76.361 2.448 0.876 0.674 0.952 0.667 CB 1.874 54 residues pruned to eliminate duplicates Z: 13 38.000 2.334 0.753 0.899 1.000 0.750 CA 1.916 13 residues pruned to eliminate duplicates Z: 17 33.137 2.294 0.862 0.856 0.875 0.625 C 1.634 17 residues pruned to eliminate duplicates Z: 8 8.824 1.935 0.687 0.501 0.714 0.429 CB 1.430 Z: 17 40.481 2.337 0.905 0.792 0.938 0.625 C 1.877 19 residues pruned to eliminate duplicates Z: 15 45.550 2.554 0.586 0.927 1.000 1.000 CA 2.106 15 residues pruned to eliminate duplicates Z: 34 45.184 2.439 0.823 0.612 0.909 0.697 CB 1.751 34 residues pruned to eliminate duplicates Z: 13 33.293 2.340 0.524 0.916 1.000 1.000 CB 1.903 13 residues pruned to eliminate duplicates Z: 15 49.569 2.579 0.765 0.930 1.000 0.714 C 2.036 15 residues pruned to eliminate duplicates Z: 15 51.581 2.487 1.069 0.884 1.000 0.929 CA 1.936 16 residues pruned to eliminate duplicates Z: 15 45.107 2.682 0.631 0.919 1.000 0.714 C 1.942 15 residues pruned to eliminate duplicates Z: 17 44.958 2.329 1.025 0.859 0.938 0.625 CA 1.871 17 residues pruned to eliminate duplicates Z: 19 51.974 2.270 1.023 0.939 1.000 0.944 CA 1.853 19 residues pruned to eliminate duplicates Z: 16 46.411 2.376 0.979 0.900 1.000 0.867 CA 1.820 16 residues pruned to eliminate duplicates Z: 29 45.146 2.381 0.754 0.713 0.929 0.714 CB 1.814 29 residues pruned to eliminate duplicates Z: 32 29.809 2.419 0.747 0.444 0.839 0.419 CB 1.600 33 residues pruned to eliminate duplicates Z: 22 33.808 2.256 0.429 0.919 1.000 0.857 CB 1.614 22 residues pruned to eliminate duplicates Z: 10 17.046 1.984 0.641 0.791 0.889 0.889 CB 1.520 10 residues pruned to eliminate duplicates Z: 20 48.712 2.404 0.827 0.936 0.947 0.947 CB 1.870 20 residues pruned to eliminate duplicates Z: 14 57.419 2.745 1.022 0.899 1.000 0.846 C 2.050 14 residues pruned to eliminate duplicates Z: 17 36.966 2.233 0.941 0.895 0.875 0.750 C 1.747 17 residues pruned to eliminate duplicates Z: 8 19.533 2.246 0.447 0.813 1.000 0.857 C 1.730 8 residues pruned to eliminate duplicates Z: 23 26.507 2.538 0.633 0.448 0.864 0.727 CB 1.665 Z: 20 43.315 2.371 0.602 0.932 1.000 0.895 CB 1.827 20 residues pruned to eliminate duplicates Z: 19 35.994 2.217 0.647 0.927 1.000 0.889 CB 1.628 Z: 17 37.737 2.279 0.722 0.822 1.000 0.688 C 1.818 17 residues pruned to eliminate duplicates Z: 8 7.985 2.121 0.656 0.488 0.857 0.429 CB 1.014 8 residues pruned to eliminate duplicates Z: 21 45.012 2.321 0.655 0.940 1.000 0.900 C 1.820 20 residues pruned to eliminate duplicates Z: 20 43.197 2.351 0.691 0.945 1.000 0.632 CB 1.726 20 residues pruned to eliminate duplicates Z: 15 38.699 2.417 0.660 0.894 1.000 0.929 C 1.850 15 residues pruned to eliminate duplicates Z: 16 38.105 2.442 0.748 0.881 0.933 0.867 C 1.787 16 residues pruned to eliminate duplicates Z: 17 37.210 2.399 0.877 0.871 0.875 0.750 C 1.722 17 residues pruned to eliminate duplicates Z: 20 36.571 2.402 0.387 0.929 1.000 0.895 CB 1.762 20 residues pruned to eliminate duplicates Z: 20 42.173 2.417 0.589 0.958 1.000 0.947 CB 1.728 20 residues pruned to eliminate duplicates Z: 31 28.906 2.281 0.482 0.426 0.933 0.467 CB 1.806 Z: 30 24.489 2.351 0.720 0.405 0.862 0.517 CB 1.441 30 residues pruned to eliminate duplicates Z: 19 41.525 2.229 0.771 0.893 1.000 0.833 CB 1.780 19 residues pruned to eliminate duplicates Z: 45 39.749 2.301 0.495 0.612 0.955 0.705 CB 1.641 29 residues pruned to eliminate duplicates Z: 20 39.065 2.322 0.592 0.889 1.000 0.842 CB 1.746 20 residues pruned to eliminate duplicates Z: 14 35.300 2.156 0.829 0.915 1.000 0.769 C 1.755 14 residues pruned to eliminate duplicates Z: 32 31.710 2.427 0.779 0.457 0.903 0.452 CB 1.525 32 residues pruned to eliminate duplicates Z: 16 63.770 2.727 0.874 0.943 1.000 1.000 C 2.232 17 residues pruned to eliminate duplicates Z: 15 52.611 2.577 0.911 0.913 1.000 0.929 CA 2.022 15 residues pruned to eliminate duplicates Z: 18 38.635 2.177 0.827 0.877 1.000 0.765 C 1.711 18 residues pruned to eliminate duplicates Z: 6 4.730 1.537 0.553 0.864 1.000 1.000 C 0.650 5 residues pruned to eliminate duplicates Z: 17 36.490 2.253 0.782 0.844 1.000 0.750 C 1.690 17 residues pruned to eliminate duplicates Z: 18 48.547 2.469 0.886 0.951 0.941 0.824 CB 1.851 18 residues pruned to eliminate duplicates Z: 19 56.404 2.463 0.815 0.945 1.000 0.778 C 2.057 19 residues pruned to eliminate duplicates Z: 17 38.106 2.403 0.548 0.878 1.000 0.812 CA 1.859 17 residues pruned to eliminate duplicates Z: 8 17.859 2.088 0.363 0.830 1.000 0.857 CA 1.783 8 residues pruned to eliminate duplicates Z: 17 52.981 2.441 0.971 0.928 1.000 0.938 CA 1.928 17 residues pruned to eliminate duplicates Z: 91 53.229 2.278 0.678 0.511 0.867 0.633 CB 1.675 5 residues pruned to eliminate duplicates Z: 9 21.106 2.184 0.847 0.844 0.875 0.875 CA 1.572 9 residues pruned to eliminate duplicates Z: 19 54.259 2.436 0.903 0.955 1.000 0.778 CB 1.896 19 residues pruned to eliminate duplicates Z: 16 43.421 2.274 0.971 0.894 1.000 0.800 CA 1.795 16 residues pruned to eliminate duplicates Z: 14 68.902 2.579 1.488 0.920 1.000 0.769 CA 2.097 15 residues pruned to eliminate duplicates Z: 14 27.594 2.158 0.602 0.853 0.923 0.769 CA 1.773 14 residues pruned to eliminate duplicates Z: 44 49.120 2.376 0.573 0.630 0.977 0.651 CB 1.815 28 residues pruned to eliminate duplicates Z: 17 51.613 2.409 1.060 0.912 1.000 0.875 CA 1.842 17 residues pruned to eliminate duplicates Z: 7 19.522 2.484 0.615 0.534 1.000 0.667 CA 1.922 7 residues pruned to eliminate duplicates Z: 16 48.975 2.422 1.135 0.885 0.933 0.867 CA 1.892 14 residues pruned to eliminate duplicates Z: 17 38.119 2.232 0.826 0.862 1.000 0.875 CA 1.717 Z: 17 34.148 2.260 0.711 0.884 1.000 0.750 CA 1.596 17 residues pruned to eliminate duplicates Z: 17 33.506 2.166 0.695 0.926 1.000 0.750 CA 1.600 17 residues pruned to eliminate duplicates Z: 62 61.052 2.380 0.724 0.652 0.885 0.705 CB 1.868 62 residues pruned to eliminate duplicates Z: 19 51.977 2.426 0.747 0.937 1.000 0.944 CA 2.011 19 residues pruned to eliminate duplicates Z: 7 11.344 2.077 0.047 0.902 1.000 1.000 CB 1.519 7 residues pruned to eliminate duplicates Z: 28 26.666 2.438 0.881 0.390 0.815 0.519 CB 1.544 28 residues pruned to eliminate duplicates Z: 88 71.482 2.453 0.624 0.594 0.920 0.678 CB 1.913 87 residues pruned to eliminate duplicates Z: 26 21.037 2.461 0.384 0.428 0.800 0.480 CB 1.664 26 residues pruned to eliminate duplicates Z: 14 41.742 2.546 0.580 0.928 1.000 0.846 C 2.016 14 residues pruned to eliminate duplicates Z: 15 16.414 2.257 0.506 0.493 0.929 0.571 CB 1.401 Z: 35 54.575 2.384 0.924 0.640 0.971 0.647 CB 1.844 17 residues pruned to eliminate duplicates Z: 32 44.196 2.345 0.966 0.575 0.871 0.581 CB 1.839 25 residues pruned to eliminate duplicates Z: 20 51.584 2.411 0.814 0.948 1.000 0.789 CB 1.869 21 residues pruned to eliminate duplicates Z: 16 51.891 2.430 1.088 0.912 1.000 0.867 CA 1.870 16 residues pruned to eliminate duplicates Z: 18 54.212 2.444 1.103 0.948 0.941 0.588 C 1.878 18 residues pruned to eliminate duplicates Z: 50 55.871 2.398 0.675 0.634 0.959 0.714 CB 1.826 50 residues pruned to eliminate duplicates Z: 55 35.299 2.229 0.748 0.445 0.870 0.519 CB 1.499 102 residues pruned to eliminate duplicates Z: 17 38.424 2.242 1.016 0.876 0.938 0.812 C 1.647 17 residues pruned to eliminate duplicates Z: 64 72.974 2.422 0.901 0.649 0.937 0.667 CB 1.857 64 residues pruned to eliminate duplicates Z: 19 39.832 2.254 0.708 0.935 1.000 0.944 CB 1.700 19 residues pruned to eliminate duplicates Z: 17 34.753 2.160 0.809 0.875 0.938 0.625 CA 1.725 17 residues pruned to eliminate duplicates Z: 16 53.525 2.421 1.052 0.884 1.000 0.733 CA 2.010 16 residues pruned to eliminate duplicates Z: 22 41.620 2.257 0.763 0.940 1.000 0.857 CB 1.585 Z: 16 24.038 2.209 0.241 0.897 0.933 0.933 CA 1.736 16 residues pruned to eliminate duplicates Z: 16 58.865 2.503 1.189 0.876 1.000 0.733 C 2.016 16 residues pruned to eliminate duplicates Z: 14 38.480 2.478 0.852 0.922 0.923 0.615 C 1.771 14 residues pruned to eliminate duplicates Z: 47 28.760 2.136 0.557 0.426 0.891 0.609 CB 1.545 31 residues pruned to eliminate duplicates Z: 6 19.175 2.566 0.496 0.847 1.000 1.000 CB 1.658 6 residues pruned to eliminate duplicates Z: 8 13.554 2.100 0.265 0.789 0.857 0.857 CA 1.746 8 residues pruned to eliminate duplicates Z: 49 32.397 2.317 0.680 0.418 0.875 0.479 CB 1.495 Z: 21 43.702 2.361 0.713 0.926 0.950 0.850 CB 1.783 21 residues pruned to eliminate duplicates Z: 16 17.474 2.220 0.597 0.482 0.867 0.533 CB 1.495 16 residues pruned to eliminate duplicates Z: 33 29.232 2.345 0.680 0.449 0.875 0.500 CB 1.580 33 residues pruned to eliminate duplicates Z: 33 51.757 2.463 0.778 0.682 0.938 0.688 CB 1.885 33 residues pruned to eliminate duplicates Z: 61 32.279 2.224 0.477 0.439 0.833 0.567 CB 1.620 61 residues pruned to eliminate duplicates Z: 7 17.961 2.292 0.240 0.809 1.000 0.667 CB 1.972 7 residues pruned to eliminate duplicates Z: 9 17.109 2.023 0.568 0.854 0.875 0.750 CA 1.609 9 residues pruned to eliminate duplicates Z: 33 49.487 2.410 0.998 0.635 0.906 0.656 CB 1.766 33 residues pruned to eliminate duplicates Z: 20 42.557 2.185 0.977 0.904 0.947 0.789 CB 1.700 20 residues pruned to eliminate duplicates Z: 22 55.382 2.306 1.087 0.910 1.000 0.619 CB 1.782 22 residues pruned to eliminate duplicates Z: 17 35.919 2.227 0.684 0.870 1.000 0.938 CA 1.747 17 residues pruned to eliminate duplicates Z: 19 36.831 2.250 0.676 0.927 0.944 0.833 CB 1.708 19 residues pruned to eliminate duplicates Z: 17 53.942 2.372 1.171 0.871 1.000 0.750 CA 1.909 17 residues pruned to eliminate duplicates Z: 19 48.770 2.412 0.770 0.924 0.944 0.944 CA 2.003 19 residues pruned to eliminate duplicates Z: 14 26.718 2.196 0.391 0.876 1.000 0.923 CA 1.763 14 residues pruned to eliminate duplicates Z: 30 26.681 2.452 0.677 0.465 0.828 0.448 CB 1.510 30 residues pruned to eliminate duplicates Z: 7 9.630 2.149 0.078 0.762 0.833 0.500 CB 1.614 7 residues pruned to eliminate duplicates Z: 10 19.666 2.054 0.594 0.891 1.000 0.778 CA 1.439 10 residues pruned to eliminate duplicates Z: 8 10.477 1.956 0.164 0.788 0.857 0.714 CB 1.576 8 residues pruned to eliminate duplicates Z: 20 56.120 2.417 0.998 0.949 1.000 1.000 CB 1.840 20 residues pruned to eliminate duplicates Z: 16 29.348 2.120 0.981 0.840 0.933 0.800 CB 1.443 16 residues pruned to eliminate duplicates Z: 6 21.074 2.507 0.395 0.855 1.000 1.000 C 1.988 6 residues pruned to eliminate duplicates Z: 16 54.828 2.464 1.097 0.919 1.000 0.867 CA 1.931 16 residues pruned to eliminate duplicates Z: 47 53.038 2.309 0.805 0.608 0.935 0.609 CB 1.811 35 residues pruned to eliminate duplicates Z: 20 46.752 2.357 0.868 0.943 1.000 0.632 CB 1.688 20 residues pruned to eliminate duplicates Z: 17 35.842 2.255 0.708 0.916 1.000 0.938 CA 1.643 17 residues pruned to eliminate duplicates Z: 10 11.271 1.913 0.687 0.493 0.889 0.556 CB 1.319 Z: 33 30.432 2.216 0.562 0.433 0.969 0.531 CB 1.720 30 residues pruned to eliminate duplicates Z: 21 56.638 2.293 1.084 0.950 1.000 0.750 CB 1.828 21 residues pruned to eliminate duplicates Z: 17 33.643 2.231 0.647 0.914 1.000 0.938 CA 1.619 17 residues pruned to eliminate duplicates Z: 8 7.082 1.748 0.478 0.437 0.857 0.857 CB 1.289 7 residues pruned to eliminate duplicates Z: 17 24.261 2.151 0.351 0.874 0.938 0.875 CA 1.620 17 residues pruned to eliminate duplicates Z: 19 42.619 2.238 0.940 0.947 0.944 0.722 C 1.693 19 residues pruned to eliminate duplicates Z: 20 19.173 2.247 0.560 0.465 0.947 0.579 CB 1.373 20 residues pruned to eliminate duplicates Z: 16 33.660 2.249 0.721 0.872 0.933 0.800 CA 1.754 16 residues pruned to eliminate duplicates Z: 18 49.664 2.479 0.822 0.921 0.941 0.941 CB 1.995 18 residues pruned to eliminate duplicates Z: 8 13.078 1.964 0.331 0.843 1.000 0.571 CB 1.408 8 residues pruned to eliminate duplicates Z: 15 35.696 2.425 0.669 0.908 0.929 0.714 C 1.802 15 residues pruned to eliminate duplicates Z: 32 65.933 2.440 1.177 0.701 0.968 0.710 CB 1.919 36 residues pruned to eliminate duplicates Z: 17 37.911 2.211 1.026 0.882 0.875 0.875 CA 1.749 17 residues pruned to eliminate duplicates Z: 17 41.425 2.227 1.148 0.944 1.000 0.875 C 1.499 17 residues pruned to eliminate duplicates Z: 17 60.121 2.622 0.968 0.940 1.000 0.750 C 2.023 17 residues pruned to eliminate duplicates Z: 12 42.828 2.422 0.887 0.924 1.000 0.909 C 1.984 12 residues pruned to eliminate duplicates Z: 19 51.858 2.240 1.073 0.922 1.000 0.833 CB 1.851 19 residues pruned to eliminate duplicates Z: 17 48.255 2.330 0.995 0.936 1.000 0.750 C 1.806 17 residues pruned to eliminate duplicates Z: 8 19.475 2.382 0.797 0.823 0.857 0.714 CB 1.516 8 residues pruned to eliminate duplicates Z: 15 60.530 2.518 1.185 0.917 1.000 1.000 CA 2.075 15 residues pruned to eliminate duplicates Z: 40 51.670 2.407 0.940 0.630 0.872 0.667 CB 1.798 41 residues pruned to eliminate duplicates Z: 28 31.369 2.116 0.607 0.746 0.963 0.778 CB 1.479 Z: 8 13.840 1.994 0.302 0.852 1.000 0.857 CB 1.490 8 residues pruned to eliminate duplicates Z: 19 24.891 1.962 0.719 0.933 0.889 0.889 CB 1.366 19 residues pruned to eliminate duplicates Z: 19 41.397 2.176 1.080 0.904 0.889 0.611 CB 1.728 19 residues pruned to eliminate duplicates Z: 8 14.803 2.177 0.440 0.705 1.000 0.714 CB 1.481 8 residues pruned to eliminate duplicates Z: 20 49.266 2.156 1.104 0.952 1.000 0.947 CB 1.717 20 residues pruned to eliminate duplicates Z: 44 50.095 2.401 0.595 0.645 0.953 0.744 CB 1.827 44 residues pruned to eliminate duplicates Z: 18 44.867 2.240 1.003 0.943 1.000 0.765 C 1.681 18 residues pruned to eliminate duplicates Z: 17 42.337 2.221 1.002 0.906 1.000 0.750 CA 1.693 17 residues pruned to eliminate duplicates Z: 70 56.409 2.349 0.616 0.602 0.899 0.638 CB 1.808 70 residues pruned to eliminate duplicates Z: 20 53.735 2.385 1.067 0.950 1.000 0.895 CB 1.725 20 residues pruned to eliminate duplicates Z: 24 36.514 2.474 0.689 0.538 0.957 0.565 CB 1.836 16 residues pruned to eliminate duplicates Z: 17 44.583 2.429 0.717 0.898 1.000 0.875 CA 1.911 17 residues pruned to eliminate duplicates Z: 17 28.975 2.153 0.465 0.896 1.000 0.812 CA 1.645 17 residues pruned to eliminate duplicates Z: 76 53.062 2.282 0.655 0.526 0.920 0.667 CB 1.719 73 residues pruned to eliminate duplicates Z: 16 32.351 2.232 0.581 0.949 1.000 0.933 CA 1.634 16 residues pruned to eliminate duplicates Z: 24 32.280 2.136 0.488 0.923 1.000 0.957 CB 1.488 24 residues pruned to eliminate duplicates Z: 18 43.575 2.238 1.197 0.932 0.941 0.706 C 1.595 18 residues pruned to eliminate duplicates Z: 30 39.050 2.497 0.771 0.490 0.862 0.414 CB 1.921 29 residues pruned to eliminate duplicates Z: 17 37.016 2.247 0.848 0.894 0.938 0.938 CA 1.705 17 residues pruned to eliminate duplicates Z: 8 28.478 2.483 0.564 0.912 1.000 1.000 CA 1.962 8 residues pruned to eliminate duplicates Z: 10 14.325 1.982 0.140 0.892 1.000 0.889 CB 1.518 10 residues pruned to eliminate duplicates Z: 18 29.634 2.075 0.679 0.867 0.941 0.882 CA 1.603 18 residues pruned to eliminate duplicates Z: 17 39.457 2.210 0.859 0.897 1.000 0.812 CA 1.719 17 residues pruned to eliminate duplicates Z: 17 30.870 2.233 0.509 0.891 1.000 0.875 CA 1.647 17 residues pruned to eliminate duplicates Z: 29 25.368 2.432 0.654 0.426 0.821 0.679 CB 1.568 33 residues pruned to eliminate duplicates Z: 43 48.702 2.392 0.668 0.601 0.929 0.690 CB 1.842 43 residues pruned to eliminate duplicates Z: 15 28.090 2.300 0.265 0.926 1.000 0.929 CA 1.808 15 residues pruned to eliminate duplicates Z: 34 56.916 2.376 1.083 0.675 0.909 0.697 CB 1.873 35 residues pruned to eliminate duplicates Z: 10 7.744 1.972 0.503 0.468 0.778 0.556 CB 1.158 11 residues pruned to eliminate duplicates Z: 38 49.269 2.374 0.840 0.606 0.946 0.649 CB 1.773 39 residues pruned to eliminate duplicates Z: 36 43.653 2.212 0.776 0.657 0.943 0.771 CB 1.722 36 residues pruned to eliminate duplicates Z: 17 28.148 2.201 0.529 0.830 0.938 0.875 CA 1.677 17 residues pruned to eliminate duplicates Z: 19 57.684 2.447 1.040 0.948 1.000 0.889 CB 1.881 31 residues pruned to eliminate duplicates Z: 20 21.394 2.499 0.385 0.482 0.842 0.789 CB 1.716 20 residues pruned to eliminate duplicates Z: 7 12.121 2.221 -0.097 0.863 1.000 0.833 CA 1.810 7 residues pruned to eliminate duplicates Z: 43 53.556 2.322 0.836 0.633 0.952 0.595 CB 1.798 36 residues pruned to eliminate duplicates Z: 15 40.826 2.509 0.872 0.844 0.929 0.786 C 1.862 15 residues pruned to eliminate duplicates Z: 17 43.870 2.200 1.077 0.871 1.000 0.812 CA 1.751 17 residues pruned to eliminate duplicates Z: 17 40.385 2.234 0.943 0.911 1.000 0.875 CA 1.648 17 residues pruned to eliminate duplicates Z: 16 36.125 2.385 0.945 0.887 0.867 0.667 C 1.672 16 residues pruned to eliminate duplicates Z: 17 31.467 2.114 0.632 0.924 1.000 0.875 CA 1.602 17 residues pruned to eliminate duplicates Z: 8 13.726 1.966 0.310 0.830 1.000 0.857 CB 1.515 8 residues pruned to eliminate duplicates Z: 24 24.389 1.875 0.436 0.908 1.000 0.870 CB 1.342 Z: 22 27.486 2.563 0.526 0.469 0.857 0.667 CB 1.846 22 residues pruned to eliminate duplicates Z: 18 53.944 2.316 1.140 0.930 1.000 0.941 CB 1.846 18 residues pruned to eliminate duplicates Z: 21 52.873 2.255 1.335 0.955 1.000 0.850 CB 1.543 21 residues pruned to eliminate duplicates Z: 29 30.262 2.254 0.617 0.515 0.893 0.750 CB 1.732 29 residues pruned to eliminate duplicates Z: 41 58.604 2.409 0.903 0.666 0.925 0.700 CB 1.874 42 residues pruned to eliminate duplicates Z: 8 11.841 2.004 0.018 0.869 1.000 0.857 CB 1.602 8 residues pruned to eliminate duplicates Z: 13 30.410 2.302 0.469 0.907 1.000 0.833 CA 1.845 13 residues pruned to eliminate duplicates Z: 21 49.697 2.308 0.944 0.930 1.000 0.750 CB 1.732 21 residues pruned to eliminate duplicates Z: 8 14.540 1.935 0.344 0.857 1.000 0.857 CB 1.558 8 residues pruned to eliminate duplicates Z: 18 27.663 2.004 0.576 0.929 1.000 0.882 CB 1.487 18 residues pruned to eliminate duplicates Z: 40 32.903 1.950 0.990 0.677 0.897 0.615 CB 1.285 7 residues pruned to eliminate duplicates Z: 37 47.592 2.405 0.874 0.644 0.889 0.694 CB 1.730 37 residues pruned to eliminate duplicates Z: 10 11.345 1.949 0.120 0.901 1.000 0.778 CA 1.236 10 residues pruned to eliminate duplicates Z: 20 13.490 2.077 0.609 0.430 0.737 0.421 CB 1.352 12 residues pruned to eliminate duplicates Z: 24 49.348 2.177 1.255 0.909 1.000 0.609 CB 1.488 23 residues pruned to eliminate duplicates Z: 16 40.401 2.265 0.872 0.908 1.000 0.667 CA 1.747 16 residues pruned to eliminate duplicates Z: 24 44.786 2.168 1.070 0.910 1.000 0.870 CB 1.476 24 residues pruned to eliminate duplicates Z: 9 12.446 2.080 -0.021 0.918 1.000 0.875 CA 1.524 9 residues pruned to eliminate duplicates Z: 16 49.127 2.301 1.239 0.919 1.000 0.733 C 1.736 16 residues pruned to eliminate duplicates Z: 8 31.197 2.520 0.786 0.895 1.000 1.000 C 1.878 8 residues pruned to eliminate duplicates Z: 24 50.607 2.189 1.295 0.923 1.000 0.783 CB 1.476 24 residues pruned to eliminate duplicates Z: 23 47.212 2.188 1.174 0.927 1.000 0.909 CB 1.483 23 residues pruned to eliminate duplicates Z: 45 44.586 2.420 0.716 0.578 0.909 0.591 CB 1.652 38 residues pruned to eliminate duplicates Z: 13 21.495 2.347 0.508 0.546 0.917 0.750 C 1.828 13 residues pruned to eliminate duplicates Z: 37 32.063 2.357 0.691 0.415 0.861 0.528 CB 1.702 42 residues pruned to eliminate duplicates Z: 64 76.592 2.439 0.925 0.669 0.921 0.651 CB 1.910 64 residues pruned to eliminate duplicates Z: 32 47.132 2.385 0.729 0.674 0.935 0.710 CB 1.868 32 residues pruned to eliminate duplicates Z: 15 56.038 2.433 1.277 0.898 1.000 0.857 C 1.935 15 residues pruned to eliminate duplicates Z: 37 35.546 2.383 0.682 0.472 0.833 0.417 CB 1.825 37 residues pruned to eliminate duplicates Z: 11 9.213 2.240 0.768 0.374 0.800 0.500 CB 1.052 11 residues pruned to eliminate duplicates Z: 40 23.509 2.177 0.408 0.442 0.846 0.667 CB 1.540 40 residues pruned to eliminate duplicates Z: 19 45.428 2.261 0.829 0.900 1.000 0.944 CB 1.849 19 residues pruned to eliminate duplicates Z: 15 38.966 2.405 0.844 0.896 1.000 0.714 C 1.683 15 residues pruned to eliminate duplicates Z: 41 50.641 2.373 0.975 0.603 0.875 0.625 CB 1.770 41 residues pruned to eliminate duplicates Z: 23 46.688 2.213 1.114 0.933 1.000 0.909 CB 1.485 23 residues pruned to eliminate duplicates Z: 15 40.660 2.469 0.854 0.918 0.857 0.786 C 1.953 15 residues pruned to eliminate duplicates Z: 17 27.835 2.042 0.676 0.937 1.000 0.750 CB 1.415 17 residues pruned to eliminate duplicates Z: 11 11.070 1.861 0.242 0.867 0.900 0.800 CA 1.230 11 residues pruned to eliminate duplicates Z: 7 18.520 2.330 0.433 0.865 1.000 1.000 CB 1.659 7 residues pruned to eliminate duplicates Z: 17 37.051 2.180 0.775 0.894 1.000 0.875 CA 1.716 17 residues pruned to eliminate duplicates Z: 22 43.977 2.258 0.669 0.915 1.000 0.762 CB 1.799 22 residues pruned to eliminate duplicates Z: 29 45.089 2.379 0.574 0.746 0.964 0.786 CB 1.893 29 residues pruned to eliminate duplicates Z: 25 24.618 2.179 0.641 0.458 0.917 0.667 CB 1.601 25 residues pruned to eliminate duplicates Z: 16 29.585 2.246 0.541 0.857 0.933 0.733 CA 1.743 16 residues pruned to eliminate duplicates Z: 10 19.334 1.975 0.548 0.909 1.000 0.778 CA 1.496 10 residues pruned to eliminate duplicates Z: 36 40.763 2.381 0.654 0.640 0.857 0.686 CB 1.791 36 residues pruned to eliminate duplicates Z: 7 9.187 1.969 0.526 0.503 1.000 0.667 CB 1.245 7 residues pruned to eliminate duplicates Z: 8 11.132 1.999 0.306 0.718 0.857 0.571 CB 1.544 8 residues pruned to eliminate duplicates Z: 17 40.593 2.214 0.917 0.848 1.000 0.812 CA 1.774 17 residues pruned to eliminate duplicates Z: 33 59.728 2.364 1.071 0.687 0.969 0.781 CA 1.875 33 residues pruned to eliminate duplicates Z: 13 30.924 2.318 0.461 0.897 1.000 0.917 CA 1.888 13 residues pruned to eliminate duplicates Z: 18 39.506 2.461 0.509 0.929 0.941 0.941 C 1.918 18 residues pruned to eliminate duplicates Z: 19 24.954 1.945 0.694 0.924 0.944 0.944 CB 1.328 19 residues pruned to eliminate duplicates Z: 24 41.868 2.165 0.902 0.930 1.000 0.957 CB 1.483 24 residues pruned to eliminate duplicates Z: 24 25.139 1.854 0.516 0.890 1.000 0.826 CB 1.342 24 residues pruned to eliminate duplicates Z: 18 28.542 2.016 0.654 0.947 1.000 1.000 CB 1.435 18 residues pruned to eliminate duplicates Z: 16 56.082 2.481 1.101 0.885 1.000 1.000 CA 2.005 16 residues pruned to eliminate duplicates Z: 42 51.734 2.326 0.861 0.629 0.927 0.585 CB 1.784 42 residues pruned to eliminate duplicates Z: 34 45.385 2.368 0.681 0.659 0.909 0.758 CB 1.884 34 residues pruned to eliminate duplicates Z: 9 5.233 2.038 0.408 0.365 0.750 0.625 CB 0.994 9 residues pruned to eliminate duplicates Z: 9 18.511 2.078 0.294 0.906 1.000 1.000 CB 1.730 9 residues pruned to eliminate duplicates Z: 57 48.610 2.470 0.812 0.491 0.857 0.518 CB 1.709 57 residues pruned to eliminate duplicates Z: 18 37.884 2.229 0.833 0.923 0.941 0.765 C 1.679 18 residues pruned to eliminate duplicates Z: 17 38.221 2.240 0.839 0.903 1.000 0.938 CA 1.653 17 residues pruned to eliminate duplicates Z: 9 18.250 2.134 0.362 0.914 1.000 1.000 CB 1.570 9 residues pruned to eliminate duplicates Z: 24 44.075 2.169 1.027 0.917 1.000 0.870 CB 1.475 24 residues pruned to eliminate duplicates Z: 6 8.221 2.029 0.071 0.843 1.000 0.800 CB 1.260 6 residues pruned to eliminate duplicates Z: 14 34.210 2.373 1.204 0.538 0.923 0.615 CB 1.893 14 residues pruned to eliminate duplicates Z: 9 20.014 2.221 0.547 0.761 1.000 0.750 C 1.632 9 residues pruned to eliminate duplicates Z: 17 29.607 2.128 0.558 0.922 1.000 1.000 CA 1.570 17 residues pruned to eliminate duplicates Z: 36 31.452 2.357 0.590 0.427 0.857 0.600 CB 1.785 36 residues pruned to eliminate duplicates Z: 10 17.726 1.941 0.559 0.868 1.000 0.778 CA 1.428 10 residues pruned to eliminate duplicates Z: 9 16.679 2.000 0.480 0.912 1.000 0.875 CB 1.411 9 residues pruned to eliminate duplicates Z: 19 51.114 2.267 1.023 0.919 1.000 0.944 CB 1.852 19 residues pruned to eliminate duplicates Z: 26 21.258 2.224 0.679 0.393 0.880 0.560 CB 1.448 26 residues pruned to eliminate duplicates Z: 10 7.771 1.876 0.627 0.466 0.778 0.556 CB 1.130 10 residues pruned to eliminate duplicates Z: 41 28.343 2.005 0.814 0.602 0.900 0.575 CB 1.242 41 residues pruned to eliminate duplicates Z: 18 44.762 2.305 0.810 0.919 1.000 0.882 CA 1.834 19 residues pruned to eliminate duplicates Z: 63 56.706 2.304 0.679 0.557 0.952 0.694 CB 1.850 63 residues pruned to eliminate duplicates Z: 49 39.656 2.283 0.677 0.541 0.938 0.688 CB 1.533 49 residues pruned to eliminate duplicates Z: 10 11.932 2.220 0.469 0.411 0.778 0.222 C 1.722 10 residues pruned to eliminate duplicates Z: 18 30.915 2.268 0.796 0.801 0.882 0.647 C 1.604 18 residues pruned to eliminate duplicates Z: 20 50.866 2.349 1.033 0.937 1.000 0.632 CB 1.701 20 residues pruned to eliminate duplicates Z: 20 45.750 2.159 0.981 0.930 1.000 0.895 CB 1.716 19 residues pruned to eliminate duplicates Z: 19 45.859 2.256 0.952 0.940 1.000 0.944 C 1.704 19 residues pruned to eliminate duplicates Z: 32 27.165 2.292 0.540 0.388 0.871 0.516 CB 1.788 32 residues pruned to eliminate duplicates Z: 9 5.824 2.144 0.159 0.350 0.625 0.375 CB 1.560 9 residues pruned to eliminate duplicates Z: 17 36.179 2.085 1.009 0.901 0.938 0.938 CA 1.644 17 residues pruned to eliminate duplicates Z: 62 45.265 2.432 0.826 0.445 0.836 0.443 CB 1.653 62 residues pruned to eliminate duplicates Z: 26 23.840 2.341 0.544 0.445 0.880 0.680 CB 1.587 26 residues pruned to eliminate duplicates Z: 19 55.508 2.268 1.179 0.916 1.000 0.833 CB 1.870 19 residues pruned to eliminate duplicates Z: 19 26.812 1.917 0.709 0.937 1.000 1.000 CB 1.342 19 residues pruned to eliminate duplicates Z: 12 18.586 2.344 0.430 0.521 0.909 0.455 CA 1.802 12 residues pruned to eliminate duplicates Z: 34 43.740 2.270 0.681 0.688 1.000 0.758 CB 1.680 34 residues pruned to eliminate duplicates Z: 22 43.014 2.473 0.802 0.691 0.905 0.571 CA 1.955 22 residues pruned to eliminate duplicates Z: 20 51.223 2.313 1.126 0.947 1.000 0.632 CB 1.652 20 residues pruned to eliminate duplicates Z: 28 28.913 2.193 0.788 0.522 0.889 0.519 CB 1.563 28 residues pruned to eliminate duplicates Z: 16 30.135 2.252 0.415 0.935 1.000 1.000 CA 1.702 16 residues pruned to eliminate duplicates Z: 18 30.466 2.012 0.730 0.929 1.000 0.941 CB 1.485 18 residues pruned to eliminate duplicates Z: 18 59.220 2.525 1.087 0.919 1.000 0.882 C 1.920 18 residues pruned to eliminate duplicates Z: 14 18.983 1.909 0.576 0.834 1.000 0.923 CB 1.312 14 residues pruned to eliminate duplicates Z: 17 31.262 2.221 0.555 0.912 1.000 0.875 CA 1.603 17 residues pruned to eliminate duplicates Z: 18 51.448 2.525 0.762 0.929 1.000 0.882 C 1.963 18 residues pruned to eliminate duplicates Z: 15 17.946 2.198 0.591 0.511 0.929 0.429 CB 1.461 15 residues pruned to eliminate duplicates Z: 23 37.517 2.171 0.792 0.797 1.000 0.864 CB 1.585 23 residues pruned to eliminate duplicates Z: 27 33.477 2.184 0.478 0.773 0.962 0.808 CB 1.662 27 residues pruned to eliminate duplicates Z: 20 42.904 2.371 0.608 0.940 1.000 0.842 CB 1.793 20 residues pruned to eliminate duplicates Z: 37 47.203 2.306 0.831 0.672 0.944 0.611 CB 1.683 37 residues pruned to eliminate duplicates Z: 10 13.287 1.959 0.247 0.860 1.000 0.667 CA 1.333 10 residues pruned to eliminate duplicates Z: 38 26.507 2.248 0.391 0.431 0.865 0.703 CB 1.730 38 residues pruned to eliminate duplicates Z: 16 29.153 2.231 0.539 0.876 0.933 0.867 CA 1.706 16 residues pruned to eliminate duplicates Z: 23 51.836 2.241 1.158 0.960 1.000 0.818 CB 1.566 23 residues pruned to eliminate duplicates Z: 15 58.469 2.494 1.174 0.907 1.000 0.929 CA 2.048 16 residues pruned to eliminate duplicates Z: 17 42.704 2.284 0.809 0.947 1.000 1.000 C 1.786 18 residues pruned to eliminate duplicates Z: 6 4.402 1.699 0.243 0.607 0.800 0.800 CA 1.053 6 residues pruned to eliminate duplicates Z: 15 36.874 2.307 0.656 0.926 1.000 0.857 CA 1.809 15 residues pruned to eliminate duplicates Z: 57 58.261 2.429 0.906 0.575 0.893 0.714 CB 1.752 58 residues pruned to eliminate duplicates Z: 40 52.929 2.402 0.781 0.614 0.949 0.692 CB 1.874 40 residues pruned to eliminate duplicates Z: 9 18.200 2.148 0.396 0.885 1.000 0.500 CB 1.550 9 residues pruned to eliminate duplicates Z: 9 21.293 2.230 0.501 0.848 1.000 0.750 C 1.669 9 residues pruned to eliminate duplicates Z: 11 12.932 2.089 0.678 0.434 0.800 0.700 CB 1.562 11 residues pruned to eliminate duplicates Z: 96 82.714 2.346 0.944 0.673 0.937 0.716 CB 1.693 86 residues pruned to eliminate duplicates Z: 10 18.765 2.310 0.486 0.868 0.778 0.667 C 1.712 10 residues pruned to eliminate duplicates Z: 20 33.553 2.275 0.364 0.879 1.000 0.895 CB 1.798 20 residues pruned to eliminate duplicates Z: 21 28.668 2.486 0.762 0.470 0.850 0.750 CB 1.775 21 residues pruned to eliminate duplicates Z: 96 57.375 2.252 0.699 0.524 0.905 0.611 CB 1.660 96 residues pruned to eliminate duplicates Z: 30 28.668 2.430 0.730 0.470 0.862 0.483 CB 1.514 30 residues pruned to eliminate duplicates Z: 38 24.689 2.226 0.455 0.378 0.892 0.568 CB 1.601 38 residues pruned to eliminate duplicates Z: 17 31.347 2.211 0.600 0.802 0.938 0.750 CB 1.816 17 residues pruned to eliminate duplicates Z: 6 4.821 1.815 0.852 0.523 0.600 0.600 N 1.045 6 residues pruned to eliminate duplicates Z: 8 7.819 1.859 0.565 0.414 0.714 0.429 CB 1.556 8 residues pruned to eliminate duplicates Z: 16 28.495 2.239 0.434 0.919 0.933 0.867 CA 1.730 16 residues pruned to eliminate duplicates Z: 92 55.435 2.275 0.577 0.548 0.934 0.670 CB 1.656 92 residues pruned to eliminate duplicates Z: 8 8.852 1.911 0.351 0.662 0.857 0.571 CB 1.301 8 residues pruned to eliminate duplicates Z: 18 36.227 1.962 1.152 0.905 1.000 0.882 CB 1.481 18 residues pruned to eliminate duplicates Z: 18 36.587 2.239 0.636 0.926 1.000 1.000 CB 1.699 18 residues pruned to eliminate duplicates Z: 10 12.011 2.144 0.778 0.373 0.778 0.778 CB 1.546 10 residues pruned to eliminate duplicates Z: 19 58.262 2.258 1.293 0.916 1.000 0.833 CA 1.873 19 residues pruned to eliminate duplicates Z: 6 8.471 2.026 0.510 0.563 0.800 0.600 CA 1.456 6 residues pruned to eliminate duplicates Z: 13 23.626 1.948 0.777 0.870 1.000 0.833 CB 1.438 13 residues pruned to eliminate duplicates Z: 9 10.868 1.777 1.105 0.420 0.750 0.750 N 1.488 9 residues pruned to eliminate duplicates Z: 9 16.560 2.022 0.371 0.882 1.000 1.000 CA 1.529 9 residues pruned to eliminate duplicates Z: 56 56.929 2.420 0.877 0.586 0.873 0.691 CB 1.782 55 residues pruned to eliminate duplicates Z: 24 49.482 2.174 1.267 0.933 1.000 0.739 CB 1.461 24 residues pruned to eliminate duplicates Z: 18 60.868 2.519 1.143 0.938 1.000 0.941 C 1.901 18 residues pruned to eliminate duplicates Z: 19 55.914 2.260 1.252 0.907 1.000 0.722 CB 1.841 19 residues pruned to eliminate duplicates Z: 7 15.796 2.148 0.411 0.797 1.000 0.667 CB 1.640 7 residues pruned to eliminate duplicates Z: 16 23.686 2.266 0.611 0.856 0.800 0.733 C 1.544 16 residues pruned to eliminate duplicates Z: 37 27.660 2.229 0.589 0.435 0.861 0.694 CB 1.616 37 residues pruned to eliminate duplicates Z: 74 48.274 2.230 0.640 0.517 0.904 0.603 CB 1.680 82 residues pruned to eliminate duplicates Z: 23 27.626 1.889 0.632 0.919 1.000 0.727 CB 1.345 23 residues pruned to eliminate duplicates Z: 64 64.782 2.417 0.692 0.655 0.937 0.698 CB 1.846 64 residues pruned to eliminate duplicates Z: 32 62.038 2.434 1.063 0.733 0.935 0.710 CB 1.924 32 residues pruned to eliminate duplicates Z: 24 39.379 2.152 0.834 0.922 1.000 0.957 CB 1.463 24 residues pruned to eliminate duplicates Z: 19 53.139 2.251 1.254 0.913 0.944 0.833 CA 1.849 19 residues pruned to eliminate duplicates Z: 58 32.012 2.173 0.427 0.452 0.947 0.596 CB 1.516 60 residues pruned to eliminate duplicates Z: 18 23.302 2.065 0.283 0.904 0.941 0.824 CA 1.615 18 residues pruned to eliminate duplicates Z: 17 29.314 2.171 0.659 0.831 0.938 0.812 CA 1.631 17 residues pruned to eliminate duplicates Z: 10 17.569 1.884 0.665 0.859 1.000 0.778 CB 1.374 10 residues pruned to eliminate duplicates Z: 63 70.059 2.374 0.948 0.653 0.919 0.694 CB 1.816 63 residues pruned to eliminate duplicates Z: 93 56.206 2.270 0.618 0.522 0.935 0.641 CB 1.671 93 residues pruned to eliminate duplicates Z: 17 30.558 2.080 0.780 0.960 1.000 0.938 CB 1.413 17 residues pruned to eliminate duplicates Z: 8 18.441 2.105 1.180 0.666 0.857 0.714 CB 1.520 8 residues pruned to eliminate duplicates Z: 17 47.829 2.317 1.016 0.934 1.000 0.812 C 1.785 17 residues pruned to eliminate duplicates Z: 19 23.030 2.463 0.790 0.434 0.833 0.722 CB 1.582 19 residues pruned to eliminate duplicates Z: 13 23.503 1.975 0.750 0.873 1.000 0.917 CB 1.430 13 residues pruned to eliminate duplicates Z: 44 42.296 2.223 0.757 0.600 0.907 0.605 CB 1.655 44 residues pruned to eliminate duplicates Z: 9 12.610 1.948 0.211 0.903 1.000 1.000 CA 1.348 9 residues pruned to eliminate duplicates Z: 16 18.678 2.476 0.346 0.454 0.867 0.667 CB 1.752 16 residues pruned to eliminate duplicates Z: 17 35.376 2.176 0.707 0.868 1.000 0.812 CA 1.740 17 residues pruned to eliminate duplicates Z: 24 50.461 2.198 1.212 0.936 1.000 0.913 CB 1.507 24 residues pruned to eliminate duplicates Z: 13 13.568 2.029 0.520 0.485 0.917 0.583 CB 1.407 13 residues pruned to eliminate duplicates Z: 19 29.821 2.166 0.591 0.881 0.944 0.833 CB 1.564 19 residues pruned to eliminate duplicates Z: 88 61.606 2.389 0.662 0.531 0.920 0.667 CB 1.755 88 residues pruned to eliminate duplicates Z: 7 5.923 1.770 0.313 0.348 1.000 0.667 CB 1.226 7 residues pruned to eliminate duplicates Z: 11 14.657 1.985 0.380 0.779 1.000 0.700 CB 1.322 11 residues pruned to eliminate duplicates Z: 10 5.345 1.711 0.545 0.303 0.667 0.444 CB 1.259 10 residues pruned to eliminate duplicates Z: 36 54.104 2.341 1.006 0.668 0.914 0.771 CB 1.823 36 residues pruned to eliminate duplicates Z: 17 41.011 2.346 1.031 0.888 0.938 0.750 C 1.654 17 residues pruned to eliminate duplicates Z: 8 6.093 1.878 0.386 0.373 0.857 0.429 CB 1.182 Z: 15 45.586 2.402 1.171 0.916 0.929 0.929 CA 1.778 15 residues pruned to eliminate duplicates Z: 7 5.588 1.801 0.381 0.611 0.667 0.500 CB 1.239 7 residues pruned to eliminate duplicates Z: 40 49.142 2.324 0.870 0.589 0.923 0.615 CB 1.800 40 residues pruned to eliminate duplicates Z: 40 28.013 2.286 0.475 0.416 0.897 0.564 CB 1.619 40 residues pruned to eliminate duplicates Z: 87 56.117 2.264 0.651 0.559 0.919 0.628 CB 1.664 87 residues pruned to eliminate duplicates Z: 12 21.050 1.977 0.535 0.907 1.000 0.909 CB 1.486 12 residues pruned to eliminate duplicates Z: 17 19.927 2.125 0.182 0.894 0.938 0.875 CA 1.517 17 residues pruned to eliminate duplicates Z: 14 34.229 2.191 0.808 0.890 1.000 0.769 CB 1.724 14 residues pruned to eliminate duplicates Z: 8 14.667 2.134 0.243 0.896 1.000 1.000 CB 1.497 8 residues pruned to eliminate duplicates Z: 19 32.851 1.945 1.033 0.926 1.000 0.778 CB 1.374 18 residues pruned to eliminate duplicates Z: 6 7.080 1.698 1.341 0.606 0.800 0.600 CB 0.900 6 residues pruned to eliminate duplicates Z: 13 19.230 2.220 0.559 0.503 0.917 0.667 CB 1.744 13 residues pruned to eliminate duplicates Z: 27 30.717 2.451 0.529 0.467 0.885 0.654 C 1.879 27 residues pruned to eliminate duplicates Z: 17 30.978 2.232 0.666 0.922 0.938 0.938 CB 1.562 17 residues pruned to eliminate duplicates Z: 13 19.928 1.998 0.443 0.863 1.000 0.750 CB 1.464 13 residues pruned to eliminate duplicates Z: 13 22.709 1.957 0.735 0.857 1.000 0.833 CB 1.423 13 residues pruned to eliminate duplicates Z: 8 14.537 2.396 0.600 0.489 0.857 0.571 CA 1.690 8 residues pruned to eliminate duplicates Z: 22 55.217 2.277 1.340 0.962 0.952 0.857 CB 1.624 22 residues pruned to eliminate duplicates Z: 9 19.653 2.102 0.458 0.913 1.000 0.875 CA 1.604 9 residues pruned to eliminate duplicates Z: 7 5.040 1.761 0.505 0.324 0.667 0.667 CB 1.412 Z: 19 41.683 2.388 0.658 0.909 0.944 0.889 CB 1.864 18 residues pruned to eliminate duplicates Z: 24 31.839 1.846 0.916 0.910 1.000 0.696 CB 1.332 24 residues pruned to eliminate duplicates Z: 16 17.912 2.182 0.692 0.567 0.933 0.600 CB 1.258 16 residues pruned to eliminate duplicates Z: 39 30.010 2.420 0.788 0.408 0.763 0.421 CB 1.624 39 residues pruned to eliminate duplicates Z: 39 35.850 2.076 0.738 0.613 0.947 0.711 CB 1.529 39 residues pruned to eliminate duplicates Z: 6 8.770 1.862 0.289 0.815 1.000 0.600 CA 1.243 6 residues pruned to eliminate duplicates Z: 16 27.501 2.248 0.291 0.928 1.000 0.800 CB 1.714 16 residues pruned to eliminate duplicates Z: 7 8.434 1.783 0.065 0.899 1.000 1.000 CB 1.297 7 residues pruned to eliminate duplicates Z: 11 12.774 1.862 0.379 0.871 0.900 0.700 CA 1.275 11 residues pruned to eliminate duplicates Z: 10 19.563 2.087 0.733 0.790 0.889 0.778 C 1.571 10 residues pruned to eliminate duplicates Z: 66 57.270 2.441 0.721 0.526 0.908 0.646 CB 1.815 66 residues pruned to eliminate duplicates Z: 16 44.439 2.414 0.812 0.901 1.000 0.800 CB 1.873 16 residues pruned to eliminate duplicates Z: 11 10.187 1.818 0.175 0.805 0.900 0.800 CA 1.284 11 residues pruned to eliminate duplicates Z: 8 3.517 1.595 0.285 0.451 0.714 0.286 CB 0.955 8 residues pruned to eliminate duplicates Z: 17 40.201 2.216 1.185 0.934 1.000 0.750 C 1.447 17 residues pruned to eliminate duplicates Z: 8 6.677 1.905 0.299 0.423 0.714 0.571 CA 1.547 8 residues pruned to eliminate duplicates Z: 9 12.066 1.858 0.429 0.716 1.000 0.500 C 1.322 9 residues pruned to eliminate duplicates Z: 22 21.489 2.251 0.761 0.413 0.857 0.571 CB 1.512 18 residues pruned to eliminate duplicates Z: 18 39.128 2.010 1.201 0.945 1.000 0.941 CB 1.484 18 residues pruned to eliminate duplicates Z: 18 48.637 2.386 0.864 0.950 1.000 0.706 CB 1.828 18 residues pruned to eliminate duplicates Z: 11 15.647 1.879 0.493 0.871 1.000 0.700 CA 1.286 11 residues pruned to eliminate duplicates Z: 39 24.389 2.197 0.520 0.392 0.816 0.447 CB 1.628 39 residues pruned to eliminate duplicates Z: 34 28.194 2.203 0.532 0.484 0.909 0.697 CB 1.626 34 residues pruned to eliminate duplicates Z: 7 6.775 1.895 -0.020 0.758 0.833 0.500 CB 1.420 7 residues pruned to eliminate duplicates Z: 19 43.165 2.162 0.964 0.926 1.000 0.722 C 1.680 19 residues pruned to eliminate duplicates Z: 36 27.512 2.200 0.315 0.484 0.943 0.743 CB 1.732 36 residues pruned to eliminate duplicates Z: 22 32.912 1.954 0.744 0.957 1.000 0.905 CB 1.446 23 residues pruned to eliminate duplicates Z: 7 4.954 1.851 0.081 0.358 0.833 0.667 N 1.414 7 residues pruned to eliminate duplicates Z: 99 51.613 2.241 0.547 0.511 0.908 0.633 CB 1.638 99 residues pruned to eliminate duplicates Z: 16 28.160 2.221 0.497 0.868 0.933 0.933 CA 1.713 16 residues pruned to eliminate duplicates Z: 43 54.913 2.363 0.826 0.620 0.952 0.667 CB 1.842 43 residues pruned to eliminate duplicates Z: 24 33.907 1.868 0.995 0.922 1.000 0.913 CB 1.334 23 residues pruned to eliminate duplicates Z: 18 47.290 2.225 1.211 0.956 1.000 0.765 C 1.601 18 residues pruned to eliminate duplicates Z: 6 3.953 1.298 0.194 0.692 1.000 0.200 CB 0.958 6 residues pruned to eliminate duplicates Z: 44 20.021 1.915 0.626 0.552 0.884 0.581 CB 1.055 44 residues pruned to eliminate duplicates Z: 15 18.419 2.106 0.568 0.486 0.929 0.500 CB 1.627 15 residues pruned to eliminate duplicates Z: 17 29.649 2.090 0.720 0.958 1.000 1.000 CB 1.414 17 residues pruned to eliminate duplicates Z: 17 39.366 2.282 0.700 0.918 1.000 1.000 CB 1.789 17 residues pruned to eliminate duplicates Z: 10 18.636 1.993 0.530 0.907 1.000 0.667 CA 1.447 10 residues pruned to eliminate duplicates Z: 8 14.804 2.076 1.115 0.648 0.714 0.714 CA 1.554 8 residues pruned to eliminate duplicates Z: 23 48.409 2.218 1.099 0.929 1.000 0.636 CB 1.552 23 residues pruned to eliminate duplicates Z: 33 30.083 2.384 0.803 0.469 0.875 0.469 CB 1.458 33 residues pruned to eliminate duplicates Z: 16 42.520 2.260 1.081 0.876 0.933 0.933 CA 1.818 16 residues pruned to eliminate duplicates Z: 18 31.178 2.025 0.762 0.948 1.000 0.941 CB 1.464 18 residues pruned to eliminate duplicates Z: 8 12.505 2.008 0.240 0.763 1.000 0.571 CA 1.504 8 residues pruned to eliminate duplicates Z: 24 22.729 2.452 0.643 0.427 0.783 0.652 CB 1.622 24 residues pruned to eliminate duplicates Z: 50 41.712 2.312 0.817 0.542 0.857 0.633 CB 1.587 50 residues pruned to eliminate duplicates Z: 29 28.086 2.419 0.781 0.433 0.893 0.571 CB 1.480 29 residues pruned to eliminate duplicates Z: 8 7.513 1.481 0.524 0.787 0.857 0.429 CB 1.141 Z: 11 19.907 2.137 0.379 0.908 1.000 1.000 CB 1.517 11 residues pruned to eliminate duplicates Z: 14 13.301 1.987 0.407 0.525 0.923 0.385 CB 1.394 8 residues pruned to eliminate duplicates Z: 12 11.620 1.829 0.590 0.458 0.909 0.455 CB 1.383 12 residues pruned to eliminate duplicates Z: 24 32.747 1.853 0.939 0.915 1.000 0.652 CB 1.343 24 residues pruned to eliminate duplicates Z: 28 33.534 2.157 0.703 0.751 0.889 0.741 CB 1.580 28 residues pruned to eliminate duplicates Z: 18 18.793 2.177 0.452 0.485 0.882 0.588 CB 1.660 18 residues pruned to eliminate duplicates Z: 25 29.221 1.848 0.748 0.888 1.000 0.750 CB 1.330 25 residues pruned to eliminate duplicates Z: 11 10.497 1.839 0.134 0.848 1.000 0.900 CA 1.181 11 residues pruned to eliminate duplicates Z: 10 15.695 2.136 0.146 0.932 1.000 1.000 CB 1.493 10 residues pruned to eliminate duplicates Z: 7 10.909 2.213 0.670 0.206 1.000 0.500 CA 1.707 7 residues pruned to eliminate duplicates Z: 9 25.366 2.261 0.780 0.895 1.000 0.875 C 1.597 9 residues pruned to eliminate duplicates Z: 23 39.694 2.188 0.792 0.920 1.000 0.955 CB 1.520 23 residues pruned to eliminate duplicates Z: 24 20.213 1.842 0.236 0.896 1.000 0.870 CB 1.326 24 residues pruned to eliminate duplicates Z: 24 21.386 1.852 0.290 0.900 1.000 0.913 CB 1.333 24 residues pruned to eliminate duplicates Z: 16 33.302 2.241 0.801 0.889 0.933 0.667 C 1.643 16 residues pruned to eliminate duplicates Z: 23 40.335 2.545 0.897 0.575 0.864 0.636 C 1.919 18 residues pruned to eliminate duplicates Z: 15 50.249 2.486 0.949 0.898 1.000 0.786 C 1.983 15 residues pruned to eliminate duplicates Z: 6 4.565 1.564 -0.133 0.833 1.000 0.600 CA 1.130 6 residues pruned to eliminate duplicates Z: 7 10.998 1.968 0.176 0.789 1.000 0.333 CB 1.505 7 residues pruned to eliminate duplicates Z: 74 51.030 2.310 0.765 0.516 0.863 0.630 CB 1.669 74 residues pruned to eliminate duplicates Z: 20 23.665 1.920 0.812 0.672 0.947 0.632 CB 1.406 20 residues pruned to eliminate duplicates Z: 9 8.357 2.163 0.393 0.289 0.750 0.500 CB 1.658 9 residues pruned to eliminate duplicates Z: 47 51.411 2.486 0.715 0.509 0.935 0.500 CB 1.885 47 residues pruned to eliminate duplicates Z: 6 7.331 2.118 0.661 0.338 0.800 0.600 CB 1.390 6 residues pruned to eliminate duplicates Z: 24 17.230 2.097 0.685 0.432 0.913 0.565 CB 1.195 24 residues pruned to eliminate duplicates Z: 10 6.685 2.140 0.561 0.233 0.667 0.444 CB 1.365 10 residues pruned to eliminate duplicates Z: 7 23.146 2.243 0.937 0.793 0.833 0.833 C 2.020 7 residues pruned to eliminate duplicates Z: 25 47.433 2.474 0.547 0.793 1.000 0.792 CB 1.956 25 residues pruned to eliminate duplicates Z: 20 33.751 2.032 0.775 0.959 0.947 0.895 CB 1.554 20 residues pruned to eliminate duplicates Z: 92 55.455 2.254 0.612 0.551 0.945 0.615 CB 1.611 92 residues pruned to eliminate duplicates Z: 8 8.958 1.909 0.355 0.681 0.714 0.429 CB 1.551 8 residues pruned to eliminate duplicates Z: 10 6.296 1.964 0.002 0.500 0.667 0.667 CB 1.600 10 residues pruned to eliminate duplicates Z: 31 26.076 1.963 0.951 0.634 0.933 0.700 CB 1.174 31 residues pruned to eliminate duplicates Z: 9 3.600 1.909 0.035 0.270 0.875 0.500 CB 0.957 9 residues pruned to eliminate duplicates Z: 11 9.071 1.893 0.434 0.316 0.900 0.500 CB 1.438 11 residues pruned to eliminate duplicates Z: 6 7.070 1.705 0.075 0.808 1.000 0.800 CB 1.318 6 residues pruned to eliminate duplicates Z: 24 33.202 2.093 0.683 0.880 1.000 0.739 CB 1.424 24 residues pruned to eliminate duplicates Z: 9 10.650 1.871 0.207 0.786 1.000 0.750 CB 1.297 9 residues pruned to eliminate duplicates Z: 17 30.849 2.130 0.754 0.880 0.938 0.750 CA 1.596 17 residues pruned to eliminate duplicates Z: 13 16.131 2.212 0.880 0.472 0.750 0.750 CB 1.536 13 residues pruned to eliminate duplicates Z: 19 48.796 2.196 1.148 0.922 1.000 0.778 C 1.716 19 residues pruned to eliminate duplicates Z: 23 46.586 2.179 1.219 0.919 1.000 0.682 CB 1.448 23 residues pruned to eliminate duplicates Z: 22 47.626 2.221 1.185 0.945 0.952 0.667 CB 1.556 22 residues pruned to eliminate duplicates Z: 17 35.131 2.068 1.189 0.950 0.938 0.875 CB 1.427 17 residues pruned to eliminate duplicates Z: 13 19.161 2.256 0.550 0.477 0.917 0.500 CB 1.766 13 residues pruned to eliminate duplicates Z: 6 5.821 1.892 -0.128 0.799 0.800 0.800 CA 1.518 6 residues pruned to eliminate duplicates Z: 12 26.306 2.029 0.928 0.926 1.000 0.727 CB 1.423 12 residues pruned to eliminate duplicates Z: 22 32.594 1.953 0.685 0.955 1.000 0.905 CB 1.486 22 residues pruned to eliminate duplicates Z: 24 29.781 1.871 0.811 0.881 1.000 0.652 CB 1.327 24 residues pruned to eliminate duplicates Z: 18 15.700 2.216 0.421 0.482 0.882 0.529 CB 1.397 18 residues pruned to eliminate duplicates Z: 10 13.120 2.263 0.662 0.422 0.778 0.556 CB 1.623 10 residues pruned to eliminate duplicates Z: 24 23.545 2.238 0.718 0.509 0.826 0.522 CB 1.533 24 residues pruned to eliminate duplicates Z: 65 70.882 2.377 0.895 0.642 0.922 0.688 CB 1.868 65 residues pruned to eliminate duplicates Z: 35 29.224 2.024 0.625 0.644 0.912 0.735 CB 1.461 35 residues pruned to eliminate duplicates Z: 8 20.341 2.152 0.580 0.922 1.000 0.857 CB 1.590 8 residues pruned to eliminate duplicates Z: 11 11.931 2.140 0.761 0.341 0.800 0.700 CB 1.488 11 residues pruned to eliminate duplicates Z: 14 11.271 1.971 0.268 0.366 0.923 0.462 C 1.564 14 residues pruned to eliminate duplicates Z: 13 42.130 2.284 1.024 0.913 1.000 0.833 CB 1.862 13 residues pruned to eliminate duplicates Z: 62 42.967 2.009 0.776 0.684 0.918 0.656 CB 1.418 62 residues pruned to eliminate duplicates Z: 18 27.398 1.983 1.017 0.877 0.882 0.706 C 1.368 18 residues pruned to eliminate duplicates Z: 10 14.885 1.959 0.164 0.865 1.000 1.000 CA 1.593 10 residues pruned to eliminate duplicates Z: 29 48.124 2.305 0.819 0.756 0.964 0.750 CA 1.791 29 residues pruned to eliminate duplicates Z: 31 31.099 2.396 0.792 0.486 0.867 0.500 CB 1.548 31 residues pruned to eliminate duplicates Z: 18 34.607 2.001 1.138 0.937 0.941 0.882 CB 1.450 18 residues pruned to eliminate duplicates Z: 24 53.666 2.178 1.463 0.930 1.000 0.609 CB 1.458 24 residues pruned to eliminate duplicates Z: 22 21.797 2.275 0.683 0.449 0.905 0.619 CB 1.446 22 residues pruned to eliminate duplicates Z: 24 50.435 2.177 1.294 0.922 1.000 0.870 CB 1.481 24 residues pruned to eliminate duplicates Z: 18 22.109 2.400 0.430 0.547 0.824 0.471 CB 1.812 18 residues pruned to eliminate duplicates Z: 20 32.103 2.400 0.872 0.592 0.842 0.684 C 1.782 20 residues pruned to eliminate duplicates Z: 18 34.619 2.074 1.062 0.917 0.941 0.706 CB 1.472 18 residues pruned to eliminate duplicates Z: 98 57.764 2.261 0.703 0.510 0.907 0.598 CB 1.662 98 residues pruned to eliminate duplicates Z: 17 46.241 2.274 1.180 0.943 1.000 0.812 C 1.616 17 residues pruned to eliminate duplicates Z: 81 58.790 2.393 0.679 0.531 0.900 0.650 CB 1.763 81 residues pruned to eliminate duplicates Z: 33 17.615 2.021 0.310 0.437 0.844 0.562 CB 1.489 33 residues pruned to eliminate duplicates Z: 13 15.638 1.926 0.390 0.842 0.917 0.833 CB 1.371 13 residues pruned to eliminate duplicates Z: 21 22.966 2.160 0.587 0.479 0.900 0.750 CB 1.700 21 residues pruned to eliminate duplicates Z: 25 39.096 2.093 0.844 0.909 1.000 0.875 CB 1.468 25 residues pruned to eliminate duplicates Z: 8 7.758 1.474 0.509 0.792 1.000 0.714 CB 1.020 8 residues pruned to eliminate duplicates Z: 13 50.344 2.575 1.053 0.939 1.000 0.750 C 1.911 13 residues pruned to eliminate duplicates Z: 23 29.515 1.912 0.661 0.962 0.955 0.818 CB 1.420 23 residues pruned to eliminate duplicates Z: 20 38.798 2.403 0.521 0.933 1.000 0.947 CB 1.699 20 residues pruned to eliminate duplicates Z: 32 26.633 2.228 0.646 0.436 0.903 0.581 CB 1.544 32 residues pruned to eliminate duplicates Z: 23 34.835 2.512 0.739 0.515 0.864 0.682 C 1.940 23 residues pruned to eliminate duplicates Z: 20 22.232 2.288 0.596 0.516 0.842 0.368 CB 1.633 20 residues pruned to eliminate duplicates Z: 21 20.120 2.140 0.404 0.548 0.900 0.600 CB 1.587 21 residues pruned to eliminate duplicates Z: 6 8.311 1.738 0.445 0.786 1.000 0.600 CA 1.151 6 residues pruned to eliminate duplicates Z: 25 29.878 2.372 0.783 0.525 0.875 0.500 CB 1.608 25 residues pruned to eliminate duplicates Z: 27 21.607 2.214 0.712 0.470 0.885 0.500 CB 1.303 27 residues pruned to eliminate duplicates Z: 13 42.753 2.283 1.063 0.912 1.000 0.667 CA 1.856 13 residues pruned to eliminate duplicates Z: 42 36.711 2.342 0.543 0.574 0.854 0.707 CB 1.731 42 residues pruned to eliminate duplicates Z: 44 47.480 2.369 0.833 0.611 0.860 0.674 CB 1.744 44 residues pruned to eliminate duplicates Z: 16 16.986 2.100 0.584 0.441 0.867 0.600 C 1.617 16 residues pruned to eliminate duplicates Z: 29 28.265 2.087 0.542 0.709 0.893 0.786 CB 1.538 29 residues pruned to eliminate duplicates Z: 19 35.382 2.181 0.559 0.919 1.000 0.944 CB 1.727 19 residues pruned to eliminate duplicates Z: 10 16.788 1.884 0.815 0.850 1.000 0.778 CB 1.212 10 residues pruned to eliminate duplicates Z: 14 29.831 2.080 0.761 0.892 1.000 0.769 C 1.622 14 residues pruned to eliminate duplicates Z: 11 11.673 2.142 0.610 0.304 0.900 0.700 CB 1.480 11 residues pruned to eliminate duplicates Z: 7 8.192 1.632 0.301 0.882 1.000 0.833 CB 1.140 7 residues pruned to eliminate duplicates Z: 37 29.287 2.233 0.538 0.454 0.917 0.722 CB 1.626 37 residues pruned to eliminate duplicates Z: 15 24.415 2.356 0.636 0.555 0.857 0.714 CA 1.872 15 residues pruned to eliminate duplicates Z: 9 7.393 1.857 0.535 0.483 0.750 0.500 CB 1.244 9 residues pruned to eliminate duplicates Z: 20 33.971 2.415 0.268 0.941 1.000 1.000 CB 1.766 20 residues pruned to eliminate duplicates Z: 39 29.715 2.288 0.573 0.436 0.868 0.632 CB 1.648 39 residues pruned to eliminate duplicates Z: 38 24.641 2.138 0.380 0.450 0.919 0.568 CB 1.573 38 residues pruned to eliminate duplicates Z: 7 4.618 1.606 0.217 0.834 0.833 0.667 CB 0.867 7 residues pruned to eliminate duplicates Z: 10 9.316 1.945 1.028 0.547 0.889 0.778 CB 0.846 9 residues pruned to eliminate duplicates Z: 6 7.269 1.691 0.096 0.856 1.000 0.800 CB 1.294 6 residues pruned to eliminate duplicates Z: 7 3.687 2.064 0.226 0.388 0.667 0.667 CB 1.004 7 residues pruned to eliminate duplicates Z: 11 21.858 1.973 0.830 0.882 1.000 0.900 CB 1.385 11 residues pruned to eliminate duplicates Z: 42 45.861 2.316 0.711 0.642 0.902 0.707 CB 1.754 42 residues pruned to eliminate duplicates 6 1.302 1.213 -0.056 0.556 0.800 0.600 N 0.602 ? Z: 7 4.463 1.802 0.635 0.506 0.667 0.667 CB 0.922 7 residues pruned to eliminate duplicates 7 1.433 1.837 -0.061 0.275 0.500 0.333 CB 0.876 ? Z: 7 10.125 1.802 0.548 0.687 1.000 0.833 CB 1.249 7 residues pruned to eliminate duplicates Z: 11 19.400 2.127 0.418 0.884 1.000 0.800 CB 1.469 11 residues pruned to eliminate duplicates Z: 72 57.985 2.262 0.855 0.650 0.901 0.746 CB 1.583 72 residues pruned to eliminate duplicates Z: 36 22.804 2.101 0.564 0.474 0.857 0.571 CB 1.404 36 residues pruned to eliminate duplicates Z: 17 41.730 2.381 0.580 0.932 1.000 0.875 C 1.937 17 residues pruned to eliminate duplicates Z: 24 33.824 2.098 0.980 0.820 0.913 0.783 CB 1.408 24 residues pruned to eliminate duplicates Z: 23 37.878 2.128 0.918 0.902 1.000 0.773 CB 1.411 23 residues pruned to eliminate duplicates Z: 28 45.538 2.154 1.184 0.796 0.963 0.704 CB 1.492 28 residues pruned to eliminate duplicates Z: 67 52.913 2.487 0.749 0.463 0.848 0.530 CB 1.832 67 residues pruned to eliminate duplicates Z: 58 30.653 2.196 0.457 0.437 0.895 0.544 CB 1.514 58 residues pruned to eliminate duplicates Z: 57 57.756 2.403 0.962 0.577 0.893 0.625 CB 1.703 57 residues pruned to eliminate duplicates Z: 7 12.766 1.978 0.476 0.673 1.000 0.667 CA 1.521 7 residues pruned to eliminate duplicates Z: 7 6.661 1.669 0.452 0.771 1.000 0.833 CB 0.883 7 residues pruned to eliminate duplicates Z: 20 48.626 2.332 0.940 0.945 1.000 0.789 CB 1.706 20 residues pruned to eliminate duplicates Z: 8 20.078 2.168 0.552 0.922 1.000 1.000 CB 1.586 8 residues pruned to eliminate duplicates Z: 12 9.118 2.103 0.285 0.320 0.909 0.636 CB 1.366 12 residues pruned to eliminate duplicates Z: 6 5.269 1.729 0.299 0.619 0.800 0.800 C 1.173 6 residues pruned to eliminate duplicates Z: 20 36.167 2.118 0.921 0.890 0.947 0.789 CB 1.548 20 residues pruned to eliminate duplicates Z: 44 43.235 2.265 0.884 0.517 0.907 0.558 CB 1.676 44 residues pruned to eliminate duplicates Z: 6 9.752 2.003 0.328 0.870 1.000 0.600 CB 1.196 6 residues pruned to eliminate duplicates Z: 61 71.346 2.463 0.823 0.641 0.933 0.717 CB 1.928 57 residues pruned to eliminate duplicates Z: 10 7.271 1.853 0.052 0.407 0.889 0.556 C 1.541 10 residues pruned to eliminate duplicates Z: 41 55.337 2.378 0.886 0.627 0.925 0.725 CB 1.871 41 residues pruned to eliminate duplicates Z: 34 27.408 2.234 0.670 0.446 0.818 0.636 CB 1.651 34 residues pruned to eliminate duplicates Z: 6 10.847 1.843 0.388 0.872 1.000 0.800 CA 1.383 6 residues pruned to eliminate duplicates Z: 61 62.169 2.389 0.615 0.675 0.933 0.717 CB 1.898 61 residues pruned to eliminate duplicates Z: 49 38.782 2.296 0.801 0.517 0.854 0.583 CB 1.558 49 residues pruned to eliminate duplicates Z: 18 32.856 2.413 0.847 0.595 0.882 0.882 CB 1.850 18 residues pruned to eliminate duplicates Z: 20 40.175 2.679 0.729 0.613 0.895 0.737 C 1.998 20 residues pruned to eliminate duplicates Z: 20 33.295 2.390 1.125 0.491 0.842 0.579 CB 1.802 20 residues pruned to eliminate duplicates Z: 27 28.985 2.316 0.784 0.520 0.885 0.577 CB 1.525 27 residues pruned to eliminate duplicates Z: 6 2.646 1.722 0.337 0.494 0.800 0.600 CB 0.646 6 residues pruned to eliminate duplicates Z: 20 56.996 2.370 1.146 0.942 1.000 0.789 CB 1.783 20 residues pruned to eliminate duplicates Z: 37 22.090 2.055 0.434 0.435 0.861 0.500 CB 1.552 37 residues pruned to eliminate duplicates Z: 35 57.124 2.298 0.854 0.723 1.000 0.706 CB 1.880 35 residues pruned to eliminate duplicates Z: 10 5.170 1.767 0.338 0.299 0.889 0.556 CB 1.026 10 residues pruned to eliminate duplicates Z: 7 10.442 1.774 0.350 0.810 1.000 0.500 CA 1.358 7 residues pruned to eliminate duplicates Z: 38 38.151 2.287 0.459 0.641 0.973 0.838 CB 1.694 38 residues pruned to eliminate duplicates Z: 37 40.772 2.344 0.626 0.584 0.944 0.694 CB 1.741 37 residues pruned to eliminate duplicates Z: 114 60.800 2.312 0.623 0.497 0.903 0.673 CB 1.693 76 residues pruned to eliminate duplicates Z: 19 40.157 2.181 0.932 0.903 0.944 0.667 C 1.696 18 residues pruned to eliminate duplicates Z: 8 7.048 1.605 0.571 0.683 0.857 0.857 CB 1.042 8 residues pruned to eliminate duplicates Z: 68 40.888 1.976 0.881 0.662 0.910 0.657 CB 1.270 59 residues pruned to eliminate duplicates Z: 130 83.633 2.309 0.834 0.626 0.907 0.674 CB 1.704 91 residues pruned to eliminate duplicates Z: 16 56.471 2.291 1.337 0.935 1.000 1.000 C 1.898 16 residues pruned to eliminate duplicates Z: 66 74.811 2.380 0.965 0.640 0.938 0.662 CB 1.854 67 residues pruned to eliminate duplicates Z: 41 53.867 2.344 0.939 0.618 0.950 0.550 CB 1.764 41 residues pruned to eliminate duplicates Z: 23 34.969 1.910 0.826 0.952 1.000 0.864 CB 1.472 23 residues pruned to eliminate duplicates Z: 7 10.054 1.898 0.653 0.730 0.833 0.333 C 1.277 7 residues pruned to eliminate duplicates Z: 28 33.410 2.154 0.576 0.772 0.889 0.815 CB 1.675 28 residues pruned to eliminate duplicates Z: 6 3.006 1.578 0.071 0.611 0.600 0.600 C 1.193 6 residues pruned to eliminate duplicates Z: 18 26.918 2.370 0.607 0.596 0.882 0.706 CB 1.772 18 residues pruned to eliminate duplicates Z: 15 38.574 2.150 0.914 0.941 1.000 0.714 CA 1.739 15 residues pruned to eliminate duplicates Z: 12 8.026 1.742 0.520 0.447 0.909 0.545 CB 1.062 12 residues pruned to eliminate duplicates Z: 28 35.815 2.284 0.889 0.551 0.889 0.556 CB 1.710 28 residues pruned to eliminate duplicates Z: 54 54.104 2.418 0.804 0.603 0.906 0.623 CB 1.706 37 residues pruned to eliminate duplicates Z: 14 18.651 2.357 0.591 0.388 0.923 0.538 CB 1.684 14 residues pruned to eliminate duplicates Z: 8 17.023 1.950 0.844 0.686 1.000 0.857 C 1.509 8 residues pruned to eliminate duplicates Z: 13 9.471 1.965 0.876 0.385 0.833 0.583 CB 1.006 13 residues pruned to eliminate duplicates Z: 6 3.383 1.471 0.384 0.494 0.600 0.400 C 1.246 Z: 71 53.531 2.256 0.714 0.597 0.929 0.614 CB 1.625 71 residues pruned to eliminate duplicates Z: 31 36.508 2.504 0.618 0.460 0.867 0.667 C 1.977 31 residues pruned to eliminate duplicates Z: 9 15.878 2.020 0.317 0.865 1.000 0.750 CA 1.546 9 residues pruned to eliminate duplicates Z: 19 17.061 2.271 0.375 0.405 0.889 0.722 CB 1.602 19 residues pruned to eliminate duplicates Z: 7 4.544 1.267 0.577 0.516 1.000 0.667 CB 0.913 Z: 6 10.075 1.994 0.096 0.868 1.000 0.800 CB 1.508 6 residues pruned to eliminate duplicates Z: 18 36.399 2.000 1.091 0.941 1.000 0.765 CB 1.464 19 residues pruned to eliminate duplicates Z: 27 40.094 2.460 0.645 0.658 0.923 0.808 CB 1.818 27 residues pruned to eliminate duplicates Z: 19 45.956 2.433 1.127 0.592 0.944 0.667 CA 2.029 19 residues pruned to eliminate duplicates Z: 17 11.724 2.149 0.185 0.419 0.875 0.625 CB 1.430 17 residues pruned to eliminate duplicates Z: 6 3.633 1.927 0.385 0.515 0.600 0.600 CA 1.000 Z: 8 5.811 1.863 0.307 0.294 0.857 0.571 C 1.326 8 residues pruned to eliminate duplicates Z: 27 47.088 2.124 1.152 0.874 0.962 0.885 CB 1.528 27 residues pruned to eliminate duplicates Z: 18 25.971 1.990 0.682 0.932 0.941 0.882 CB 1.396 18 residues pruned to eliminate duplicates Z: 10 10.330 1.996 0.710 0.364 0.889 0.667 CB 1.314 10 residues pruned to eliminate duplicates Z: 21 15.561 2.326 0.552 0.461 0.650 0.300 CB 1.543 21 residues pruned to eliminate duplicates Z: 12 16.030 2.389 0.536 0.310 0.909 0.545 CB 1.789 12 residues pruned to eliminate duplicates Z: 65 44.873 2.264 0.499 0.530 0.906 0.672 CB 1.771 65 residues pruned to eliminate duplicates Z: 8 13.463 2.311 0.398 0.474 0.857 0.857 CA 1.886 8 residues pruned to eliminate duplicates Z: 16 8.350 1.662 0.379 0.377 0.867 0.400 CA 1.237 16 residues pruned to eliminate duplicates Z: 8 10.178 2.063 0.158 0.829 0.857 0.571 CB 1.413 8 residues pruned to eliminate duplicates Z: 28 63.575 2.399 1.021 0.787 1.000 0.778 C 1.961 28 residues pruned to eliminate duplicates Z: 21 35.531 2.451 0.825 0.649 0.900 0.700 C 1.717 21 residues pruned to eliminate duplicates Z: 17 7.570 1.755 0.388 0.372 0.938 0.500 CB 0.950 17 residues pruned to eliminate duplicates Z: 6 8.025 2.003 0.433 0.759 1.000 1.000 CB 0.993 6 residues pruned to eliminate duplicates Z: 11 18.060 2.219 0.516 0.473 1.000 0.600 C 1.744 11 residues pruned to eliminate duplicates Z: 9 5.455 1.550 0.854 0.221 0.875 0.625 CB 1.063 9 residues pruned to eliminate duplicates Z: 32 30.331 2.212 0.759 0.469 0.935 0.645 CB 1.545 32 residues pruned to eliminate duplicates Z: 23 50.405 2.228 1.240 0.925 1.000 0.864 CB 1.510 23 residues pruned to eliminate duplicates Z: 8 8.147 1.784 0.917 0.438 0.857 0.571 CA 1.120 4 residues pruned to eliminate duplicates Z: 106 90.771 2.394 0.733 0.695 0.952 0.762 CB 1.876 106 residues pruned to eliminate duplicates Z: 14 9.619 2.200 0.318 0.144 0.923 0.462 CB 1.549 14 residues pruned to eliminate duplicates Z: 23 51.783 2.205 1.419 0.924 0.955 0.591 CB 1.523 23 residues pruned to eliminate duplicates Z: 18 55.672 2.374 1.132 0.953 1.000 0.471 C 1.836 18 residues pruned to eliminate duplicates Z: 18 25.784 1.943 0.772 0.929 1.000 0.882 CB 1.272 18 residues pruned to eliminate duplicates Z: 12 7.859 1.872 0.269 0.399 0.727 0.455 CA 1.526 12 residues pruned to eliminate duplicates Z: 7 2.518 1.353 -0.001 0.639 1.000 0.667 C 0.668 Z: 21 54.954 2.336 1.187 0.941 0.950 0.650 CB 1.757 21 residues pruned to eliminate duplicates Z: 87 61.551 2.278 0.704 0.572 0.942 0.651 CB 1.694 87 residues pruned to eliminate duplicates Z: 17 19.910 2.088 0.678 0.574 0.938 0.500 CB 1.411 20 residues pruned to eliminate duplicates Z: 12 15.893 2.081 0.440 0.701 0.909 0.909 CA 1.464 12 residues pruned to eliminate duplicates Z: 66 51.758 2.457 0.796 0.443 0.877 0.508 CB 1.758 66 residues pruned to eliminate duplicates Z: 10 17.319 2.255 0.687 0.475 0.889 0.667 CA 1.751 10 residues pruned to eliminate duplicates Z: 7 7.804 1.687 0.318 0.808 1.000 0.667 CB 1.095 7 residues pruned to eliminate duplicates Z: 41 32.166 2.340 0.778 0.352 0.850 0.450 CB 1.688 41 residues pruned to eliminate duplicates Z: 31 54.255 2.403 1.011 0.664 0.967 0.633 CB 1.821 31 residues pruned to eliminate duplicates Z: 11 26.809 2.042 1.009 0.940 1.000 0.900 CB 1.435 11 residues pruned to eliminate duplicates Z: 14 17.344 2.284 0.370 0.451 0.923 0.615 CB 1.751 14 residues pruned to eliminate duplicates Z: 6 2.766 1.441 0.161 0.543 0.800 0.600 CB 0.886 6 residues pruned to eliminate duplicates Z: 13 20.739 2.164 0.669 0.552 1.000 0.667 CB 1.575 13 residues pruned to eliminate duplicates Z: 14 37.975 2.551 1.031 0.604 0.923 0.615 CA 1.995 14 residues pruned to eliminate duplicates Z: 13 7.945 1.691 0.364 0.355 0.917 0.583 CB 1.269 13 residues pruned to eliminate duplicates Z: 6 6.283 1.701 0.522 0.490 0.800 0.600 CB 1.370 6 residues pruned to eliminate duplicates Z: 43 47.687 2.278 0.739 0.626 0.976 0.595 CB 1.690 43 residues pruned to eliminate duplicates Z: 45 38.996 2.213 0.766 0.573 0.932 0.636 CB 1.505 96 residues pruned to eliminate duplicates Z: 9 11.561 1.835 0.133 0.791 1.000 0.625 CA 1.523 9 residues pruned to eliminate duplicates Z: 33 46.562 2.106 1.212 0.716 0.969 0.781 CB 1.500 33 residues pruned to eliminate duplicates Z: 9 18.198 2.068 0.469 0.925 1.000 1.000 CA 1.485 9 residues pruned to eliminate duplicates Z: 11 8.314 1.988 0.515 0.471 0.800 0.400 CB 1.124 11 residues pruned to eliminate duplicates Z: 33 18.692 1.843 0.230 0.723 0.906 0.875 CB 1.316 33 residues pruned to eliminate duplicates Z: 24 39.229 2.120 0.990 0.926 1.000 0.739 CB 1.360 24 residues pruned to eliminate duplicates Z: 6 4.420 1.531 0.254 0.768 0.800 0.600 CB 1.015 6 residues pruned to eliminate duplicates Z: 42 33.564 2.528 0.580 0.380 0.878 0.463 CB 1.698 42 residues pruned to eliminate duplicates Z: 50 49.330 2.480 0.895 0.477 0.837 0.531 CB 1.835 50 residues pruned to eliminate duplicates Z: 11 14.144 2.078 0.915 0.400 0.900 0.600 CB 1.388 Z: 33 27.118 2.367 0.699 0.459 0.844 0.562 CB 1.472 Z: 10 7.312 1.838 0.748 0.324 0.667 0.333 CB 1.380 10 residues pruned to eliminate duplicates Z: 17 35.649 2.349 0.854 0.677 1.000 0.812 C 1.739 Z: 37 19.369 1.849 0.668 0.536 0.861 0.667 CB 1.173 37 residues pruned to eliminate duplicates Z: 9 6.989 1.775 0.084 0.705 1.000 0.750 CB 1.065 9 residues pruned to eliminate duplicates Z: 20 62.781 2.383 1.315 0.922 1.000 0.632 CB 1.836 20 residues pruned to eliminate duplicates Z: 11 6.078 1.687 0.447 0.239 0.800 0.500 CA 1.332 11 residues pruned to eliminate duplicates Z: 16 42.446 2.392 1.044 0.814 0.933 0.733 C 1.828 16 residues pruned to eliminate duplicates Z: 34 20.137 1.828 0.342 0.725 0.970 0.818 CB 1.203 34 residues pruned to eliminate duplicates Z: 16 40.237 2.484 0.975 0.646 0.933 0.800 CB 1.980 16 residues pruned to eliminate duplicates Z: 24 23.608 2.421 0.459 0.465 0.913 0.609 CB 1.581 30 residues pruned to eliminate duplicates Z: 20 48.751 2.622 1.184 0.609 0.895 0.684 C 1.969 20 residues pruned to eliminate duplicates Z: 10 5.768 1.748 0.157 0.456 0.778 0.556 CA 1.280 10 residues pruned to eliminate duplicates Z: 42 44.263 2.341 0.651 0.639 0.927 0.756 CB 1.695 42 residues pruned to eliminate duplicates Z: 19 47.077 2.161 1.046 0.950 1.000 0.889 CA 1.730 19 residues pruned to eliminate duplicates Z: 7 6.991 1.956 0.074 0.721 0.833 0.667 CB 1.336 7 residues pruned to eliminate duplicates Z: 64 61.088 2.389 0.665 0.628 0.937 0.651 CB 1.831 64 residues pruned to eliminate duplicates Z: 9 12.695 1.776 0.296 0.895 1.000 0.875 CB 1.399 9 residues pruned to eliminate duplicates Z: 16 52.625 2.409 1.151 0.917 1.000 0.867 CA 1.850 16 residues pruned to eliminate duplicates Z: 31 29.861 2.401 0.661 0.424 0.933 0.600 CB 1.586 31 residues pruned to eliminate duplicates Z: 7 8.076 1.860 0.525 0.605 1.000 0.833 CA 1.052 7 residues pruned to eliminate duplicates Z: 8 6.536 1.607 0.764 0.304 1.000 0.714 CB 1.083 8 residues pruned to eliminate duplicates Z: 6 4.979 1.777 -0.207 0.622 1.000 0.600 C 1.408 6 residues pruned to eliminate duplicates Z: 15 37.760 2.407 0.780 0.722 1.000 0.857 CA 1.928 15 residues pruned to eliminate duplicates Z: 17 40.957 2.425 1.042 0.663 0.938 0.625 C 1.896 17 residues pruned to eliminate duplicates Z: 67 57.652 2.371 0.573 0.623 0.939 0.727 CB 1.803 67 residues pruned to eliminate duplicates Z: 17 60.118 2.485 1.064 0.950 1.000 0.812 CB 2.021 17 residues pruned to eliminate duplicates Z: 7 3.326 1.860 -0.137 0.596 0.667 0.500 CB 1.158 7 residues pruned to eliminate duplicates Z: 13 6.892 1.889 0.786 0.457 0.833 0.667 CB 0.739 13 residues pruned to eliminate duplicates Z: 9 4.129 1.476 0.414 0.402 0.875 0.625 CB 0.886 Z: 8 11.206 1.881 0.755 0.569 0.857 0.571 CB 1.399 8 residues pruned to eliminate duplicates Z: 58 52.555 2.344 0.600 0.606 0.930 0.754 CB 1.805 58 residues pruned to eliminate duplicates Z: 12 15.127 2.315 0.641 0.413 0.909 0.818 CB 1.446 12 residues pruned to eliminate duplicates Z: 21 30.726 2.431 0.737 0.560 0.950 0.800 CB 1.616 21 residues pruned to eliminate duplicates Z: 7 2.035 1.580 -0.061 0.245 0.667 0.500 C 1.127 7 residues pruned to eliminate duplicates Z: 56 36.342 2.173 0.559 0.472 0.927 0.527 CB 1.604 56 residues pruned to eliminate duplicates Z: 48 47.434 2.422 0.695 0.579 0.851 0.638 CB 1.835 48 residues pruned to eliminate duplicates Z: 29 30.718 2.392 0.765 0.468 0.893 0.500 CB 1.591 29 residues pruned to eliminate duplicates Z: 9 2.064 1.422 0.450 0.186 0.750 0.500 C 0.688 9 residues pruned to eliminate duplicates Z: 15 39.264 2.435 0.814 0.896 0.929 0.857 C 1.833 15 residues pruned to eliminate duplicates Z: 20 27.502 1.873 0.881 0.924 1.000 0.737 CB 1.258 20 residues pruned to eliminate duplicates Z: 6 8.030 1.807 0.436 0.853 1.000 1.000 CA 1.023 6 residues pruned to eliminate duplicates Z: 22 37.930 2.399 0.559 0.703 0.952 0.810 CB 1.931 22 residues pruned to eliminate duplicates Z: 19 20.884 2.323 0.533 0.460 0.889 0.556 CB 1.619 19 residues pruned to eliminate duplicates Z: 105 69.299 2.306 0.722 0.598 0.913 0.692 CB 1.706 105 residues pruned to eliminate duplicates Z: 24 29.068 1.847 0.715 0.903 1.000 0.826 CB 1.363 24 residues pruned to eliminate duplicates Z: 11 16.543 2.153 0.566 0.591 0.900 0.500 CA 1.581 11 residues pruned to eliminate duplicates Z: 22 29.917 1.892 0.830 0.898 1.000 0.857 CB 1.349 22 residues pruned to eliminate duplicates Z: 41 55.428 2.357 0.815 0.636 0.950 0.675 CB 1.898 41 residues pruned to eliminate duplicates Z: 22 33.222 2.231 0.868 0.544 0.905 0.667 CB 1.841 22 residues pruned to eliminate duplicates Z: 9 2.746 1.276 0.196 0.239 0.875 0.625 CB 0.984 Z: 10 10.603 2.132 0.392 0.362 0.889 0.667 CB 1.555 10 residues pruned to eliminate duplicates Z: 7 9.030 1.776 0.616 0.636 0.833 0.667 C 1.356 7 residues pruned to eliminate duplicates Z: 37 40.449 2.418 0.948 0.507 0.889 0.556 CB 1.599 37 residues pruned to eliminate duplicates Z: 17 15.561 2.168 0.507 0.543 0.938 0.688 CB 1.217 17 residues pruned to eliminate duplicates Z: 38 46.961 2.325 0.714 0.606 0.973 0.649 CB 1.800 38 residues pruned to eliminate duplicates Z: 16 40.843 2.387 1.011 0.933 0.933 0.800 C 1.643 14 residues pruned to eliminate duplicates Z: 9 19.396 2.108 0.672 0.896 0.875 0.750 C 1.593 9 residues pruned to eliminate duplicates Z: 72 59.989 2.265 0.766 0.655 0.944 0.718 CB 1.633 72 residues pruned to eliminate duplicates Z: 10 9.048 1.906 1.402 0.560 0.889 0.778 CB 0.699 10 residues pruned to eliminate duplicates Z: 18 20.968 2.492 0.523 0.416 0.882 0.471 CB 1.657 18 residues pruned to eliminate duplicates Z: 20 25.304 1.979 0.903 0.673 0.947 0.684 CB 1.387 20 residues pruned to eliminate duplicates Z: 13 9.744 1.835 0.381 0.460 1.000 0.417 CB 1.156 13 residues pruned to eliminate duplicates Z: 9 17.529 2.693 0.532 0.482 0.750 0.625 CA 2.039 9 residues pruned to eliminate duplicates Z: 33 18.996 1.975 0.638 0.409 0.875 0.531 CB 1.306 174 residues pruned to eliminate duplicates Z: 6 9.059 1.966 0.340 0.830 1.000 0.800 CB 1.156 6 residues pruned to eliminate duplicates Z: 7 3.374 1.936 0.635 0.083 0.500 0.167 C 1.492 7 residues pruned to eliminate duplicates Z: 20 56.657 2.392 1.082 0.949 1.000 0.895 CB 1.801 20 residues pruned to eliminate duplicates Z: 33 24.360 1.885 0.946 0.639 0.875 0.688 CB 1.178 33 residues pruned to eliminate duplicates Z: 6 9.142 1.810 0.736 0.769 1.000 0.600 CA 1.026 6 residues pruned to eliminate duplicates Z: 15 10.839 1.718 0.520 0.516 1.000 0.500 CB 1.092 8 residues pruned to eliminate duplicates Z: 18 16.445 2.143 0.495 0.526 0.824 0.529 CB 1.474 18 residues pruned to eliminate duplicates Z: 19 35.901 2.108 0.945 0.843 0.944 0.889 CB 1.627 Z: 16 41.166 2.531 0.897 0.689 1.000 0.800 C 1.862 16 residues pruned to eliminate duplicates Z: 43 31.590 2.287 0.714 0.468 0.833 0.571 CB 1.541 43 residues pruned to eliminate duplicates Z: 23 40.228 2.286 0.970 0.639 0.955 0.500 CB 1.752 22 residues pruned to eliminate duplicates Z: 9 22.752 2.088 0.710 0.850 1.000 0.750 CB 1.669 9 residues pruned to eliminate duplicates Z: 31 24.928 2.175 0.516 0.392 0.933 0.633 CB 1.658 31 residues pruned to eliminate duplicates Z: 10 8.213 1.907 0.687 0.260 0.889 0.444 CB 1.260 10 residues pruned to eliminate duplicates Z: 11 15.865 1.894 0.517 0.795 0.900 0.900 CA 1.498 Z: 19 42.372 2.480 1.095 0.568 0.944 0.667 CA 1.905 19 residues pruned to eliminate duplicates Z: 9 18.004 2.020 0.539 0.853 1.000 0.875 CA 1.514 9 residues pruned to eliminate duplicates Z: 8 5.198 1.379 0.506 0.488 1.000 0.429 N 0.957 Z: 28 41.413 2.226 0.734 0.795 0.963 0.778 CB 1.657 28 residues pruned to eliminate duplicates Z: 19 47.330 2.327 0.890 0.891 1.000 1.000 CB 1.824 19 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 6 3.839 1.729 1.038 0.310 1.000 0.600 CB 0.601 6 residues pruned to eliminate duplicates Z: 28 31.328 2.458 0.832 0.436 0.889 0.519 CB 1.610 28 residues pruned to eliminate duplicates Z: 33 27.152 2.435 0.803 0.450 0.812 0.500 CB 1.417 33 residues pruned to eliminate duplicates Z: 35 26.520 2.286 0.804 0.408 0.882 0.412 CB 1.377 35 residues pruned to eliminate duplicates Z: 28 29.451 2.488 0.763 0.426 0.852 0.481 CB 1.638 28 residues pruned to eliminate duplicates Z: 59 36.292 2.292 0.700 0.430 0.862 0.414 CB 1.526 48 residues pruned to eliminate duplicates Z: 7 10.008 1.815 0.672 0.444 1.000 0.667 C 1.425 7 residues pruned to eliminate duplicates Z: 26 27.034 2.489 0.792 0.449 0.800 0.400 CB 1.596 26 residues pruned to eliminate duplicates Z: 28 33.707 2.479 0.777 0.472 0.926 0.481 CB 1.636 28 residues pruned to eliminate duplicates Z: 77 62.987 2.488 0.900 0.501 0.829 0.526 CB 1.842 77 residues pruned to eliminate duplicates Z: 60 50.666 2.482 0.780 0.471 0.864 0.559 CB 1.779 60 residues pruned to eliminate duplicates Z: 27 23.491 2.252 0.700 0.419 0.808 0.500 CB 1.621 27 residues pruned to eliminate duplicates Z: 33 23.036 2.280 0.824 0.425 0.781 0.344 CB 1.356 33 residues pruned to eliminate duplicates Z: 37 33.365 2.466 0.793 0.430 0.861 0.333 CB 1.571 37 residues pruned to eliminate duplicates Z: 40 27.981 2.330 0.728 0.396 0.821 0.359 CB 1.513 40 residues pruned to eliminate duplicates Z: 34 32.147 2.382 0.778 0.478 0.848 0.394 CB 1.592 34 residues pruned to eliminate duplicates Z: 39 52.274 2.540 0.836 0.538 0.895 0.526 C 1.958 39 residues pruned to eliminate duplicates Z: 31 31.900 2.464 0.728 0.481 0.867 0.467 CB 1.610 31 residues pruned to eliminate duplicates Z: 39 34.579 2.420 0.931 0.456 0.816 0.421 CB 1.538 39 residues pruned to eliminate duplicates Z: 45 43.356 2.499 0.946 0.424 0.795 0.409 CB 1.829 45 residues pruned to eliminate duplicates Z: 37 36.731 2.497 0.815 0.437 0.861 0.417 CB 1.673 37 residues pruned to eliminate duplicates Z: 53 69.287 2.577 0.951 0.562 0.865 0.519 C 2.080 53 residues pruned to eliminate duplicates Z: 38 37.304 2.514 0.909 0.430 0.865 0.405 CB 1.590 38 residues pruned to eliminate duplicates Z: 10 11.749 2.467 0.471 0.381 0.778 0.222 CB 1.575 10 residues pruned to eliminate duplicates Z: 34 22.367 2.327 0.691 0.353 0.788 0.576 CB 1.473 34 residues pruned to eliminate duplicates Z: 11 7.652 2.327 0.470 0.075 0.700 0.100 CA 1.757 11 residues pruned to eliminate duplicates Z: 41 28.680 2.488 0.629 0.386 0.800 0.425 CB 1.579 41 residues pruned to eliminate duplicates Z: 56 62.559 2.508 0.872 0.537 0.855 0.582 C 2.028 56 residues pruned to eliminate duplicates Z: 29 34.663 2.537 0.648 0.443 0.857 0.536 C 1.938 29 residues pruned to eliminate duplicates Z: 19 39.168 2.508 0.765 0.663 1.000 0.778 C 1.794 19 residues pruned to eliminate duplicates Z: 23 40.148 2.645 0.770 0.519 0.955 0.636 C 1.880 23 residues pruned to eliminate duplicates Z: 32 36.890 2.507 0.915 0.388 0.806 0.484 C 1.927 32 residues pruned to eliminate duplicates Z: 22 41.963 2.535 0.809 0.578 0.952 0.667 C 1.945 22 residues pruned to eliminate duplicates Z: 36 47.211 2.585 0.849 0.473 0.857 0.429 C 2.003 36 residues pruned to eliminate duplicates Z: 23 39.602 2.549 0.834 0.554 0.909 0.636 C 1.885 23 residues pruned to eliminate duplicates Z: 58 44.728 2.506 0.680 0.449 0.825 0.456 CB 1.799 58 residues pruned to eliminate duplicates Z: 58 51.199 2.555 0.740 0.465 0.877 0.526 CB 1.801 58 residues pruned to eliminate duplicates Z: 24 40.239 2.542 0.788 0.533 0.913 0.565 C 1.956 24 residues pruned to eliminate duplicates Z: 24 44.281 2.543 0.999 0.540 0.957 0.609 C 1.827 24 residues pruned to eliminate duplicates Z: 22 48.032 2.586 1.104 0.555 0.952 0.667 C 1.918 22 residues pruned to eliminate duplicates Z: 36 40.700 2.463 0.966 0.377 0.829 0.543 CB 1.956 36 residues pruned to eliminate duplicates Z: 23 41.674 2.610 0.992 0.529 0.864 0.636 C 1.922 23 residues pruned to eliminate duplicates Z: 31 45.893 2.545 0.993 0.399 0.933 0.533 C 1.970 31 residues pruned to eliminate duplicates Z: 22 45.621 2.680 0.807 0.539 0.952 0.619 C 2.078 22 residues pruned to eliminate duplicates Z: 60 53.900 2.524 0.817 0.455 0.847 0.458 CB 1.889 60 residues pruned to eliminate duplicates Z: 57 57.986 2.584 0.915 0.462 0.857 0.482 CB 1.898 57 residues pruned to eliminate duplicates Z: 43 76.151 2.627 1.022 0.620 0.952 0.690 C 2.074 43 residues pruned to eliminate duplicates Z: 34 49.200 2.431 1.030 0.504 0.879 0.485 CB 1.968 34 residues pruned to eliminate duplicates Z: 34 40.500 2.342 0.825 0.535 0.879 0.576 CB 1.813 34 residues pruned to eliminate duplicates Z: 32 41.313 2.324 0.910 0.572 0.871 0.581 CB 1.790 32 residues pruned to eliminate duplicates Z: 52 61.174 2.413 0.680 0.687 0.941 0.725 CB 1.891 52 residues pruned to eliminate duplicates Z: 21 54.808 2.593 0.948 0.716 0.950 0.700 C 2.101 21 residues pruned to eliminate duplicates Z: 23 49.401 2.541 0.940 0.689 0.909 0.636 C 1.977 23 residues pruned to eliminate duplicates Z: 26 44.498 2.373 1.036 0.619 0.920 0.720 C 1.788 26 residues pruned to eliminate duplicates Z: 28 45.531 2.445 0.901 0.618 0.889 0.667 CB 1.897 28 residues pruned to eliminate duplicates Z: 27 44.986 2.487 0.858 0.621 0.846 0.577 CB 2.012 27 residues pruned to eliminate duplicates Z: 66 68.227 2.421 0.731 0.640 0.954 0.738 CB 1.857 66 residues pruned to eliminate duplicates Z: 21 60.227 2.610 1.083 0.738 0.950 0.750 C 2.106 21 residues pruned to eliminate duplicates Z: 31 46.940 2.371 0.926 0.597 0.900 0.600 C 1.900 31 residues pruned to eliminate duplicates Z: 50 68.043 2.486 0.912 0.607 0.939 0.592 C 1.968 50 residues pruned to eliminate duplicates Z: 29 44.812 2.394 0.963 0.624 0.821 0.643 C 1.952 29 residues pruned to eliminate duplicates Z: 68 65.963 2.400 0.753 0.638 0.910 0.731 CB 1.849 68 residues pruned to eliminate duplicates Z: 27 49.211 2.465 0.931 0.620 0.923 0.692 C 1.961 27 residues pruned to eliminate duplicates Z: 31 41.303 2.340 0.855 0.592 0.867 0.567 CB 1.835 31 residues pruned to eliminate duplicates Z: 28 53.373 2.492 0.953 0.641 0.926 0.667 C 1.998 28 residues pruned to eliminate duplicates Z: 69 66.424 2.336 0.760 0.625 0.941 0.706 CB 1.850 69 residues pruned to eliminate duplicates Z: 31 46.203 2.413 0.795 0.566 0.933 0.633 C 1.958 31 residues pruned to eliminate duplicates Z: 27 48.735 2.452 0.876 0.656 0.885 0.731 CB 2.033 27 residues pruned to eliminate duplicates Z: 30 46.361 2.414 0.893 0.615 0.897 0.655 C 1.884 30 residues pruned to eliminate duplicates Z: 7 5.975 1.917 0.266 0.654 1.000 0.500 CB 0.871 7 residues pruned to eliminate duplicates Z: 14 33.266 2.637 0.543 0.601 1.000 0.769 C 2.060 14 residues pruned to eliminate duplicates Z: 8 17.303 2.366 0.861 0.400 0.857 0.429 CA 1.925 8 residues pruned to eliminate duplicates Z: 32 39.265 2.324 0.519 0.700 1.000 0.806 CB 1.665 32 residues pruned to eliminate duplicates Z: 45 40.267 2.267 0.611 0.577 0.886 0.705 CB 1.741 45 residues pruned to eliminate duplicates Z: 43 42.722 2.326 0.582 0.631 0.905 0.714 CB 1.752 43 residues pruned to eliminate duplicates Z: 42 45.896 2.381 0.610 0.622 0.927 0.756 CB 1.797 42 residues pruned to eliminate duplicates Z: 41 42.152 2.334 0.546 0.654 0.925 0.725 CB 1.731 41 residues pruned to eliminate duplicates Z: 39 41.792 2.344 0.639 0.608 0.921 0.737 CB 1.729 39 residues pruned to eliminate duplicates Z: 45 36.616 2.284 0.518 0.580 0.886 0.591 CB 1.664 45 residues pruned to eliminate duplicates Z: 43 45.592 2.326 0.668 0.598 0.905 0.714 CB 1.826 43 residues pruned to eliminate duplicates Z: 36 42.199 2.322 0.567 0.683 0.971 0.686 CB 1.706 36 residues pruned to eliminate duplicates Z: 29 37.845 2.249 0.744 0.721 0.929 0.679 CB 1.609 29 residues pruned to eliminate duplicates Z: 50 42.915 2.163 0.721 0.587 0.918 0.551 CB 1.651 50 residues pruned to eliminate duplicates Z: 37 46.988 2.291 0.821 0.644 0.944 0.639 CB 1.737 37 residues pruned to eliminate duplicates Z: 45 46.334 2.302 0.769 0.592 0.932 0.659 CB 1.686 45 residues pruned to eliminate duplicates Z: 36 49.755 2.304 0.860 0.677 0.971 0.600 CB 1.717 36 residues pruned to eliminate duplicates Z: 37 46.651 2.302 0.888 0.658 0.917 0.667 CB 1.685 37 residues pruned to eliminate duplicates Z: 35 47.854 2.325 0.808 0.692 0.941 0.559 CB 1.741 35 residues pruned to eliminate duplicates Z: 36 57.837 2.366 1.030 0.695 0.971 0.629 CB 1.753 36 residues pruned to eliminate duplicates Z: 44 47.859 2.292 0.745 0.589 0.953 0.721 CB 1.757 44 residues pruned to eliminate duplicates Z: 41 54.986 2.374 0.935 0.644 0.925 0.675 CB 1.788 41 residues pruned to eliminate duplicates Z: 37 52.257 2.357 0.966 0.660 0.944 0.528 CB 1.715 37 residues pruned to eliminate duplicates Z: 37 48.624 2.326 0.904 0.672 0.917 0.778 CB 1.703 37 residues pruned to eliminate duplicates Z: 67 50.347 2.326 0.759 0.507 0.894 0.682 CB 1.682 67 residues pruned to eliminate duplicates Z: 17 19.979 2.210 0.618 0.440 0.875 0.562 CB 1.699 17 residues pruned to eliminate duplicates Z: 20 14.575 2.068 0.511 0.364 0.895 0.684 CB 1.384 20 residues pruned to eliminate duplicates Z: 70 47.184 2.207 0.709 0.517 0.884 0.623 CB 1.675 70 residues pruned to eliminate duplicates Z: 41 51.975 2.353 0.865 0.634 0.925 0.650 CB 1.785 41 residues pruned to eliminate duplicates Z: 37 47.964 2.297 0.848 0.659 0.944 0.722 CB 1.721 37 residues pruned to eliminate duplicates Z: 36 53.230 2.322 0.988 0.680 0.943 0.629 CB 1.751 36 residues pruned to eliminate duplicates Z: 42 49.801 2.350 0.723 0.643 0.951 0.659 CB 1.767 42 residues pruned to eliminate duplicates Z: 38 51.923 2.368 0.861 0.651 0.946 0.595 CB 1.779 38 residues pruned to eliminate duplicates Z: 43 56.674 2.293 0.923 0.645 0.976 0.619 CB 1.774 43 residues pruned to eliminate duplicates Z: 57 47.663 2.232 0.834 0.530 0.929 0.518 CB 1.627 57 residues pruned to eliminate duplicates Z: 37 51.617 2.371 0.826 0.676 0.944 0.667 CB 1.789 37 residues pruned to eliminate duplicates Z: 47 49.931 2.354 0.692 0.634 0.957 0.717 CB 1.705 47 residues pruned to eliminate duplicates Z: 37 48.983 2.311 0.806 0.684 0.972 0.639 CB 1.699 37 residues pruned to eliminate duplicates Z: 49 49.002 2.188 0.867 0.652 0.979 0.646 CB 1.535 49 residues pruned to eliminate duplicates Z: 37 50.356 2.303 0.868 0.701 0.972 0.722 CB 1.670 37 residues pruned to eliminate duplicates Z: 44 55.357 2.324 0.840 0.645 0.977 0.698 CB 1.765 44 residues pruned to eliminate duplicates Z: 58 46.627 2.267 0.699 0.578 0.947 0.649 CB 1.570 58 residues pruned to eliminate duplicates Z: 58 52.873 2.356 0.671 0.612 0.947 0.649 CB 1.689 58 residues pruned to eliminate duplicates Z: 22 14.017 2.124 0.459 0.411 0.857 0.429 CB 1.265 22 residues pruned to eliminate duplicates Z: 61 46.755 2.296 0.682 0.566 0.900 0.517 CB 1.629 61 residues pruned to eliminate duplicates Z: 59 43.151 2.265 0.732 0.558 0.862 0.621 CB 1.584 59 residues pruned to eliminate duplicates Z: 15 12.912 2.312 0.500 0.407 0.786 0.357 CB 1.396 15 residues pruned to eliminate duplicates Z: 17 22.908 2.251 0.571 0.617 0.938 0.375 CB 1.546 17 residues pruned to eliminate duplicates Z: 19 19.563 2.170 0.682 0.480 0.889 0.444 CB 1.451 19 residues pruned to eliminate duplicates Z: 39 26.767 2.114 0.718 0.404 0.921 0.526 CB 1.436 39 residues pruned to eliminate duplicates Z: 21 15.211 2.075 0.702 0.445 0.800 0.400 CB 1.273 21 residues pruned to eliminate duplicates Z: 83 73.756 2.377 0.848 0.628 0.927 0.695 CB 1.774 83 residues pruned to eliminate duplicates Z: 55 50.259 2.341 0.688 0.617 0.926 0.574 CB 1.674 55 residues pruned to eliminate duplicates Z: 62 54.676 2.304 0.749 0.617 0.934 0.705 CB 1.664 62 residues pruned to eliminate duplicates Z: 86 67.808 2.279 0.846 0.580 0.965 0.576 CB 1.678 86 residues pruned to eliminate duplicates Z: 59 55.120 2.285 0.904 0.613 0.931 0.621 CB 1.605 59 residues pruned to eliminate duplicates Z: 62 54.823 2.282 0.798 0.594 0.951 0.574 CB 1.645 62 residues pruned to eliminate duplicates Z: 56 53.344 2.340 0.697 0.638 0.964 0.636 CB 1.652 56 residues pruned to eliminate duplicates Z: 56 50.389 2.318 0.763 0.624 0.909 0.618 CB 1.628 56 residues pruned to eliminate duplicates Z: 62 48.486 2.267 0.696 0.553 0.934 0.574 CB 1.642 62 residues pruned to eliminate duplicates Z: 99 50.521 2.235 0.647 0.494 0.857 0.561 CB 1.626 99 residues pruned to eliminate duplicates Z: 81 59.431 2.269 0.758 0.569 0.938 0.588 CB 1.662 81 residues pruned to eliminate duplicates Z: 65 55.983 2.318 0.764 0.592 0.938 0.656 CB 1.671 65 residues pruned to eliminate duplicates Z: 6 4.754 1.846 0.079 0.424 0.800 0.600 CA 1.444 6 residues pruned to eliminate duplicates Z: 37 27.868 2.269 0.493 0.435 0.861 0.722 CB 1.703 37 residues pruned to eliminate duplicates Z: 60 29.568 2.199 0.406 0.441 0.847 0.661 CB 1.561 60 residues pruned to eliminate duplicates Z: 44 23.556 2.166 0.301 0.424 0.884 0.628 CB 1.561 44 residues pruned to eliminate duplicates Z: 36 25.897 2.234 0.364 0.425 0.914 0.600 CB 1.698 36 residues pruned to eliminate duplicates Z: 61 33.230 2.194 0.495 0.433 0.883 0.567 CB 1.587 61 residues pruned to eliminate duplicates Z: 91 54.473 2.232 0.658 0.528 0.922 0.622 CB 1.636 91 residues pruned to eliminate duplicates Z: 39 21.906 2.143 0.318 0.355 0.895 0.500 CB 1.644 39 residues pruned to eliminate duplicates Z: 41 23.105 2.154 0.332 0.399 0.875 0.625 CB 1.618 41 residues pruned to eliminate duplicates Z: 38 24.123 2.105 0.444 0.441 0.892 0.568 CB 1.556 38 residues pruned to eliminate duplicates Z: 91 58.642 2.278 0.701 0.549 0.933 0.600 CB 1.629 91 residues pruned to eliminate duplicates Z: 40 24.022 2.200 0.396 0.416 0.846 0.641 CB 1.616 40 residues pruned to eliminate duplicates Z: 100 56.139 2.260 0.642 0.525 0.899 0.586 CB 1.649 100 residues pruned to eliminate duplicates Z: 101 54.230 2.239 0.567 0.526 0.910 0.710 CB 1.656 101 residues pruned to eliminate duplicates Z: 90 51.787 2.278 0.596 0.553 0.899 0.618 CB 1.596 90 residues pruned to eliminate duplicates Z: 97 50.861 2.241 0.581 0.518 0.906 0.552 CB 1.588 97 residues pruned to eliminate duplicates Z: 90 56.049 2.264 0.703 0.545 0.899 0.618 CB 1.641 90 residues pruned to eliminate duplicates Z: 97 58.802 2.292 0.692 0.512 0.906 0.542 CB 1.688 97 residues pruned to eliminate duplicates Z: 101 54.663 2.257 0.649 0.499 0.880 0.610 CB 1.671 101 residues pruned to eliminate duplicates Z: 71 50.945 2.304 0.707 0.539 0.886 0.643 CB 1.682 71 residues pruned to eliminate duplicates Z: 40 22.724 2.172 0.400 0.387 0.821 0.615 CB 1.645 40 residues pruned to eliminate duplicates Z: 59 33.748 2.210 0.525 0.433 0.897 0.569 CB 1.572 59 residues pruned to eliminate duplicates Z: 220 85.996 2.250 0.651 0.578 0.913 0.630 CB 1.589 220 residues pruned to eliminate duplicates Z: 38 25.696 2.145 0.518 0.431 0.865 0.649 CB 1.611 38 residues pruned to eliminate duplicates Z: 97 59.004 2.363 0.693 0.501 0.885 0.635 CB 1.698 97 residues pruned to eliminate duplicates Z: 71 50.310 2.317 0.621 0.535 0.886 0.586 CB 1.747 71 residues pruned to eliminate duplicates Z: 131 66.435 2.238 0.658 0.557 0.915 0.669 CB 1.622 131 residues pruned to eliminate duplicates Z: 28 35.356 2.197 0.849 0.615 0.852 0.741 CA 1.764 28 residues pruned to eliminate duplicates Z: 75 37.105 2.198 0.499 0.434 0.878 0.554 CB 1.595 75 residues pruned to eliminate duplicates Z: 90 56.557 2.293 0.650 0.530 0.921 0.596 CB 1.670 90 residues pruned to eliminate duplicates Z: 34 29.376 2.215 0.535 0.438 0.939 0.636 CB 1.708 34 residues pruned to eliminate duplicates Z: 11 13.818 2.263 0.557 0.377 0.900 0.600 CA 1.571 11 residues pruned to eliminate duplicates Z: 72 49.949 2.286 0.669 0.525 0.859 0.704 CB 1.765 72 residues pruned to eliminate duplicates Z: 45 24.539 2.149 0.479 0.390 0.818 0.591 CB 1.598 45 residues pruned to eliminate duplicates Z: 36 26.615 2.180 0.584 0.432 0.886 0.629 CB 1.578 36 residues pruned to eliminate duplicates Z: 133 73.671 2.277 0.725 0.555 0.924 0.614 CB 1.673 133 residues pruned to eliminate duplicates Z: 94 56.057 2.370 0.681 0.510 0.849 0.677 CB 1.700 94 residues pruned to eliminate duplicates Z: 91 58.383 2.320 0.728 0.531 0.889 0.667 CB 1.675 91 residues pruned to eliminate duplicates Z: 33 54.137 2.417 0.943 0.660 0.969 0.594 CB 1.814 33 residues pruned to eliminate duplicates Z: 36 48.318 2.452 0.887 0.637 0.857 0.600 CB 1.812 36 residues pruned to eliminate duplicates Z: 36 50.044 2.322 0.779 0.636 0.943 0.629 CA 1.911 36 residues pruned to eliminate duplicates Z: 34 49.600 2.434 0.818 0.667 0.909 0.636 CB 1.839 34 residues pruned to eliminate duplicates Z: 78 54.533 2.344 0.763 0.516 0.883 0.584 CB 1.677 78 residues pruned to eliminate duplicates Z: 32 54.059 2.441 0.853 0.701 0.968 0.774 CB 1.847 32 residues pruned to eliminate duplicates Z: 32 50.305 2.414 0.801 0.699 0.935 0.774 CB 1.853 32 residues pruned to eliminate duplicates Z: 33 55.854 2.427 0.951 0.671 0.969 0.750 CB 1.838 33 residues pruned to eliminate duplicates Z: 58 54.812 2.406 0.885 0.555 0.877 0.649 CB 1.729 58 residues pruned to eliminate duplicates Z: 32 59.215 2.396 1.019 0.702 0.935 0.677 CB 1.955 32 residues pruned to eliminate duplicates Z: 68 53.729 2.335 0.694 0.535 0.910 0.687 CB 1.761 68 residues pruned to eliminate duplicates Z: 63 56.038 2.335 0.747 0.554 0.919 0.694 CB 1.800 63 residues pruned to eliminate duplicates Z: 33 56.147 2.431 0.969 0.645 0.969 0.625 CB 1.870 33 residues pruned to eliminate duplicates Z: 55 60.019 2.454 0.896 0.600 0.889 0.704 CB 1.795 55 residues pruned to eliminate duplicates Z: 33 53.608 2.424 0.935 0.665 0.938 0.656 CB 1.850 33 residues pruned to eliminate duplicates Z: 73 53.291 2.378 0.692 0.521 0.889 0.597 CB 1.720 73 residues pruned to eliminate duplicates Z: 72 50.609 2.284 0.670 0.520 0.901 0.620 CB 1.712 72 residues pruned to eliminate duplicates Z: 35 53.655 2.355 1.020 0.645 0.971 0.647 CB 1.740 35 residues pruned to eliminate duplicates Z: 33 56.627 2.449 0.966 0.687 0.938 0.688 CB 1.868 33 residues pruned to eliminate duplicates Z: 34 49.403 2.381 0.903 0.660 0.909 0.636 CB 1.800 34 residues pruned to eliminate duplicates Z: 34 48.340 2.411 0.835 0.669 0.879 0.667 CB 1.852 34 residues pruned to eliminate duplicates Z: 35 51.833 2.356 0.923 0.665 0.912 0.676 CB 1.847 35 residues pruned to eliminate duplicates Z: 106 60.440 2.324 0.680 0.487 0.886 0.610 CB 1.729 106 residues pruned to eliminate duplicates Z: 34 52.538 2.385 0.974 0.660 0.939 0.727 CB 1.781 34 residues pruned to eliminate duplicates Z: 105 61.654 2.306 0.691 0.500 0.913 0.663 CB 1.697 105 residues pruned to eliminate duplicates Z: 35 49.699 2.400 0.944 0.653 0.882 0.647 CB 1.795 35 residues pruned to eliminate duplicates Z: 33 54.486 2.368 1.080 0.668 0.906 0.594 CB 1.847 33 residues pruned to eliminate duplicates Z: 72 53.598 2.282 0.674 0.544 0.901 0.648 CB 1.770 72 residues pruned to eliminate duplicates Z: 67 52.434 2.312 0.768 0.540 0.879 0.606 CB 1.727 67 residues pruned to eliminate duplicates Z: 32 58.238 2.426 1.032 0.710 0.935 0.613 CB 1.875 32 residues pruned to eliminate duplicates Z: 55 55.411 2.386 0.919 0.543 0.889 0.630 CB 1.777 55 residues pruned to eliminate duplicates Z: 40 28.354 2.298 0.621 0.374 0.846 0.564 CB 1.649 40 residues pruned to eliminate duplicates Z: 23 22.252 2.446 0.705 0.415 0.727 0.682 CB 1.710 23 residues pruned to eliminate duplicates Z: 56 57.272 2.410 0.847 0.562 0.945 0.636 CB 1.727 56 residues pruned to eliminate duplicates Z: 22 31.261 2.476 0.734 0.473 0.905 0.714 CB 1.805 22 residues pruned to eliminate duplicates Z: 24 24.212 2.475 0.561 0.423 0.826 0.609 CB 1.713 24 residues pruned to eliminate duplicates Z: 23 24.089 2.456 0.589 0.410 0.864 0.682 CB 1.674 23 residues pruned to eliminate duplicates Z: 43 30.480 2.328 0.619 0.400 0.881 0.619 CB 1.574 43 residues pruned to eliminate duplicates Z: 22 21.964 2.333 0.750 0.425 0.857 0.619 CB 1.481 22 residues pruned to eliminate duplicates Z: 22 29.926 2.532 0.706 0.471 0.857 0.714 CB 1.817 22 residues pruned to eliminate duplicates Z: 43 32.641 2.321 0.633 0.423 0.905 0.619 CB 1.591 43 residues pruned to eliminate duplicates Z: 23 26.711 2.511 0.753 0.457 0.818 0.682 CB 1.652 23 residues pruned to eliminate duplicates Z: 22 32.224 2.522 0.720 0.464 0.905 0.619 CB 1.857 22 residues pruned to eliminate duplicates Z: 44 32.456 2.285 0.665 0.420 0.884 0.605 CB 1.601 44 residues pruned to eliminate duplicates Z: 21 26.373 2.525 0.604 0.448 0.850 0.650 CB 1.807 21 residues pruned to eliminate duplicates Z: 91 47.109 2.146 0.512 0.606 0.911 0.744 CB 1.518 91 residues pruned to eliminate duplicates Z: 19 24.891 2.414 0.580 0.500 0.889 0.722 CB 1.731 19 residues pruned to eliminate duplicates Z: 38 34.651 2.323 0.693 0.466 0.892 0.622 CB 1.682 38 residues pruned to eliminate duplicates Z: 21 26.281 2.439 0.827 0.459 0.800 0.550 CB 1.719 21 residues pruned to eliminate duplicates Z: 22 30.913 2.467 0.674 0.476 0.952 0.714 CB 1.758 22 residues pruned to eliminate duplicates Z: 76 55.864 2.370 0.738 0.544 0.907 0.653 CB 1.655 76 residues pruned to eliminate duplicates Z: 77 56.010 2.343 0.802 0.511 0.895 0.592 CB 1.681 77 residues pruned to eliminate duplicates Z: 40 33.713 2.325 0.676 0.424 0.897 0.667 CB 1.670 40 residues pruned to eliminate duplicates Z: 40 29.260 2.323 0.586 0.382 0.872 0.564 CB 1.654 40 residues pruned to eliminate duplicates Z: 23 17.451 2.133 0.509 0.442 0.864 0.636 CB 1.420 23 residues pruned to eliminate duplicates Z: 23 17.087 2.127 0.498 0.463 0.955 0.455 CB 1.244 23 residues pruned to eliminate duplicates Z: 23 20.217 2.140 0.737 0.479 0.955 0.636 CB 1.240 23 residues pruned to eliminate duplicates Z: 27 16.539 2.134 0.599 0.403 0.808 0.500 CB 1.304 27 residues pruned to eliminate duplicates Z: 41 28.487 2.305 0.614 0.376 0.850 0.625 CB 1.626 41 residues pruned to eliminate duplicates Z: 30 21.441 2.099 0.653 0.394 0.931 0.552 CB 1.378 30 residues pruned to eliminate duplicates Z: 20 10.410 2.014 0.195 0.335 0.842 0.421 CB 1.411 20 residues pruned to eliminate duplicates Z: 76 38.840 2.018 0.569 0.576 0.947 0.693 CB 1.391 76 residues pruned to eliminate duplicates Z: 36 29.938 2.329 0.675 0.432 0.829 0.657 CB 1.680 36 residues pruned to eliminate duplicates Z: 24 16.278 2.146 0.475 0.316 0.913 0.391 CB 1.440 57 residues pruned to eliminate duplicates Z: 52 26.078 2.217 0.611 0.389 0.863 0.529 CB 1.332 52 residues pruned to eliminate duplicates Z: 25 12.359 2.034 0.413 0.330 0.833 0.417 CB 1.270 25 residues pruned to eliminate duplicates Z: 54 31.850 2.346 0.661 0.409 0.830 0.453 CB 1.487 63 residues pruned to eliminate duplicates Z: 56 31.612 2.325 0.570 0.415 0.873 0.509 CB 1.462 56 residues pruned to eliminate duplicates Z: 38 30.150 2.499 0.761 0.425 0.811 0.541 CB 1.503 4 residues pruned to eliminate duplicates Z: 6 4.360 1.877 0.168 0.305 0.800 0.600 CB 1.382 6 residues pruned to eliminate duplicates Z: 65 38.415 2.266 0.679 0.440 0.859 0.500 CB 1.564 65 residues pruned to eliminate duplicates Z: 42 27.327 2.425 0.749 0.390 0.805 0.439 CB 1.405 44 residues pruned to eliminate duplicates Z: 7 7.680 1.748 1.261 0.508 0.833 0.833 CB 0.944 7 residues pruned to eliminate duplicates Z: 33 22.565 2.381 0.611 0.381 0.812 0.531 CB 1.452 33 residues pruned to eliminate duplicates Z: 50 27.929 2.388 0.629 0.418 0.776 0.429 CB 1.441 50 residues pruned to eliminate duplicates Z: 20 21.648 2.466 0.678 0.419 0.895 0.632 CB 1.459 20 residues pruned to eliminate duplicates Z: 63 43.426 2.347 0.869 0.411 0.839 0.468 CB 1.646 63 residues pruned to eliminate duplicates Z: 75 64.887 2.482 0.980 0.486 0.851 0.527 CB 1.827 75 residues pruned to eliminate duplicates Z: 7 11.290 2.026 0.535 0.481 1.000 0.333 CB 1.510 7 residues pruned to eliminate duplicates Z: 18 19.091 2.111 0.712 0.478 0.941 0.294 CB 1.392 18 residues pruned to eliminate duplicates Z: 36 32.508 2.499 0.774 0.432 0.829 0.429 CB 1.605 36 residues pruned to eliminate duplicates Z: 37 30.133 2.476 0.658 0.447 0.806 0.389 CB 1.605 37 residues pruned to eliminate duplicates Z: 32 24.353 2.374 0.680 0.430 0.806 0.419 CB 1.462 32 residues pruned to eliminate duplicates Z: 60 47.917 2.506 0.759 0.456 0.847 0.492 CB 1.747 60 residues pruned to eliminate duplicates Z: 123 78.763 2.439 0.754 0.537 0.902 0.615 CB 1.782 123 residues pruned to eliminate duplicates Z: 69 44.452 2.387 0.700 0.442 0.838 0.500 CB 1.682 69 residues pruned to eliminate duplicates Z: 9 5.509 2.260 0.127 0.130 0.750 0.375 C 1.619 9 residues pruned to eliminate duplicates Z: 15 11.632 2.335 0.636 0.389 0.714 0.143 CB 1.281 15 residues pruned to eliminate duplicates Z: 21 18.253 2.383 0.620 0.419 0.800 0.450 CB 1.438 21 residues pruned to eliminate duplicates Z: 40 29.714 2.473 0.730 0.395 0.846 0.487 CB 1.468 40 residues pruned to eliminate duplicates Z: 56 46.684 2.435 0.778 0.483 0.891 0.509 CB 1.661 56 residues pruned to eliminate duplicates Z: 47 44.080 2.549 0.751 0.467 0.826 0.413 CB 1.823 47 residues pruned to eliminate duplicates Z: 75 49.135 2.432 0.755 0.435 0.838 0.527 CB 1.709 75 residues pruned to eliminate duplicates Z: 23 41.190 2.580 0.919 0.529 0.864 0.591 C 1.995 23 residues pruned to eliminate duplicates Z: 122 82.502 2.491 0.742 0.547 0.901 0.620 CB 1.832 122 residues pruned to eliminate duplicates Z: 42 57.130 2.425 0.752 0.636 0.976 0.561 C 1.895 53 residues pruned to eliminate duplicates Z: 29 33.229 2.380 0.792 0.439 0.857 0.500 C 1.829 29 residues pruned to eliminate duplicates Z: 24 40.793 2.502 0.933 0.538 0.913 0.522 C 1.857 24 residues pruned to eliminate duplicates Z: 61 45.148 2.445 0.843 0.436 0.833 0.500 CB 1.659 61 residues pruned to eliminate duplicates Z: 24 39.168 2.481 0.954 0.504 0.913 0.435 C 1.838 24 residues pruned to eliminate duplicates Z: 23 46.020 2.591 1.092 0.536 0.955 0.591 C 1.830 23 residues pruned to eliminate duplicates Z: 20 37.254 2.473 0.841 0.648 0.895 0.684 C 1.827 20 residues pruned to eliminate duplicates Z: 28 35.173 2.534 0.869 0.462 0.778 0.481 CB 1.909 28 residues pruned to eliminate duplicates Z: 60 43.477 2.440 0.856 0.427 0.797 0.475 CB 1.693 60 residues pruned to eliminate duplicates Z: 79 44.174 2.373 0.767 0.405 0.795 0.449 CB 1.658 79 residues pruned to eliminate duplicates Z: 23 32.924 2.308 0.960 0.614 0.818 0.455 C 1.702 23 residues pruned to eliminate duplicates Z: 22 45.779 2.536 0.897 0.569 0.952 0.524 C 2.040 22 residues pruned to eliminate duplicates Z: 39 41.029 2.435 0.853 0.471 0.868 0.553 CB 1.748 39 residues pruned to eliminate duplicates Z: 60 46.767 2.531 0.783 0.453 0.814 0.492 CB 1.740 60 residues pruned to eliminate duplicates Z: 47 66.160 2.500 1.050 0.575 0.891 0.652 C 1.987 47 residues pruned to eliminate duplicates Z: 41 76.239 2.650 1.027 0.648 0.925 0.700 C 2.114 41 residues pruned to eliminate duplicates Z: 29 44.649 2.379 0.838 0.641 0.929 0.643 CB 1.822 29 residues pruned to eliminate duplicates Z: 27 49.674 2.299 1.152 0.657 0.923 0.654 C 1.843 27 residues pruned to eliminate duplicates Z: 46 50.287 2.367 0.786 0.588 0.867 0.533 CB 1.881 46 residues pruned to eliminate duplicates Z: 48 67.309 2.505 0.863 0.610 0.957 0.638 CB 1.979 48 residues pruned to eliminate duplicates Z: 21 62.059 2.606 1.234 0.723 0.950 0.750 C 2.051 21 residues pruned to eliminate duplicates Z: 59 70.722 2.574 0.930 0.571 0.897 0.534 CB 1.946 59 residues pruned to eliminate duplicates Z: 57 63.492 2.536 0.881 0.515 0.911 0.518 CB 1.924 57 residues pruned to eliminate duplicates Z: 99 72.226 2.476 0.844 0.518 0.878 0.592 CB 1.789 99 residues pruned to eliminate duplicates Z: 66 74.468 2.448 0.782 0.638 0.938 0.692 CB 1.982 66 residues pruned to eliminate duplicates Z: 56 64.028 2.502 0.925 0.528 0.891 0.582 C 1.957 56 residues pruned to eliminate duplicates Z: 21 60.267 2.604 1.274 0.723 0.900 0.750 C 2.067 21 residues pruned to eliminate duplicates Z: 65 75.602 2.470 0.807 0.640 0.953 0.703 CB 1.948 65 residues pruned to eliminate duplicates Z: 25 54.558 2.393 1.145 0.632 0.958 0.708 CA 2.001 25 residues pruned to eliminate duplicates Z: 24 52.981 2.458 1.105 0.650 0.913 0.652 C 2.033 24 residues pruned to eliminate duplicates Z: 46 67.138 2.506 0.945 0.638 0.911 0.644 CB 1.980 46 residues pruned to eliminate duplicates Z: 22 59.578 2.571 1.264 0.737 0.905 0.667 C 1.997 22 residues pruned to eliminate duplicates Z: 29 52.759 2.410 1.075 0.638 0.929 0.607 CB 1.887 29 residues pruned to eliminate duplicates Z: 92 71.054 2.392 0.754 0.578 0.923 0.648 CB 1.785 92 residues pruned to eliminate duplicates Z: 21 57.832 2.580 1.143 0.721 0.950 0.850 C 2.017 21 residues pruned to eliminate duplicates Z: 48 70.649 2.568 1.027 0.577 0.915 0.681 C 2.009 48 residues pruned to eliminate duplicates Z: 10 8.857 2.070 0.326 0.490 0.889 0.556 CB 1.223 10 residues pruned to eliminate duplicates Z: 66 65.382 2.421 0.699 0.608 0.938 0.738 CB 1.896 66 residues pruned to eliminate duplicates Z: 43 50.218 2.414 0.535 0.619 0.976 0.738 CB 1.916 43 residues pruned to eliminate duplicates Z: 65 65.305 2.476 0.649 0.636 0.922 0.719 CB 1.908 65 residues pruned to eliminate duplicates Z: 44 48.669 2.388 0.531 0.631 0.977 0.744 CB 1.837 44 residues pruned to eliminate duplicates Z: 42 48.308 2.416 0.525 0.626 0.951 0.683 CB 1.912 42 residues pruned to eliminate duplicates Z: 40 44.077 2.392 0.467 0.637 0.974 0.692 CB 1.816 40 residues pruned to eliminate duplicates Z: 50 48.707 2.331 0.623 0.576 0.939 0.694 CB 1.821 53 residues pruned to eliminate duplicates Z: 21 32.196 2.397 0.157 0.901 1.000 0.850 CB 1.853 21 residues pruned to eliminate duplicates Z: 42 51.767 2.391 0.631 0.625 0.951 0.780 CB 1.937 42 residues pruned to eliminate duplicates Z: 47 48.248 2.321 0.577 0.633 0.957 0.674 CB 1.793 47 residues pruned to eliminate duplicates Z: 41 52.940 2.453 0.557 0.651 0.975 0.700 CB 1.952 41 residues pruned to eliminate duplicates Z: 51 41.320 2.194 0.541 0.615 0.900 0.560 CB 1.723 51 residues pruned to eliminate duplicates Z: 42 52.886 2.406 0.684 0.633 0.951 0.756 CB 1.892 42 residues pruned to eliminate duplicates Z: 44 48.124 2.371 0.712 0.616 0.907 0.698 CB 1.785 44 residues pruned to eliminate duplicates Z: 42 49.083 2.409 0.660 0.607 0.927 0.707 CB 1.868 42 residues pruned to eliminate duplicates Z: 42 53.815 2.428 0.690 0.625 0.976 0.683 CB 1.865 42 residues pruned to eliminate duplicates Z: 42 49.517 2.372 0.618 0.593 0.976 0.683 CB 1.891 42 residues pruned to eliminate duplicates Z: 43 50.924 2.336 0.808 0.602 0.905 0.714 CB 1.867 43 residues pruned to eliminate duplicates Z: 41 57.555 2.410 0.833 0.633 0.950 0.725 CB 1.913 41 residues pruned to eliminate duplicates Z: 41 57.490 2.414 0.795 0.632 0.950 0.750 CB 1.951 41 residues pruned to eliminate duplicates Z: 36 54.692 2.362 0.858 0.652 0.971 0.686 CB 1.881 36 residues pruned to eliminate duplicates Z: 26 54.918 2.438 0.931 0.774 0.960 0.800 CB 1.908 26 residues pruned to eliminate duplicates Z: 43 54.746 2.357 0.765 0.609 0.976 0.738 CB 1.876 43 residues pruned to eliminate duplicates Z: 38 54.441 2.380 0.834 0.641 0.946 0.811 C 1.900 38 residues pruned to eliminate duplicates Z: 43 60.206 2.392 0.923 0.631 0.976 0.762 CB 1.830 43 residues pruned to eliminate duplicates Z: 42 57.001 2.424 0.868 0.629 0.927 0.732 CB 1.879 42 residues pruned to eliminate duplicates Z: 42 57.970 2.397 0.918 0.633 0.927 0.732 CB 1.876 42 residues pruned to eliminate duplicates Z: 38 54.774 2.386 0.906 0.641 0.946 0.757 CB 1.835 38 residues pruned to eliminate duplicates Z: 35 50.373 2.325 0.882 0.619 0.941 0.647 C 1.876 35 residues pruned to eliminate duplicates Z: 44 50.715 2.364 0.761 0.616 0.907 0.605 CB 1.835 44 residues pruned to eliminate duplicates Z: 40 54.846 2.390 0.859 0.614 0.949 0.744 CB 1.870 40 residues pruned to eliminate duplicates Z: 35 49.348 2.292 0.963 0.654 0.912 0.647 CB 1.787 35 residues pruned to eliminate duplicates Z: 43 59.332 2.377 0.983 0.624 0.929 0.714 CB 1.861 43 residues pruned to eliminate duplicates Z: 44 54.197 2.330 0.888 0.627 0.930 0.605 CB 1.792 44 residues pruned to eliminate duplicates Z: 43 54.437 2.378 0.922 0.622 0.905 0.690 CB 1.811 43 residues pruned to eliminate duplicates Z: 39 54.124 2.389 0.885 0.640 0.947 0.684 CB 1.805 39 residues pruned to eliminate duplicates Z: 36 57.397 2.384 0.902 0.680 0.971 0.714 CB 1.867 36 residues pruned to eliminate duplicates Z: 35 61.106 2.384 0.988 0.717 0.971 0.794 CB 1.871 35 residues pruned to eliminate duplicates Z: 35 45.467 2.262 0.728 0.650 0.971 0.647 C 1.788 35 residues pruned to eliminate duplicates Z: 50 61.322 2.458 0.837 0.629 0.898 0.714 CB 1.914 50 residues pruned to eliminate duplicates Z: 61 61.196 2.358 0.792 0.598 0.950 0.683 CB 1.793 61 residues pruned to eliminate duplicates Z: 49 58.182 2.414 0.799 0.611 0.938 0.646 CB 1.857 49 residues pruned to eliminate duplicates Z: 51 62.873 2.394 0.845 0.624 0.960 0.760 CB 1.866 51 residues pruned to eliminate duplicates Z: 10 17.247 2.297 0.500 0.665 0.889 0.778 CB 1.610 10 residues pruned to eliminate duplicates Z: 74 80.158 2.436 0.919 0.623 0.932 0.726 CB 1.918 74 residues pruned to eliminate duplicates Z: 21 17.012 2.128 0.443 0.483 0.800 0.450 CB 1.575 21 residues pruned to eliminate duplicates Z: 19 19.406 2.204 0.614 0.512 0.889 0.444 CB 1.430 19 residues pruned to eliminate duplicates Z: 21 22.616 2.166 0.613 0.515 0.900 0.450 CB 1.585 21 residues pruned to eliminate duplicates Z: 10 19.688 2.415 0.326 0.581 1.000 0.667 CB 1.897 10 residues pruned to eliminate duplicates Z: 70 55.570 2.283 0.736 0.549 0.913 0.551 CB 1.763 70 residues pruned to eliminate duplicates Z: 19 17.302 2.181 0.526 0.507 0.778 0.444 CB 1.564 19 residues pruned to eliminate duplicates Z: 61 59.179 2.337 0.741 0.608 0.933 0.650 CB 1.816 61 residues pruned to eliminate duplicates Z: 21 23.078 2.172 0.477 0.522 0.900 0.450 CB 1.749 21 residues pruned to eliminate duplicates Z: 23 17.160 2.099 0.465 0.401 0.864 0.364 CB 1.529 23 residues pruned to eliminate duplicates Z: 60 56.489 2.343 0.770 0.575 0.898 0.644 CB 1.837 60 residues pruned to eliminate duplicates Z: 23 15.479 2.011 0.468 0.393 0.818 0.227 CB 1.530 23 residues pruned to eliminate duplicates Z: 33 19.216 2.132 0.381 0.373 0.906 0.500 CB 1.457 33 residues pruned to eliminate duplicates Z: 62 60.442 2.355 0.751 0.588 0.934 0.590 CB 1.846 62 residues pruned to eliminate duplicates Z: 22 23.672 2.169 0.531 0.509 0.952 0.524 CB 1.619 22 residues pruned to eliminate duplicates Z: 33 25.644 2.204 0.516 0.444 0.906 0.594 CB 1.587 33 residues pruned to eliminate duplicates Z: 70 48.162 2.256 0.676 0.544 0.884 0.609 CB 1.661 70 residues pruned to eliminate duplicates Z: 58 36.558 2.227 0.537 0.427 0.930 0.526 CB 1.642 58 residues pruned to eliminate duplicates Z: 100 62.708 2.327 0.690 0.518 0.899 0.586 CB 1.751 100 residues pruned to eliminate duplicates Z: 37 25.168 2.230 0.417 0.387 0.917 0.500 CB 1.632 37 residues pruned to eliminate duplicates Z: 30 21.434 2.155 0.315 0.539 0.897 0.517 CB 1.508 30 residues pruned to eliminate duplicates Z: 44 25.891 2.226 0.387 0.417 0.884 0.512 CB 1.578 44 residues pruned to eliminate duplicates Z: 39 26.084 2.242 0.525 0.386 0.868 0.553 CB 1.609 39 residues pruned to eliminate duplicates Z: 41 21.464 2.170 0.483 0.368 0.800 0.450 CB 1.518 41 residues pruned to eliminate duplicates Z: 59 31.916 2.230 0.456 0.437 0.862 0.483 CB 1.598 59 residues pruned to eliminate duplicates Z: 27 26.597 2.259 0.539 0.465 0.923 0.615 CB 1.684 27 residues pruned to eliminate duplicates Z: 33 29.088 2.275 0.525 0.438 0.938 0.469 CB 1.686 33 residues pruned to eliminate duplicates Z: 33 30.756 2.258 0.599 0.454 0.938 0.562 CB 1.684 33 residues pruned to eliminate duplicates Z: 32 31.729 2.296 0.547 0.471 0.935 0.581 CB 1.766 32 residues pruned to eliminate duplicates Z: 33 27.132 2.230 0.485 0.443 0.906 0.531 CB 1.694 33 residues pruned to eliminate duplicates Z: 33 28.913 2.253 0.518 0.427 0.906 0.500 CB 1.779 33 residues pruned to eliminate duplicates Z: 97 63.623 2.330 0.651 0.525 0.938 0.625 CB 1.757 97 residues pruned to eliminate duplicates Z: 47 25.717 2.172 0.529 0.438 0.826 0.522 CB 1.473 47 residues pruned to eliminate duplicates Z: 34 28.515 2.228 0.545 0.447 0.909 0.576 CB 1.675 34 residues pruned to eliminate duplicates Z: 25 18.765 2.055 0.428 0.494 0.875 0.542 CB 1.501 25 residues pruned to eliminate duplicates Z: 31 33.181 2.310 0.672 0.467 0.933 0.733 CB 1.738 31 residues pruned to eliminate duplicates Z: 28 25.451 2.232 0.484 0.471 0.926 0.667 CB 1.645 28 residues pruned to eliminate duplicates Z: 31 32.897 2.297 0.642 0.484 0.933 0.800 CB 1.733 31 residues pruned to eliminate duplicates Z: 32 27.539 2.258 0.408 0.432 0.935 0.613 CB 1.784 32 residues pruned to eliminate duplicates Z: 23 29.955 2.282 0.548 0.525 0.955 0.773 CB 1.847 23 residues pruned to eliminate duplicates Z: 29 25.092 2.158 0.629 0.383 0.893 0.679 CB 1.710 29 residues pruned to eliminate duplicates Z: 30 27.552 2.208 0.494 0.442 0.931 0.690 CB 1.768 30 residues pruned to eliminate duplicates Z: 36 27.437 2.212 0.589 0.450 0.829 0.657 CB 1.676 36 residues pruned to eliminate duplicates Z: 94 46.047 2.195 0.502 0.458 0.914 0.591 CB 1.654 113 residues pruned to eliminate duplicates Z: 39 27.656 2.243 0.501 0.435 0.895 0.658 CB 1.594 39 residues pruned to eliminate duplicates Z: 32 29.125 2.301 0.511 0.460 0.871 0.645 CB 1.800 32 residues pruned to eliminate duplicates Z: 51 23.153 2.133 0.409 0.392 0.800 0.620 CB 1.526 51 residues pruned to eliminate duplicates Z: 33 24.066 2.147 0.521 0.456 0.906 0.594 CB 1.503 33 residues pruned to eliminate duplicates Z: 94 61.704 2.326 0.666 0.527 0.925 0.624 CB 1.737 94 residues pruned to eliminate duplicates Z: 32 31.006 2.219 0.535 0.484 0.935 0.742 CB 1.775 32 residues pruned to eliminate duplicates Z: 36 28.517 2.106 0.547 0.438 0.914 0.657 CB 1.726 36 residues pruned to eliminate duplicates Z: 61 25.991 2.113 0.435 0.429 0.833 0.567 CB 1.429 61 residues pruned to eliminate duplicates Z: 33 27.776 2.194 0.653 0.474 0.906 0.688 CB 1.534 33 residues pruned to eliminate duplicates Z: 36 23.334 2.191 0.464 0.433 0.857 0.686 CB 1.538 36 residues pruned to eliminate duplicates Z: 37 52.476 2.377 0.848 0.617 0.944 0.667 CB 1.888 37 residues pruned to eliminate duplicates Z: 34 47.754 2.395 0.735 0.606 0.939 0.667 CB 1.925 34 residues pruned to eliminate duplicates Z: 33 51.201 2.424 0.756 0.667 0.969 0.750 CB 1.882 33 residues pruned to eliminate duplicates Z: 36 47.969 2.395 0.857 0.625 0.857 0.657 CB 1.890 36 residues pruned to eliminate duplicates Z: 68 54.910 2.337 0.706 0.524 0.940 0.701 CB 1.748 68 residues pruned to eliminate duplicates Z: 34 60.448 2.391 0.916 0.676 1.000 0.727 CB 1.953 34 residues pruned to eliminate duplicates Z: 32 56.545 2.484 0.821 0.720 0.935 0.774 CB 1.967 32 residues pruned to eliminate duplicates Z: 34 54.527 2.417 0.964 0.669 0.879 0.667 CB 1.945 34 residues pruned to eliminate duplicates Z: 33 52.727 2.403 0.850 0.673 0.969 0.719 CB 1.844 33 residues pruned to eliminate duplicates Z: 32 48.746 2.438 0.728 0.696 0.903 0.677 CB 1.923 32 residues pruned to eliminate duplicates Z: 34 51.294 2.425 0.968 0.652 0.879 0.697 CB 1.849 34 residues pruned to eliminate duplicates Z: 37 51.522 2.418 0.907 0.609 0.917 0.639 CB 1.832 37 residues pruned to eliminate duplicates Z: 72 51.881 2.386 0.850 0.537 0.831 0.606 CB 1.619 67 residues pruned to eliminate duplicates Z: 17 31.548 2.261 0.579 0.904 0.938 0.875 CA 1.678 17 residues pruned to eliminate duplicates Z: 29 52.546 2.392 0.937 0.673 1.000 0.714 CB 1.827 29 residues pruned to eliminate duplicates Z: 33 56.605 2.409 0.902 0.671 0.969 0.688 CB 1.925 33 residues pruned to eliminate duplicates Z: 35 50.311 2.335 0.880 0.651 0.912 0.618 CA 1.873 35 residues pruned to eliminate duplicates Z: 55 60.455 2.478 0.894 0.580 0.889 0.722 CB 1.826 55 residues pruned to eliminate duplicates Z: 65 56.795 2.352 0.765 0.550 0.906 0.672 CB 1.798 65 residues pruned to eliminate duplicates Z: 33 62.524 2.406 1.144 0.693 0.938 0.656 CB 1.915 33 residues pruned to eliminate duplicates Z: 58 61.550 2.468 0.947 0.579 0.877 0.667 CB 1.792 58 residues pruned to eliminate duplicates Z: 58 52.796 2.416 0.836 0.561 0.860 0.702 CB 1.729 58 residues pruned to eliminate duplicates Z: 54 58.155 2.479 0.918 0.585 0.887 0.642 CB 1.746 54 residues pruned to eliminate duplicates Z: 17 31.437 2.282 1.208 0.470 0.875 0.438 CB 1.837 17 residues pruned to eliminate duplicates Z: 33 60.539 2.452 1.044 0.686 0.938 0.625 CB 1.920 33 residues pruned to eliminate duplicates Z: 58 62.964 2.499 0.887 0.571 0.912 0.719 CB 1.811 58 residues pruned to eliminate duplicates Z: 33 65.421 2.420 1.109 0.682 1.000 0.750 CB 1.917 33 residues pruned to eliminate duplicates Z: 33 61.986 2.425 1.131 0.696 0.938 0.688 CB 1.892 33 residues pruned to eliminate duplicates Z: 39 46.020 2.381 0.899 0.609 0.816 0.605 CB 1.825 39 residues pruned to eliminate duplicates Z: 38 55.225 2.448 1.098 0.649 0.865 0.703 CB 1.779 38 residues pruned to eliminate duplicates Z: 125 86.179 2.399 0.883 0.603 0.919 0.694 CB 1.690 125 residues pruned to eliminate duplicates Z: 34 62.855 2.388 1.120 0.689 0.939 0.636 CB 1.934 34 residues pruned to eliminate duplicates Z: 33 61.893 2.427 1.144 0.702 0.906 0.688 CB 1.930 33 residues pruned to eliminate duplicates Z: 7 3.477 2.179 0.485 0.399 0.500 0.333 CB 0.976 Z: 39 53.291 2.373 1.005 0.613 0.921 0.632 CB 1.772 46 residues pruned to eliminate duplicates Z: 24 23.806 2.564 0.472 0.415 0.826 0.652 CB 1.739 24 residues pruned to eliminate duplicates Z: 24 26.613 2.496 0.665 0.435 0.870 0.652 CB 1.643 24 residues pruned to eliminate duplicates Z: 22 19.583 2.260 0.432 0.422 0.857 0.524 CB 1.670 22 residues pruned to eliminate duplicates Z: 19 24.066 2.555 0.459 0.468 0.889 0.778 CB 1.767 19 residues pruned to eliminate duplicates Z: 23 19.242 2.300 0.447 0.399 0.864 0.773 CB 1.587 23 residues pruned to eliminate duplicates Z: 51 26.001 2.280 0.655 0.262 0.780 0.460 CB 1.640 51 residues pruned to eliminate duplicates Z: 22 28.459 2.560 0.586 0.469 0.857 0.667 CB 1.842 22 residues pruned to eliminate duplicates Z: 24 25.989 2.337 0.705 0.473 0.870 0.522 CB 1.607 24 residues pruned to eliminate duplicates Z: 20 23.593 2.447 0.635 0.482 0.842 0.632 CB 1.636 20 residues pruned to eliminate duplicates Z: 25 20.555 2.363 0.362 0.409 0.875 0.500 CB 1.639 25 residues pruned to eliminate duplicates Z: 24 20.044 2.440 0.467 0.449 0.739 0.652 CB 1.665 24 residues pruned to eliminate duplicates Z: 20 20.966 2.418 0.448 0.446 0.895 0.526 CB 1.623 20 residues pruned to eliminate duplicates Z: 23 24.670 2.429 0.586 0.455 0.864 0.636 CB 1.654 23 residues pruned to eliminate duplicates Z: 21 24.377 2.518 0.571 0.462 0.800 0.550 CB 1.792 21 residues pruned to eliminate duplicates Z: 20 21.525 2.468 0.457 0.454 0.842 0.579 CB 1.710 20 residues pruned to eliminate duplicates Z: 22 20.246 2.423 0.463 0.432 0.810 0.619 CB 1.652 22 residues pruned to eliminate duplicates Z: 27 24.387 2.467 0.554 0.438 0.808 0.654 CB 1.645 27 residues pruned to eliminate duplicates Z: 26 23.152 2.475 0.541 0.402 0.800 0.560 CB 1.683 26 residues pruned to eliminate duplicates Z: 45 25.049 2.322 0.634 0.345 0.795 0.545 CB 1.480 45 residues pruned to eliminate duplicates Z: 62 48.483 2.442 0.603 0.512 0.902 0.607 CB 1.738 62 residues pruned to eliminate duplicates Z: 95 56.260 2.318 0.735 0.497 0.872 0.606 CB 1.659 95 residues pruned to eliminate duplicates Z: 6 13.562 2.339 1.126 0.519 0.800 0.600 CB 1.497 6 residues pruned to eliminate duplicates Z: 38 29.621 2.373 0.634 0.423 0.865 0.568 CB 1.574 38 residues pruned to eliminate duplicates Z: 22 16.060 2.090 0.626 0.498 0.905 0.476 CB 1.142 22 residues pruned to eliminate duplicates Z: 14 19.964 2.223 0.702 0.466 0.923 0.538 CB 1.642 14 residues pruned to eliminate duplicates Z: 17 15.300 2.178 0.560 0.466 0.875 0.500 CB 1.332 17 residues pruned to eliminate duplicates Z: 73 58.659 2.299 0.854 0.638 0.931 0.694 CB 1.532 73 residues pruned to eliminate duplicates Z: 42 42.862 2.393 0.706 0.543 0.902 0.610 CB 1.742 42 residues pruned to eliminate duplicates Z: 47 41.777 2.393 0.724 0.532 0.913 0.609 CB 1.584 47 residues pruned to eliminate duplicates Z: 19 15.062 2.188 0.533 0.445 0.833 0.444 CB 1.344 19 residues pruned to eliminate duplicates Z: 37 25.066 2.121 0.611 0.469 0.917 0.444 CB 1.377 37 residues pruned to eliminate duplicates Z: 18 15.769 2.025 0.622 0.473 0.882 0.529 CB 1.357 18 residues pruned to eliminate duplicates Z: 24 23.332 2.200 0.717 0.464 0.957 0.565 CB 1.397 24 residues pruned to eliminate duplicates Z: 78 55.437 2.279 0.745 0.619 0.922 0.675 CB 1.540 78 residues pruned to eliminate duplicates Z: 78 56.650 2.311 0.816 0.597 0.896 0.662 CB 1.564 78 residues pruned to eliminate duplicates Z: 110 70.072 2.316 0.708 0.583 0.917 0.661 CB 1.708 110 residues pruned to eliminate duplicates Z: 72 48.132 2.329 0.719 0.527 0.887 0.634 CB 1.567 72 residues pruned to eliminate duplicates Z: 73 65.411 2.319 0.824 0.657 0.972 0.694 CB 1.621 73 residues pruned to eliminate duplicates Z: 29 37.017 2.427 0.681 0.618 0.929 0.714 CB 1.652 Z: 6 5.987 1.741 0.318 0.652 1.000 0.600 CB 1.013 6 residues pruned to eliminate duplicates Z: 29 36.247 2.364 0.615 0.598 0.929 0.679 CB 1.759 28 residues pruned to eliminate duplicates Z: 7 5.794 2.086 0.953 0.335 0.667 0.333 CB 1.043 7 residues pruned to eliminate duplicates Z: 74 55.137 2.284 0.766 0.621 0.918 0.726 CB 1.555 104 residues pruned to eliminate duplicates Z: 72 54.268 2.310 0.689 0.614 0.930 0.761 CB 1.594 72 residues pruned to eliminate duplicates Z: 28 34.455 2.435 0.634 0.614 0.889 0.741 CB 1.682 Z: 20 47.413 2.379 0.661 0.935 1.000 0.842 CA 1.918 28 residues pruned to eliminate duplicates Z: 18 54.165 2.502 0.897 0.915 0.941 0.765 C 2.078 19 residues pruned to eliminate duplicates Z: 18 50.139 2.545 0.716 0.939 1.000 0.824 C 1.935 18 residues pruned to eliminate duplicates Z: 29 40.189 2.428 0.868 0.611 0.929 0.643 CB 1.624 28 residues pruned to eliminate duplicates Z: 18 61.142 2.563 1.017 0.925 1.000 0.882 C 2.012 20 residues pruned to eliminate duplicates Z: 19 60.970 2.454 1.049 0.930 1.000 0.833 CB 1.998 18 residues pruned to eliminate duplicates Z: 17 52.897 2.562 0.858 0.951 1.000 0.812 C 1.915 17 residues pruned to eliminate duplicates Z: 55 57.359 2.340 0.807 0.702 0.926 0.759 CB 1.658 24 residues pruned to eliminate duplicates Z: 19 52.546 2.419 0.949 0.928 0.944 0.667 C 1.948 19 residues pruned to eliminate duplicates Z: 42 43.123 2.334 0.776 0.560 0.927 0.610 CB 1.654 92 residues pruned to eliminate duplicates Z: 42 50.509 2.413 0.881 0.550 0.951 0.659 CB 1.741 42 residues pruned to eliminate duplicates Z: 33 32.850 2.344 0.636 0.585 0.875 0.688 CB 1.595 33 residues pruned to eliminate duplicates Z: 47 41.991 2.363 0.691 0.550 0.935 0.739 CB 1.578 47 residues pruned to eliminate duplicates Z: 108 67.510 2.271 0.787 0.567 0.907 0.654 CB 1.662 108 residues pruned to eliminate duplicates Z: 115 86.734 2.363 0.831 0.659 0.912 0.746 CB 1.775 Z: 26 37.531 2.128 0.839 0.868 0.960 0.880 CB 1.461 26 residues pruned to eliminate duplicates Z: 65 55.202 2.301 0.652 0.638 0.891 0.719 CB 1.792 65 residues pruned to eliminate duplicates Z: 59 59.485 2.295 0.840 0.693 0.948 0.759 CB 1.635 59 residues pruned to eliminate duplicates Z: 22 39.432 2.261 0.744 0.937 0.952 0.905 CB 1.595 22 residues pruned to eliminate duplicates Z: 75 60.406 2.270 0.804 0.654 0.919 0.743 CB 1.617 190 residues pruned to eliminate duplicates Z: 89 63.685 2.310 0.853 0.589 0.920 0.693 CB 1.582 89 residues pruned to eliminate duplicates Z: 133 87.793 2.363 0.799 0.622 0.917 0.674 CB 1.748 133 residues pruned to eliminate duplicates Z: 30 46.579 2.159 1.044 0.763 1.000 0.793 CB 1.552 Z: 23 47.722 2.164 1.160 0.928 1.000 0.864 CB 1.524 23 residues pruned to eliminate duplicates Z: 91 80.390 2.324 0.861 0.684 0.922 0.678 CB 1.794 30 residues pruned to eliminate duplicates Z: 23 55.697 2.243 1.334 0.956 1.000 0.864 CB 1.558 23 residues pruned to eliminate duplicates Z: 98 76.768 2.300 0.921 0.615 0.938 0.660 CB 1.686 62 residues pruned to eliminate duplicates Z: 23 51.167 2.261 1.185 0.960 0.955 0.818 CB 1.585 23 residues pruned to eliminate duplicates Z: 33 45.910 2.180 1.115 0.714 0.969 0.719 CB 1.496 33 residues pruned to eliminate duplicates Z: 93 73.246 2.325 0.838 0.616 0.957 0.685 CB 1.674 93 residues pruned to eliminate duplicates Z: 87 91.257 2.350 1.010 0.691 0.953 0.674 CB 1.835 87 residues pruned to eliminate duplicates Z: 24 53.616 2.191 1.402 0.939 1.000 0.913 CB 1.476 24 residues pruned to eliminate duplicates Z: 76 65.988 2.295 0.997 0.617 0.920 0.733 CB 1.617 203 residues pruned to eliminate duplicates Z: 34 45.262 2.157 1.150 0.729 0.970 0.667 CB 1.426 Z: 24 51.358 2.181 1.323 0.936 1.000 0.652 CB 1.472 25 residues pruned to eliminate duplicates Z: 23 58.484 2.244 1.557 0.958 0.955 0.773 CB 1.561 24 residues pruned to eliminate duplicates Z: 22 52.069 2.268 1.408 0.943 0.905 0.619 CB 1.594 22 residues pruned to eliminate duplicates Z: 31 47.290 2.145 1.331 0.724 0.967 0.700 CB 1.459 34 residues pruned to eliminate duplicates Z: 28 48.850 2.163 1.186 0.835 1.000 0.667 CB 1.489 28 residues pruned to eliminate duplicates Z: 77 64.572 2.221 0.969 0.631 0.961 0.711 CB 1.559 106 residues pruned to eliminate duplicates Z: 97 79.502 2.362 0.953 0.626 0.917 0.604 CB 1.704 Z: 7 8.865 1.666 0.649 0.473 1.000 0.667 C 1.354 7 residues pruned to eliminate duplicates Z: 80 65.381 2.279 0.964 0.621 0.924 0.633 CB 1.586 177 residues pruned to eliminate duplicates Z: 64 62.575 2.256 0.889 0.622 0.937 0.714 CB 1.760 Z: 7 7.823 1.849 1.141 0.427 1.000 0.667 CB 0.870 Z: 6 5.008 1.764 0.728 0.427 0.800 0.800 CB 0.990 Z: 6 8.739 1.653 0.773 0.495 1.000 1.000 C 1.340 Z: 6 9.793 1.779 0.995 0.389 1.000 0.600 CA 1.388 12 residues pruned to eliminate duplicates Z: 38 49.936 2.348 0.717 0.631 1.000 0.703 CA 1.800 38 residues pruned to eliminate duplicates Z: 6 4.080 1.626 0.683 0.497 0.600 0.200 CA 1.114 6 residues pruned to eliminate duplicates Z: 64 66.884 2.438 0.726 0.646 0.921 0.714 CB 1.899 41 residues pruned to eliminate duplicates Z: 6 3.912 1.803 0.264 0.348 1.000 0.800 CA 0.905 6 residues pruned to eliminate duplicates Z: 41 43.534 2.358 0.838 0.547 0.900 0.625 CB 1.685 41 residues pruned to eliminate duplicates Z: 37 39.417 2.301 0.782 0.540 0.917 0.639 CB 1.681 37 residues pruned to eliminate duplicates Z: 63 65.142 2.425 0.742 0.648 0.935 0.677 CB 1.822 63 residues pruned to eliminate duplicates Z: 64 71.656 2.436 0.827 0.660 0.937 0.746 CB 1.867 64 residues pruned to eliminate duplicates Z: 14 40.017 2.204 0.996 0.905 1.000 0.769 C 1.796 14 residues pruned to eliminate duplicates Z: 66 72.566 2.416 0.898 0.656 0.938 0.662 CB 1.809 66 residues pruned to eliminate duplicates Z: 34 47.871 2.369 1.000 0.624 0.909 0.697 CB 1.721 34 residues pruned to eliminate duplicates Z: 63 69.607 2.416 0.877 0.650 0.903 0.726 CB 1.877 63 residues pruned to eliminate duplicates Z: 120 99.082 2.379 1.032 0.675 0.933 0.622 CB 1.714 100 residues pruned to eliminate duplicates Z: 14 41.020 2.227 1.048 0.899 1.000 0.923 C 1.784 14 residues pruned to eliminate duplicates Z: 96 86.762 2.343 0.963 0.683 0.937 0.726 CB 1.746 96 residues pruned to eliminate duplicates Z: 65 72.062 2.408 0.935 0.655 0.906 0.719 CB 1.848 65 residues pruned to eliminate duplicates Z: 15 38.156 2.228 1.033 0.775 1.000 0.786 CA 1.766 15 residues pruned to eliminate duplicates Z: 44 46.849 2.265 0.897 0.560 0.884 0.651 CB 1.774 44 residues pruned to eliminate duplicates Z: 65 75.192 2.422 0.877 0.649 0.953 0.672 CB 1.888 65 residues pruned to eliminate duplicates Z: 40 56.735 2.399 0.982 0.628 0.949 0.590 CB 1.785 40 residues pruned to eliminate duplicates Z: 65 73.881 2.404 0.877 0.663 0.922 0.734 CB 1.909 65 residues pruned to eliminate duplicates Z: 63 72.466 2.421 0.895 0.663 0.903 0.726 CB 1.909 63 residues pruned to eliminate duplicates Z: 43 44.582 2.335 0.859 0.549 0.881 0.571 CB 1.716 43 residues pruned to eliminate duplicates Z: 68 76.238 2.377 0.959 0.673 0.940 0.776 CB 1.813 68 residues pruned to eliminate duplicates Z: 6 5.857 1.794 0.513 0.151 1.000 0.400 CA 1.482 6 residues pruned to eliminate duplicates Z: 64 83.838 2.453 0.996 0.667 0.968 0.698 CB 1.910 64 residues pruned to eliminate duplicates Z: 64 73.242 2.434 0.906 0.633 0.952 0.667 CB 1.843 64 residues pruned to eliminate duplicates Z: 65 74.131 2.419 0.926 0.653 0.906 0.703 CB 1.903 65 residues pruned to eliminate duplicates Z: 29 50.846 2.435 0.789 0.725 0.929 0.714 CB 1.939 29 residues pruned to eliminate duplicates Z: 29 43.140 2.406 0.507 0.700 0.964 0.679 CB 1.943 29 residues pruned to eliminate duplicates Z: 19 36.019 2.574 0.577 0.569 0.944 0.667 CB 2.072 19 residues pruned to eliminate duplicates Z: 121 95.231 2.362 0.992 0.652 0.942 0.642 CB 1.703 121 residues pruned to eliminate duplicates Z: 30 50.481 2.352 0.775 0.710 1.000 0.793 CB 1.855 30 residues pruned to eliminate duplicates Z: 28 53.154 2.450 0.641 0.769 1.000 0.778 CB 2.005 28 residues pruned to eliminate duplicates Z: 34 49.274 2.370 0.815 0.597 0.939 0.636 CB 1.935 34 residues pruned to eliminate duplicates Z: 28 53.436 2.437 0.776 0.748 0.963 0.815 CB 1.977 28 residues pruned to eliminate duplicates Z: 19 53.812 2.244 1.121 0.942 1.000 0.889 CB 1.847 19 residues pruned to eliminate duplicates Z: 18 47.063 2.304 0.950 0.917 0.941 0.765 CB 1.906 18 residues pruned to eliminate duplicates Z: 30 52.414 2.391 0.926 0.712 0.931 0.724 CB 1.873 30 residues pruned to eliminate duplicates Z: 21 56.248 2.427 1.107 0.790 0.950 0.800 C 2.006 21 residues pruned to eliminate duplicates Z: 30 55.485 2.346 1.095 0.699 0.966 0.655 C 1.811 30 residues pruned to eliminate duplicates Z: 19 56.952 2.240 1.334 0.931 1.000 0.889 CB 1.794 19 residues pruned to eliminate duplicates Z: 19 51.785 2.255 1.088 0.907 1.000 0.889 CA 1.842 19 residues pruned to eliminate duplicates Z: 29 63.462 2.416 1.140 0.721 0.964 0.643 C 1.970 29 residues pruned to eliminate duplicates Z: 27 58.741 2.416 1.053 0.700 0.962 0.615 C 2.013 27 residues pruned to eliminate duplicates Z: 26 59.184 2.483 1.118 0.716 0.920 0.680 C 2.012 26 residues pruned to eliminate duplicates Z: 27 60.966 2.428 1.082 0.730 0.962 0.692 C 2.000 27 residues pruned to eliminate duplicates Z: 29 59.184 2.418 1.099 0.730 0.929 0.679 C 1.929 29 residues pruned to eliminate duplicates Z: 30 52.593 2.318 1.108 0.697 0.897 0.586 C 1.862 30 residues pruned to eliminate duplicates Z: 28 57.137 2.417 1.134 0.707 0.926 0.630 C 1.908 28 residues pruned to eliminate duplicates Z: 21 68.337 2.412 1.433 0.826 1.000 0.850 CB 1.963 21 residues pruned to eliminate duplicates 754 residues left after pruning, divided into chains as follows: A: 97 B: 31 C: 506 D: 120 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 40.30 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 4 used as input for final density modification = 0.300, Contrast = 0.490, Connect. = 0.774 for dens.mod. cycle 1 = 0.302, Contrast = 0.559, Connect. = 0.796 for dens.mod. cycle 2 = 0.302, Contrast = 0.693, Connect. = 0.827 for dens.mod. cycle 3 = 0.302, Contrast = 0.703, Connect. = 0.830 for dens.mod. cycle 4 = 0.302, Contrast = 0.720, Connect. = 0.832 for dens.mod. cycle 5 = 0.302, Contrast = 0.725, Connect. = 0.834 for dens.mod. cycle 6 = 0.302, Contrast = 0.734, Connect. = 0.835 for dens.mod. cycle 7 = 0.302, Contrast = 0.738, Connect. = 0.836 for dens.mod. cycle 8 = 0.302, Contrast = 0.744, Connect. = 0.836 for dens.mod. cycle 9 = 0.302, Contrast = 0.747, Connect. = 0.837 for dens.mod. cycle 10 Estimated mean FOM and mapCC as a function of resolution d inf - 3.23 - 2.56 - 2.23 - 2.02 - 1.87 - 1.76 - 1.67 - 1.60 - 1.51 - 1.41 0.740 0.767 0.791 0.787 0.767 0.738 0.694 0.648 0.586 0.505 0.905 0.905 0.911 0.901 0.882 0.844 0.787 0.735 0.673 0.587 N 13931 13800 14022 14205 14340 13876 14128 12723 14529 12989 Estimated mean FOM = 0.704 Pseudo-free CC = 72.62 % Best trace (cycle 4 with CC 40.30%) was saved as ./2ord-1.4-parrot-noncs/2ord-1.4-parrot-noncs.pdb ============================================================================== CPU times required in seconds ----------------------------- 1.5 - Setup, data input and phasing 24.7 - FFTs and peak-searches 54.7 - Sphere of influence 1.6 - Rest of density modification 0.0 - Alpha-helix search 4089.0 - Tripeptide search 20878.1 - Chain tracing 0.0 - NCS analysis 132.4 - B-value refinement for trace TimeTaking 422.65