++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 01:14:36 on 15 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: ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.ins Phases from ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.phi Native data from ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.hkl Listing output to ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.lst Phases output to ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.phs Poly-Ala trace output to ./2aml-1.5-parrot-noncs/2aml-1.5-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 110667 Reflections read from file ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.phi 110667 Reflections read from file ./2aml-1.5-parrot-noncs/2aml-1.5-parrot-noncs.hkl 110667 Unique data, highest resolution = 1.500 Angstroms Anisotropic scaling: intensities multiplied by 0.000144h^2 -0.000080k^2 +0.000042l^2 +0.000000kl +0.000000hl +0.000000hk 22 Reflections with d > 1.700 and 0 in range 1.700 > d > 1.500 added Density sharpening factor set to 1.50 Fourier grid = 128 x 256 x 61 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|> = 0.726 = 0.300, Contrast = 0.359, Connect. = 0.760 for dens.mod. cycle 1 = 0.300, Contrast = 0.429, Connect. = 0.772 for dens.mod. cycle 2 = 0.300, Contrast = 0.496, Connect. = 0.789 for dens.mod. cycle 3 = 0.300, Contrast = 0.520, Connect. = 0.793 for dens.mod. cycle 4 = 0.300, Contrast = 0.532, Connect. = 0.796 for dens.mod. cycle 5 = 0.300, Contrast = 0.542, Connect. = 0.796 for dens.mod. cycle 6 = 0.300, Contrast = 0.549, Connect. = 0.797 for dens.mod. cycle 7 = 0.300, Contrast = 0.554, Connect. = 0.797 for dens.mod. cycle 8 = 0.300, Contrast = 0.558, Connect. = 0.797 for dens.mod. cycle 9 = 0.300, Contrast = 0.562, Connect. = 0.797 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5055 peaks > 0.5 sigma used to seed fragment search Space for about 755 unique residues taking solvent into account 958 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 12 24.864 2.305 0.516 0.845 0.909 0.636 CB 1.755 B: 21 35.252 2.052 0.857 0.876 0.950 0.700 CA 1.583 13 residues pruned to eliminate duplicates C: 20 35.843 2.153 0.727 0.880 1.000 0.579 CB 1.603 20 residues pruned to eliminate duplicates D: 23 44.854 2.159 1.076 0.938 0.955 0.909 CB 1.554 E: 23 43.540 2.162 1.063 0.949 0.955 0.909 CB 1.505 22 residues pruned to eliminate duplicates F: 14 39.598 2.319 0.907 0.944 1.000 1.000 C 1.719 G: 17 44.296 2.345 0.830 0.869 1.000 0.625 CB 1.885 19 residues pruned to eliminate duplicates H: 18 42.760 2.368 0.699 0.892 1.000 0.824 CB 1.851 I: 18 33.394 2.178 1.058 0.915 0.882 0.882 CB 1.447 J: 19 42.739 2.204 0.904 0.884 1.000 0.833 CB 1.735 18 residues pruned to eliminate duplicates K: 18 42.308 2.312 0.833 0.858 1.000 0.706 C 1.782 19 residues pruned to eliminate duplicates L: 17 44.566 2.391 0.790 0.884 1.000 0.750 C 1.880 18 residues pruned to eliminate duplicates M: 19 45.078 2.179 1.028 0.921 1.000 0.833 CB 1.692 N: 23 42.056 2.157 0.913 0.951 1.000 0.909 CB 1.497 23 residues pruned to eliminate duplicates O: 11 19.262 2.060 0.498 0.871 1.000 0.700 CB 1.439 11 residues pruned to eliminate duplicates P: 11 18.969 2.026 0.465 0.917 1.000 0.800 C 1.427 11 residues pruned to eliminate duplicates Q: 21 42.190 2.192 0.717 0.885 1.000 0.800 CB 1.810 R: 18 37.738 2.247 0.893 0.852 0.941 0.765 CB 1.691 S: 9 18.121 1.962 0.628 0.857 1.000 0.750 C 1.478 T: 37 45.294 2.072 1.115 0.663 0.944 0.694 CB 1.568 U: 19 31.521 2.114 0.933 0.835 0.889 0.611 CB 1.532 19 residues pruned to eliminate duplicates V: 20 33.608 2.188 0.532 0.866 1.000 0.789 CB 1.683 20 residues pruned to eliminate duplicates W: 21 52.695 2.318 1.334 0.945 1.000 0.900 CB 1.507 18 residues pruned to eliminate duplicates X: 18 44.810 2.273 1.034 0.925 1.000 0.882 CB 1.650 19 residues pruned to eliminate duplicates Y: 11 26.838 2.323 0.647 0.832 0.900 0.800 CB 1.851 11 residues pruned to eliminate duplicates Z: 19 41.909 2.183 0.872 0.918 1.000 0.889 CB 1.705 14 residues pruned to eliminate duplicates Z: 55 58.740 2.266 0.975 0.621 0.944 0.648 CB 1.688 18 residues pruned to eliminate duplicates Z: 55 62.499 2.219 0.973 0.725 0.944 0.722 CB 1.679 3 residues pruned to eliminate duplicates Z: 47 58.530 2.267 1.016 0.634 1.000 0.674 CB 1.666 47 residues pruned to eliminate duplicates Z: 24 48.583 2.213 1.160 0.951 0.957 0.913 CB 1.528 24 residues pruned to eliminate duplicates Z: 18 39.734 2.247 0.826 0.920 1.000 0.706 CB 1.654 18 residues pruned to eliminate duplicates Z: 20 41.106 2.273 1.015 0.879 0.947 0.789 CB 1.575 20 residues pruned to eliminate duplicates Z: 19 42.945 2.289 0.810 0.895 1.000 0.722 CB 1.751 18 residues pruned to eliminate duplicates Z: 45 53.142 2.165 0.959 0.650 0.955 0.727 CB 1.721 37 residues pruned to eliminate duplicates Z: 10 12.699 1.833 0.446 0.743 0.889 0.444 C 1.445 10 residues pruned to eliminate duplicates Z: 24 42.965 2.159 1.044 0.922 1.000 0.870 CB 1.427 24 residues pruned to eliminate duplicates Z: 31 39.142 2.153 0.841 0.679 0.867 0.767 CB 1.765 19 residues pruned to eliminate duplicates Z: 19 51.580 2.206 1.246 0.908 1.000 0.667 CB 1.743 18 residues pruned to eliminate duplicates Z: 18 42.313 2.264 0.956 0.942 1.000 0.941 CB 1.607 18 residues pruned to eliminate duplicates Z: 93 82.439 2.217 1.046 0.778 0.946 0.685 CB 1.568 44 residues pruned to eliminate duplicates Z: 21 38.856 2.207 0.944 0.886 0.950 0.800 CB 1.538 21 residues pruned to eliminate duplicates Z: 22 39.089 2.218 0.737 0.948 1.000 0.905 CB 1.530 22 residues pruned to eliminate duplicates Z: 46 47.483 2.201 0.910 0.659 0.889 0.733 CB 1.633 40 residues pruned to eliminate duplicates Z: 25 30.462 2.090 0.497 0.805 0.958 0.708 CB 1.589 25 residues pruned to eliminate duplicates Z: 9 21.504 2.074 0.731 0.841 1.000 0.875 CA 1.579 9 residues pruned to eliminate duplicates Z: 22 46.908 2.304 1.079 0.927 1.000 0.857 CB 1.497 21 residues pruned to eliminate duplicates Z: 31 33.377 1.861 0.881 0.855 0.967 0.833 CB 1.329 Z: 9 22.920 2.191 0.696 0.850 0.875 0.750 CB 1.847 9 residues pruned to eliminate duplicates Z: 18 37.026 2.168 0.682 0.930 1.000 0.882 CA 1.721 Z: 8 13.675 1.887 0.325 0.901 1.000 0.857 C 1.475 Z: 24 42.968 2.082 1.059 0.936 1.000 0.870 CB 1.456 24 residues pruned to eliminate duplicates Z: 18 35.668 2.156 0.880 0.895 0.941 0.824 CB 1.626 18 residues pruned to eliminate duplicates Z: 25 37.260 2.220 0.618 0.853 0.958 0.833 CB 1.634 24 residues pruned to eliminate duplicates Z: 47 54.531 2.250 0.980 0.624 0.978 0.674 CB 1.641 47 residues pruned to eliminate duplicates Z: 20 36.845 2.105 0.784 0.906 1.000 0.842 C 1.601 20 residues pruned to eliminate duplicates Z: 19 42.229 2.166 1.043 0.879 1.000 0.722 CB 1.631 19 residues pruned to eliminate duplicates Z: 29 40.369 2.209 0.675 0.743 0.929 0.714 CB 1.787 31 residues pruned to eliminate duplicates Z: 18 38.779 2.255 0.939 0.904 0.941 0.824 CB 1.629 18 residues pruned to eliminate duplicates Z: 8 14.548 1.956 0.756 0.766 0.857 0.857 CA 1.475 8 residues pruned to eliminate duplicates Z: 11 22.895 2.347 0.417 0.899 0.900 0.800 CB 1.729 11 residues pruned to eliminate duplicates Z: 40 58.776 2.221 0.802 0.911 0.974 0.744 CB 1.710 44 residues pruned to eliminate duplicates Z: 9 20.247 2.260 0.338 0.902 1.000 1.000 CB 1.688 9 residues pruned to eliminate duplicates Z: 20 46.315 2.174 1.083 0.895 1.000 0.842 CB 1.682 20 residues pruned to eliminate duplicates Z: 20 42.899 2.242 1.029 0.927 1.000 0.842 CB 1.516 20 residues pruned to eliminate duplicates Z: 35 61.114 2.232 1.004 0.921 0.971 0.853 CB 1.699 35 residues pruned to eliminate duplicates Z: 20 36.956 2.229 0.754 0.906 1.000 0.842 CB 1.542 19 residues pruned to eliminate duplicates Z: 20 40.332 2.219 0.963 0.909 1.000 0.842 CB 1.507 19 residues pruned to eliminate duplicates Z: 15 27.435 1.861 0.998 0.858 1.000 0.786 CB 1.451 Z: 33 44.008 2.174 0.479 0.924 1.000 0.938 CB 1.699 33 residues pruned to eliminate duplicates Z: 35 62.947 2.349 1.133 0.698 1.000 0.706 CB 1.797 36 residues pruned to eliminate duplicates Z: 22 54.652 2.321 1.329 0.942 1.000 0.857 CB 1.531 23 residues pruned to eliminate duplicates Z: 33 35.369 2.114 0.786 0.626 0.875 0.625 CB 1.681 33 residues pruned to eliminate duplicates Z: 23 57.009 2.289 1.395 0.936 1.000 0.864 CB 1.544 23 residues pruned to eliminate duplicates Z: 26 36.931 2.178 0.547 0.830 0.920 0.760 CA 1.792 19 residues pruned to eliminate duplicates Z: 45 59.893 2.302 1.018 0.650 1.000 0.682 CB 1.690 45 residues pruned to eliminate duplicates Z: 23 32.786 2.239 0.460 0.847 0.955 0.909 CB 1.663 23 residues pruned to eliminate duplicates Z: 26 41.442 2.183 0.748 0.866 0.880 0.680 CA 1.807 25 residues pruned to eliminate duplicates Z: 22 45.882 2.235 1.011 0.945 1.000 0.905 CB 1.541 22 residues pruned to eliminate duplicates Z: 18 43.921 2.387 0.766 0.868 1.000 0.824 CB 1.847 18 residues pruned to eliminate duplicates Z: 21 42.978 2.308 0.973 0.943 1.000 0.950 CB 1.463 21 residues pruned to eliminate duplicates Z: 16 41.748 2.415 0.761 0.871 1.000 0.933 C 1.848 16 residues pruned to eliminate duplicates Z: 18 45.953 2.383 0.827 0.880 1.000 0.647 CB 1.854 18 residues pruned to eliminate duplicates Z: 18 39.414 2.194 0.703 0.924 1.000 0.765 CA 1.798 18 residues pruned to eliminate duplicates Z: 20 42.733 2.161 0.980 0.908 1.000 0.789 CB 1.628 20 residues pruned to eliminate duplicates Z: 31 32.694 1.912 0.697 0.880 0.967 0.733 CB 1.380 31 residues pruned to eliminate duplicates Z: 21 39.373 2.237 0.694 0.872 0.950 0.850 CA 1.783 21 residues pruned to eliminate duplicates Z: 10 12.461 1.886 0.760 0.699 0.778 0.444 C 1.341 10 residues pruned to eliminate duplicates Z: 40 63.481 2.204 1.043 0.903 0.949 0.795 CB 1.695 40 residues pruned to eliminate duplicates Z: 17 37.933 2.294 0.708 0.875 1.000 0.750 CB 1.760 17 residues pruned to eliminate duplicates Z: 6 10.468 2.104 0.360 0.864 0.800 0.800 CB 1.499 6 residues pruned to eliminate duplicates Z: 39 63.650 2.232 0.910 0.905 1.000 0.816 CB 1.724 39 residues pruned to eliminate duplicates Z: 9 19.316 1.973 0.519 0.853 1.000 0.750 CA 1.684 8 residues pruned to eliminate duplicates Z: 25 36.085 2.077 0.791 0.902 1.000 0.875 CB 1.412 24 residues pruned to eliminate duplicates Z: 8 23.401 2.171 0.746 0.884 1.000 0.857 CB 1.685 9 residues pruned to eliminate duplicates Z: 38 41.110 2.157 0.445 0.908 0.973 0.946 CB 1.583 38 residues pruned to eliminate duplicates Z: 19 33.023 2.085 0.766 0.866 1.000 0.722 CB 1.547 19 residues pruned to eliminate duplicates Z: 13 29.452 2.044 1.072 0.896 1.000 0.917 CB 1.438 13 residues pruned to eliminate duplicates Z: 19 37.402 2.252 0.983 0.886 0.889 0.889 CB 1.602 19 residues pruned to eliminate duplicates Z: 21 43.161 2.167 0.925 0.871 0.950 0.700 C 1.777 20 residues pruned to eliminate duplicates Z: 39 49.946 2.164 0.722 0.891 0.974 0.789 CB 1.606 39 residues pruned to eliminate duplicates Z: 22 42.162 2.164 0.953 0.958 1.000 0.952 CB 1.493 22 residues pruned to eliminate duplicates Z: 21 31.367 2.153 0.784 0.884 0.900 0.850 CB 1.466 20 residues pruned to eliminate duplicates Z: 18 35.439 2.173 0.725 0.895 1.000 0.824 CB 1.643 18 residues pruned to eliminate duplicates Z: 15 26.780 1.901 0.858 0.907 1.000 1.000 CB 1.440 15 residues pruned to eliminate duplicates Z: 41 64.485 2.185 0.957 0.896 1.000 0.725 CB 1.708 41 residues pruned to eliminate duplicates Z: 18 39.938 2.272 1.049 0.666 1.000 0.824 CB 1.785 18 residues pruned to eliminate duplicates Z: 7 8.775 2.071 0.027 0.771 0.833 0.500 CB 1.589 6 residues pruned to eliminate duplicates Z: 23 42.779 2.150 1.033 0.943 0.955 0.909 CB 1.515 23 residues pruned to eliminate duplicates Z: 18 38.440 2.185 0.776 0.906 0.941 0.882 CA 1.815 18 residues pruned to eliminate duplicates Z: 18 33.746 2.208 0.546 0.919 0.941 0.824 CA 1.794 18 residues pruned to eliminate duplicates Z: 13 34.325 2.135 0.978 0.937 1.000 0.833 CB 1.633 15 residues pruned to eliminate duplicates Z: 20 37.233 2.261 0.895 0.907 0.947 0.895 CB 1.496 20 residues pruned to eliminate duplicates Z: 7 17.879 2.183 0.509 0.860 1.000 1.000 CB 1.629 7 residues pruned to eliminate duplicates Z: 20 32.491 2.034 0.889 0.898 1.000 0.789 CB 1.388 Z: 31 41.095 2.041 0.830 0.883 1.000 0.733 CB 1.452 20 residues pruned to eliminate duplicates Z: 53 62.528 2.331 1.048 0.619 0.942 0.635 CB 1.723 54 residues pruned to eliminate duplicates Z: 22 39.109 2.233 0.711 0.849 0.952 0.857 CB 1.739 22 residues pruned to eliminate duplicates Z: 17 45.068 2.405 0.828 0.869 1.000 0.688 CB 1.872 17 residues pruned to eliminate duplicates Z: 25 44.533 2.238 0.796 0.856 0.917 0.708 CA 1.820 27 residues pruned to eliminate duplicates Z: 18 46.212 2.347 0.926 0.894 1.000 0.647 CB 1.778 18 residues pruned to eliminate duplicates Z: 32 46.240 2.227 0.855 0.704 0.968 0.871 CB 1.725 32 residues pruned to eliminate duplicates Z: 8 18.473 2.103 0.629 0.829 1.000 0.714 CA 1.534 Z: 40 57.721 2.179 1.011 0.896 0.949 0.667 CB 1.593 40 residues pruned to eliminate duplicates Z: 15 26.922 1.896 0.835 0.897 1.000 1.000 CB 1.481 14 residues pruned to eliminate duplicates Z: 18 36.140 2.155 0.825 0.880 0.941 0.706 CB 1.716 18 residues pruned to eliminate duplicates Z: 8 12.811 1.584 0.784 0.884 1.000 0.571 CB 1.239 7 residues pruned to eliminate duplicates Z: 21 26.696 2.148 0.369 0.892 0.950 0.750 CB 1.535 21 residues pruned to eliminate duplicates Z: 12 29.117 2.055 0.954 0.930 1.000 0.727 C 1.529 12 residues pruned to eliminate duplicates Z: 40 56.173 2.179 0.870 0.857 0.974 0.769 CB 1.669 40 residues pruned to eliminate duplicates Z: 20 38.228 2.219 0.904 0.890 0.947 0.895 CB 1.577 20 residues pruned to eliminate duplicates Z: 46 56.710 2.280 1.082 0.638 0.933 0.689 CB 1.677 46 residues pruned to eliminate duplicates Z: 24 37.103 2.225 0.599 0.821 0.957 0.739 CB 1.721 22 residues pruned to eliminate duplicates Z: 33 49.572 2.210 0.669 0.945 1.000 0.938 CB 1.644 33 residues pruned to eliminate duplicates Z: 20 41.915 2.241 0.943 0.912 1.000 0.895 CB 1.564 20 residues pruned to eliminate duplicates Z: 24 53.099 2.218 1.358 0.942 0.913 0.826 CB 1.608 24 residues pruned to eliminate duplicates Z: 14 36.516 2.047 1.379 0.898 0.923 0.846 CB 1.611 14 residues pruned to eliminate duplicates Z: 109 93.102 2.275 1.090 0.735 0.963 0.704 CB 1.585 102 residues pruned to eliminate duplicates Z: 23 43.170 2.185 1.077 0.931 1.000 0.955 CB 1.416 23 residues pruned to eliminate duplicates Z: 18 37.665 2.195 0.884 0.871 0.941 0.765 CB 1.712 18 residues pruned to eliminate duplicates Z: 18 36.714 2.230 0.821 0.883 0.941 0.882 CB 1.684 18 residues pruned to eliminate duplicates Z: 24 41.454 2.208 0.706 0.859 0.957 0.783 CB 1.765 24 residues pruned to eliminate duplicates Z: 41 56.108 2.185 0.805 0.871 0.975 0.850 CB 1.682 41 residues pruned to eliminate duplicates Z: 35 59.135 2.228 0.957 0.918 0.971 0.765 CB 1.690 35 residues pruned to eliminate duplicates Z: 34 31.296 2.095 0.616 0.652 0.909 0.667 CB 1.537 24 residues pruned to eliminate duplicates Z: 21 43.800 2.270 0.768 0.865 0.950 0.750 CB 1.882 21 residues pruned to eliminate duplicates Z: 10 12.636 1.781 0.742 0.696 0.778 0.444 CA 1.460 10 residues pruned to eliminate duplicates Z: 7 11.185 1.960 0.519 0.789 0.833 0.667 CA 1.427 7 residues pruned to eliminate duplicates Z: 8 15.749 1.817 0.847 0.860 1.000 0.429 CB 1.305 8 residues pruned to eliminate duplicates Z: 18 40.295 2.296 0.662 0.880 1.000 0.706 C 1.856 18 residues pruned to eliminate duplicates Z: 93 91.008 2.250 1.116 0.771 0.978 0.641 CB 1.603 94 residues pruned to eliminate duplicates Z: 21 36.740 2.008 1.198 0.894 0.900 0.650 CA 1.483 21 residues pruned to eliminate duplicates Z: 21 34.764 2.231 0.541 0.855 0.950 0.650 CB 1.756 21 residues pruned to eliminate duplicates Z: 34 53.843 2.242 0.784 0.908 1.000 0.848 CB 1.665 34 residues pruned to eliminate duplicates Z: 16 26.417 1.829 1.114 0.879 0.933 0.933 CB 1.371 16 residues pruned to eliminate duplicates Z: 40 49.619 2.217 0.943 0.636 0.923 0.744 CB 1.759 40 residues pruned to eliminate duplicates Z: 6 16.156 2.152 0.710 0.875 1.000 0.600 CB 1.428 Z: 38 54.286 2.178 0.749 0.923 1.000 0.757 CB 1.646 38 residues pruned to eliminate duplicates Z: 39 56.926 2.225 0.808 0.894 0.974 0.737 CB 1.691 39 residues pruned to eliminate duplicates Z: 19 44.350 2.225 0.967 0.924 1.000 0.722 CB 1.676 18 residues pruned to eliminate duplicates Z: 8 19.820 2.045 0.702 0.876 1.000 1.000 CB 1.565 8 residues pruned to eliminate duplicates Z: 11 7.889 1.641 0.447 0.749 0.700 0.400 C 1.202 8 residues pruned to eliminate duplicates Z: 37 44.445 2.053 1.104 0.651 0.972 0.667 CB 1.532 37 residues pruned to eliminate duplicates Z: 78 87.022 2.250 1.296 0.760 0.948 0.675 CB 1.607 75 residues pruned to eliminate duplicates Z: 15 22.087 2.083 0.749 0.605 0.857 0.786 C 1.711 8 residues pruned to eliminate duplicates Z: 22 37.830 2.262 0.622 0.855 0.952 0.810 CB 1.744 22 residues pruned to eliminate duplicates Z: 38 56.515 2.204 0.834 0.914 0.973 0.811 CB 1.670 38 residues pruned to eliminate duplicates Z: 18 18.312 2.006 0.522 0.425 0.941 0.647 CA 1.672 7 residues pruned to eliminate duplicates Z: 32 38.122 2.008 0.681 0.885 1.000 0.839 CB 1.465 32 residues pruned to eliminate duplicates Z: 38 72.037 2.214 1.215 0.907 1.000 0.865 CB 1.716 38 residues pruned to eliminate duplicates Z: 41 66.646 2.197 1.166 0.867 0.950 0.700 CB 1.704 41 residues pruned to eliminate duplicates Z: 19 42.028 2.206 0.887 0.873 1.000 0.722 C 1.733 19 residues pruned to eliminate duplicates Z: 39 62.511 2.203 0.910 0.907 1.000 0.579 CB 1.713 39 residues pruned to eliminate duplicates Z: 20 31.741 2.136 0.597 0.869 0.947 0.842 CA 1.645 20 residues pruned to eliminate duplicates Z: 21 37.533 2.048 1.142 0.857 0.900 0.800 CB 1.567 21 residues pruned to eliminate duplicates Z: 14 31.399 1.994 1.006 0.908 1.000 1.000 CB 1.545 14 residues pruned to eliminate duplicates Z: 80 84.967 2.262 1.204 0.746 0.962 0.671 CB 1.599 80 residues pruned to eliminate duplicates Z: 18 32.528 2.200 0.447 0.912 1.000 0.824 CA 1.755 18 residues pruned to eliminate duplicates Z: 6 14.093 2.156 0.594 0.865 1.000 0.800 CB 1.343 6 residues pruned to eliminate duplicates Z: 40 43.766 2.177 0.470 0.870 0.974 0.872 CB 1.641 40 residues pruned to eliminate duplicates Z: 31 40.162 2.036 0.852 0.880 0.967 0.833 CB 1.458 31 residues pruned to eliminate duplicates Z: 23 47.848 2.236 1.054 0.922 1.000 0.955 CB 1.561 23 residues pruned to eliminate duplicates Z: 48 39.991 2.086 0.991 0.622 0.957 0.723 CB 1.307 31 residues pruned to eliminate duplicates Z: 17 25.769 2.039 0.532 0.891 0.938 0.812 CB 1.581 17 residues pruned to eliminate duplicates Z: 14 39.949 2.344 1.101 0.945 1.000 0.923 CB 1.557 14 residues pruned to eliminate duplicates Z: 32 36.525 2.002 0.668 0.890 1.000 0.871 CB 1.414 32 residues pruned to eliminate duplicates Z: 41 63.810 2.214 0.881 0.904 1.000 0.900 CB 1.725 41 residues pruned to eliminate duplicates Z: 25 39.502 2.084 1.057 0.856 0.917 0.708 CB 1.513 26 residues pruned to eliminate duplicates Z: 24 39.563 2.247 0.588 0.847 0.957 0.696 CB 1.794 24 residues pruned to eliminate duplicates Z: 6 8.430 2.104 -0.018 0.854 1.000 0.800 CB 1.348 6 residues pruned to eliminate duplicates Z: 31 35.456 1.921 0.882 0.861 0.967 0.633 CB 1.361 31 residues pruned to eliminate duplicates Z: 14 32.436 2.167 0.763 0.926 1.000 0.769 CB 1.651 14 residues pruned to eliminate duplicates Z: 17 27.998 2.167 0.328 0.948 1.000 1.000 CA 1.679 17 residues pruned to eliminate duplicates Z: 9 16.440 1.970 0.785 0.895 1.000 1.000 CA 1.185 9 residues pruned to eliminate duplicates Z: 15 26.077 2.062 0.498 0.907 1.000 0.929 CB 1.603 15 residues pruned to eliminate duplicates Z: 7 7.463 1.849 0.572 0.700 0.667 0.667 CB 1.310 7 residues pruned to eliminate duplicates Z: 13 20.615 2.002 0.745 0.883 0.917 0.833 CB 1.344 13 residues pruned to eliminate duplicates Z: 24 32.279 2.223 0.372 0.856 0.957 0.826 CB 1.702 24 residues pruned to eliminate duplicates Z: 39 63.037 2.229 0.931 0.927 0.974 0.789 CB 1.710 39 residues pruned to eliminate duplicates Z: 40 55.426 2.203 0.809 0.876 0.949 0.795 CB 1.705 40 residues pruned to eliminate duplicates Z: 14 27.337 2.038 1.095 0.887 0.923 0.769 CB 1.387 14 residues pruned to eliminate duplicates Z: 42 60.656 2.272 1.064 0.722 0.951 0.732 CB 1.738 42 residues pruned to eliminate duplicates Z: 10 16.982 1.927 0.847 0.774 0.889 0.889 CB 1.404 10 residues pruned to eliminate duplicates Z: 21 35.234 2.150 0.863 0.882 0.900 0.850 CB 1.582 21 residues pruned to eliminate duplicates Z: 6 8.342 2.015 0.368 0.841 0.800 0.800 CB 1.262 Z: 22 43.682 2.183 0.797 0.890 1.000 0.810 CA 1.748 22 residues pruned to eliminate duplicates Z: 19 41.587 2.232 0.894 0.882 1.000 0.833 CB 1.678 28 residues pruned to eliminate duplicates Z: 17 34.787 2.111 0.765 0.882 1.000 0.688 CA 1.690 17 residues pruned to eliminate duplicates Z: 36 54.716 2.260 1.184 0.630 0.971 0.629 CB 1.707 35 residues pruned to eliminate duplicates Z: 19 33.695 2.079 0.794 0.885 1.000 0.722 CB 1.537 19 residues pruned to eliminate duplicates Z: 21 39.029 2.205 0.968 0.879 1.000 0.700 CB 1.458 21 residues pruned to eliminate duplicates Z: 40 52.088 2.201 0.704 0.860 0.974 0.846 CB 1.679 40 residues pruned to eliminate duplicates Z: 40 55.316 2.220 0.787 0.885 0.949 0.846 CB 1.699 40 residues pruned to eliminate duplicates Z: 39 58.247 2.203 0.928 0.893 0.974 0.737 CB 1.640 39 residues pruned to eliminate duplicates Z: 23 46.481 2.125 1.251 0.952 1.000 0.955 CB 1.427 23 residues pruned to eliminate duplicates Z: 38 52.036 2.213 0.703 0.901 0.973 0.865 CB 1.665 38 residues pruned to eliminate duplicates Z: 14 29.873 1.987 1.054 0.931 0.923 0.923 CB 1.537 14 residues pruned to eliminate duplicates Z: 36 55.640 2.280 1.241 0.641 0.943 0.657 CB 1.711 36 residues pruned to eliminate duplicates Z: 25 35.946 2.252 0.499 0.866 0.958 0.750 CB 1.661 31 residues pruned to eliminate duplicates Z: 8 22.300 2.179 0.559 0.791 1.000 0.571 CA 1.922 8 residues pruned to eliminate duplicates Z: 11 23.814 2.020 1.219 0.829 0.800 0.600 CB 1.580 11 residues pruned to eliminate duplicates Z: 25 35.933 2.209 0.610 0.869 0.875 0.750 CB 1.722 25 residues pruned to eliminate duplicates Z: 7 11.476 2.300 0.310 0.824 0.667 0.667 CA 1.762 7 residues pruned to eliminate duplicates Z: 23 55.252 2.226 1.481 0.912 1.000 0.864 CB 1.510 26 residues pruned to eliminate duplicates Z: 20 41.407 2.233 0.854 0.900 1.000 0.632 CB 1.640 20 residues pruned to eliminate duplicates Z: 6 3.556 1.865 0.548 0.400 0.600 0.600 CB 1.021 6 residues pruned to eliminate duplicates Z: 23 53.626 2.244 1.366 0.944 0.955 0.909 CB 1.562 23 residues pruned to eliminate duplicates Z: 42 43.920 2.125 0.837 0.627 0.951 0.805 CB 1.638 33 residues pruned to eliminate duplicates Z: 13 24.582 2.071 0.933 0.646 0.917 0.667 CB 1.687 13 residues pruned to eliminate duplicates Z: 14 31.034 1.977 1.039 0.928 1.000 0.846 CB 1.495 14 residues pruned to eliminate duplicates Z: 39 52.264 2.194 0.733 0.910 0.974 0.711 CB 1.624 39 residues pruned to eliminate duplicates Z: 41 70.010 2.210 1.079 0.882 1.000 0.825 CB 1.743 41 residues pruned to eliminate duplicates Z: 39 44.542 2.168 0.520 0.872 0.974 0.816 CB 1.641 39 residues pruned to eliminate duplicates Z: 39 49.170 2.216 0.538 0.894 1.000 0.816 CB 1.679 39 residues pruned to eliminate duplicates Z: 16 28.868 2.026 0.549 0.926 1.000 0.867 CB 1.665 16 residues pruned to eliminate duplicates Z: 25 32.415 2.214 0.515 0.892 0.875 0.708 CB 1.619 25 residues pruned to eliminate duplicates Z: 34 17.681 1.958 0.566 0.382 0.818 0.667 CB 1.391 Z: 31 37.212 1.908 1.025 0.882 0.933 0.667 CB 1.363 31 residues pruned to eliminate duplicates Z: 18 43.226 2.248 0.997 0.938 1.000 0.824 CB 1.623 18 residues pruned to eliminate duplicates Z: 33 62.618 2.234 1.036 0.951 1.000 0.938 CB 1.677 33 residues pruned to eliminate duplicates Z: 9 15.586 2.103 0.598 0.771 1.000 0.625 CB 1.290 9 residues pruned to eliminate duplicates Z: 6 9.133 1.931 0.299 0.853 1.000 0.800 N 1.204 6 residues pruned to eliminate duplicates Z: 19 34.575 2.139 0.551 0.910 1.000 0.889 CA 1.742 19 residues pruned to eliminate duplicates Z: 35 53.395 2.173 0.794 0.932 0.971 0.941 CB 1.690 35 residues pruned to eliminate duplicates Z: 20 36.419 2.163 0.683 0.878 1.000 0.895 CB 1.665 20 residues pruned to eliminate duplicates Z: 41 69.596 2.195 1.093 0.880 1.000 0.625 CB 1.735 41 residues pruned to eliminate duplicates Z: 37 44.276 2.210 0.517 0.910 0.972 0.833 CB 1.605 37 residues pruned to eliminate duplicates Z: 30 32.759 1.943 0.725 0.891 0.931 0.552 CB 1.401 30 residues pruned to eliminate duplicates Z: 10 16.715 1.866 0.896 0.742 1.000 0.778 CB 1.268 Z: 41 68.732 2.195 1.084 0.885 1.000 0.750 CB 1.716 41 residues pruned to eliminate duplicates Z: 18 36.594 2.243 0.602 0.899 1.000 0.824 CA 1.766 18 residues pruned to eliminate duplicates Z: 42 60.294 2.305 0.933 0.701 0.976 0.707 CB 1.805 42 residues pruned to eliminate duplicates Z: 24 38.392 2.241 0.588 0.851 0.957 0.826 CB 1.741 29 residues pruned to eliminate duplicates Z: 18 46.191 2.294 0.947 0.873 1.000 0.765 CB 1.828 18 residues pruned to eliminate duplicates Z: 40 57.032 2.183 0.933 0.883 0.949 0.744 CB 1.650 40 residues pruned to eliminate duplicates Z: 6 5.953 1.535 0.304 0.770 1.000 0.800 CB 1.048 8 residues pruned to eliminate duplicates Z: 19 37.029 2.129 0.926 0.903 1.000 0.667 CB 1.518 19 residues pruned to eliminate duplicates Z: 44 31.645 2.064 0.639 0.587 0.837 0.605 CB 1.567 44 residues pruned to eliminate duplicates Z: 39 44.001 2.211 0.389 0.872 1.000 0.921 CB 1.694 39 residues pruned to eliminate duplicates Z: 39 49.982 2.199 0.663 0.918 0.974 0.868 CB 1.606 39 residues pruned to eliminate duplicates Z: 20 41.397 2.090 1.229 0.904 1.000 0.737 CB 1.452 20 residues pruned to eliminate duplicates Z: 26 43.128 2.166 0.901 0.850 0.920 0.760 CB 1.687 25 residues pruned to eliminate duplicates Z: 14 36.011 2.012 1.206 0.926 1.000 1.000 CB 1.578 14 residues pruned to eliminate duplicates Z: 21 31.799 2.086 0.934 0.837 0.900 0.750 CB 1.465 21 residues pruned to eliminate duplicates Z: 18 43.245 2.366 0.796 0.880 1.000 0.765 C 1.789 18 residues pruned to eliminate duplicates Z: 19 29.974 2.064 0.593 0.904 0.944 0.722 C 1.621 19 residues pruned to eliminate duplicates Z: 39 55.236 2.239 0.730 0.891 0.974 0.816 CB 1.708 39 residues pruned to eliminate duplicates Z: 18 32.046 2.152 0.654 0.894 0.882 0.882 CB 1.775 18 residues pruned to eliminate duplicates Z: 11 17.375 2.192 0.394 0.791 0.800 0.600 CB 1.741 11 residues pruned to eliminate duplicates Z: 45 51.118 2.197 0.907 0.672 0.955 0.818 CB 1.644 45 residues pruned to eliminate duplicates Z: 20 40.148 2.210 0.829 0.901 1.000 0.895 CB 1.627 20 residues pruned to eliminate duplicates Z: 20 35.580 2.155 0.802 0.857 0.947 0.684 CB 1.635 20 residues pruned to eliminate duplicates Z: 25 39.466 2.204 0.695 0.829 0.958 0.792 CB 1.692 25 residues pruned to eliminate duplicates Z: 8 16.124 2.270 0.610 0.825 0.714 0.429 CB 1.762 8 residues pruned to eliminate duplicates Z: 38 53.370 2.208 0.713 0.912 0.973 0.811 CB 1.689 38 residues pruned to eliminate duplicates Z: 17 36.424 2.078 1.054 0.921 1.000 0.750 CB 1.501 17 residues pruned to eliminate duplicates Z: 20 47.132 2.176 1.212 0.894 0.947 0.789 CA 1.701 20 residues pruned to eliminate duplicates Z: 20 42.644 2.157 0.958 0.927 1.000 0.737 CB 1.623 20 residues pruned to eliminate duplicates Z: 10 20.936 1.841 1.421 0.623 0.889 0.778 CB 1.568 10 residues pruned to eliminate duplicates Z: 27 30.942 2.209 0.175 0.932 1.000 0.962 CB 1.633 27 residues pruned to eliminate duplicates Z: 40 61.739 2.208 0.924 0.878 1.000 0.718 CB 1.689 40 residues pruned to eliminate duplicates Z: 20 46.162 2.160 1.119 0.900 1.000 0.789 CB 1.653 20 residues pruned to eliminate duplicates Z: 20 45.277 2.161 1.174 0.888 1.000 0.737 CB 1.593 20 residues pruned to eliminate duplicates Z: 19 39.398 2.217 0.708 0.890 1.000 0.722 CA 1.765 19 residues pruned to eliminate duplicates Z: 19 43.480 2.152 1.047 0.882 1.000 0.778 CB 1.684 20 residues pruned to eliminate duplicates Z: 40 53.309 2.187 0.805 0.877 0.949 0.821 CB 1.654 40 residues pruned to eliminate duplicates Z: 9 12.250 1.989 0.188 0.826 1.000 0.500 CA 1.382 9 residues pruned to eliminate duplicates Z: 15 16.337 2.131 0.634 0.495 0.929 0.500 CB 1.357 15 residues pruned to eliminate duplicates Z: 11 36.735 2.348 1.250 0.886 0.900 0.700 C 1.762 11 residues pruned to eliminate duplicates Z: 9 17.988 1.851 1.419 0.884 0.875 0.625 CB 1.173 8 residues pruned to eliminate duplicates Z: 16 27.694 2.029 0.519 0.922 1.000 0.867 CB 1.632 16 residues pruned to eliminate duplicates Z: 19 39.493 2.245 0.851 0.907 1.000 0.833 CB 1.591 19 residues pruned to eliminate duplicates Z: 18 34.802 2.090 0.799 0.872 0.941 0.706 CB 1.738 18 residues pruned to eliminate duplicates Z: 30 41.577 1.950 1.083 0.892 0.966 0.655 CB 1.414 31 residues pruned to eliminate duplicates Z: 26 43.749 2.155 0.707 0.861 1.000 0.840 CA 1.747 26 residues pruned to eliminate duplicates Z: 46 41.451 2.112 0.954 0.622 0.933 0.689 CB 1.430 46 residues pruned to eliminate duplicates Z: 21 50.011 2.321 1.209 0.949 1.000 0.900 CB 1.505 21 residues pruned to eliminate duplicates Z: 22 68.199 2.337 1.686 0.950 1.000 0.952 CB 1.635 22 residues pruned to eliminate duplicates Z: 14 24.328 2.178 0.340 0.942 1.000 0.923 CB 1.604 14 residues pruned to eliminate duplicates Z: 9 18.673 2.120 0.436 0.833 1.000 0.750 CB 1.627 9 residues pruned to eliminate duplicates Z: 24 37.728 2.107 0.846 0.912 1.000 0.913 CB 1.432 24 residues pruned to eliminate duplicates Z: 39 65.244 2.212 1.081 0.903 0.974 0.632 CB 1.684 39 residues pruned to eliminate duplicates Z: 40 43.899 2.185 0.478 0.867 0.974 0.769 CB 1.634 40 residues pruned to eliminate duplicates Z: 8 25.036 2.125 0.963 0.898 1.000 0.857 C 1.623 8 residues pruned to eliminate duplicates Z: 21 54.960 2.236 1.410 0.953 1.000 0.800 CB 1.570 24 residues pruned to eliminate duplicates Z: 13 26.298 1.863 1.067 0.887 1.000 0.917 CB 1.421 Z: 20 46.452 2.136 1.312 0.883 1.000 0.684 CB 1.560 20 residues pruned to eliminate duplicates Z: 15 28.565 2.123 0.561 0.922 1.000 1.000 CB 1.620 15 residues pruned to eliminate duplicates Z: 6 6.085 1.820 0.172 0.691 0.800 0.400 CB 1.338 6 residues pruned to eliminate duplicates Z: 18 31.195 2.269 0.445 0.840 0.941 0.647 CA 1.829 18 residues pruned to eliminate duplicates Z: 37 52.472 2.184 1.209 0.635 0.972 0.639 CB 1.643 37 residues pruned to eliminate duplicates Z: 40 50.903 2.163 0.644 0.899 1.000 0.846 CB 1.638 40 residues pruned to eliminate duplicates Z: 12 24.991 2.161 0.884 0.811 0.818 0.636 CB 1.725 12 residues pruned to eliminate duplicates Z: 40 72.561 2.220 1.121 0.912 1.000 0.795 CB 1.747 40 residues pruned to eliminate duplicates Z: 31 37.979 2.201 0.784 0.679 0.933 0.667 CB 1.606 31 residues pruned to eliminate duplicates Z: 24 26.628 2.013 0.989 0.628 0.957 0.565 CB 1.285 13 residues pruned to eliminate duplicates Z: 8 9.765 1.913 0.547 0.540 1.000 0.429 CB 1.199 8 residues pruned to eliminate duplicates Z: 19 50.821 2.226 1.286 0.896 1.000 0.667 CB 1.687 19 residues pruned to eliminate duplicates Z: 19 40.222 2.138 0.859 0.885 1.000 0.778 CA 1.723 19 residues pruned to eliminate duplicates Z: 40 46.697 2.210 0.492 0.880 0.974 0.897 CB 1.686 40 residues pruned to eliminate duplicates Z: 18 42.672 2.245 0.877 0.911 1.000 0.882 CA 1.741 18 residues pruned to eliminate duplicates Z: 17 42.165 2.315 0.913 0.842 1.000 0.688 CB 1.774 17 residues pruned to eliminate duplicates Z: 18 45.413 2.222 0.935 0.951 1.000 0.765 CB 1.765 18 residues pruned to eliminate duplicates Z: 24 44.013 2.195 1.095 0.929 0.913 0.826 CB 1.530 24 residues pruned to eliminate duplicates Z: 14 35.753 1.989 1.170 0.925 1.000 1.000 CB 1.613 14 residues pruned to eliminate duplicates Z: 8 11.349 1.870 0.588 0.474 1.000 0.429 CB 1.483 Z: 19 36.168 2.146 0.884 0.891 0.944 0.722 CB 1.605 19 residues pruned to eliminate duplicates Z: 10 12.387 2.019 0.441 0.502 1.000 0.556 CB 1.417 Z: 40 56.350 2.206 0.742 0.921 0.949 0.744 CB 1.741 40 residues pruned to eliminate duplicates Z: 20 46.957 2.129 1.213 0.893 1.000 0.737 CB 1.642 20 residues pruned to eliminate duplicates Z: 15 31.771 1.901 1.074 0.913 1.000 0.929 CB 1.524 15 residues pruned to eliminate duplicates Z: 39 55.580 2.227 0.747 0.893 0.974 0.868 CB 1.708 39 residues pruned to eliminate duplicates Z: 12 20.399 1.947 0.651 0.932 1.000 1.000 CB 1.336 12 residues pruned to eliminate duplicates Z: 20 44.015 2.098 1.318 0.894 1.000 0.737 CB 1.490 20 residues pruned to eliminate duplicates Z: 30 38.534 2.193 0.667 0.697 0.931 0.690 CB 1.757 30 residues pruned to eliminate duplicates Z: 23 39.379 2.087 0.949 0.924 1.000 0.818 CB 1.449 23 residues pruned to eliminate duplicates Z: 23 48.406 2.195 1.289 0.930 1.000 0.773 CB 1.436 23 residues pruned to eliminate duplicates Z: 18 44.847 2.269 1.160 0.910 1.000 0.706 CB 1.574 18 residues pruned to eliminate duplicates Z: 46 61.537 2.296 1.108 0.635 1.000 0.667 CB 1.670 46 residues pruned to eliminate duplicates Z: 37 49.756 2.210 0.703 0.898 0.972 0.917 CB 1.621 37 residues pruned to eliminate duplicates Z: 6 5.744 1.629 0.912 0.819 0.800 0.800 CB 0.782 6 residues pruned to eliminate duplicates Z: 22 58.094 2.218 1.568 0.938 1.000 0.714 CB 1.548 21 residues pruned to eliminate duplicates Z: 16 30.337 2.031 0.748 0.903 0.933 0.867 CB 1.686 16 residues pruned to eliminate duplicates Z: 20 38.530 2.089 0.976 0.925 1.000 0.737 CB 1.503 20 residues pruned to eliminate duplicates Z: 25 50.063 2.263 0.969 0.861 0.917 0.750 CA 1.838 25 residues pruned to eliminate duplicates Z: 16 24.946 1.990 0.558 0.895 0.933 0.867 CB 1.595 16 residues pruned to eliminate duplicates Z: 21 37.837 2.025 1.076 0.885 0.950 0.850 CB 1.530 21 residues pruned to eliminate duplicates Z: 21 43.365 2.141 1.083 0.848 1.000 0.800 CB 1.613 21 residues pruned to eliminate duplicates Z: 7 12.535 2.179 0.290 0.881 0.833 0.500 CB 1.582 Z: 39 63.470 2.196 0.997 0.889 1.000 0.816 CB 1.690 39 residues pruned to eliminate duplicates Z: 20 35.514 2.205 0.473 0.917 1.000 0.947 CB 1.771 20 residues pruned to eliminate duplicates Z: 53 56.873 2.318 0.889 0.622 0.981 0.538 CB 1.637 53 residues pruned to eliminate duplicates Z: 25 44.214 2.253 0.779 0.835 0.917 0.792 CA 1.840 25 residues pruned to eliminate duplicates Z: 17 35.152 2.044 0.991 0.878 1.000 0.875 CB 1.567 17 residues pruned to eliminate duplicates Z: 10 11.871 2.003 0.453 0.741 0.889 0.444 CB 1.232 10 residues pruned to eliminate duplicates Z: 7 5.080 1.933 -0.135 0.694 0.833 0.667 CB 1.247 7 residues pruned to eliminate duplicates Z: 20 43.948 2.145 1.174 0.877 1.000 0.842 CB 1.571 20 residues pruned to eliminate duplicates Z: 21 32.656 2.019 1.071 0.888 0.900 0.750 CB 1.397 21 residues pruned to eliminate duplicates Z: 19 36.598 2.294 0.689 0.904 1.000 0.889 CB 1.585 29 residues pruned to eliminate duplicates Z: 18 42.327 2.356 0.779 0.859 1.000 0.765 CB 1.803 18 residues pruned to eliminate duplicates Z: 19 38.602 2.182 0.793 0.869 1.000 0.722 C 1.698 19 residues pruned to eliminate duplicates Z: 19 34.211 1.958 1.134 0.859 0.944 0.556 CB 1.504 19 residues pruned to eliminate duplicates Z: 41 46.519 2.204 0.466 0.878 0.975 0.900 CB 1.694 41 residues pruned to eliminate duplicates Z: 18 39.666 2.143 1.006 0.884 0.941 0.706 CB 1.718 18 residues pruned to eliminate duplicates Z: 6 14.016 2.327 0.125 0.810 1.000 0.600 CB 1.827 6 residues pruned to eliminate duplicates Z: 17 23.635 1.934 0.662 0.850 0.875 0.750 CB 1.556 17 residues pruned to eliminate duplicates Z: 21 40.012 2.023 1.026 0.914 1.000 0.650 C 1.543 21 residues pruned to eliminate duplicates Z: 6 8.508 1.958 0.105 0.866 1.000 0.600 CB 1.287 6 residues pruned to eliminate duplicates Z: 36 47.295 2.101 1.192 0.650 0.971 0.714 CB 1.554 37 residues pruned to eliminate duplicates Z: 12 18.473 1.873 0.675 0.921 0.909 0.818 CB 1.374 12 residues pruned to eliminate duplicates Z: 22 53.499 2.228 1.275 0.947 1.000 0.810 CB 1.592 22 residues pruned to eliminate duplicates Z: 13 16.940 1.801 0.478 0.887 1.000 1.000 CB 1.324 13 residues pruned to eliminate duplicates Z: 6 4.150 1.540 0.340 0.815 0.800 0.600 CB 0.855 Z: 10 16.869 2.078 0.704 0.875 0.889 0.778 CB 1.300 10 residues pruned to eliminate duplicates Z: 20 35.776 2.065 0.952 0.888 1.000 0.789 CB 1.468 20 residues pruned to eliminate duplicates Z: 25 47.835 2.202 0.839 0.895 0.958 0.833 CA 1.804 25 residues pruned to eliminate duplicates Z: 39 43.701 2.162 0.514 0.870 1.000 0.895 CB 1.581 39 residues pruned to eliminate duplicates Z: 18 30.987 2.029 0.820 0.866 0.941 0.824 CB 1.583 18 residues pruned to eliminate duplicates Z: 36 51.977 2.252 1.072 0.655 0.943 0.686 CB 1.729 36 residues pruned to eliminate duplicates Z: 38 52.127 2.206 0.720 0.889 0.973 0.730 CB 1.672 38 residues pruned to eliminate duplicates Z: 13 14.264 1.966 1.001 0.426 0.833 0.583 CB 1.356 Z: 22 57.423 2.221 1.562 0.961 1.000 0.619 CB 1.508 22 residues pruned to eliminate duplicates Z: 17 29.437 1.989 0.744 0.898 1.000 0.812 CB 1.518 17 residues pruned to eliminate duplicates Z: 14 16.952 1.964 0.500 0.846 0.923 0.692 CB 1.285 14 residues pruned to eliminate duplicates Z: 39 57.158 2.225 0.772 0.888 1.000 0.763 CB 1.694 39 residues pruned to eliminate duplicates Z: 36 62.215 2.215 1.033 0.914 1.000 0.657 CB 1.652 36 residues pruned to eliminate duplicates Z: 23 42.855 2.206 0.891 0.939 1.000 0.955 CB 1.523 23 residues pruned to eliminate duplicates Z: 35 55.942 2.187 0.875 0.938 1.000 0.971 CB 1.628 35 residues pruned to eliminate duplicates Z: 35 58.143 2.175 0.945 0.932 1.000 0.853 CB 1.646 35 residues pruned to eliminate duplicates Z: 40 60.426 2.187 1.016 0.893 0.974 0.615 CB 1.616 40 residues pruned to eliminate duplicates Z: 24 46.427 2.213 0.993 0.940 1.000 0.957 CB 1.525 24 residues pruned to eliminate duplicates Z: 36 50.767 2.111 0.786 0.910 1.000 0.886 CB 1.614 36 residues pruned to eliminate duplicates Z: 19 44.427 2.135 1.175 0.906 1.000 0.778 CB 1.603 19 residues pruned to eliminate duplicates Z: 24 43.941 2.174 1.215 0.882 0.957 0.826 CB 1.439 24 residues pruned to eliminate duplicates Z: 40 54.301 2.216 0.689 0.901 0.974 0.744 CB 1.702 40 residues pruned to eliminate duplicates Z: 15 29.037 2.043 0.707 0.923 1.000 0.929 CB 1.563 15 residues pruned to eliminate duplicates Z: 29 39.604 2.180 0.696 0.741 0.929 0.679 CB 1.757 29 residues pruned to eliminate duplicates Z: 41 67.720 2.176 1.074 0.898 1.000 0.650 CB 1.698 41 residues pruned to eliminate duplicates Z: 18 46.475 2.234 1.172 0.911 1.000 0.765 CB 1.646 18 residues pruned to eliminate duplicates Z: 70 36.227 2.006 0.769 0.467 0.928 0.638 CB 1.370 66 residues pruned to eliminate duplicates Z: 36 25.856 2.019 0.567 0.561 0.886 0.629 CB 1.471 34 residues pruned to eliminate duplicates Z: 36 52.243 2.119 1.179 0.681 0.971 0.714 CB 1.667 35 residues pruned to eliminate duplicates Z: 14 28.513 1.962 0.969 0.918 1.000 1.000 CB 1.444 14 residues pruned to eliminate duplicates Z: 10 9.611 1.953 0.698 0.473 0.778 0.333 CB 1.277 10 residues pruned to eliminate duplicates Z: 14 17.482 1.727 0.448 0.895 1.000 0.692 CA 1.390 13 residues pruned to eliminate duplicates Z: 19 36.043 2.203 0.640 0.869 1.000 0.889 C 1.718 19 residues pruned to eliminate duplicates Z: 8 14.939 2.125 0.477 0.720 0.857 0.714 C 1.719 8 residues pruned to eliminate duplicates Z: 108 84.491 2.250 0.923 0.746 0.953 0.692 CB 1.589 108 residues pruned to eliminate duplicates Z: 17 30.692 2.155 0.722 0.873 0.938 0.750 CB 1.606 17 residues pruned to eliminate duplicates Z: 17 25.413 1.994 0.565 0.851 1.000 0.750 CB 1.508 17 residues pruned to eliminate duplicates Z: 18 43.324 2.272 0.976 0.871 1.000 0.824 C 1.707 18 residues pruned to eliminate duplicates Z: 72 78.975 2.212 1.235 0.768 0.930 0.634 CB 1.608 72 residues pruned to eliminate duplicates Z: 23 39.155 2.210 0.681 0.823 0.955 0.636 CA 1.780 23 residues pruned to eliminate duplicates Z: 15 36.008 2.164 0.978 0.872 1.000 0.714 CB 1.638 15 residues pruned to eliminate duplicates Z: 108 91.924 2.261 1.011 0.767 0.953 0.766 CB 1.618 101 residues pruned to eliminate duplicates Z: 18 28.890 2.115 0.611 0.826 0.941 0.588 C 1.647 18 residues pruned to eliminate duplicates Z: 20 42.310 2.110 1.139 0.899 1.000 0.842 CB 1.537 20 residues pruned to eliminate duplicates Z: 53 53.281 2.243 0.889 0.655 0.923 0.673 CB 1.636 53 residues pruned to eliminate duplicates Z: 22 51.128 2.262 1.322 0.956 1.000 0.667 CB 1.459 22 residues pruned to eliminate duplicates Z: 19 39.766 2.144 1.071 0.900 1.000 0.500 CB 1.508 19 residues pruned to eliminate duplicates Z: 20 35.720 2.050 1.042 0.899 1.000 0.632 CB 1.400 20 residues pruned to eliminate duplicates Z: 34 35.588 2.115 0.704 0.631 0.970 0.667 CB 1.566 34 residues pruned to eliminate duplicates Z: 31 39.026 2.052 0.811 0.869 0.967 0.800 CB 1.449 31 residues pruned to eliminate duplicates Z: 38 49.985 2.161 0.836 0.929 0.919 0.784 CB 1.577 38 residues pruned to eliminate duplicates Z: 46 52.136 2.115 1.065 0.655 0.933 0.689 CB 1.650 49 residues pruned to eliminate duplicates Z: 57 33.708 2.041 0.649 0.525 0.911 0.643 CB 1.432 52 residues pruned to eliminate duplicates Z: 18 26.478 2.131 0.469 0.864 0.941 0.765 CB 1.598 18 residues pruned to eliminate duplicates Z: 9 6.883 1.679 -0.007 0.796 1.000 0.500 CB 1.126 9 residues pruned to eliminate duplicates Z: 37 42.757 1.999 0.891 0.771 0.972 0.694 CB 1.525 32 residues pruned to eliminate duplicates Z: 6 14.464 2.074 0.448 0.883 1.000 1.000 CB 1.557 6 residues pruned to eliminate duplicates Z: 15 26.349 1.875 0.829 0.829 1.000 0.857 CA 1.546 15 residues pruned to eliminate duplicates Z: 39 20.074 1.944 0.620 0.376 0.868 0.632 CB 1.360 37 residues pruned to eliminate duplicates Z: 38 58.972 2.232 0.831 0.891 1.000 0.730 CB 1.706 38 residues pruned to eliminate duplicates Z: 30 37.152 1.956 0.954 0.877 0.897 0.655 CB 1.462 31 residues pruned to eliminate duplicates Z: 37 42.753 2.168 0.885 0.718 0.889 0.750 CB 1.610 37 residues pruned to eliminate duplicates Z: 25 48.173 2.254 0.774 0.878 0.958 0.917 CB 1.862 25 residues pruned to eliminate duplicates Z: 39 51.482 2.221 1.033 0.665 0.921 0.789 CB 1.723 38 residues pruned to eliminate duplicates Z: 58 40.649 2.117 0.641 0.583 0.912 0.614 CB 1.568 57 residues pruned to eliminate duplicates Z: 32 36.236 2.162 0.656 0.677 0.935 0.645 CB 1.650 32 residues pruned to eliminate duplicates Z: 31 41.577 1.994 0.973 0.894 0.967 0.700 CB 1.432 31 residues pruned to eliminate duplicates Z: 19 32.783 2.160 0.614 0.889 1.000 0.778 CB 1.596 19 residues pruned to eliminate duplicates Z: 26 14.864 1.858 0.646 0.463 0.840 0.640 CB 1.202 14 residues pruned to eliminate duplicates Z: 20 15.820 1.862 0.716 0.427 0.895 0.632 CB 1.370 17 residues pruned to eliminate duplicates Z: 18 28.714 1.966 0.703 0.861 1.000 0.824 CB 1.528 18 residues pruned to eliminate duplicates Z: 40 56.657 2.192 0.784 0.889 0.974 0.744 CB 1.714 40 residues pruned to eliminate duplicates Z: 12 14.225 1.854 0.843 0.489 1.000 0.727 CB 1.269 10 residues pruned to eliminate duplicates Z: 18 45.520 2.281 0.891 0.866 1.000 0.765 CB 1.874 18 residues pruned to eliminate duplicates Z: 22 28.497 2.052 0.866 0.525 0.952 0.762 CB 1.664 22 residues pruned to eliminate duplicates Z: 24 35.451 2.116 0.824 0.855 0.957 0.870 CB 1.477 24 residues pruned to eliminate duplicates Z: 18 44.758 2.228 1.015 0.936 1.000 0.882 CB 1.684 18 residues pruned to eliminate duplicates Z: 14 27.269 1.987 0.892 0.911 0.923 0.923 CB 1.545 14 residues pruned to eliminate duplicates Z: 7 10.454 2.053 -0.067 0.843 1.000 1.000 C 1.658 7 residues pruned to eliminate duplicates Z: 20 33.116 2.071 1.043 0.890 0.842 0.526 CB 1.535 20 residues pruned to eliminate duplicates Z: 29 24.826 1.991 0.686 0.557 0.857 0.571 CB 1.544 38 residues pruned to eliminate duplicates Z: 22 60.516 2.256 1.570 0.953 1.000 0.762 CB 1.568 22 residues pruned to eliminate duplicates Z: 16 21.807 1.931 0.425 0.855 1.000 0.733 CB 1.510 16 residues pruned to eliminate duplicates Z: 35 50.422 2.194 0.709 0.927 0.971 0.912 CB 1.666 35 residues pruned to eliminate duplicates Z: 27 29.528 2.088 0.934 0.587 0.885 0.615 CB 1.491 27 residues pruned to eliminate duplicates Z: 8 6.375 1.769 0.111 0.693 0.857 0.286 CB 1.198 8 residues pruned to eliminate duplicates Z: 18 46.538 2.223 1.112 0.948 1.000 1.000 C 1.660 18 residues pruned to eliminate duplicates Z: 19 39.237 2.164 1.115 0.939 0.944 0.889 CB 1.487 19 residues pruned to eliminate duplicates Z: 15 16.371 1.819 0.755 0.483 0.929 0.500 CB 1.501 15 residues pruned to eliminate duplicates Z: 19 38.915 2.154 0.802 0.888 1.000 0.722 CB 1.702 19 residues pruned to eliminate duplicates Z: 19 48.950 2.221 1.140 0.902 1.000 0.833 CB 1.732 19 residues pruned to eliminate duplicates Z: 19 40.464 2.301 0.862 0.886 0.944 0.778 CB 1.700 19 residues pruned to eliminate duplicates Z: 42 46.692 2.045 1.021 0.624 0.976 0.756 CB 1.609 42 residues pruned to eliminate duplicates Z: 22 49.765 2.289 1.255 0.936 1.000 0.857 CB 1.465 22 residues pruned to eliminate duplicates Z: 11 18.298 1.938 0.799 0.889 0.900 0.900 CB 1.328 11 residues pruned to eliminate duplicates Z: 14 35.442 2.027 1.087 0.919 1.000 0.846 CB 1.637 14 residues pruned to eliminate duplicates Z: 32 24.974 2.076 0.568 0.551 0.935 0.710 CB 1.401 32 residues pruned to eliminate duplicates Z: 17 28.992 2.131 0.467 0.907 1.000 0.812 CB 1.647 17 residues pruned to eliminate duplicates Z: 40 65.313 2.175 1.119 0.894 0.974 0.692 CB 1.671 40 residues pruned to eliminate duplicates Z: 35 34.990 2.108 0.355 0.911 0.971 0.882 CB 1.534 35 residues pruned to eliminate duplicates Z: 10 16.858 2.006 0.778 0.707 0.889 0.889 CB 1.469 10 residues pruned to eliminate duplicates Z: 24 37.226 2.244 0.551 0.849 0.957 0.739 CB 1.729 24 residues pruned to eliminate duplicates Z: 39 59.487 2.229 0.859 0.901 0.974 0.658 CB 1.707 39 residues pruned to eliminate duplicates Z: 25 36.684 2.201 0.618 0.843 0.958 0.708 CB 1.634 25 residues pruned to eliminate duplicates Z: 16 16.303 2.170 0.496 0.492 0.867 0.400 CB 1.509 16 residues pruned to eliminate duplicates Z: 8 14.979 2.124 0.382 0.836 1.000 0.571 CA 1.444 8 residues pruned to eliminate duplicates Z: 13 16.316 1.804 0.278 0.898 1.000 0.833 CA 1.461 13 residues pruned to eliminate duplicates Z: 22 61.814 2.307 1.602 0.963 1.000 0.952 CB 1.536 22 residues pruned to eliminate duplicates Z: 13 23.083 1.870 0.832 0.926 1.000 0.917 CB 1.364 13 residues pruned to eliminate duplicates Z: 31 43.208 2.035 0.951 0.904 0.967 0.767 CB 1.464 31 residues pruned to eliminate duplicates Z: 23 41.065 2.273 0.732 0.855 0.955 0.727 CB 1.719 23 residues pruned to eliminate duplicates Z: 25 37.815 2.224 0.555 0.864 0.958 0.792 CB 1.708 25 residues pruned to eliminate duplicates Z: 18 42.721 2.217 0.955 0.922 0.941 0.765 C 1.786 18 residues pruned to eliminate duplicates Z: 9 17.610 1.885 0.787 0.823 1.000 0.875 CB 1.397 9 residues pruned to eliminate duplicates Z: 27 22.700 2.040 0.738 0.425 0.923 0.731 CB 1.471 27 residues pruned to eliminate duplicates Z: 42 46.915 2.225 0.791 0.690 0.951 0.707 CB 1.624 42 residues pruned to eliminate duplicates Z: 8 19.417 2.198 0.639 0.896 1.000 1.000 CB 1.459 8 residues pruned to eliminate duplicates Z: 33 32.243 2.110 1.043 0.602 0.875 0.625 CB 1.372 33 residues pruned to eliminate duplicates Z: 11 24.230 2.241 0.579 0.810 0.900 0.700 CB 1.837 11 residues pruned to eliminate duplicates Z: 19 43.272 2.211 0.906 0.873 1.000 0.556 C 1.763 19 residues pruned to eliminate duplicates Z: 99 63.694 2.142 0.763 0.651 0.959 0.704 CB 1.544 104 residues pruned to eliminate duplicates Z: 40 48.862 2.155 0.642 0.886 0.974 0.897 CB 1.637 40 residues pruned to eliminate duplicates Z: 27 54.949 2.258 0.979 0.934 1.000 0.846 CB 1.681 27 residues pruned to eliminate duplicates Z: 15 9.644 1.771 0.541 0.480 0.929 0.571 CB 1.038 15 residues pruned to eliminate duplicates Z: 18 38.519 2.217 0.849 0.922 1.000 0.941 CB 1.602 18 residues pruned to eliminate duplicates Z: 26 42.755 2.169 0.678 0.889 0.960 0.840 CA 1.762 26 residues pruned to eliminate duplicates Z: 9 7.771 1.749 0.416 0.757 0.875 0.875 CB 1.008 9 residues pruned to eliminate duplicates Z: 21 17.153 2.021 0.590 0.458 0.750 0.450 CA 1.660 22 residues pruned to eliminate duplicates Z: 26 44.761 2.139 0.843 0.877 0.960 0.560 CA 1.719 26 residues pruned to eliminate duplicates Z: 12 18.519 2.190 0.682 0.621 0.909 0.545 CB 1.488 12 residues pruned to eliminate duplicates Z: 19 31.739 2.065 0.741 0.836 1.000 0.556 CB 1.557 19 residues pruned to eliminate duplicates Z: 36 47.255 2.207 0.513 0.916 1.000 0.914 CB 1.689 36 residues pruned to eliminate duplicates Z: 43 39.314 2.144 0.743 0.650 0.857 0.690 CB 1.647 43 residues pruned to eliminate duplicates Z: 25 18.422 1.862 0.693 0.507 0.917 0.750 CB 1.292 27 residues pruned to eliminate duplicates Z: 12 38.907 2.192 1.333 0.922 1.000 0.909 C 1.614 12 residues pruned to eliminate duplicates Z: 61 38.816 2.008 0.932 0.518 0.950 0.733 CB 1.335 61 residues pruned to eliminate duplicates Z: 58 48.382 2.166 0.759 0.611 0.930 0.649 CB 1.629 59 residues pruned to eliminate duplicates Z: 29 20.781 1.953 0.658 0.405 0.929 0.500 CB 1.444 29 residues pruned to eliminate duplicates Z: 38 38.843 2.149 0.327 0.910 1.000 0.892 CB 1.589 38 residues pruned to eliminate duplicates Z: 15 15.400 1.652 0.680 0.827 0.929 0.857 CB 1.204 14 residues pruned to eliminate duplicates Z: 19 39.226 2.170 0.946 0.862 0.944 0.778 CB 1.702 19 residues pruned to eliminate duplicates Z: 25 35.467 2.208 0.556 0.857 0.958 0.875 CB 1.620 25 residues pruned to eliminate duplicates Z: 19 44.920 2.190 1.102 0.912 1.000 0.667 CB 1.629 19 residues pruned to eliminate duplicates Z: 19 13.151 1.677 0.985 0.379 0.889 0.611 CB 1.192 18 residues pruned to eliminate duplicates Z: 35 54.629 2.123 1.035 0.894 0.971 0.559 CB 1.603 35 residues pruned to eliminate duplicates Z: 26 40.926 2.138 0.649 0.837 1.000 0.640 CB 1.737 26 residues pruned to eliminate duplicates Z: 23 54.154 2.175 1.395 0.943 0.955 0.409 CB 1.610 23 residues pruned to eliminate duplicates Z: 23 44.010 2.280 0.914 0.923 0.955 0.955 CB 1.583 23 residues pruned to eliminate duplicates Z: 12 18.121 1.902 0.404 0.918 1.000 0.818 CB 1.443 12 residues pruned to eliminate duplicates Z: 22 52.845 2.240 1.383 0.942 1.000 0.857 CB 1.498 22 residues pruned to eliminate duplicates Z: 25 36.249 2.213 0.473 0.893 1.000 0.708 CB 1.630 25 residues pruned to eliminate duplicates Z: 6 2.611 1.694 -0.286 0.823 0.600 0.400 O 1.217 6 residues pruned to eliminate duplicates Z: 25 45.190 2.216 0.734 0.888 1.000 0.750 CB 1.730 36 residues pruned to eliminate duplicates Z: 15 21.163 1.804 0.562 0.892 1.000 1.000 CA 1.443 15 residues pruned to eliminate duplicates Z: 17 23.659 1.918 0.548 0.887 0.938 0.812 CA 1.532 17 residues pruned to eliminate duplicates Z: 6 4.997 1.766 0.422 0.663 1.000 1.000 CB 0.765 6 residues pruned to eliminate duplicates Z: 35 36.382 2.014 1.096 0.572 1.000 0.706 CB 1.378 35 residues pruned to eliminate duplicates Z: 40 45.034 2.197 0.473 0.885 0.974 0.897 CB 1.652 40 residues pruned to eliminate duplicates Z: 24 15.631 1.950 0.676 0.406 0.913 0.609 CB 1.206 23 residues pruned to eliminate duplicates Z: 12 17.566 1.916 0.635 0.905 0.909 0.727 CB 1.323 12 residues pruned to eliminate duplicates Z: 9 10.311 1.633 0.617 0.870 1.000 0.875 CB 1.007 9 residues pruned to eliminate duplicates Z: 41 58.120 2.171 0.850 0.881 1.000 0.650 CB 1.657 41 residues pruned to eliminate duplicates Z: 21 35.035 2.229 0.383 0.906 1.000 0.800 CB 1.807 21 residues pruned to eliminate duplicates Z: 7 14.129 2.258 0.269 0.837 0.833 0.833 CB 1.807 7 residues pruned to eliminate duplicates Z: 12 23.367 1.976 0.772 0.920 1.000 1.000 CB 1.417 12 residues pruned to eliminate duplicates Z: 19 38.541 2.165 1.076 0.828 0.944 0.722 CB 1.612 19 residues pruned to eliminate duplicates Z: 18 40.145 2.199 1.122 0.923 0.882 0.706 CB 1.661 18 residues pruned to eliminate duplicates Z: 19 20.535 2.169 0.424 0.544 0.889 0.722 CB 1.688 19 residues pruned to eliminate duplicates Z: 20 43.572 2.156 1.152 0.892 0.947 0.789 CA 1.633 20 residues pruned to eliminate duplicates Z: 25 41.578 2.193 0.666 0.857 0.958 0.708 CA 1.786 25 residues pruned to eliminate duplicates Z: 8 14.003 1.911 0.659 0.891 1.000 1.000 CB 1.200 8 residues pruned to eliminate duplicates Z: 22 61.406 2.307 1.584 0.961 1.000 0.857 CB 1.538 22 residues pruned to eliminate duplicates Z: 36 51.278 2.264 1.103 0.650 0.943 0.686 CB 1.678 36 residues pruned to eliminate duplicates Z: 18 47.539 2.267 1.079 0.946 1.000 0.824 C 1.692 18 residues pruned to eliminate duplicates Z: 12 18.635 1.909 0.427 0.913 1.000 0.909 CB 1.460 12 residues pruned to eliminate duplicates Z: 18 37.037 2.149 1.070 0.839 1.000 0.706 CB 1.508 18 residues pruned to eliminate duplicates Z: 6 4.821 1.429 0.583 0.382 1.000 0.400 CA 1.080 6 residues pruned to eliminate duplicates Z: 45 54.094 2.280 1.001 0.636 0.909 0.659 CB 1.731 45 residues pruned to eliminate duplicates Z: 11 36.747 2.274 1.177 0.932 0.900 0.500 CA 1.821 11 residues pruned to eliminate duplicates Z: 10 20.909 1.852 0.858 0.840 1.000 0.667 C 1.511 10 residues pruned to eliminate duplicates Z: 35 52.698 2.153 0.813 0.924 1.000 0.765 CB 1.625 35 residues pruned to eliminate duplicates Z: 40 54.481 2.191 0.770 0.872 1.000 0.795 CB 1.639 40 residues pruned to eliminate duplicates Z: 22 56.146 2.166 1.606 0.955 1.000 0.810 CB 1.492 22 residues pruned to eliminate duplicates Z: 40 47.847 2.194 0.532 0.878 1.000 0.872 CB 1.654 40 residues pruned to eliminate duplicates Z: 85 70.740 2.246 0.782 0.734 0.952 0.762 CB 1.642 85 residues pruned to eliminate duplicates Z: 6 5.745 1.705 -0.068 0.764 1.000 1.000 CB 1.279 6 residues pruned to eliminate duplicates Z: 61 41.717 1.978 0.999 0.561 0.983 0.717 CB 1.306 61 residues pruned to eliminate duplicates Z: 35 40.354 2.171 0.358 0.927 1.000 1.000 CB 1.645 35 residues pruned to eliminate duplicates Z: 7 12.739 2.128 0.136 0.817 1.000 0.833 CB 1.633 8 residues pruned to eliminate duplicates Z: 27 31.048 2.160 0.827 0.576 0.885 0.654 CB 1.621 27 residues pruned to eliminate duplicates Z: 6 5.056 1.890 -0.196 0.793 1.000 0.400 CB 1.150 6 residues pruned to eliminate duplicates Z: 16 28.792 2.027 0.803 0.844 1.000 0.600 CB 1.513 16 residues pruned to eliminate duplicates Z: 11 37.732 2.217 1.218 0.928 1.000 0.800 C 1.699 11 residues pruned to eliminate duplicates Z: 25 38.683 2.169 0.998 0.701 1.000 0.792 CB 1.518 25 residues pruned to eliminate duplicates Z: 18 43.201 2.281 0.828 0.950 1.000 1.000 CB 1.733 18 residues pruned to eliminate duplicates Z: 8 13.756 1.815 0.975 0.678 1.000 0.714 CB 1.231 8 residues pruned to eliminate duplicates Z: 12 14.037 1.886 0.196 0.890 1.000 0.727 CB 1.351 12 residues pruned to eliminate duplicates Z: 21 40.894 2.147 0.890 0.923 1.000 0.750 CB 1.584 21 residues pruned to eliminate duplicates Z: 25 33.470 2.045 0.715 0.903 1.000 0.750 CB 1.388 25 residues pruned to eliminate duplicates Z: 30 40.039 2.070 0.810 0.885 0.931 0.862 CB 1.539 30 residues pruned to eliminate duplicates Z: 13 19.246 1.858 0.690 0.885 0.917 0.583 CB 1.393 13 residues pruned to eliminate duplicates Z: 24 37.546 2.094 0.855 0.940 1.000 0.957 CB 1.400 24 residues pruned to eliminate duplicates Z: 40 46.362 2.178 0.574 0.846 0.974 0.744 CB 1.651 40 residues pruned to eliminate duplicates Z: 38 50.211 2.255 0.889 0.642 0.973 0.703 CB 1.744 38 residues pruned to eliminate duplicates Z: 6 3.218 1.758 0.242 0.746 0.600 0.600 CB 0.882 Z: 13 15.076 1.829 0.363 0.897 0.917 0.833 CB 1.363 13 residues pruned to eliminate duplicates Z: 6 9.816 1.720 0.819 0.838 1.000 1.000 CB 1.048 6 residues pruned to eliminate duplicates Z: 7 16.531 1.966 0.745 0.774 1.000 0.667 CB 1.545 7 residues pruned to eliminate duplicates Z: 27 25.352 2.041 0.761 0.453 0.923 0.692 CB 1.573 27 residues pruned to eliminate duplicates Z: 31 36.768 2.019 0.984 0.658 0.900 0.667 CB 1.607 31 residues pruned to eliminate duplicates Z: 20 43.391 2.236 0.903 0.864 0.947 0.842 CB 1.811 20 residues pruned to eliminate duplicates Z: 6 3.692 1.515 -0.183 0.755 1.000 1.000 CB 1.062 6 residues pruned to eliminate duplicates Z: 13 18.975 1.875 0.484 0.904 1.000 0.667 CB 1.402 13 residues pruned to eliminate duplicates Z: 8 16.298 1.956 0.847 0.835 1.000 0.714 CB 1.278 8 residues pruned to eliminate duplicates Z: 40 50.520 2.176 0.650 0.889 1.000 0.821 CB 1.622 40 residues pruned to eliminate duplicates Z: 7 10.174 1.890 0.281 0.877 1.000 1.000 CB 1.246 7 residues pruned to eliminate duplicates Z: 40 43.346 2.147 0.478 0.908 0.974 0.872 CB 1.594 40 residues pruned to eliminate duplicates Z: 41 66.016 2.211 1.056 0.891 0.975 0.700 CB 1.692 41 residues pruned to eliminate duplicates Z: 33 34.344 2.095 1.056 0.511 0.875 0.688 CB 1.593 33 residues pruned to eliminate duplicates Z: 16 29.499 2.088 0.745 0.880 0.933 0.867 CB 1.623 16 residues pruned to eliminate duplicates Z: 9 11.477 1.686 1.295 0.592 0.750 0.750 CB 1.281 9 residues pruned to eliminate duplicates Z: 16 34.093 2.075 0.912 0.893 1.000 0.933 CB 1.593 16 residues pruned to eliminate duplicates Z: 9 10.656 1.850 0.383 0.765 0.875 0.625 CA 1.331 9 residues pruned to eliminate duplicates Z: 8 3.150 1.177 0.309 0.664 1.000 0.714 N 0.664 Z: 108 88.101 2.248 1.016 0.758 0.935 0.682 CB 1.598 108 residues pruned to eliminate duplicates Z: 26 19.408 1.987 0.760 0.397 0.880 0.480 CB 1.406 25 residues pruned to eliminate duplicates Z: 7 8.294 1.652 0.799 0.736 1.000 0.833 CB 0.922 7 residues pruned to eliminate duplicates Z: 9 21.968 2.051 1.095 0.838 1.000 0.625 CB 1.350 9 residues pruned to eliminate duplicates Z: 39 60.207 2.214 0.957 0.894 0.974 0.763 CB 1.661 39 residues pruned to eliminate duplicates Z: 22 42.349 2.226 1.061 0.922 0.952 0.905 CB 1.487 22 residues pruned to eliminate duplicates Z: 16 28.098 2.200 0.430 0.910 1.000 0.800 CB 1.635 16 residues pruned to eliminate duplicates Z: 69 85.032 2.252 1.148 0.814 0.985 0.809 CB 1.647 69 residues pruned to eliminate duplicates Z: 40 46.869 2.206 0.461 0.897 0.974 0.923 CB 1.711 40 residues pruned to eliminate duplicates Z: 40 71.545 2.237 1.077 0.918 1.000 0.795 CB 1.738 40 residues pruned to eliminate duplicates Z: 20 28.394 1.991 0.638 0.844 0.895 0.789 CB 1.660 20 residues pruned to eliminate duplicates Z: 6 5.046 1.594 0.599 0.294 1.000 0.400 CB 1.116 Z: 40 57.209 2.208 0.873 0.857 0.974 0.667 CB 1.675 40 residues pruned to eliminate duplicates Z: 22 57.116 2.163 1.565 0.958 1.000 0.667 CB 1.541 22 residues pruned to eliminate duplicates Z: 11 22.457 2.175 0.723 0.777 0.900 0.700 CB 1.648 11 residues pruned to eliminate duplicates Z: 11 5.432 1.621 0.321 0.253 0.800 0.500 CA 1.332 11 residues pruned to eliminate duplicates Z: 46 57.368 2.214 1.118 0.655 0.956 0.778 CB 1.652 44 residues pruned to eliminate duplicates Z: 13 23.895 1.874 1.051 0.838 1.000 0.667 CB 1.340 13 residues pruned to eliminate duplicates Z: 13 14.240 1.774 0.179 0.918 1.000 0.917 CA 1.386 13 residues pruned to eliminate duplicates Z: 20 43.090 2.070 1.255 0.893 1.000 0.842 CB 1.520 20 residues pruned to eliminate duplicates Z: 6 5.232 1.563 0.183 0.756 1.000 0.600 CB 1.008 6 residues pruned to eliminate duplicates Z: 8 9.417 1.509 0.686 0.861 1.000 0.714 CB 1.028 6 residues pruned to eliminate duplicates Z: 23 34.904 2.135 0.640 0.938 1.000 0.909 CB 1.478 23 residues pruned to eliminate duplicates Z: 9 20.926 2.021 0.866 0.804 1.000 0.750 C 1.504 9 residues pruned to eliminate duplicates Z: 25 39.495 2.238 0.656 0.877 0.958 0.792 CB 1.649 25 residues pruned to eliminate duplicates Z: 28 37.738 2.194 0.756 0.684 0.963 0.704 CB 1.653 28 residues pruned to eliminate duplicates Z: 19 29.733 2.040 0.554 0.901 1.000 0.889 CB 1.577 19 residues pruned to eliminate duplicates Z: 10 15.179 1.881 1.381 0.610 0.778 0.667 CA 1.309 10 residues pruned to eliminate duplicates Z: 18 14.091 2.075 0.479 0.569 0.765 0.588 CB 1.361 18 residues pruned to eliminate duplicates Z: 9 25.721 2.163 0.864 0.887 1.000 0.750 CA 1.627 9 residues pruned to eliminate duplicates Z: 15 18.518 1.663 0.862 0.833 0.929 0.643 CB 1.291 15 residues pruned to eliminate duplicates Z: 35 71.593 2.184 1.369 0.942 0.971 0.706 CB 1.696 35 residues pruned to eliminate duplicates Z: 7 11.848 1.862 0.383 0.872 1.000 1.000 CB 1.370 7 residues pruned to eliminate duplicates Z: 8 26.088 2.239 0.702 0.861 1.000 0.714 CB 1.901 8 residues pruned to eliminate duplicates Z: 8 14.829 2.008 0.424 0.868 1.000 0.857 CA 1.432 8 residues pruned to eliminate duplicates Z: 18 28.354 2.015 0.688 0.827 0.941 0.706 CB 1.618 18 residues pruned to eliminate duplicates Z: 9 19.391 1.977 0.923 0.802 1.000 0.750 CB 1.385 9 residues pruned to eliminate duplicates Z: 39 51.334 2.211 0.740 0.903 0.947 0.868 CB 1.628 39 residues pruned to eliminate duplicates Z: 26 14.864 1.869 0.481 0.422 0.960 0.600 CB 1.214 26 residues pruned to eliminate duplicates Z: 22 43.283 2.168 0.983 0.945 1.000 0.905 CB 1.520 22 residues pruned to eliminate duplicates Z: 19 36.292 2.151 0.741 0.890 1.000 0.722 CB 1.643 19 residues pruned to eliminate duplicates Z: 16 38.409 2.207 0.861 0.920 1.000 0.867 CB 1.700 16 residues pruned to eliminate duplicates Z: 12 18.355 1.865 0.730 0.885 1.000 0.727 CB 1.239 12 residues pruned to eliminate duplicates Z: 6 7.936 2.011 0.058 0.852 0.800 0.800 C 1.543 6 residues pruned to eliminate duplicates Z: 24 39.977 2.243 0.577 0.871 0.957 0.652 CB 1.796 24 residues pruned to eliminate duplicates Z: 35 44.730 2.148 0.591 0.915 0.971 0.912 CB 1.634 35 residues pruned to eliminate duplicates Z: 11 17.095 1.895 1.372 0.574 0.900 0.700 CB 1.244 11 residues pruned to eliminate duplicates Z: 19 41.089 2.193 0.969 0.920 1.000 0.833 CB 1.579 19 residues pruned to eliminate duplicates Z: 25 32.515 2.197 0.412 0.875 0.958 0.833 CB 1.625 25 residues pruned to eliminate duplicates Z: 26 15.909 1.864 0.682 0.469 0.880 0.680 CB 1.190 26 residues pruned to eliminate duplicates Z: 50 51.133 2.090 0.925 0.739 0.959 0.694 CB 1.528 50 residues pruned to eliminate duplicates Z: 12 14.415 1.817 0.524 0.866 0.909 0.818 CB 1.263 12 residues pruned to eliminate duplicates Z: 7 21.497 2.192 0.776 0.745 1.000 0.833 CA 1.810 7 residues pruned to eliminate duplicates Z: 13 22.102 2.280 0.668 0.699 1.000 0.583 CB 1.399 13 residues pruned to eliminate duplicates Z: 22 34.388 2.067 0.714 0.890 0.952 0.810 C 1.600 22 residues pruned to eliminate duplicates Z: 50 43.891 2.192 0.891 0.631 0.816 0.735 CB 1.638 51 residues pruned to eliminate duplicates Z: 7 7.993 1.738 0.715 0.509 0.833 0.667 CB 1.302 7 residues pruned to eliminate duplicates Z: 54 32.376 1.994 0.588 0.528 0.887 0.623 CB 1.541 40 residues pruned to eliminate duplicates Z: 31 41.539 2.044 0.941 0.857 0.967 0.700 CB 1.458 31 residues pruned to eliminate duplicates Z: 36 53.035 2.112 0.889 0.915 1.000 0.800 CB 1.589 36 residues pruned to eliminate duplicates Z: 7 11.981 1.938 0.315 0.796 1.000 0.667 CA 1.480 7 residues pruned to eliminate duplicates Z: 20 42.051 2.265 1.134 0.691 0.947 0.789 CB 1.769 23 residues pruned to eliminate duplicates Z: 21 35.925 2.007 1.028 0.888 0.950 0.700 CB 1.497 21 residues pruned to eliminate duplicates Z: 11 16.757 1.948 0.655 0.641 0.900 0.700 CA 1.601 11 residues pruned to eliminate duplicates Z: 74 87.543 2.257 1.228 0.781 0.986 0.726 CB 1.613 74 residues pruned to eliminate duplicates Z: 10 17.878 1.979 0.613 0.846 1.000 0.556 CB 1.387 10 residues pruned to eliminate duplicates Z: 13 15.506 1.787 0.318 0.908 1.000 0.750 CB 1.350 13 residues pruned to eliminate duplicates Z: 48 44.863 2.138 0.956 0.581 0.915 0.681 CB 1.581 48 residues pruned to eliminate duplicates Z: 25 40.314 2.074 1.109 0.908 1.000 0.875 CB 1.336 25 residues pruned to eliminate duplicates Z: 25 18.254 1.887 0.796 0.484 0.917 0.708 CB 1.219 26 residues pruned to eliminate duplicates Z: 39 59.225 2.201 0.929 0.877 1.000 0.737 CB 1.643 39 residues pruned to eliminate duplicates Z: 44 57.806 2.172 0.927 0.799 1.000 0.814 CB 1.621 44 residues pruned to eliminate duplicates Z: 15 15.790 1.755 0.882 0.487 0.929 0.643 C 1.394 11 residues pruned to eliminate duplicates Z: 10 10.012 1.521 0.803 0.723 1.000 0.556 CB 0.995 10 residues pruned to eliminate duplicates Z: 12 7.871 1.797 0.706 0.279 0.727 0.545 CB 1.367 12 residues pruned to eliminate duplicates Z: 7 4.443 1.457 0.513 0.558 1.000 0.500 CB 0.777 Z: 40 51.111 2.135 0.859 0.901 0.974 0.641 CB 1.510 40 residues pruned to eliminate duplicates Z: 13 15.320 2.044 0.707 0.417 1.000 0.583 CB 1.382 13 residues pruned to eliminate duplicates Z: 17 11.678 1.727 0.354 0.518 0.938 0.562 CB 1.309 17 residues pruned to eliminate duplicates Z: 17 41.942 2.314 0.868 0.908 1.000 0.875 CB 1.723 17 residues pruned to eliminate duplicates Z: 41 38.918 2.255 0.676 0.675 0.900 0.550 CB 1.540 41 residues pruned to eliminate duplicates Z: 9 5.915 1.950 0.419 0.225 0.875 0.625 CB 1.192 9 residues pruned to eliminate duplicates Z: 47 24.614 1.769 0.685 0.590 0.913 0.630 CB 1.224 71 residues pruned to eliminate duplicates Z: 103 88.627 2.252 1.027 0.749 0.961 0.765 CB 1.601 103 residues pruned to eliminate duplicates Z: 6 3.858 1.659 0.885 0.282 0.800 0.600 CB 0.882 6 residues pruned to eliminate duplicates Z: 10 14.012 1.831 1.132 0.579 0.889 0.778 CB 1.247 10 residues pruned to eliminate duplicates Z: 6 10.534 2.137 0.134 0.802 1.000 0.800 CB 1.493 6 residues pruned to eliminate duplicates Z: 14 10.858 1.836 0.437 0.540 0.923 0.538 CB 1.189 6 residues pruned to eliminate duplicates Z: 12 27.015 2.043 1.302 0.579 1.000 0.727 CB 1.605 13 residues pruned to eliminate duplicates Z: 23 57.537 2.144 1.541 0.958 1.000 0.682 CB 1.544 25 residues pruned to eliminate duplicates Z: 8 13.962 2.182 0.177 0.870 1.000 0.714 CB 1.499 8 residues pruned to eliminate duplicates Z: 9 15.207 1.853 0.462 0.825 1.000 0.750 C 1.498 9 residues pruned to eliminate duplicates Z: 40 45.763 2.172 0.594 0.895 0.949 0.897 CB 1.598 40 residues pruned to eliminate duplicates Z: 10 17.020 1.835 0.664 0.798 1.000 0.778 C 1.431 10 residues pruned to eliminate duplicates Z: 49 38.487 2.031 0.721 0.593 0.917 0.604 CB 1.587 49 residues pruned to eliminate duplicates Z: 17 19.951 2.156 0.757 0.569 0.875 0.438 CB 1.408 17 residues pruned to eliminate duplicates Z: 25 30.799 2.191 0.408 0.882 0.917 0.792 CB 1.608 25 residues pruned to eliminate duplicates Z: 30 40.298 2.153 0.875 0.703 0.931 0.759 CB 1.655 30 residues pruned to eliminate duplicates Z: 13 11.659 1.860 0.298 0.731 0.750 0.500 CB 1.511 13 residues pruned to eliminate duplicates Z: 8 23.360 2.390 0.720 0.777 0.857 0.429 CB 1.962 8 residues pruned to eliminate duplicates Z: 22 39.145 2.133 0.750 0.910 1.000 0.810 C 1.622 22 residues pruned to eliminate duplicates Z: 14 14.621 1.763 0.491 0.823 0.923 0.615 CB 1.263 14 residues pruned to eliminate duplicates Z: 6 4.474 1.651 0.293 0.289 1.000 0.400 CA 1.187 6 residues pruned to eliminate duplicates Z: 6 6.533 1.805 0.643 0.490 1.000 1.000 CB 0.996 Z: 32 38.952 1.954 0.991 0.846 0.968 0.645 CB 1.381 32 residues pruned to eliminate duplicates Z: 16 30.468 2.006 0.696 0.909 1.000 0.800 CB 1.641 16 residues pruned to eliminate duplicates Z: 47 48.714 2.257 1.046 0.691 0.957 0.761 CB 1.365 47 residues pruned to eliminate duplicates Z: 13 15.113 1.841 0.513 0.869 0.917 0.750 CB 1.248 13 residues pruned to eliminate duplicates Z: 24 22.654 1.940 0.849 0.643 0.957 0.609 CB 1.204 25 residues pruned to eliminate duplicates Z: 22 51.794 2.320 1.195 0.940 1.000 0.952 CB 1.541 22 residues pruned to eliminate duplicates Z: 53 52.078 2.238 0.645 0.754 0.942 0.788 CB 1.660 53 residues pruned to eliminate duplicates Z: 9 15.892 1.910 0.753 0.866 1.000 0.875 CB 1.229 9 residues pruned to eliminate duplicates Z: 37 38.940 2.316 0.733 0.654 0.944 0.528 CB 1.483 37 residues pruned to eliminate duplicates Z: 14 30.040 1.904 1.172 0.902 1.000 0.846 CB 1.437 14 residues pruned to eliminate duplicates Z: 17 48.997 2.292 1.123 0.904 1.000 0.875 CB 1.794 17 residues pruned to eliminate duplicates Z: 18 51.038 2.126 1.350 0.914 1.000 0.824 CB 1.752 18 residues pruned to eliminate duplicates Z: 9 5.572 1.683 0.233 0.359 0.875 0.625 CB 1.264 7 residues pruned to eliminate duplicates Z: 8 9.869 2.296 0.223 0.460 0.857 0.857 CB 1.615 8 residues pruned to eliminate duplicates Z: 19 14.717 2.070 0.516 0.499 0.833 0.444 CB 1.328 19 residues pruned to eliminate duplicates Z: 20 52.945 2.146 1.428 0.905 1.000 0.789 CB 1.659 20 residues pruned to eliminate duplicates Z: 32 42.376 1.961 1.047 0.907 0.935 0.677 CB 1.441 32 residues pruned to eliminate duplicates Z: 17 24.795 1.976 0.635 0.860 0.938 0.625 CB 1.504 17 residues pruned to eliminate duplicates Z: 35 47.171 2.188 1.177 0.689 0.971 0.824 CB 1.472 35 residues pruned to eliminate duplicates Z: 10 11.241 1.743 0.664 0.711 0.889 0.444 CB 1.200 10 residues pruned to eliminate duplicates Z: 8 14.882 2.120 0.747 0.825 0.714 0.714 CB 1.604 8 residues pruned to eliminate duplicates Z: 35 68.458 2.191 1.246 0.930 1.000 0.588 CB 1.668 35 residues pruned to eliminate duplicates Z: 7 10.643 1.571 0.796 0.881 1.000 1.000 CB 1.115 7 residues pruned to eliminate duplicates Z: 44 54.368 2.147 1.052 0.773 0.953 0.837 CB 1.550 44 residues pruned to eliminate duplicates Z: 21 35.323 2.233 0.522 0.890 0.950 0.850 CB 1.760 21 residues pruned to eliminate duplicates Z: 17 17.042 1.916 0.687 0.624 1.000 0.750 CB 1.173 17 residues pruned to eliminate duplicates Z: 6 5.328 1.725 0.497 0.481 0.800 0.800 CB 1.176 6 residues pruned to eliminate duplicates Z: 20 35.981 2.025 1.146 0.932 0.947 0.789 CB 1.400 20 residues pruned to eliminate duplicates Z: 38 37.269 2.282 0.824 0.570 0.919 0.568 CB 1.496 38 residues pruned to eliminate duplicates Z: 10 9.613 1.722 0.393 0.736 0.889 0.667 CA 1.216 10 residues pruned to eliminate duplicates Z: 7 14.198 1.879 1.051 0.834 1.000 0.833 CB 1.128 7 residues pruned to eliminate duplicates Z: 90 86.053 2.229 1.045 0.780 0.978 0.764 CB 1.600 90 residues pruned to eliminate duplicates Z: 19 29.394 2.150 0.706 0.621 1.000 0.667 CB 1.684 19 residues pruned to eliminate duplicates Z: 28 39.803 2.231 0.607 0.772 0.926 0.704 CB 1.815 28 residues pruned to eliminate duplicates Z: 32 32.199 1.924 0.777 0.888 0.935 0.645 CB 1.302 32 residues pruned to eliminate duplicates Z: 57 82.479 2.211 1.242 0.859 0.964 0.821 CB 1.697 57 residues pruned to eliminate duplicates Z: 45 43.667 2.122 0.767 0.606 0.955 0.591 CB 1.664 45 residues pruned to eliminate duplicates Z: 23 51.924 2.257 1.361 0.930 1.000 0.864 CB 1.453 23 residues pruned to eliminate duplicates Z: 15 36.014 2.048 1.203 0.865 1.000 0.929 CB 1.563 15 residues pruned to eliminate duplicates Z: 8 8.051 1.619 0.573 0.647 0.857 0.571 CA 1.215 8 residues pruned to eliminate duplicates Z: 7 4.494 1.591 0.599 0.426 0.833 0.500 CA 0.935 7 residues pruned to eliminate duplicates Z: 13 15.407 1.734 0.330 0.900 1.000 0.667 CA 1.378 13 residues pruned to eliminate duplicates Z: 46 47.478 2.088 0.958 0.668 0.978 0.756 CB 1.516 46 residues pruned to eliminate duplicates Z: 23 22.867 1.999 0.789 0.671 0.955 0.591 CB 1.219 23 residues pruned to eliminate duplicates Z: 7 10.631 1.935 0.529 0.521 1.000 0.500 CA 1.436 8 residues pruned to eliminate duplicates Z: 25 19.879 2.037 0.554 0.430 0.958 0.625 CB 1.438 25 residues pruned to eliminate duplicates Z: 10 6.919 1.811 -0.097 0.753 1.000 0.778 CB 1.126 10 residues pruned to eliminate duplicates Z: 8 18.502 2.095 1.380 0.553 0.857 0.714 CB 1.554 8 residues pruned to eliminate duplicates Z: 16 38.220 2.158 1.200 0.699 1.000 0.733 CB 1.733 13 residues pruned to eliminate duplicates Z: 11 10.742 1.617 0.458 0.851 0.900 0.700 CB 1.186 11 residues pruned to eliminate duplicates Z: 17 28.945 2.065 0.951 0.888 0.875 0.688 CB 1.479 17 residues pruned to eliminate duplicates Z: 9 8.052 1.373 0.605 0.894 1.000 0.875 CB 0.927 9 residues pruned to eliminate duplicates Z: 25 35.171 2.150 0.884 0.615 0.958 0.667 CB 1.658 25 residues pruned to eliminate duplicates Z: 16 21.083 2.137 0.680 0.467 0.933 0.533 CB 1.681 16 residues pruned to eliminate duplicates Z: 16 14.242 1.845 0.480 0.498 0.867 0.667 CA 1.558 16 residues pruned to eliminate duplicates Z: 21 33.321 2.355 1.042 0.633 0.950 0.650 CB 1.439 21 residues pruned to eliminate duplicates Z: 9 7.485 1.708 -0.023 0.724 1.000 0.625 CA 1.296 9 residues pruned to eliminate duplicates Z: 10 7.293 1.754 0.522 0.500 0.889 0.778 CB 1.025 10 residues pruned to eliminate duplicates Z: 35 50.797 2.137 0.786 0.935 0.971 0.765 CB 1.639 35 residues pruned to eliminate duplicates Z: 11 7.031 1.812 0.802 0.302 0.800 0.500 CB 1.062 11 residues pruned to eliminate duplicates Z: 13 22.735 2.047 0.551 0.810 1.000 0.667 CB 1.578 13 residues pruned to eliminate duplicates Z: 12 20.596 1.972 0.786 0.937 0.909 0.909 CB 1.349 12 residues pruned to eliminate duplicates Z: 16 30.861 2.135 1.388 0.732 0.933 0.867 CB 1.359 16 residues pruned to eliminate duplicates Z: 34 47.846 2.269 0.903 0.691 0.939 0.758 CB 1.723 40 residues pruned to eliminate duplicates Z: 12 10.468 1.468 0.777 0.869 0.909 0.727 CB 0.972 12 residues pruned to eliminate duplicates Z: 6 5.759 1.852 0.612 0.455 1.000 0.600 CB 0.903 6 residues pruned to eliminate duplicates Z: 10 12.204 1.731 0.594 0.690 1.000 0.667 CB 1.239 10 residues pruned to eliminate duplicates Z: 8 5.208 1.771 0.285 0.335 1.000 0.714 CB 1.036 8 residues pruned to eliminate duplicates Z: 17 48.534 2.270 1.335 0.897 0.938 0.812 C 1.748 17 residues pruned to eliminate duplicates Z: 9 8.180 1.565 0.515 0.845 1.000 0.750 CB 0.907 9 residues pruned to eliminate duplicates Z: 15 12.204 1.967 0.482 0.386 0.857 0.571 CB 1.473 14 residues pruned to eliminate duplicates Z: 10 15.314 2.044 0.834 0.539 0.889 0.556 CB 1.474 10 residues pruned to eliminate duplicates Z: 68 64.986 2.226 0.668 0.822 0.985 0.851 CB 1.642 68 residues pruned to eliminate duplicates Z: 8 5.111 2.048 0.031 0.315 0.714 0.286 CA 1.572 8 residues pruned to eliminate duplicates Z: 22 57.840 2.192 1.603 0.959 0.952 0.714 CB 1.592 22 residues pruned to eliminate duplicates Z: 8 6.934 1.636 0.794 0.468 0.857 0.571 CB 1.076 Z: 92 84.352 2.227 1.077 0.773 0.956 0.758 CB 1.571 92 residues pruned to eliminate duplicates Z: 33 42.250 2.046 1.165 0.719 0.969 0.625 CB 1.428 33 residues pruned to eliminate duplicates Z: 8 6.311 1.461 0.493 0.870 1.000 0.857 CB 0.798 8 residues pruned to eliminate duplicates Z: 7 4.809 1.443 0.076 0.657 1.000 0.833 CB 1.092 Z: 12 14.739 1.804 0.534 0.676 0.909 0.636 C 1.503 12 residues pruned to eliminate duplicates Z: 7 10.561 1.997 0.182 0.663 1.000 0.500 CB 1.571 7 residues pruned to eliminate duplicates Z: 28 33.895 2.243 0.947 0.518 0.963 0.667 CB 1.524 28 residues pruned to eliminate duplicates Z: 51 74.563 2.214 1.216 0.845 1.000 0.740 CB 1.598 51 residues pruned to eliminate duplicates Z: 22 11.532 2.057 0.395 0.402 0.714 0.476 CB 1.361 22 residues pruned to eliminate duplicates Z: 13 25.982 2.045 0.946 0.669 1.000 0.667 CB 1.613 13 residues pruned to eliminate duplicates Z: 6 7.233 1.449 1.094 0.810 0.800 0.600 C 1.017 6 residues pruned to eliminate duplicates Z: 18 18.054 1.876 0.755 0.625 0.882 0.765 CB 1.340 18 residues pruned to eliminate duplicates Z: 17 40.868 2.302 1.241 0.726 1.000 0.938 CB 1.615 14 residues pruned to eliminate duplicates Z: 92 47.953 2.088 0.836 0.512 0.912 0.681 CB 1.421 92 residues pruned to eliminate duplicates Z: 11 9.880 1.542 0.439 0.920 1.000 1.000 CB 0.992 11 residues pruned to eliminate duplicates Z: 18 49.029 2.213 1.061 0.958 1.000 0.706 CB 1.789 18 residues pruned to eliminate duplicates Z: 35 37.024 2.008 0.913 0.630 0.941 0.706 CB 1.554 35 residues pruned to eliminate duplicates Z: 7 13.475 2.088 0.890 0.622 0.833 0.333 C 1.490 7 residues pruned to eliminate duplicates Z: 14 20.226 2.217 0.643 0.459 0.923 0.615 CB 1.740 14 residues pruned to eliminate duplicates Z: 82 72.675 2.199 0.974 0.732 0.975 0.753 CB 1.548 82 residues pruned to eliminate duplicates Z: 53 27.693 1.910 0.497 0.520 0.942 0.596 CB 1.398 53 residues pruned to eliminate duplicates Z: 11 17.394 1.938 0.868 0.553 1.000 0.700 CB 1.443 11 residues pruned to eliminate duplicates Z: 48 46.331 2.216 1.042 0.679 0.915 0.723 CB 1.385 48 residues pruned to eliminate duplicates Z: 39 52.854 2.209 0.695 0.894 0.974 0.816 CB 1.687 39 residues pruned to eliminate duplicates Z: 9 6.499 1.811 0.446 0.321 0.875 0.500 CB 1.221 6 residues pruned to eliminate duplicates Z: 54 71.309 2.260 1.145 0.805 1.000 0.736 CB 1.548 54 residues pruned to eliminate duplicates Z: 21 46.638 2.175 1.170 0.829 0.950 0.750 CB 1.751 21 residues pruned to eliminate duplicates Z: 26 32.113 2.250 0.679 0.706 0.960 0.680 CB 1.468 26 residues pruned to eliminate duplicates Z: 23 47.975 2.165 1.121 0.938 1.000 0.818 CB 1.549 23 residues pruned to eliminate duplicates Z: 12 15.175 2.121 0.680 0.435 0.909 0.545 CB 1.510 12 residues pruned to eliminate duplicates Z: 17 13.028 1.916 0.555 0.417 0.875 0.500 CB 1.363 22 residues pruned to eliminate duplicates Z: 24 18.045 2.000 0.583 0.432 0.870 0.565 CB 1.466 24 residues pruned to eliminate duplicates Z: 46 40.088 2.003 0.957 0.597 0.911 0.711 CB 1.525 46 residues pruned to eliminate duplicates Z: 9 12.619 1.858 1.119 0.482 0.875 0.625 CB 1.319 9 residues pruned to eliminate duplicates Z: 13 19.418 1.879 0.697 0.701 1.000 0.833 CB 1.464 13 residues pruned to eliminate duplicates Z: 14 17.096 2.163 0.635 0.441 0.923 0.538 CB 1.543 14 residues pruned to eliminate duplicates Z: 19 26.418 2.140 0.784 0.612 1.000 0.722 CB 1.467 19 residues pruned to eliminate duplicates Z: 24 29.939 2.101 0.940 0.646 0.957 0.609 CB 1.397 24 residues pruned to eliminate duplicates Z: 21 30.966 2.070 0.567 0.846 0.950 0.850 CA 1.669 21 residues pruned to eliminate duplicates Z: 7 12.258 1.522 1.058 0.895 1.000 1.000 CA 1.145 7 residues pruned to eliminate duplicates Z: 9 6.859 1.616 0.948 0.408 0.750 0.750 C 1.131 9 residues pruned to eliminate duplicates Z: 8 3.675 1.548 0.166 0.333 0.714 0.429 N 1.292 8 residues pruned to eliminate duplicates Z: 13 33.028 2.137 0.980 0.925 1.000 0.750 CB 1.581 13 residues pruned to eliminate duplicates Z: 104 96.330 2.270 1.132 0.746 0.981 0.816 CB 1.605 104 residues pruned to eliminate duplicates Z: 89 96.338 2.307 1.152 0.800 0.977 0.795 CB 1.629 89 residues pruned to eliminate duplicates Z: 39 50.509 2.186 0.658 0.859 1.000 0.684 CB 1.664 39 residues pruned to eliminate duplicates Z: 17 34.925 2.322 0.974 0.585 1.000 0.688 CB 1.756 17 residues pruned to eliminate duplicates Z: 25 49.346 2.073 1.340 0.932 1.000 0.875 CB 1.450 25 residues pruned to eliminate duplicates Z: 17 25.447 2.039 0.560 0.882 0.875 0.625 C 1.653 17 residues pruned to eliminate duplicates 675 residues left after pruning, divided into chains as follows: A: 42 B: 24 C: 37 D: 32 E: 255 F: 59 G: 8 H: 152 I: 6 J: 60 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.78 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.365, Connect. = 0.729 for dens.mod. cycle 1 = 0.300, Contrast = 0.423, Connect. = 0.756 for dens.mod. cycle 2 = 0.300, Contrast = 0.502, Connect. = 0.785 for dens.mod. cycle 3 = 0.300, Contrast = 0.511, Connect. = 0.787 for dens.mod. cycle 4 = 0.300, Contrast = 0.523, Connect. = 0.790 for dens.mod. cycle 5 = 0.300, Contrast = 0.530, Connect. = 0.792 for dens.mod. cycle 6 = 0.300, Contrast = 0.538, Connect. = 0.793 for dens.mod. cycle 7 = 0.300, Contrast = 0.544, Connect. = 0.794 for dens.mod. cycle 8 = 0.300, Contrast = 0.549, Connect. = 0.794 for dens.mod. cycle 9 = 0.300, Contrast = 0.553, Connect. = 0.795 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5283 peaks > 0.5 sigma used to seed fragment search Space for about 755 unique residues taking solvent into account 1018 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 12 27.880 2.329 0.659 0.862 1.000 0.727 CB 1.598 B: 18 38.782 2.416 0.462 0.870 1.000 0.706 CA 1.944 12 residues pruned to eliminate duplicates C: 19 42.107 2.396 0.572 0.873 1.000 0.778 CA 1.918 18 residues pruned to eliminate duplicates D: 20 41.180 2.304 0.752 0.894 1.000 0.789 CB 1.679 E: 19 36.529 2.271 0.788 0.856 0.889 0.833 CA 1.760 F: 18 32.709 2.379 0.757 0.840 0.765 0.647 C 1.853 18 residues pruned to eliminate duplicates G: 14 22.087 2.135 0.446 0.850 0.846 0.846 C 1.738 H: 20 41.094 2.297 0.804 0.904 1.000 0.789 CB 1.621 20 residues pruned to eliminate duplicates I: 24 47.475 2.184 0.933 0.931 0.957 0.826 CB 1.713 J: 13 19.626 2.251 0.269 0.849 0.833 0.833 CB 1.764 14 residues pruned to eliminate duplicates K: 18 38.193 2.283 0.756 0.919 0.941 0.765 CB 1.730 18 residues pruned to eliminate duplicates L: 19 38.426 2.333 0.624 0.884 0.944 0.611 CB 1.829 13 residues pruned to eliminate duplicates M: 37 44.501 2.177 0.898 0.670 0.944 0.694 CB 1.625 N: 12 34.028 2.374 0.752 0.883 1.000 0.727 C 1.783 12 residues pruned to eliminate duplicates O: 24 42.218 2.397 0.448 0.857 0.957 0.870 CB 1.954 P: 20 37.905 2.316 0.714 0.902 0.947 0.737 CB 1.650 Q: 19 42.567 2.373 0.856 0.867 0.944 0.722 CB 1.764 20 residues pruned to eliminate duplicates R: 22 53.905 2.288 1.070 0.955 1.000 0.857 CB 1.707 24 residues pruned to eliminate duplicates S: 18 34.559 2.353 0.680 0.834 0.882 0.647 CB 1.801 18 residues pruned to eliminate duplicates T: 19 38.095 2.395 0.465 0.869 1.000 0.778 CB 1.869 19 residues pruned to eliminate duplicates U: 25 37.345 2.365 0.393 0.856 0.917 0.750 CB 1.862 25 residues pruned to eliminate duplicates V: 30 48.322 2.086 0.901 0.907 1.000 0.759 CB 1.608 W: 19 41.426 2.287 0.740 0.880 0.944 0.556 CB 1.883 19 residues pruned to eliminate duplicates X: 20 44.126 2.219 0.860 0.925 1.000 0.895 CB 1.721 19 residues pruned to eliminate duplicates Y: 18 40.115 2.413 0.579 0.900 0.941 0.824 CA 1.938 18 residues pruned to eliminate duplicates Z: 20 51.617 2.323 1.084 0.844 0.947 0.684 C 1.921 20 residues pruned to eliminate duplicates Z: 96 94.264 2.327 0.960 0.749 0.968 0.726 CB 1.753 20 residues pruned to eliminate duplicates Z: 23 49.038 2.313 1.103 0.938 1.000 0.864 CB 1.495 27 residues pruned to eliminate duplicates Z: 18 31.602 2.248 0.583 0.864 0.882 0.765 CB 1.789 18 residues pruned to eliminate duplicates Z: 18 42.002 2.302 0.855 0.877 0.941 0.647 CB 1.842 18 residues pruned to eliminate duplicates Z: 25 44.467 2.144 0.900 0.907 1.000 0.833 CB 1.584 25 residues pruned to eliminate duplicates Z: 37 47.543 2.172 1.014 0.671 0.944 0.667 CB 1.638 37 residues pruned to eliminate duplicates Z: 40 61.980 2.269 0.786 0.913 0.949 0.692 C 1.828 40 residues pruned to eliminate duplicates Z: 53 66.649 2.385 0.964 0.636 0.962 0.635 CB 1.806 19 residues pruned to eliminate duplicates Z: 9 19.661 2.122 0.695 0.824 0.875 0.500 C 1.668 11 residues pruned to eliminate duplicates Z: 21 39.595 2.274 0.775 0.909 0.950 0.800 CB 1.639 21 residues pruned to eliminate duplicates Z: 15 37.086 2.012 1.117 0.914 1.000 1.000 C 1.646 Z: 11 23.490 2.288 0.381 0.865 0.900 0.800 C 1.914 11 residues pruned to eliminate duplicates Z: 20 40.446 2.268 0.717 0.887 1.000 0.789 CB 1.718 20 residues pruned to eliminate duplicates Z: 35 60.228 2.236 0.900 0.928 0.971 0.882 CB 1.755 Z: 22 51.500 2.306 0.951 0.953 1.000 0.952 CB 1.718 22 residues pruned to eliminate duplicates Z: 38 48.356 2.268 0.423 0.916 1.000 0.919 CB 1.739 34 residues pruned to eliminate duplicates Z: 33 54.462 2.347 0.518 0.937 1.000 0.906 CB 1.880 33 residues pruned to eliminate duplicates Z: 18 46.832 2.470 0.665 0.862 1.000 0.824 CB 2.028 19 residues pruned to eliminate duplicates Z: 18 45.300 2.349 0.921 0.915 1.000 0.824 CB 1.721 19 residues pruned to eliminate duplicates Z: 31 41.140 2.046 0.850 0.880 0.900 0.733 CB 1.597 31 residues pruned to eliminate duplicates Z: 19 43.524 2.289 1.024 0.847 0.889 0.556 C 1.849 19 residues pruned to eliminate duplicates Z: 22 43.836 2.251 0.819 0.949 1.000 0.952 CB 1.613 22 residues pruned to eliminate duplicates Z: 38 56.867 2.321 1.004 0.662 1.000 0.703 CB 1.730 38 residues pruned to eliminate duplicates Z: 19 35.674 2.182 0.895 0.846 0.889 0.611 CB 1.700 19 residues pruned to eliminate duplicates Z: 10 34.604 2.526 0.678 0.908 1.000 0.889 C 1.933 10 residues pruned to eliminate duplicates Z: 22 44.445 2.367 0.758 0.935 1.000 0.952 CB 1.624 22 residues pruned to eliminate duplicates Z: 30 39.738 2.280 0.608 0.707 0.862 0.690 C 1.934 20 residues pruned to eliminate duplicates Z: 11 37.467 2.657 0.483 0.890 1.000 0.900 C 2.164 11 residues pruned to eliminate duplicates Z: 18 40.443 2.261 0.832 0.881 0.941 0.706 CB 1.822 18 residues pruned to eliminate duplicates Z: 22 39.567 2.241 0.566 0.879 0.952 0.762 CB 1.874 22 residues pruned to eliminate duplicates Z: 19 35.841 2.310 0.462 0.863 1.000 0.722 CB 1.836 18 residues pruned to eliminate duplicates Z: 20 37.416 2.269 0.915 0.874 0.895 0.632 CB 1.606 20 residues pruned to eliminate duplicates Z: 29 30.922 2.209 0.546 0.603 0.893 0.607 CB 1.738 29 residues pruned to eliminate duplicates Z: 25 53.565 2.142 1.157 0.948 0.958 0.792 CB 1.706 22 residues pruned to eliminate duplicates Z: 15 16.093 1.941 0.357 0.730 0.857 0.500 CB 1.549 15 residues pruned to eliminate duplicates Z: 20 36.364 2.230 0.603 0.907 0.947 0.895 CB 1.751 20 residues pruned to eliminate duplicates Z: 6 12.838 2.252 0.099 0.876 1.000 0.800 CB 1.686 6 residues pruned to eliminate duplicates Z: 31 40.746 2.054 0.742 0.896 0.933 0.800 CB 1.596 31 residues pruned to eliminate duplicates Z: 18 24.027 2.100 0.248 0.881 0.941 0.765 CB 1.710 18 residues pruned to eliminate duplicates Z: 31 40.358 2.024 0.743 0.871 0.967 0.733 CB 1.576 31 residues pruned to eliminate duplicates Z: 79 90.193 2.365 1.020 0.771 0.962 0.769 CB 1.749 76 residues pruned to eliminate duplicates Z: 9 18.167 1.953 0.493 0.875 1.000 0.875 CA 1.603 Z: 108 97.062 2.337 0.980 0.745 0.953 0.692 CB 1.708 95 residues pruned to eliminate duplicates Z: 38 61.686 2.317 0.742 0.921 0.973 0.784 CB 1.817 38 residues pruned to eliminate duplicates Z: 14 33.645 2.246 0.851 0.936 1.000 0.846 C 1.563 14 residues pruned to eliminate duplicates Z: 19 45.887 2.401 0.690 0.886 1.000 0.722 CB 1.923 19 residues pruned to eliminate duplicates Z: 20 38.631 2.291 0.855 0.880 0.947 0.632 CB 1.595 20 residues pruned to eliminate duplicates Z: 19 46.742 2.407 0.769 0.880 1.000 0.778 CB 1.875 19 residues pruned to eliminate duplicates Z: 15 35.621 2.220 0.833 0.921 0.929 0.786 CB 1.773 15 residues pruned to eliminate duplicates Z: 24 48.615 2.185 1.017 0.898 0.957 0.913 CB 1.721 24 residues pruned to eliminate duplicates Z: 102 74.484 2.236 0.864 0.578 0.960 0.713 CB 1.718 44 residues pruned to eliminate duplicates Z: 45 52.164 2.279 0.712 0.646 0.955 0.727 CB 1.842 42 residues pruned to eliminate duplicates Z: 7 10.339 1.966 0.284 0.891 1.000 0.833 CB 1.201 6 residues pruned to eliminate duplicates Z: 22 46.456 2.276 0.870 0.951 1.000 0.952 CB 1.642 22 residues pruned to eliminate duplicates Z: 39 58.966 2.255 0.708 0.909 0.974 0.658 CB 1.810 39 residues pruned to eliminate duplicates Z: 40 64.564 2.286 0.860 0.876 0.974 0.744 C 1.814 40 residues pruned to eliminate duplicates Z: 19 39.834 2.330 0.593 0.865 1.000 0.722 C 1.853 19 residues pruned to eliminate duplicates Z: 41 55.744 2.178 1.052 0.674 0.975 0.675 CB 1.723 37 residues pruned to eliminate duplicates Z: 20 33.162 2.222 0.693 0.869 0.895 0.789 CB 1.652 20 residues pruned to eliminate duplicates Z: 39 51.626 2.315 0.410 0.865 1.000 0.868 CB 1.880 38 residues pruned to eliminate duplicates Z: 8 9.583 1.970 0.256 0.787 0.857 0.571 CB 1.327 8 residues pruned to eliminate duplicates Z: 54 51.124 2.175 0.772 0.620 0.962 0.660 CB 1.691 52 residues pruned to eliminate duplicates Z: 10 23.346 2.287 0.413 0.902 1.000 0.889 CA 1.717 10 residues pruned to eliminate duplicates Z: 103 68.295 2.226 0.826 0.581 0.951 0.686 CB 1.618 106 residues pruned to eliminate duplicates Z: 13 18.101 2.101 0.137 0.908 0.917 0.917 CB 1.695 13 residues pruned to eliminate duplicates Z: 18 37.556 2.233 0.772 0.851 0.941 0.647 CA 1.809 18 residues pruned to eliminate duplicates Z: 15 35.415 1.995 1.036 0.925 1.000 1.000 CA 1.635 15 residues pruned to eliminate duplicates Z: 20 41.026 2.157 0.903 0.900 1.000 0.737 CB 1.638 Z: 15 30.292 1.949 0.815 0.908 1.000 0.929 CB 1.625 15 residues pruned to eliminate duplicates Z: 17 30.376 2.251 0.605 0.865 0.875 0.812 CB 1.760 17 residues pruned to eliminate duplicates Z: 18 34.790 2.315 0.501 0.917 1.000 0.882 CB 1.713 18 residues pruned to eliminate duplicates Z: 24 37.136 2.373 0.330 0.857 0.957 0.783 CB 1.892 24 residues pruned to eliminate duplicates Z: 39 58.812 2.334 0.542 0.890 1.000 0.816 CA 1.907 40 residues pruned to eliminate duplicates Z: 19 39.952 2.393 0.725 0.915 0.944 0.889 CB 1.708 21 residues pruned to eliminate duplicates Z: 36 59.551 2.263 0.767 0.908 0.971 0.743 CB 1.841 36 residues pruned to eliminate duplicates Z: 25 48.923 2.134 1.034 0.937 0.958 0.833 CB 1.671 25 residues pruned to eliminate duplicates Z: 24 52.834 2.290 1.193 0.934 0.957 0.913 CB 1.600 24 residues pruned to eliminate duplicates Z: 20 34.151 2.170 0.590 0.916 0.947 0.842 CB 1.693 20 residues pruned to eliminate duplicates Z: 24 49.562 2.256 1.051 0.945 0.957 0.870 CB 1.616 24 residues pruned to eliminate duplicates Z: 7 15.598 2.251 0.162 0.884 1.000 1.000 CA 1.759 7 residues pruned to eliminate duplicates Z: 23 47.123 2.316 0.950 0.928 1.000 0.864 CB 1.559 23 residues pruned to eliminate duplicates Z: 7 22.324 2.414 0.552 0.877 1.000 0.833 CB 1.767 7 residues pruned to eliminate duplicates Z: 39 65.560 2.297 0.899 0.905 0.947 0.684 CB 1.833 39 residues pruned to eliminate duplicates Z: 39 53.094 2.328 0.425 0.883 1.000 0.842 CB 1.877 39 residues pruned to eliminate duplicates Z: 8 12.911 2.042 0.234 0.845 1.000 0.571 C 1.439 8 residues pruned to eliminate duplicates Z: 18 38.881 2.339 0.843 0.823 0.941 0.647 CB 1.757 18 residues pruned to eliminate duplicates Z: 7 14.462 2.187 0.302 0.760 1.000 0.500 CB 1.645 7 residues pruned to eliminate duplicates Z: 26 39.082 2.297 0.555 0.873 0.880 0.760 CA 1.810 Z: 70 79.901 2.322 0.841 0.764 0.971 0.710 CB 1.833 70 residues pruned to eliminate duplicates Z: 25 45.417 2.277 0.634 0.875 1.000 0.875 CB 1.812 26 residues pruned to eliminate duplicates Z: 21 38.850 2.190 1.013 0.886 0.900 0.700 CB 1.580 21 residues pruned to eliminate duplicates Z: 7 9.249 1.785 0.562 0.857 0.833 0.667 C 1.197 7 residues pruned to eliminate duplicates Z: 36 60.997 2.339 1.156 0.617 1.000 0.657 CB 1.830 36 residues pruned to eliminate duplicates Z: 8 20.655 2.084 0.613 0.886 1.000 0.857 CA 1.677 9 residues pruned to eliminate duplicates Z: 55 53.127 2.200 0.854 0.637 0.926 0.741 CB 1.684 55 residues pruned to eliminate duplicates Z: 39 59.558 2.350 0.575 0.884 1.000 0.921 CB 1.887 39 residues pruned to eliminate duplicates Z: 35 74.271 2.242 1.261 0.937 1.000 0.794 C 1.749 35 residues pruned to eliminate duplicates Z: 12 26.243 2.239 0.589 0.884 0.909 0.909 CB 1.767 12 residues pruned to eliminate duplicates Z: 7 18.496 2.220 0.444 0.818 1.000 0.833 CA 1.787 7 residues pruned to eliminate duplicates Z: 28 30.804 2.229 0.569 0.640 0.852 0.741 CB 1.745 22 residues pruned to eliminate duplicates Z: 24 43.266 2.270 0.851 0.930 0.913 0.826 CB 1.645 24 residues pruned to eliminate duplicates Z: 20 39.162 2.250 0.744 0.892 0.947 0.737 C 1.736 20 residues pruned to eliminate duplicates Z: 40 64.797 2.287 0.799 0.902 0.974 0.692 CB 1.846 40 residues pruned to eliminate duplicates Z: 25 44.820 2.109 0.753 0.945 1.000 0.917 CB 1.712 25 residues pruned to eliminate duplicates Z: 40 61.445 2.314 0.678 0.868 1.000 0.667 CA 1.852 40 residues pruned to eliminate duplicates Z: 14 40.068 2.069 1.242 0.928 1.000 1.000 CA 1.678 14 residues pruned to eliminate duplicates Z: 25 40.488 2.257 0.558 0.880 0.958 0.750 CB 1.778 26 residues pruned to eliminate duplicates Z: 25 41.280 2.308 0.506 0.854 0.958 0.750 CA 1.868 25 residues pruned to eliminate duplicates Z: 40 59.682 2.256 0.801 0.868 0.949 0.641 CB 1.812 40 residues pruned to eliminate duplicates Z: 33 64.649 2.306 0.862 0.936 1.000 0.812 CB 1.853 33 residues pruned to eliminate duplicates Z: 19 37.142 2.262 0.584 0.920 0.944 0.889 CA 1.822 18 residues pruned to eliminate duplicates Z: 11 33.382 2.340 0.889 0.864 1.000 0.800 C 1.751 11 residues pruned to eliminate duplicates Z: 17 39.486 2.267 0.855 0.840 0.938 0.562 CA 1.869 17 residues pruned to eliminate duplicates Z: 10 17.301 2.002 0.447 0.847 1.000 0.667 CB 1.478 10 residues pruned to eliminate duplicates Z: 23 57.336 2.283 1.356 0.950 0.955 0.773 CB 1.642 23 residues pruned to eliminate duplicates Z: 22 49.647 2.257 0.995 0.936 1.000 0.905 CB 1.675 22 residues pruned to eliminate duplicates Z: 22 50.825 2.401 0.968 0.950 1.000 0.905 CB 1.619 22 residues pruned to eliminate duplicates Z: 24 33.981 2.329 0.267 0.873 0.957 0.739 CB 1.828 24 residues pruned to eliminate duplicates Z: 95 93.194 2.344 0.925 0.780 0.947 0.777 CB 1.757 83 residues pruned to eliminate duplicates Z: 17 29.934 2.260 0.463 0.905 0.875 0.750 CA 1.841 17 residues pruned to eliminate duplicates Z: 16 39.112 2.316 1.136 0.916 1.000 0.800 CB 1.441 16 residues pruned to eliminate duplicates Z: 20 39.162 2.250 0.661 0.837 1.000 0.789 CA 1.797 20 residues pruned to eliminate duplicates Z: 9 15.721 1.861 0.561 0.824 1.000 0.500 CB 1.445 9 residues pruned to eliminate duplicates Z: 34 67.633 2.323 0.888 0.938 1.000 0.667 CB 1.867 34 residues pruned to eliminate duplicates Z: 34 53.619 2.275 0.593 0.924 1.000 0.939 CB 1.809 34 residues pruned to eliminate duplicates Z: 11 29.645 2.383 0.555 0.920 1.000 0.800 C 1.782 11 residues pruned to eliminate duplicates Z: 16 36.190 1.950 1.107 0.907 1.000 0.867 CA 1.617 16 residues pruned to eliminate duplicates Z: 18 44.410 2.384 0.786 0.885 1.000 0.882 CA 1.827 18 residues pruned to eliminate duplicates Z: 10 18.099 2.147 0.272 0.874 1.000 0.889 CA 1.607 10 residues pruned to eliminate duplicates Z: 18 44.121 2.386 0.812 0.910 0.941 0.824 C 1.866 18 residues pruned to eliminate duplicates Z: 40 46.101 2.303 0.290 0.878 0.974 0.846 CB 1.851 40 residues pruned to eliminate duplicates Z: 19 35.192 2.381 0.512 0.903 0.944 0.889 CB 1.738 17 residues pruned to eliminate duplicates Z: 37 52.988 2.338 1.035 0.619 0.917 0.611 CB 1.810 37 residues pruned to eliminate duplicates Z: 19 43.868 2.185 0.944 0.877 1.000 0.667 CA 1.768 19 residues pruned to eliminate duplicates Z: 21 47.806 2.211 0.978 0.887 1.000 0.700 CB 1.763 21 residues pruned to eliminate duplicates Z: 41 46.872 2.255 0.314 0.877 0.975 0.875 CB 1.862 41 residues pruned to eliminate duplicates Z: 34 59.523 2.245 0.763 0.932 1.000 0.909 CA 1.829 34 residues pruned to eliminate duplicates Z: 18 43.069 2.258 0.901 0.897 1.000 0.765 CB 1.742 18 residues pruned to eliminate duplicates Z: 23 50.567 2.201 1.011 0.939 1.000 0.955 CB 1.692 23 residues pruned to eliminate duplicates Z: 40 63.353 2.306 0.680 0.892 1.000 0.846 CA 1.881 40 residues pruned to eliminate duplicates Z: 11 34.193 2.544 0.939 0.884 0.800 0.700 C 1.980 11 residues pruned to eliminate duplicates Z: 18 42.993 2.376 0.746 0.890 0.941 0.765 CA 1.921 18 residues pruned to eliminate duplicates Z: 23 42.050 2.303 0.833 0.926 1.000 0.818 CB 1.489 23 residues pruned to eliminate duplicates Z: 19 39.112 2.339 0.537 0.901 0.944 0.889 C 1.938 20 residues pruned to eliminate duplicates Z: 20 44.739 2.383 0.711 0.876 0.947 0.684 CA 1.931 20 residues pruned to eliminate duplicates Z: 48 53.994 2.244 1.029 0.595 0.936 0.574 CB 1.687 48 residues pruned to eliminate duplicates Z: 19 40.834 2.366 0.593 0.847 1.000 0.833 C 1.895 19 residues pruned to eliminate duplicates Z: 26 42.309 2.256 0.638 0.852 0.960 0.840 CB 1.763 25 residues pruned to eliminate duplicates Z: 9 16.777 2.038 0.636 0.877 0.875 0.875 CB 1.476 9 residues pruned to eliminate duplicates Z: 21 35.615 2.213 0.700 0.882 0.950 0.800 CB 1.612 20 residues pruned to eliminate duplicates Z: 35 66.628 2.269 0.921 0.938 1.000 0.765 CB 1.823 35 residues pruned to eliminate duplicates Z: 22 52.068 2.295 0.986 0.955 1.000 0.905 CB 1.713 22 residues pruned to eliminate duplicates Z: 77 47.210 2.105 0.821 0.494 0.908 0.618 CB 1.566 77 residues pruned to eliminate duplicates Z: 14 37.975 2.070 1.061 0.944 1.000 1.000 CB 1.710 14 residues pruned to eliminate duplicates Z: 24 35.605 2.230 0.797 0.879 0.913 0.870 CB 1.471 24 residues pruned to eliminate duplicates Z: 31 42.090 2.048 0.757 0.878 1.000 0.633 CB 1.551 31 residues pruned to eliminate duplicates Z: 6 15.260 2.264 0.555 0.866 1.000 0.800 CB 1.419 5 residues pruned to eliminate duplicates Z: 38 67.286 2.343 0.784 0.899 1.000 0.676 CB 1.892 38 residues pruned to eliminate duplicates Z: 26 42.087 2.274 0.507 0.894 0.960 0.800 CB 1.835 25 residues pruned to eliminate duplicates Z: 19 35.875 2.223 0.883 0.872 0.889 0.722 CB 1.656 19 residues pruned to eliminate duplicates Z: 19 44.535 2.413 1.046 0.871 0.889 0.778 CB 1.745 20 residues pruned to eliminate duplicates Z: 24 46.950 2.401 0.680 0.846 0.913 0.870 CB 1.975 26 residues pruned to eliminate duplicates Z: 40 64.186 2.331 0.702 0.856 1.000 0.769 CB 1.911 40 residues pruned to eliminate duplicates Z: 54 63.533 2.308 0.892 0.629 0.981 0.642 CB 1.804 52 residues pruned to eliminate duplicates Z: 31 42.015 2.075 0.635 0.904 0.967 0.867 CB 1.666 20 residues pruned to eliminate duplicates Z: 35 62.406 2.319 0.821 0.922 0.971 0.735 C 1.836 35 residues pruned to eliminate duplicates Z: 18 43.451 2.400 0.690 0.863 1.000 0.706 C 1.906 18 residues pruned to eliminate duplicates Z: 13 33.785 2.141 1.147 0.740 1.000 0.583 C 1.711 8 residues pruned to eliminate duplicates Z: 40 69.132 2.308 0.855 0.881 1.000 0.821 CA 1.873 40 residues pruned to eliminate duplicates Z: 87 84.794 2.318 0.962 0.737 0.953 0.721 CB 1.705 87 residues pruned to eliminate duplicates Z: 14 38.634 2.243 0.939 0.870 1.000 0.769 C 1.797 14 residues pruned to eliminate duplicates Z: 7 18.239 2.359 0.502 0.863 0.833 0.333 C 1.849 7 residues pruned to eliminate duplicates Z: 7 19.471 2.239 0.581 0.825 1.000 0.667 CA 1.695 7 residues pruned to eliminate duplicates Z: 53 61.655 2.284 0.754 0.752 0.981 0.808 CB 1.737 53 residues pruned to eliminate duplicates Z: 20 31.184 2.304 0.572 0.873 0.947 0.789 CB 1.519 20 residues pruned to eliminate duplicates Z: 24 41.645 2.359 0.461 0.868 0.957 0.870 CB 1.926 24 residues pruned to eliminate duplicates Z: 21 50.365 2.256 1.115 0.945 1.000 0.850 CB 1.634 21 residues pruned to eliminate duplicates Z: 19 43.349 2.262 0.813 0.944 1.000 0.833 CB 1.725 19 residues pruned to eliminate duplicates Z: 7 11.497 1.972 0.688 0.819 0.833 0.833 CB 1.282 7 residues pruned to eliminate duplicates Z: 43 59.403 2.326 0.979 0.654 0.929 0.643 CB 1.858 43 residues pruned to eliminate duplicates Z: 6 5.323 1.663 0.433 0.807 1.000 0.600 CB 0.764 6 residues pruned to eliminate duplicates Z: 29 26.571 2.040 0.758 0.422 0.929 0.571 CB 1.634 29 residues pruned to eliminate duplicates Z: 35 53.994 2.315 0.604 0.929 0.971 0.882 CB 1.798 35 residues pruned to eliminate duplicates Z: 31 42.572 2.039 0.784 0.871 1.000 0.633 CB 1.558 31 residues pruned to eliminate duplicates Z: 40 62.152 2.294 0.723 0.891 0.974 0.795 CB 1.857 40 residues pruned to eliminate duplicates Z: 14 39.652 2.065 1.211 0.920 1.000 0.846 CA 1.696 14 residues pruned to eliminate duplicates Z: 21 35.639 2.134 0.780 0.862 0.950 0.650 CB 1.621 21 residues pruned to eliminate duplicates Z: 7 9.511 2.085 0.361 0.367 1.000 0.333 CA 1.578 Z: 20 30.494 2.136 0.527 0.921 0.947 0.895 CB 1.594 20 residues pruned to eliminate duplicates Z: 23 55.252 2.198 1.305 0.947 0.955 0.636 CB 1.683 23 residues pruned to eliminate duplicates Z: 20 43.428 2.304 0.923 0.889 1.000 0.842 CB 1.619 20 residues pruned to eliminate duplicates Z: 32 45.653 2.337 0.266 0.943 1.000 0.968 CB 1.921 32 residues pruned to eliminate duplicates Z: 16 25.899 2.152 0.927 0.632 0.933 0.800 CB 1.527 16 residues pruned to eliminate duplicates Z: 22 49.884 2.256 0.985 0.951 1.000 0.952 CB 1.676 22 residues pruned to eliminate duplicates Z: 25 40.288 2.301 0.507 0.841 0.958 0.750 CA 1.846 25 residues pruned to eliminate duplicates Z: 34 52.336 2.267 0.615 0.935 1.000 0.848 CB 1.734 34 residues pruned to eliminate duplicates Z: 20 37.478 2.213 0.743 0.864 0.947 0.632 C 1.724 20 residues pruned to eliminate duplicates Z: 31 36.879 2.088 0.584 0.874 0.967 0.700 CB 1.532 31 residues pruned to eliminate duplicates Z: 19 45.549 2.285 0.891 0.941 1.000 0.833 CB 1.724 19 residues pruned to eliminate duplicates Z: 25 44.158 2.261 0.653 0.875 0.958 0.708 C 1.831 26 residues pruned to eliminate duplicates Z: 33 62.708 2.326 0.777 0.945 1.000 0.781 C 1.856 33 residues pruned to eliminate duplicates Z: 9 15.849 2.175 0.345 0.808 0.875 0.750 CB 1.673 9 residues pruned to eliminate duplicates Z: 21 35.625 2.094 0.874 0.859 0.900 0.700 CB 1.659 21 residues pruned to eliminate duplicates Z: 140 78.020 2.214 0.674 0.610 0.935 0.734 CB 1.721 169 residues pruned to eliminate duplicates Z: 40 65.123 2.306 0.802 0.885 0.974 0.846 CB 1.860 40 residues pruned to eliminate duplicates Z: 41 62.359 2.278 0.860 0.843 0.950 0.750 CB 1.824 41 residues pruned to eliminate duplicates Z: 39 58.777 2.336 0.566 0.884 1.000 0.842 CB 1.884 39 residues pruned to eliminate duplicates Z: 43 47.096 2.229 0.702 0.691 0.905 0.762 CB 1.778 41 residues pruned to eliminate duplicates Z: 25 42.252 2.335 0.599 0.853 0.917 0.792 CA 1.862 25 residues pruned to eliminate duplicates Z: 20 41.101 2.261 0.556 0.890 1.000 0.842 CB 1.928 20 residues pruned to eliminate duplicates Z: 14 7.981 1.832 0.392 0.457 0.769 0.538 CB 1.179 14 residues pruned to eliminate duplicates Z: 25 45.234 2.307 0.651 0.868 0.958 0.750 CA 1.849 26 residues pruned to eliminate duplicates Z: 18 43.045 2.347 0.856 0.899 0.941 0.824 CA 1.821 18 residues pruned to eliminate duplicates Z: 11 23.208 2.362 0.216 0.910 1.000 0.900 C 1.812 11 residues pruned to eliminate duplicates Z: 16 28.150 1.881 0.970 0.871 1.000 0.933 CB 1.431 Z: 9 8.779 1.740 1.009 0.585 0.875 0.750 CA 0.935 9 residues pruned to eliminate duplicates Z: 17 34.392 2.295 0.700 0.841 0.938 0.688 CB 1.753 17 residues pruned to eliminate duplicates Z: 18 43.797 2.334 0.633 0.925 1.000 0.824 CB 1.956 18 residues pruned to eliminate duplicates Z: 17 25.368 2.128 0.425 0.896 0.938 0.875 CB 1.599 17 residues pruned to eliminate duplicates Z: 11 15.298 1.884 0.652 0.846 0.800 0.600 CB 1.443 Z: 21 38.931 2.351 0.503 0.828 0.950 0.750 CB 1.952 21 residues pruned to eliminate duplicates Z: 18 43.385 2.307 0.893 0.875 0.941 0.765 CB 1.862 18 residues pruned to eliminate duplicates Z: 19 55.060 2.295 1.212 0.920 1.000 0.667 CA 1.801 19 residues pruned to eliminate duplicates Z: 38 68.115 2.345 0.810 0.891 1.000 0.757 CB 1.897 38 residues pruned to eliminate duplicates Z: 17 33.101 2.186 0.541 0.896 1.000 0.750 C 1.760 17 residues pruned to eliminate duplicates Z: 34 39.536 2.164 1.017 0.636 0.970 0.667 CB 1.431 15 residues pruned to eliminate duplicates Z: 40 53.074 2.291 0.536 0.891 0.949 0.923 CB 1.830 40 residues pruned to eliminate duplicates Z: 29 41.994 2.366 0.560 0.673 0.964 0.714 CB 1.900 27 residues pruned to eliminate duplicates Z: 41 63.374 2.274 0.920 0.891 0.925 0.725 C 1.784 41 residues pruned to eliminate duplicates Z: 6 14.564 2.200 0.457 0.866 1.000 0.600 CB 1.488 6 residues pruned to eliminate duplicates Z: 22 49.722 2.383 0.891 0.950 1.000 0.905 CB 1.660 22 residues pruned to eliminate duplicates Z: 21 46.254 2.392 0.652 0.876 0.950 0.800 CB 2.003 21 residues pruned to eliminate duplicates Z: 14 37.712 2.073 1.133 0.921 1.000 0.846 CA 1.665 14 residues pruned to eliminate duplicates Z: 34 63.857 2.339 0.806 0.911 1.000 0.788 CB 1.865 34 residues pruned to eliminate duplicates Z: 16 21.791 2.228 0.751 0.521 0.867 0.400 CB 1.629 12 residues pruned to eliminate duplicates Z: 14 25.981 2.009 0.686 0.915 0.923 0.769 C 1.629 14 residues pruned to eliminate duplicates Z: 21 44.221 2.211 0.965 0.846 0.950 0.800 CB 1.779 21 residues pruned to eliminate duplicates Z: 40 46.628 2.275 0.350 0.849 0.974 0.846 CB 1.850 40 residues pruned to eliminate duplicates Z: 34 61.087 2.340 0.744 0.927 0.970 0.879 CB 1.883 34 residues pruned to eliminate duplicates Z: 31 68.083 2.368 0.851 0.947 1.000 0.800 CB 1.960 31 residues pruned to eliminate duplicates Z: 25 53.914 2.198 1.299 0.935 0.958 0.708 CB 1.583 25 residues pruned to eliminate duplicates Z: 78 68.153 2.309 0.675 0.734 0.935 0.740 CB 1.740 78 residues pruned to eliminate duplicates Z: 22 61.328 2.302 1.285 0.963 1.000 0.857 CB 1.739 25 residues pruned to eliminate duplicates Z: 21 42.714 2.182 0.809 0.884 1.000 0.600 CA 1.749 21 residues pruned to eliminate duplicates Z: 39 47.448 2.214 0.462 0.910 0.974 0.895 CB 1.732 39 residues pruned to eliminate duplicates Z: 24 49.597 2.389 0.710 0.865 0.957 0.870 CB 1.939 24 residues pruned to eliminate duplicates Z: 20 41.284 2.250 0.744 0.886 1.000 0.842 C 1.741 20 residues pruned to eliminate duplicates Z: 19 42.484 2.368 0.713 0.865 0.944 0.722 CA 1.915 19 residues pruned to eliminate duplicates Z: 40 70.763 2.292 1.010 0.895 0.974 0.872 C 1.809 40 residues pruned to eliminate duplicates Z: 7 5.749 1.952 0.183 0.570 0.667 0.333 CA 1.425 7 residues pruned to eliminate duplicates Z: 9 19.094 2.006 0.868 0.762 1.000 0.750 CB 1.427 11 residues pruned to eliminate duplicates Z: 9 14.893 1.900 0.496 0.818 1.000 0.750 CB 1.405 8 residues pruned to eliminate duplicates Z: 40 73.540 2.290 1.066 0.886 1.000 0.641 C 1.797 40 residues pruned to eliminate duplicates Z: 21 41.223 2.209 0.831 0.864 0.950 0.700 CB 1.760 21 residues pruned to eliminate duplicates Z: 39 57.329 2.347 0.491 0.887 1.000 0.868 CB 1.917 39 residues pruned to eliminate duplicates Z: 8 16.862 2.129 0.430 0.843 1.000 1.000 C 1.559 8 residues pruned to eliminate duplicates Z: 19 41.803 2.348 0.599 0.896 1.000 0.833 C 1.879 19 residues pruned to eliminate duplicates Z: 40 62.468 2.275 0.748 0.886 0.974 0.769 CB 1.863 40 residues pruned to eliminate duplicates Z: 23 36.220 2.179 0.746 0.924 1.000 0.864 CB 1.424 23 residues pruned to eliminate duplicates Z: 40 46.058 2.282 0.310 0.857 1.000 0.821 CB 1.818 40 residues pruned to eliminate duplicates Z: 35 61.310 2.274 0.841 0.905 0.971 0.765 CB 1.842 35 residues pruned to eliminate duplicates Z: 18 41.360 2.303 0.691 0.939 0.941 0.941 C 1.902 18 residues pruned to eliminate duplicates Z: 12 23.192 2.012 0.523 0.878 1.000 0.909 CB 1.656 Z: 18 39.438 2.373 0.564 0.876 1.000 0.765 C 1.873 18 residues pruned to eliminate duplicates Z: 21 48.432 2.170 1.070 0.910 1.000 0.450 C 1.709 21 residues pruned to eliminate duplicates Z: 25 42.221 2.339 0.590 0.896 0.917 0.750 CB 1.811 25 residues pruned to eliminate duplicates Z: 16 24.193 2.074 0.322 0.932 1.000 0.800 CB 1.591 16 residues pruned to eliminate duplicates Z: 7 10.196 1.945 0.737 0.565 0.833 0.833 CA 1.388 7 residues pruned to eliminate duplicates Z: 20 31.640 2.261 0.430 0.897 0.947 0.789 CB 1.696 20 residues pruned to eliminate duplicates Z: 48 63.534 2.306 0.994 0.607 1.000 0.638 CB 1.820 48 residues pruned to eliminate duplicates Z: 16 35.848 2.314 0.521 0.878 1.000 0.867 CA 1.909 16 residues pruned to eliminate duplicates Z: 9 16.902 2.002 0.630 0.824 0.875 0.875 CB 1.582 9 residues pruned to eliminate duplicates Z: 21 33.517 2.134 0.704 0.851 0.950 0.750 CB 1.606 21 residues pruned to eliminate duplicates Z: 32 55.321 2.254 0.790 0.915 0.968 0.871 CB 1.798 32 residues pruned to eliminate duplicates Z: 7 14.005 2.087 0.569 0.762 0.833 0.833 C 1.660 7 residues pruned to eliminate duplicates Z: 14 35.159 2.043 1.022 0.920 1.000 0.846 CB 1.662 14 residues pruned to eliminate duplicates Z: 22 50.779 2.363 1.093 0.938 1.000 0.905 CB 1.558 22 residues pruned to eliminate duplicates Z: 15 37.468 2.237 0.984 0.929 1.000 0.571 CB 1.579 15 residues pruned to eliminate duplicates Z: 23 44.107 2.407 0.852 0.894 0.955 0.955 CB 1.585 23 residues pruned to eliminate duplicates Z: 32 34.452 2.042 0.660 0.872 0.871 0.613 CB 1.528 32 residues pruned to eliminate duplicates Z: 24 51.303 2.389 0.769 0.854 0.957 0.783 CB 1.955 24 residues pruned to eliminate duplicates Z: 21 52.417 2.353 1.165 0.943 1.000 0.950 CB 1.595 21 residues pruned to eliminate duplicates Z: 14 10.422 2.042 0.487 0.369 0.846 0.385 CB 1.295 14 residues pruned to eliminate duplicates Z: 111 91.495 2.311 0.874 0.741 0.955 0.764 CB 1.701 112 residues pruned to eliminate duplicates Z: 24 42.507 2.221 0.865 0.924 0.957 0.739 CB 1.571 24 residues pruned to eliminate duplicates Z: 35 48.276 2.247 0.435 0.929 1.000 0.941 CB 1.796 35 residues pruned to eliminate duplicates Z: 38 50.677 2.327 0.395 0.907 0.973 0.892 CB 1.874 38 residues pruned to eliminate duplicates Z: 19 41.542 2.226 0.929 0.862 0.944 0.667 CB 1.772 19 residues pruned to eliminate duplicates Z: 39 75.899 2.311 1.042 0.915 1.000 0.816 CB 1.844 39 residues pruned to eliminate duplicates Z: 30 42.170 2.253 0.696 0.686 0.931 0.724 C 1.857 30 residues pruned to eliminate duplicates Z: 24 53.488 2.177 1.080 0.955 1.000 0.870 CB 1.692 23 residues pruned to eliminate duplicates Z: 19 47.413 2.290 1.055 0.924 0.944 0.833 CB 1.765 19 residues pruned to eliminate duplicates Z: 38 66.665 2.346 0.834 0.884 0.973 0.865 CB 1.891 38 residues pruned to eliminate duplicates Z: 22 42.904 2.361 0.834 0.928 1.000 0.857 CB 1.513 22 residues pruned to eliminate duplicates Z: 33 56.240 2.291 0.667 0.929 1.000 0.875 CB 1.821 33 residues pruned to eliminate duplicates Z: 22 42.582 2.086 0.996 0.847 0.952 0.619 CB 1.740 22 residues pruned to eliminate duplicates Z: 22 51.886 2.268 1.195 0.953 1.000 0.762 CB 1.564 22 residues pruned to eliminate duplicates Z: 8 13.904 2.136 0.182 0.695 1.000 0.571 CA 1.741 8 residues pruned to eliminate duplicates Z: 101 73.471 2.256 0.806 0.590 0.970 0.720 CB 1.706 103 residues pruned to eliminate duplicates Z: 25 39.719 2.097 0.843 0.854 0.917 0.625 CB 1.691 25 residues pruned to eliminate duplicates Z: 20 36.232 2.213 0.642 0.919 1.000 0.947 C 1.613 20 residues pruned to eliminate duplicates Z: 13 17.297 1.986 0.274 0.805 1.000 0.583 CB 1.512 13 residues pruned to eliminate duplicates Z: 18 29.166 2.119 0.556 0.873 1.000 0.765 CB 1.563 18 residues pruned to eliminate duplicates Z: 16 28.042 1.869 0.909 0.865 1.000 0.933 CB 1.487 16 residues pruned to eliminate duplicates Z: 20 44.075 2.301 0.841 0.886 1.000 0.842 C 1.722 20 residues pruned to eliminate duplicates Z: 8 19.807 2.166 0.636 0.753 1.000 0.857 C 1.687 8 residues pruned to eliminate duplicates Z: 9 12.188 2.086 0.183 0.746 0.875 0.500 C 1.602 9 residues pruned to eliminate duplicates Z: 45 58.589 2.252 0.944 0.662 1.000 0.773 CB 1.737 46 residues pruned to eliminate duplicates Z: 8 11.713 2.032 0.263 0.816 0.857 0.571 CB 1.530 8 residues pruned to eliminate duplicates Z: 31 39.268 2.076 0.565 0.903 1.000 0.833 CB 1.572 31 residues pruned to eliminate duplicates Z: 39 58.343 2.301 0.613 0.894 0.974 0.763 CB 1.879 39 residues pruned to eliminate duplicates Z: 25 47.971 2.349 0.702 0.862 0.917 0.750 CA 1.962 24 residues pruned to eliminate duplicates Z: 39 58.546 2.298 0.631 0.922 0.974 0.816 CB 1.830 39 residues pruned to eliminate duplicates Z: 19 45.057 2.371 0.854 0.904 0.944 0.778 CB 1.823 19 residues pruned to eliminate duplicates Z: 9 23.555 2.073 0.881 0.875 1.000 1.000 CB 1.553 9 residues pruned to eliminate duplicates Z: 20 46.732 2.261 0.811 0.897 1.000 0.842 CA 1.874 20 residues pruned to eliminate duplicates Z: 40 55.474 2.264 0.545 0.906 1.000 0.897 CB 1.807 40 residues pruned to eliminate duplicates Z: 17 32.686 2.255 0.802 0.781 0.938 0.750 CB 1.675 17 residues pruned to eliminate duplicates Z: 41 58.335 2.285 0.637 0.854 1.000 0.800 CB 1.822 41 residues pruned to eliminate duplicates Z: 23 46.755 2.234 0.937 0.926 0.955 0.864 CB 1.692 23 residues pruned to eliminate duplicates Z: 23 45.427 2.305 0.894 0.925 0.955 0.864 CB 1.631 23 residues pruned to eliminate duplicates Z: 24 52.695 2.154 1.176 0.950 0.957 0.870 CB 1.689 24 residues pruned to eliminate duplicates Z: 32 37.306 2.067 0.569 0.878 0.968 0.710 CB 1.550 32 residues pruned to eliminate duplicates Z: 52 60.023 2.332 0.926 0.592 0.961 0.627 CB 1.784 52 residues pruned to eliminate duplicates Z: 40 57.407 2.304 0.617 0.839 1.000 0.821 CA 1.843 40 residues pruned to eliminate duplicates Z: 13 33.770 2.184 1.087 0.817 0.917 0.667 CA 1.771 13 residues pruned to eliminate duplicates Z: 70 75.732 2.320 0.790 0.774 0.971 0.826 CB 1.775 70 residues pruned to eliminate duplicates Z: 26 40.768 2.232 0.562 0.854 0.960 0.760 C 1.800 25 residues pruned to eliminate duplicates Z: 124 101.103 2.339 0.884 0.743 0.943 0.707 CB 1.764 124 residues pruned to eliminate duplicates Z: 18 22.616 2.083 0.375 0.871 0.941 0.824 CB 1.484 18 residues pruned to eliminate duplicates Z: 38 63.503 2.267 0.815 0.921 0.973 0.757 CB 1.835 38 residues pruned to eliminate duplicates Z: 17 24.409 2.089 0.404 0.866 1.000 0.875 CB 1.524 17 residues pruned to eliminate duplicates Z: 23 51.374 2.198 1.057 0.941 1.000 0.909 CB 1.681 23 residues pruned to eliminate duplicates Z: 7 8.873 1.962 0.119 0.772 0.833 0.667 CB 1.557 7 residues pruned to eliminate duplicates Z: 7 10.143 1.927 0.205 0.816 1.000 0.833 CB 1.355 5 residues pruned to eliminate duplicates Z: 8 11.710 2.188 0.498 0.759 0.714 0.714 CB 1.502 8 residues pruned to eliminate duplicates Z: 15 10.466 1.943 0.045 0.787 0.714 0.357 CB 1.498 15 residues pruned to eliminate duplicates Z: 38 43.307 2.065 0.732 0.782 0.946 0.622 CB 1.641 31 residues pruned to eliminate duplicates Z: 39 66.376 2.318 0.849 0.909 0.974 0.842 CB 1.832 39 residues pruned to eliminate duplicates Z: 19 42.451 2.409 0.594 0.876 1.000 0.833 CB 1.894 19 residues pruned to eliminate duplicates Z: 21 47.091 2.183 0.989 0.921 1.000 0.800 C 1.706 21 residues pruned to eliminate duplicates Z: 8 11.374 2.119 0.343 0.818 0.714 0.571 CA 1.605 8 residues pruned to eliminate duplicates Z: 12 16.372 1.711 0.797 0.802 1.000 0.727 CB 1.233 9 residues pruned to eliminate duplicates Z: 37 22.450 2.067 0.583 0.363 0.861 0.583 CB 1.539 37 residues pruned to eliminate duplicates Z: 22 55.328 2.338 1.192 0.945 1.000 0.952 CB 1.631 22 residues pruned to eliminate duplicates Z: 20 43.159 2.196 0.957 0.874 1.000 0.789 CB 1.676 20 residues pruned to eliminate duplicates Z: 29 38.829 2.159 0.904 0.651 0.964 0.679 CB 1.609 29 residues pruned to eliminate duplicates Z: 24 41.568 2.399 0.426 0.871 0.957 0.870 CB 1.932 24 residues pruned to eliminate duplicates Z: 40 58.986 2.276 0.654 0.910 0.974 0.821 CB 1.827 40 residues pruned to eliminate duplicates Z: 19 38.720 2.179 0.789 0.837 1.000 0.611 CB 1.752 19 residues pruned to eliminate duplicates Z: 16 28.939 2.114 0.495 0.890 1.000 0.800 CB 1.700 16 residues pruned to eliminate duplicates Z: 19 45.108 2.391 0.751 0.865 1.000 0.722 CB 1.860 19 residues pruned to eliminate duplicates Z: 22 46.965 2.347 0.868 0.935 1.000 0.905 CB 1.629 22 residues pruned to eliminate duplicates Z: 32 41.757 1.979 1.007 0.846 0.935 0.710 CB 1.500 32 residues pruned to eliminate duplicates Z: 40 51.007 2.238 0.598 0.911 0.974 0.872 CB 1.662 40 residues pruned to eliminate duplicates Z: 40 58.579 2.313 0.599 0.869 0.974 0.872 CB 1.901 40 residues pruned to eliminate duplicates Z: 37 44.450 2.080 0.702 0.765 1.000 0.694 CB 1.654 37 residues pruned to eliminate duplicates Z: 31 42.251 2.049 0.830 0.858 0.933 0.633 CB 1.624 31 residues pruned to eliminate duplicates Z: 31 44.745 2.058 0.777 0.892 1.000 0.833 CB 1.604 31 residues pruned to eliminate duplicates Z: 11 28.543 2.392 0.618 0.818 0.900 0.700 CA 1.965 11 residues pruned to eliminate duplicates Z: 11 15.694 1.994 0.211 0.880 1.000 0.700 CB 1.489 11 residues pruned to eliminate duplicates Z: 13 21.448 1.918 0.480 0.934 1.000 0.833 CA 1.521 12 residues pruned to eliminate duplicates Z: 40 69.291 2.269 1.054 0.893 0.949 0.590 C 1.803 40 residues pruned to eliminate duplicates Z: 9 24.471 2.262 0.605 0.846 1.000 0.875 CA 1.771 9 residues pruned to eliminate duplicates Z: 22 54.799 2.405 1.102 0.950 1.000 0.952 CB 1.631 22 residues pruned to eliminate duplicates Z: 21 43.115 2.182 1.052 0.862 0.950 0.650 CB 1.664 21 residues pruned to eliminate duplicates Z: 16 25.172 2.076 0.587 0.811 0.933 0.733 CB 1.611 16 residues pruned to eliminate duplicates Z: 26 37.399 2.216 0.478 0.855 0.960 0.880 CB 1.756 26 residues pruned to eliminate duplicates Z: 20 37.462 2.181 0.640 0.860 1.000 0.947 CB 1.766 20 residues pruned to eliminate duplicates Z: 18 25.388 2.021 0.582 0.876 0.941 0.824 CB 1.487 18 residues pruned to eliminate duplicates Z: 43 42.532 2.218 0.578 0.669 0.905 0.810 CB 1.772 43 residues pruned to eliminate duplicates Z: 32 39.994 2.045 0.741 0.886 0.935 0.742 CB 1.557 32 residues pruned to eliminate duplicates Z: 9 7.814 2.022 0.321 0.385 0.875 0.625 CB 1.336 9 residues pruned to eliminate duplicates Z: 9 23.502 2.177 0.901 0.874 0.875 0.750 C 1.670 9 residues pruned to eliminate duplicates Z: 8 10.519 1.821 0.434 0.821 1.000 0.857 CB 1.153 8 residues pruned to eliminate duplicates Z: 12 23.094 2.003 0.689 0.911 1.000 0.818 CB 1.459 12 residues pruned to eliminate duplicates Z: 20 35.918 2.266 0.608 0.913 0.947 0.842 CB 1.689 20 residues pruned to eliminate duplicates Z: 19 40.464 2.345 0.779 0.898 0.944 0.833 CB 1.732 19 residues pruned to eliminate duplicates Z: 46 52.523 2.205 0.887 0.646 0.978 0.622 CB 1.679 46 residues pruned to eliminate duplicates Z: 15 26.717 1.901 0.798 0.880 1.000 0.857 CB 1.514 15 residues pruned to eliminate duplicates Z: 61 39.275 2.073 0.811 0.445 0.933 0.550 CB 1.531 61 residues pruned to eliminate duplicates Z: 15 32.518 1.976 1.112 0.908 0.929 0.929 CB 1.593 15 residues pruned to eliminate duplicates Z: 25 46.132 2.371 0.597 0.877 0.958 0.750 CB 1.885 25 residues pruned to eliminate duplicates Z: 21 39.558 2.081 0.819 0.889 1.000 0.900 CB 1.682 21 residues pruned to eliminate duplicates Z: 21 35.968 2.225 0.707 0.886 0.950 0.700 CB 1.608 21 residues pruned to eliminate duplicates Z: 10 8.830 1.819 0.450 0.536 0.889 0.667 CB 1.212 Z: 14 36.849 2.009 1.175 0.947 1.000 1.000 CA 1.616 14 residues pruned to eliminate duplicates Z: 10 28.646 2.006 1.079 0.833 1.000 0.778 C 1.718 10 residues pruned to eliminate duplicates Z: 14 20.212 1.910 0.402 0.876 1.000 0.923 CB 1.521 14 residues pruned to eliminate duplicates Z: 33 35.194 2.238 0.404 0.644 0.969 0.688 CB 1.787 33 residues pruned to eliminate duplicates Z: 39 55.799 2.266 0.569 0.906 1.000 0.737 CB 1.810 39 residues pruned to eliminate duplicates Z: 28 43.980 2.368 0.634 0.709 0.926 0.667 CB 1.955 28 residues pruned to eliminate duplicates Z: 23 42.028 2.262 1.000 0.915 0.955 0.909 CB 1.467 23 residues pruned to eliminate duplicates Z: 20 37.428 2.187 0.705 0.818 1.000 0.737 C 1.747 20 residues pruned to eliminate duplicates Z: 6 7.041 1.983 -0.033 0.548 1.000 0.600 CB 1.567 6 residues pruned to eliminate duplicates Z: 24 38.165 2.351 0.401 0.868 0.957 0.739 CB 1.846 24 residues pruned to eliminate duplicates Z: 25 53.833 2.381 0.728 0.938 1.000 0.958 CB 1.858 25 residues pruned to eliminate duplicates Z: 24 44.257 2.244 0.930 0.936 0.957 0.826 CB 1.552 24 residues pruned to eliminate duplicates Z: 24 37.320 2.243 0.784 0.918 1.000 0.783 CB 1.372 24 residues pruned to eliminate duplicates Z: 24 56.638 2.177 1.229 0.945 1.000 0.609 CB 1.685 24 residues pruned to eliminate duplicates Z: 25 43.462 2.307 0.616 0.851 0.958 0.875 CA 1.838 25 residues pruned to eliminate duplicates Z: 39 72.914 2.278 0.995 0.920 1.000 0.868 C 1.833 39 residues pruned to eliminate duplicates Z: 40 50.003 2.297 0.425 0.886 0.949 0.897 CB 1.859 40 residues pruned to eliminate duplicates Z: 13 24.195 1.925 0.842 0.918 0.917 0.833 CB 1.515 13 residues pruned to eliminate duplicates Z: 30 50.264 2.097 0.902 0.893 1.000 0.793 CB 1.680 31 residues pruned to eliminate duplicates Z: 23 35.507 2.088 0.830 0.858 0.864 0.727 CB 1.690 23 residues pruned to eliminate duplicates Z: 20 51.232 2.256 1.040 0.881 1.000 0.737 CB 1.850 20 residues pruned to eliminate duplicates Z: 20 27.588 2.253 0.446 0.887 0.947 0.842 CB 1.478 20 residues pruned to eliminate duplicates Z: 25 46.781 2.331 0.640 0.875 0.958 0.667 CA 1.896 26 residues pruned to eliminate duplicates Z: 13 12.301 1.788 0.198 0.852 1.000 0.917 CB 1.226 13 residues pruned to eliminate duplicates Z: 40 62.182 2.261 0.815 0.878 0.974 0.769 C 1.808 40 residues pruned to eliminate duplicates Z: 6 3.298 1.670 0.214 0.404 1.000 0.800 CB 0.805 6 residues pruned to eliminate duplicates Z: 24 35.942 2.359 0.277 0.866 0.957 0.826 CB 1.904 26 residues pruned to eliminate duplicates Z: 9 24.227 2.054 0.877 0.882 1.000 1.000 CB 1.608 9 residues pruned to eliminate duplicates Z: 45 48.791 2.248 0.688 0.663 0.955 0.750 CB 1.745 45 residues pruned to eliminate duplicates Z: 59 45.295 2.213 0.649 0.576 0.914 0.690 CB 1.658 44 residues pruned to eliminate duplicates Z: 25 39.153 2.286 0.485 0.843 0.958 0.708 CB 1.829 25 residues pruned to eliminate duplicates Z: 21 48.782 2.375 1.009 0.941 1.000 1.000 CB 1.586 21 residues pruned to eliminate duplicates Z: 14 25.897 1.861 0.818 0.927 1.000 0.846 CB 1.488 14 residues pruned to eliminate duplicates Z: 28 23.290 2.032 0.649 0.450 0.852 0.556 C 1.653 28 residues pruned to eliminate duplicates Z: 18 26.468 2.081 0.497 0.872 1.000 0.824 CB 1.502 18 residues pruned to eliminate duplicates Z: 47 52.225 2.221 0.724 0.648 0.978 0.652 CB 1.791 47 residues pruned to eliminate duplicates Z: 20 29.216 2.084 0.735 0.768 0.895 0.684 CB 1.633 20 residues pruned to eliminate duplicates Z: 8 9.209 2.005 0.013 0.845 1.000 0.714 CA 1.274 8 residues pruned to eliminate duplicates Z: 31 40.708 2.104 0.701 0.863 0.967 0.800 CB 1.575 31 residues pruned to eliminate duplicates Z: 22 60.093 2.210 1.388 0.947 1.000 0.810 CB 1.717 22 residues pruned to eliminate duplicates Z: 19 48.722 2.261 1.021 0.927 1.000 0.778 CB 1.761 19 residues pruned to eliminate duplicates Z: 40 73.547 2.283 1.094 0.897 0.974 0.718 C 1.810 40 residues pruned to eliminate duplicates Z: 23 47.945 2.230 1.053 0.939 1.000 0.818 CB 1.552 23 residues pruned to eliminate duplicates Z: 15 42.602 2.345 0.789 0.917 1.000 0.786 CA 1.915 15 residues pruned to eliminate duplicates Z: 12 14.523 2.016 0.336 0.548 1.000 0.545 C 1.551 12 residues pruned to eliminate duplicates Z: 13 23.376 1.934 0.544 0.905 1.000 0.917 CA 1.609 13 residues pruned to eliminate duplicates Z: 17 33.077 2.143 0.743 0.874 1.000 0.688 CB 1.611 17 residues pruned to eliminate duplicates Z: 8 9.245 1.862 0.146 0.789 0.857 0.714 C 1.481 8 residues pruned to eliminate duplicates Z: 9 18.898 2.013 0.629 0.864 1.000 0.875 CA 1.494 9 residues pruned to eliminate duplicates Z: 10 6.151 1.791 0.152 0.380 0.778 0.556 C 1.451 11 residues pruned to eliminate duplicates Z: 14 43.266 2.259 1.136 0.919 1.000 0.923 CB 1.752 14 residues pruned to eliminate duplicates Z: 32 38.886 2.031 0.613 0.864 1.000 0.806 CB 1.562 32 residues pruned to eliminate duplicates Z: 14 31.564 2.167 0.709 0.881 1.000 0.615 C 1.711 14 residues pruned to eliminate duplicates Z: 21 34.507 2.062 0.820 0.872 0.900 0.650 CB 1.665 21 residues pruned to eliminate duplicates Z: 19 38.930 2.234 0.750 0.897 0.944 0.667 C 1.778 19 residues pruned to eliminate duplicates Z: 39 48.319 2.280 0.357 0.886 0.974 0.895 CB 1.878 39 residues pruned to eliminate duplicates Z: 76 94.469 2.329 1.114 0.788 0.987 0.800 CB 1.744 76 residues pruned to eliminate duplicates Z: 7 8.426 1.963 0.191 0.560 1.000 0.833 CB 1.389 7 residues pruned to eliminate duplicates Z: 18 49.010 2.433 0.862 0.892 1.000 0.882 C 1.885 18 residues pruned to eliminate duplicates Z: 23 56.564 2.301 1.288 0.954 0.955 0.955 CB 1.651 23 residues pruned to eliminate duplicates Z: 40 52.295 2.267 0.483 0.906 0.974 0.897 CB 1.818 40 residues pruned to eliminate duplicates Z: 60 53.755 2.231 0.856 0.593 0.932 0.627 CB 1.659 60 residues pruned to eliminate duplicates Z: 16 24.140 2.094 0.299 0.908 1.000 0.933 CB 1.627 16 residues pruned to eliminate duplicates Z: 39 55.158 2.287 0.651 0.871 0.974 0.816 CB 1.776 39 residues pruned to eliminate duplicates Z: 8 13.244 1.908 0.652 0.684 0.857 0.571 CA 1.566 8 residues pruned to eliminate duplicates Z: 10 21.739 2.027 1.042 0.799 0.889 0.778 C 1.516 10 residues pruned to eliminate duplicates Z: 25 40.148 2.293 0.514 0.859 0.958 0.917 CB 1.813 25 residues pruned to eliminate duplicates Z: 17 26.236 2.020 0.608 0.913 0.938 0.750 CB 1.525 17 residues pruned to eliminate duplicates Z: 38 52.488 2.206 1.064 0.666 0.946 0.757 CB 1.718 38 residues pruned to eliminate duplicates Z: 7 6.599 2.011 0.643 0.508 0.833 0.833 CB 0.970 Z: 45 43.523 2.179 0.605 0.634 0.932 0.659 CB 1.776 45 residues pruned to eliminate duplicates Z: 32 42.471 2.073 0.725 0.878 0.968 0.710 CB 1.599 33 residues pruned to eliminate duplicates Z: 10 19.703 1.969 0.676 0.753 1.000 0.444 CB 1.589 10 residues pruned to eliminate duplicates Z: 10 7.849 1.776 0.120 0.581 0.889 0.556 CA 1.369 10 residues pruned to eliminate duplicates Z: 21 47.083 2.221 1.057 0.886 0.950 0.850 CA 1.750 21 residues pruned to eliminate duplicates Z: 69 70.895 2.324 0.708 0.772 0.971 0.809 CB 1.754 69 residues pruned to eliminate duplicates Z: 14 15.352 1.798 0.564 0.874 0.923 0.846 CB 1.194 14 residues pruned to eliminate duplicates Z: 23 55.486 2.242 1.148 0.954 1.000 0.909 CB 1.689 23 residues pruned to eliminate duplicates Z: 20 49.187 2.263 1.008 0.865 1.000 0.579 CA 1.819 20 residues pruned to eliminate duplicates Z: 7 14.146 2.078 0.457 0.800 1.000 0.833 C 1.468 7 residues pruned to eliminate duplicates Z: 22 45.634 2.209 0.867 0.929 1.000 0.714 CB 1.689 22 residues pruned to eliminate duplicates Z: 35 37.575 2.177 0.949 0.599 0.912 0.618 CB 1.515 35 residues pruned to eliminate duplicates Z: 53 43.091 2.122 0.788 0.616 0.923 0.635 CB 1.529 53 residues pruned to eliminate duplicates Z: 16 14.630 2.025 0.413 0.434 0.933 0.800 CB 1.514 16 residues pruned to eliminate duplicates Z: 14 24.280 1.871 0.684 0.901 1.000 1.000 CB 1.526 14 residues pruned to eliminate duplicates Z: 22 35.817 2.161 0.722 0.860 0.905 0.714 CB 1.708 22 residues pruned to eliminate duplicates Z: 10 4.985 1.633 0.442 0.317 0.667 0.556 CB 1.295 10 residues pruned to eliminate duplicates Z: 22 48.407 2.361 0.949 0.932 1.000 0.810 CB 1.604 22 residues pruned to eliminate duplicates Z: 19 41.065 2.353 0.642 0.852 1.000 0.667 C 1.854 19 residues pruned to eliminate duplicates Z: 50 48.615 2.263 0.691 0.598 0.959 0.653 CB 1.722 51 residues pruned to eliminate duplicates Z: 30 49.390 2.088 0.978 0.894 1.000 0.724 CB 1.593 31 residues pruned to eliminate duplicates Z: 24 40.911 2.192 0.840 0.872 0.957 0.957 CB 1.612 24 residues pruned to eliminate duplicates Z: 40 63.090 2.273 0.806 0.871 1.000 0.795 CB 1.796 40 residues pruned to eliminate duplicates Z: 10 15.830 1.840 1.289 0.666 0.778 0.667 C 1.381 10 residues pruned to eliminate duplicates Z: 108 99.144 2.349 0.910 0.767 0.963 0.701 CB 1.751 108 residues pruned to eliminate duplicates Z: 8 14.825 2.086 0.545 0.590 0.857 0.857 C 1.861 8 residues pruned to eliminate duplicates Z: 7 9.860 2.054 0.352 0.644 0.833 0.833 CA 1.521 7 residues pruned to eliminate duplicates Z: 39 54.363 2.285 0.570 0.901 0.974 0.895 CB 1.802 39 residues pruned to eliminate duplicates Z: 60 42.172 2.172 0.649 0.558 0.898 0.644 CB 1.612 60 residues pruned to eliminate duplicates Z: 20 32.251 2.156 0.577 0.836 0.947 0.632 CB 1.719 20 residues pruned to eliminate duplicates Z: 23 48.684 2.297 1.085 0.930 1.000 0.864 CB 1.515 23 residues pruned to eliminate duplicates Z: 29 26.486 2.041 0.822 0.436 0.893 0.679 CB 1.610 29 residues pruned to eliminate duplicates Z: 26 26.918 2.012 0.786 0.583 1.000 0.600 CB 1.383 13 residues pruned to eliminate duplicates Z: 24 35.605 1.958 0.705 0.903 1.000 0.783 CB 1.586 24 residues pruned to eliminate duplicates Z: 17 45.174 2.406 0.834 0.928 0.938 0.750 C 1.911 17 residues pruned to eliminate duplicates Z: 107 91.836 2.269 1.011 0.744 0.953 0.755 CB 1.650 107 residues pruned to eliminate duplicates Z: 25 46.307 2.363 0.582 0.863 0.958 0.833 CA 1.936 25 residues pruned to eliminate duplicates Z: 18 28.211 2.101 0.522 0.861 1.000 0.588 CB 1.573 18 residues pruned to eliminate duplicates Z: 45 43.216 2.139 0.756 0.639 0.886 0.727 CB 1.718 45 residues pruned to eliminate duplicates Z: 22 39.589 2.126 0.929 0.861 0.952 0.714 CB 1.626 22 residues pruned to eliminate duplicates Z: 35 38.518 2.188 0.957 0.620 0.912 0.618 CB 1.511 35 residues pruned to eliminate duplicates Z: 172 88.796 2.233 0.684 0.626 0.953 0.719 CB 1.683 172 residues pruned to eliminate duplicates Z: 13 26.664 2.285 0.816 0.905 0.833 0.833 CB 1.585 13 residues pruned to eliminate duplicates Z: 6 6.947 1.622 0.611 0.802 1.000 1.000 CA 0.913 6 residues pruned to eliminate duplicates Z: 17 41.638 2.390 0.754 0.895 0.938 0.938 CB 1.899 17 residues pruned to eliminate duplicates Z: 32 35.862 2.029 0.610 0.886 0.968 0.742 CB 1.469 32 residues pruned to eliminate duplicates Z: 109 97.450 2.336 0.874 0.755 0.972 0.778 CB 1.755 109 residues pruned to eliminate duplicates Z: 18 31.350 2.189 0.688 0.870 0.882 0.765 CB 1.703 18 residues pruned to eliminate duplicates Z: 26 37.693 2.257 0.377 0.880 1.000 0.720 CB 1.758 26 residues pruned to eliminate duplicates Z: 12 24.188 2.207 0.713 0.896 0.909 0.909 CB 1.520 12 residues pruned to eliminate duplicates Z: 11 18.050 1.898 0.725 0.874 0.900 0.900 C 1.410 11 residues pruned to eliminate duplicates Z: 17 16.442 2.048 0.498 0.526 0.875 0.625 CB 1.493 17 residues pruned to eliminate duplicates Z: 41 48.456 2.261 0.412 0.880 0.950 0.900 CB 1.831 41 residues pruned to eliminate duplicates Z: 97 87.485 2.265 0.885 0.767 0.969 0.792 CB 1.704 97 residues pruned to eliminate duplicates Z: 40 50.115 2.267 0.452 0.900 0.974 0.897 CB 1.787 40 residues pruned to eliminate duplicates Z: 8 14.299 2.108 0.410 0.882 0.857 0.571 CA 1.535 8 residues pruned to eliminate duplicates Z: 18 41.385 2.329 0.673 0.939 1.000 0.941 C 1.790 18 residues pruned to eliminate duplicates Z: 11 34.578 2.456 1.033 0.871 0.800 0.500 CB 1.997 11 residues pruned to eliminate duplicates Z: 7 8.509 1.636 0.437 0.849 0.833 0.833 C 1.315 7 residues pruned to eliminate duplicates Z: 39 52.417 2.338 0.381 0.899 1.000 0.947 CB 1.882 39 residues pruned to eliminate duplicates Z: 8 17.281 2.201 0.418 0.784 1.000 0.857 C 1.630 8 residues pruned to eliminate duplicates Z: 35 56.857 2.274 0.681 0.935 1.000 0.912 CB 1.778 35 residues pruned to eliminate duplicates Z: 43 59.713 2.311 0.972 0.686 0.905 0.738 CB 1.884 43 residues pruned to eliminate duplicates Z: 14 38.793 2.041 1.286 0.929 1.000 0.769 CA 1.614 14 residues pruned to eliminate duplicates Z: 33 20.465 1.939 0.576 0.465 0.844 0.469 CB 1.455 33 residues pruned to eliminate duplicates Z: 8 9.730 2.019 0.210 0.831 0.857 0.714 CA 1.319 8 residues pruned to eliminate duplicates Z: 11 33.690 2.259 1.156 0.889 0.900 0.800 C 1.749 11 residues pruned to eliminate duplicates Z: 9 7.077 1.817 0.164 0.672 0.875 0.250 CB 1.153 9 residues pruned to eliminate duplicates Z: 8 6.478 1.870 -0.107 0.778 1.000 0.429 CB 1.148 8 residues pruned to eliminate duplicates Z: 18 40.776 2.258 0.775 0.874 1.000 0.706 CA 1.796 18 residues pruned to eliminate duplicates Z: 44 54.270 2.314 0.793 0.670 0.930 0.744 CB 1.833 44 residues pruned to eliminate duplicates Z: 11 19.259 1.970 0.588 0.856 1.000 1.000 CB 1.435 11 residues pruned to eliminate duplicates Z: 14 34.954 2.077 1.073 0.878 1.000 0.769 CA 1.634 14 residues pruned to eliminate duplicates Z: 25 29.022 2.036 0.808 0.643 1.000 0.583 CB 1.407 26 residues pruned to eliminate duplicates Z: 13 18.953 2.049 0.664 0.644 0.917 0.500 CB 1.529 13 residues pruned to eliminate duplicates Z: 31 44.075 2.039 0.848 0.882 1.000 0.767 CB 1.545 31 residues pruned to eliminate duplicates Z: 34 51.076 2.264 0.547 0.930 1.000 0.909 CB 1.775 34 residues pruned to eliminate duplicates Z: 20 34.482 2.051 0.933 0.881 0.947 0.789 CB 1.525 20 residues pruned to eliminate duplicates Z: 40 62.452 2.190 0.906 0.888 0.974 0.667 CB 1.771 40 residues pruned to eliminate duplicates Z: 8 5.659 1.865 0.630 0.437 0.714 0.714 CB 1.051 8 residues pruned to eliminate duplicates Z: 8 18.479 2.114 0.551 0.882 1.000 1.000 C 1.541 8 residues pruned to eliminate duplicates Z: 18 27.002 2.015 0.499 0.900 1.000 0.824 CB 1.549 18 residues pruned to eliminate duplicates Z: 13 24.218 1.962 0.675 0.935 0.917 0.917 CB 1.618 13 residues pruned to eliminate duplicates Z: 17 16.233 1.926 1.035 0.373 0.938 0.562 CB 1.264 17 residues pruned to eliminate duplicates Z: 20 36.556 2.123 0.684 0.877 1.000 0.737 CB 1.704 20 residues pruned to eliminate duplicates Z: 42 55.102 2.324 0.681 0.693 0.976 0.805 CB 1.893 42 residues pruned to eliminate duplicates Z: 9 12.740 2.105 0.342 0.498 1.000 0.625 CA 1.598 7 residues pruned to eliminate duplicates Z: 67 75.123 2.327 0.793 0.811 0.970 0.818 CB 1.744 67 residues pruned to eliminate duplicates Z: 25 43.555 2.349 0.492 0.881 0.958 0.875 CB 1.917 25 residues pruned to eliminate duplicates Z: 31 25.143 1.995 0.713 0.480 0.900 0.567 CB 1.523 17 residues pruned to eliminate duplicates Z: 37 47.166 2.224 0.704 0.723 0.944 0.833 CB 1.796 37 residues pruned to eliminate duplicates Z: 12 13.434 1.844 0.154 0.877 1.000 0.909 CB 1.382 12 residues pruned to eliminate duplicates Z: 55 56.991 2.315 0.790 0.595 0.963 0.685 CB 1.775 55 residues pruned to eliminate duplicates Z: 17 32.747 2.192 0.662 0.894 0.938 0.812 CA 1.720 17 residues pruned to eliminate duplicates Z: 14 31.900 2.042 0.945 0.891 1.000 0.923 CA 1.601 14 residues pruned to eliminate duplicates Z: 38 62.212 2.272 0.843 0.896 0.946 0.730 CB 1.850 38 residues pruned to eliminate duplicates Z: 31 44.297 2.122 0.746 0.873 1.000 0.800 CB 1.590 31 residues pruned to eliminate duplicates Z: 19 44.544 2.251 0.871 0.919 1.000 0.722 C 1.757 19 residues pruned to eliminate duplicates Z: 24 37.310 2.342 0.355 0.834 1.000 0.739 CB 1.837 24 residues pruned to eliminate duplicates Z: 35 50.283 2.274 0.526 0.902 0.971 0.912 CB 1.825 35 residues pruned to eliminate duplicates Z: 13 13.227 1.832 0.055 0.884 1.000 0.833 CA 1.427 13 residues pruned to eliminate duplicates Z: 25 31.355 1.959 0.536 0.895 1.000 0.625 CB 1.524 25 residues pruned to eliminate duplicates Z: 47 44.839 2.171 0.741 0.645 0.935 0.696 CB 1.634 47 residues pruned to eliminate duplicates Z: 46 58.478 2.391 0.906 0.627 0.956 0.644 CB 1.777 46 residues pruned to eliminate duplicates Z: 10 9.667 1.861 0.433 0.370 1.000 0.778 CB 1.389 10 residues pruned to eliminate duplicates Z: 40 59.681 2.259 0.796 0.873 0.949 0.744 CB 1.808 40 residues pruned to eliminate duplicates Z: 10 9.488 1.520 0.464 0.757 1.000 0.667 CB 1.131 Z: 10 6.602 1.903 0.427 0.739 0.889 0.444 CB 0.736 10 residues pruned to eliminate duplicates Z: 7 5.568 1.809 0.674 0.671 0.667 0.667 CB 0.961 7 residues pruned to eliminate duplicates Z: 25 26.601 2.018 0.692 0.624 1.000 0.625 CB 1.414 25 residues pruned to eliminate duplicates Z: 39 40.254 2.176 0.695 0.673 0.842 0.605 CA 1.792 48 residues pruned to eliminate duplicates Z: 32 53.326 2.291 0.582 0.917 1.000 0.968 CB 1.864 32 residues pruned to eliminate duplicates Z: 13 22.602 1.901 0.556 0.920 1.000 1.000 CB 1.553 13 residues pruned to eliminate duplicates Z: 7 6.214 2.140 0.163 0.564 0.833 0.667 CB 1.149 7 residues pruned to eliminate duplicates Z: 29 24.593 1.999 0.672 0.475 0.929 0.714 CB 1.537 29 residues pruned to eliminate duplicates Z: 8 19.268 2.228 0.455 0.857 1.000 0.571 CB 1.657 8 residues pruned to eliminate duplicates Z: 8 12.110 2.109 0.382 0.485 1.000 0.857 CB 1.593 Z: 35 76.437 2.262 1.332 0.941 1.000 0.735 C 1.725 35 residues pruned to eliminate duplicates Z: 25 40.483 2.119 0.741 0.915 1.000 0.917 CB 1.583 25 residues pruned to eliminate duplicates Z: 8 9.996 1.919 0.541 0.565 0.857 0.714 CB 1.399 8 residues pruned to eliminate duplicates Z: 30 25.733 2.048 0.723 0.406 0.897 0.586 CB 1.667 30 residues pruned to eliminate duplicates Z: 25 22.796 1.941 0.337 0.863 1.000 0.792 CB 1.316 25 residues pruned to eliminate duplicates Z: 23 43.501 2.299 0.851 0.925 1.000 0.864 CB 1.530 23 residues pruned to eliminate duplicates Z: 117 88.157 2.300 0.873 0.710 0.931 0.664 CB 1.687 117 residues pruned to eliminate duplicates Z: 28 51.699 2.331 0.995 0.671 0.963 0.704 CB 1.897 28 residues pruned to eliminate duplicates Z: 8 18.081 2.038 0.529 0.840 1.000 0.857 CA 1.636 8 residues pruned to eliminate duplicates Z: 13 21.477 1.919 0.592 0.920 0.917 0.917 CA 1.559 13 residues pruned to eliminate duplicates Z: 13 17.146 1.872 0.408 0.913 0.917 0.750 CB 1.449 13 residues pruned to eliminate duplicates Z: 18 26.043 2.062 0.452 0.842 1.000 0.706 CB 1.573 18 residues pruned to eliminate duplicates Z: 11 26.357 2.251 0.654 0.795 0.900 0.600 CA 1.920 12 residues pruned to eliminate duplicates Z: 7 10.382 1.618 0.705 0.812 1.000 0.833 CB 1.171 7 residues pruned to eliminate duplicates Z: 15 23.526 2.118 0.255 0.932 1.000 1.000 CB 1.651 15 residues pruned to eliminate duplicates Z: 20 22.316 2.228 0.593 0.409 1.000 0.737 CB 1.587 20 residues pruned to eliminate duplicates Z: 15 30.195 2.259 0.475 0.898 1.000 0.857 CB 1.733 15 residues pruned to eliminate duplicates Z: 68 87.876 2.328 1.056 0.802 0.985 0.716 CB 1.748 68 residues pruned to eliminate duplicates Z: 51 33.619 2.040 0.581 0.564 0.900 0.620 CB 1.539 47 residues pruned to eliminate duplicates Z: 19 28.284 2.232 0.299 0.838 0.944 0.778 CB 1.819 19 residues pruned to eliminate duplicates Z: 7 8.145 1.591 0.435 0.829 1.000 0.500 CB 1.095 7 residues pruned to eliminate duplicates Z: 22 63.946 2.245 1.610 0.944 0.952 0.667 CB 1.733 22 residues pruned to eliminate duplicates Z: 38 22.258 2.037 0.653 0.355 0.865 0.568 CB 1.470 38 residues pruned to eliminate duplicates Z: 6 14.116 1.869 0.760 0.864 1.000 0.800 CA 1.407 6 residues pruned to eliminate duplicates Z: 10 13.331 1.984 0.384 0.796 1.000 0.889 CB 1.249 10 residues pruned to eliminate duplicates Z: 31 39.903 2.111 0.725 0.879 0.933 0.767 CB 1.555 31 residues pruned to eliminate duplicates Z: 6 9.129 1.840 0.745 0.616 0.800 0.800 CA 1.425 6 residues pruned to eliminate duplicates Z: 42 50.772 2.273 0.734 0.641 0.951 0.683 C 1.854 42 residues pruned to eliminate duplicates Z: 15 21.937 2.035 0.437 0.865 1.000 0.857 CB 1.468 15 residues pruned to eliminate duplicates Z: 13 27.424 2.072 0.939 0.896 0.917 0.833 CA 1.540 13 residues pruned to eliminate duplicates Z: 40 74.648 2.250 1.138 0.911 1.000 0.667 CB 1.761 40 residues pruned to eliminate duplicates Z: 25 45.408 2.230 1.149 0.720 0.958 0.583 CB 1.654 25 residues pruned to eliminate duplicates Z: 21 36.009 2.215 0.765 0.870 0.950 0.750 CB 1.582 21 residues pruned to eliminate duplicates Z: 12 13.376 1.585 0.633 0.917 0.909 0.455 CB 1.209 12 residues pruned to eliminate duplicates Z: 19 35.297 2.115 0.582 0.899 1.000 0.944 CB 1.776 19 residues pruned to eliminate duplicates Z: 14 32.410 1.936 1.104 0.935 1.000 0.769 C 1.538 14 residues pruned to eliminate duplicates Z: 19 42.850 2.403 0.656 0.862 1.000 0.889 C 1.863 19 residues pruned to eliminate duplicates Z: 9 9.821 1.902 0.267 0.659 1.000 1.000 CB 1.244 9 residues pruned to eliminate duplicates Z: 7 10.921 2.042 -0.021 0.882 1.000 0.833 CB 1.614 7 residues pruned to eliminate duplicates Z: 10 22.182 2.017 0.871 0.865 1.000 0.778 CB 1.436 10 residues pruned to eliminate duplicates Z: 30 37.756 2.036 0.724 0.882 0.931 0.690 CB 1.553 30 residues pruned to eliminate duplicates Z: 7 12.463 2.180 0.289 0.822 0.833 0.667 C 1.644 7 residues pruned to eliminate duplicates Z: 18 16.131 2.167 0.536 0.456 0.765 0.588 CB 1.609 18 residues pruned to eliminate duplicates Z: 53 47.661 2.116 0.944 0.550 0.962 0.731 CB 1.592 53 residues pruned to eliminate duplicates Z: 10 14.956 2.045 0.471 0.781 0.889 0.778 CB 1.456 10 residues pruned to eliminate duplicates Z: 57 59.570 2.266 0.968 0.653 0.946 0.821 CB 1.635 57 residues pruned to eliminate duplicates Z: 49 73.006 2.296 0.964 0.799 1.000 0.750 CB 1.798 49 residues pruned to eliminate duplicates Z: 65 41.820 2.111 0.879 0.445 0.906 0.500 CB 1.540 65 residues pruned to eliminate duplicates Z: 9 9.026 1.969 0.863 0.529 0.875 0.375 CB 0.967 9 residues pruned to eliminate duplicates Z: 19 33.613 2.139 0.581 0.909 1.000 0.944 CA 1.664 19 residues pruned to eliminate duplicates Z: 38 41.434 2.235 0.634 0.670 0.919 0.703 CB 1.735 38 residues pruned to eliminate duplicates Z: 8 20.194 1.913 0.965 0.770 1.000 0.714 CA 1.600 8 residues pruned to eliminate duplicates Z: 12 13.641 1.894 0.074 0.910 1.000 0.818 CA 1.435 12 residues pruned to eliminate duplicates Z: 13 15.179 1.827 0.367 0.806 0.917 0.667 CB 1.466 13 residues pruned to eliminate duplicates Z: 7 9.524 2.090 0.060 0.865 0.833 0.667 CB 1.543 7 residues pruned to eliminate duplicates Z: 14 26.143 2.013 0.480 0.905 1.000 0.769 C 1.732 14 residues pruned to eliminate duplicates Z: 34 44.658 2.247 0.439 0.930 0.970 0.939 CB 1.735 34 residues pruned to eliminate duplicates Z: 11 15.644 1.722 0.566 0.807 1.000 0.700 CA 1.403 11 residues pruned to eliminate duplicates Z: 6 5.724 1.577 0.245 0.830 1.000 0.800 CB 0.981 6 residues pruned to eliminate duplicates Z: 14 9.777 1.557 0.918 0.467 0.923 0.615 CB 1.018 Z: 6 5.847 1.632 0.633 0.677 1.000 0.800 CB 0.833 6 residues pruned to eliminate duplicates Z: 35 55.172 2.380 0.944 0.622 0.941 0.647 CB 1.936 35 residues pruned to eliminate duplicates Z: 40 52.908 2.281 0.973 0.619 0.923 0.667 CB 1.822 40 residues pruned to eliminate duplicates Z: 46 48.255 2.201 0.868 0.638 0.956 0.689 CB 1.609 46 residues pruned to eliminate duplicates Z: 44 52.638 2.301 0.679 0.658 0.930 0.721 CB 1.930 44 residues pruned to eliminate duplicates Z: 7 15.633 2.218 0.248 0.843 1.000 0.500 C 1.717 7 residues pruned to eliminate duplicates Z: 17 26.368 2.158 0.440 0.892 0.938 0.875 CB 1.626 17 residues pruned to eliminate duplicates Z: 13 16.278 1.843 0.260 0.909 1.000 0.833 CA 1.436 13 residues pruned to eliminate duplicates Z: 16 10.110 1.533 0.667 0.529 0.933 0.600 CB 1.064 14 residues pruned to eliminate duplicates Z: 19 40.046 2.345 0.523 0.902 1.000 0.833 CB 1.884 19 residues pruned to eliminate duplicates Z: 62 50.776 2.218 0.822 0.574 0.918 0.656 CB 1.631 62 residues pruned to eliminate duplicates Z: 31 33.477 1.911 0.815 0.877 0.867 0.533 CB 1.477 30 residues pruned to eliminate duplicates Z: 22 45.980 2.286 1.163 0.789 0.952 0.857 CB 1.652 22 residues pruned to eliminate duplicates Z: 13 27.878 1.947 0.786 0.904 1.000 0.750 CB 1.649 13 residues pruned to eliminate duplicates Z: 8 17.212 2.055 0.802 0.753 0.857 0.857 CB 1.636 8 residues pruned to eliminate duplicates Z: 7 5.339 1.760 0.092 0.404 1.000 0.500 CB 1.254 7 residues pruned to eliminate duplicates Z: 11 16.141 2.009 0.948 0.728 0.900 0.700 CB 1.180 11 residues pruned to eliminate duplicates Z: 29 39.816 2.070 0.755 0.863 0.929 0.750 CB 1.637 29 residues pruned to eliminate duplicates Z: 32 36.698 2.261 0.771 0.642 0.903 0.548 CB 1.596 32 residues pruned to eliminate duplicates Z: 7 18.224 2.167 0.473 0.822 1.000 1.000 CA 1.763 7 residues pruned to eliminate duplicates Z: 8 7.668 1.636 0.348 0.640 1.000 0.571 CB 1.153 8 residues pruned to eliminate duplicates Z: 11 8.438 1.601 0.779 0.467 0.900 0.500 CB 1.076 11 residues pruned to eliminate duplicates Z: 53 60.453 2.351 0.889 0.613 0.904 0.692 CB 1.876 53 residues pruned to eliminate duplicates Z: 22 19.228 2.133 0.814 0.437 0.905 0.619 CB 1.279 22 residues pruned to eliminate duplicates Z: 59 53.185 2.220 0.556 0.741 0.966 0.810 CB 1.687 59 residues pruned to eliminate duplicates Z: 12 10.614 1.644 0.264 0.912 0.909 0.909 CB 1.200 12 residues pruned to eliminate duplicates Z: 6 6.494 1.810 0.352 0.411 1.000 0.600 CB 1.303 6 residues pruned to eliminate duplicates Z: 9 12.073 2.029 0.763 0.538 0.875 0.500 CB 1.314 9 residues pruned to eliminate duplicates Z: 16 14.876 2.005 0.484 0.512 0.800 0.600 CB 1.595 16 residues pruned to eliminate duplicates Z: 11 17.277 1.925 0.447 0.889 0.900 0.700 CB 1.569 11 residues pruned to eliminate duplicates Z: 15 32.129 1.943 1.005 0.895 1.000 0.929 CA 1.580 15 residues pruned to eliminate duplicates Z: 13 27.611 1.953 0.777 0.915 1.000 0.917 CB 1.624 13 residues pruned to eliminate duplicates Z: 109 92.818 2.304 0.950 0.751 0.935 0.685 CB 1.700 109 residues pruned to eliminate duplicates Z: 14 18.104 2.005 0.365 0.788 0.846 0.615 CA 1.683 14 residues pruned to eliminate duplicates Z: 12 14.976 1.826 0.181 0.914 1.000 0.909 CB 1.480 12 residues pruned to eliminate duplicates Z: 47 56.076 2.234 0.690 0.775 0.978 0.761 CB 1.755 47 residues pruned to eliminate duplicates Z: 13 10.591 1.538 0.498 0.854 0.833 0.583 CB 1.177 13 residues pruned to eliminate duplicates Z: 13 13.066 1.574 0.546 0.892 0.917 0.750 CB 1.215 13 residues pruned to eliminate duplicates Z: 9 12.984 2.108 0.436 0.770 0.750 0.750 CA 1.592 9 residues pruned to eliminate duplicates Z: 7 3.715 1.583 0.639 0.244 0.833 0.500 CB 0.943 7 residues pruned to eliminate duplicates Z: 21 44.000 2.316 0.736 0.890 0.950 0.850 CA 1.854 21 residues pruned to eliminate duplicates Z: 13 9.237 1.509 0.323 0.883 0.833 0.583 CB 1.159 13 residues pruned to eliminate duplicates Z: 22 59.246 2.275 1.223 0.961 1.000 0.905 CB 1.750 22 residues pruned to eliminate duplicates Z: 17 19.518 1.787 0.707 0.579 1.000 0.750 C 1.482 17 residues pruned to eliminate duplicates Z: 33 65.901 2.246 1.095 0.939 1.000 0.750 CB 1.721 33 residues pruned to eliminate duplicates Z: 25 38.476 2.315 0.426 0.850 1.000 0.833 CB 1.762 25 residues pruned to eliminate duplicates Z: 18 39.911 2.314 0.640 0.872 1.000 0.765 CB 1.859 18 residues pruned to eliminate duplicates Z: 14 40.538 2.055 1.307 0.938 1.000 0.923 CA 1.649 14 residues pruned to eliminate duplicates Z: 46 45.253 2.179 0.745 0.607 0.956 0.756 CB 1.677 46 residues pruned to eliminate duplicates Z: 24 50.698 2.159 1.001 0.942 1.000 0.870 CB 1.697 24 residues pruned to eliminate duplicates Z: 28 24.757 2.084 0.563 0.432 0.963 0.630 CB 1.630 28 residues pruned to eliminate duplicates Z: 9 15.109 2.007 0.200 0.822 1.000 0.750 C 1.678 9 residues pruned to eliminate duplicates Z: 27 37.958 2.160 0.526 0.900 0.962 0.885 CB 1.678 27 residues pruned to eliminate duplicates Z: 16 24.043 2.102 0.431 0.836 1.000 0.600 CB 1.545 16 residues pruned to eliminate duplicates Z: 22 58.114 2.302 1.194 0.947 1.000 0.905 CB 1.735 22 residues pruned to eliminate duplicates Z: 86 68.303 2.342 0.525 0.746 0.976 0.847 CB 1.704 86 residues pruned to eliminate duplicates Z: 69 48.299 2.125 0.802 0.529 0.971 0.676 CB 1.531 69 residues pruned to eliminate duplicates Z: 12 12.862 1.633 0.450 0.897 1.000 0.727 CB 1.173 12 residues pruned to eliminate duplicates Z: 18 36.924 2.225 0.821 0.885 0.941 0.882 CB 1.696 18 residues pruned to eliminate duplicates Z: 10 4.927 1.498 0.532 0.407 0.778 0.556 CA 1.014 10 residues pruned to eliminate duplicates Z: 13 22.788 1.906 0.622 0.889 1.000 0.667 CB 1.532 13 residues pruned to eliminate duplicates Z: 32 40.647 2.072 0.758 0.854 0.903 0.677 CB 1.639 32 residues pruned to eliminate duplicates Z: 55 68.993 2.257 0.957 0.713 0.963 0.667 CB 1.819 55 residues pruned to eliminate duplicates Z: 32 52.904 2.382 1.006 0.637 0.935 0.677 CB 1.869 32 residues pruned to eliminate duplicates Z: 9 17.622 1.840 0.770 0.886 1.000 1.000 C 1.380 9 residues pruned to eliminate duplicates Z: 6 13.158 2.241 0.533 0.800 0.800 0.800 C 1.647 6 residues pruned to eliminate duplicates Z: 7 10.457 2.083 0.187 0.771 0.833 0.333 CB 1.630 7 residues pruned to eliminate duplicates Z: 7 6.492 1.585 0.531 0.768 0.833 0.500 CB 1.034 7 residues pruned to eliminate duplicates Z: 11 15.422 1.834 0.711 0.809 1.000 0.400 CB 1.188 11 residues pruned to eliminate duplicates Z: 21 48.398 2.228 1.050 0.896 0.950 0.850 CB 1.786 21 residues pruned to eliminate duplicates Z: 13 13.980 1.651 0.649 0.869 0.917 0.750 CB 1.181 13 residues pruned to eliminate duplicates Z: 9 21.913 1.861 1.218 0.779 1.000 1.000 C 1.467 9 residues pruned to eliminate duplicates Z: 8 5.550 1.846 0.306 0.445 0.857 0.714 CB 1.074 7 residues pruned to eliminate duplicates Z: 12 8.347 1.569 0.792 0.468 0.909 0.727 CB 1.017 12 residues pruned to eliminate duplicates Z: 23 52.888 2.301 1.203 0.944 1.000 0.864 CB 1.540 23 residues pruned to eliminate duplicates Z: 7 12.392 2.216 0.035 0.737 1.000 0.833 CA 1.783 7 residues pruned to eliminate duplicates Z: 7 9.569 1.928 0.235 0.767 0.833 0.833 C 1.554 7 residues pruned to eliminate duplicates Z: 23 40.768 2.311 0.781 0.902 0.955 0.955 CB 1.578 23 residues pruned to eliminate duplicates Z: 42 55.331 2.337 0.779 0.679 0.951 0.732 CB 1.854 42 residues pruned to eliminate duplicates Z: 47 60.204 2.350 0.953 0.630 0.957 0.674 CB 1.789 47 residues pruned to eliminate duplicates Z: 19 36.928 2.300 0.658 0.897 0.889 0.833 CB 1.838 19 residues pruned to eliminate duplicates Z: 25 38.662 2.286 0.432 0.891 0.958 0.792 CA 1.808 25 residues pruned to eliminate duplicates Z: 46 40.868 2.168 0.667 0.629 0.867 0.733 CB 1.722 39 residues pruned to eliminate duplicates Z: 22 58.180 2.286 1.199 0.954 1.000 0.857 CB 1.737 22 residues pruned to eliminate duplicates Z: 24 43.029 2.285 0.764 0.906 1.000 0.870 CB 1.583 24 residues pruned to eliminate duplicates Z: 7 12.347 2.167 0.523 0.850 0.667 0.500 CA 1.698 7 residues pruned to eliminate duplicates Z: 19 43.652 2.257 0.938 0.913 0.944 0.889 C 1.762 19 residues pruned to eliminate duplicates Z: 26 38.381 2.136 0.734 0.835 0.880 0.760 CB 1.763 26 residues pruned to eliminate duplicates Z: 106 95.323 2.345 0.914 0.748 0.952 0.714 CB 1.745 104 residues pruned to eliminate duplicates Z: 6 6.783 1.841 0.622 0.482 1.000 1.000 CB 1.034 Z: 9 11.556 1.858 0.670 0.545 1.000 0.625 CB 1.260 8 residues pruned to eliminate duplicates Z: 8 5.976 1.850 0.251 0.701 0.714 0.571 CB 1.137 8 residues pruned to eliminate duplicates Z: 52 38.891 2.092 0.592 0.576 0.922 0.686 CB 1.648 52 residues pruned to eliminate duplicates Z: 17 27.828 2.009 0.685 0.872 1.000 0.812 CB 1.498 17 residues pruned to eliminate duplicates Z: 17 33.459 2.144 0.773 0.913 1.000 0.812 CB 1.558 17 residues pruned to eliminate duplicates Z: 18 28.537 2.099 0.471 0.923 1.000 1.000 CA 1.575 18 residues pruned to eliminate duplicates Z: 22 18.180 2.206 0.379 0.454 0.810 0.476 CB 1.689 22 residues pruned to eliminate duplicates Z: 9 12.548 1.911 0.699 0.496 0.875 0.875 CA 1.568 9 residues pruned to eliminate duplicates Z: 24 42.400 2.096 0.852 0.924 1.000 0.826 CB 1.599 24 residues pruned to eliminate duplicates Z: 8 24.372 2.091 0.844 0.888 1.000 1.000 C 1.721 8 residues pruned to eliminate duplicates Z: 10 25.155 2.213 0.902 0.864 0.889 0.333 CB 1.643 10 residues pruned to eliminate duplicates Z: 23 28.088 2.090 0.497 0.898 0.909 0.909 CB 1.506 23 residues pruned to eliminate duplicates Z: 65 95.131 2.332 1.126 0.837 1.000 0.844 CB 1.794 65 residues pruned to eliminate duplicates Z: 39 34.646 2.142 0.517 0.639 0.895 0.526 CB 1.697 39 residues pruned to eliminate duplicates Z: 41 67.237 2.234 1.133 0.844 0.950 0.700 CB 1.747 41 residues pruned to eliminate duplicates Z: 23 45.870 2.096 1.287 0.866 0.909 0.636 C 1.643 23 residues pruned to eliminate duplicates Z: 17 41.249 2.184 0.975 0.883 1.000 0.750 CB 1.729 17 residues pruned to eliminate duplicates Z: 54 46.239 2.187 0.635 0.587 0.962 0.717 CB 1.698 54 residues pruned to eliminate duplicates Z: 7 4.012 1.353 0.899 0.329 0.833 0.667 CB 0.923 Z: 31 45.609 2.058 0.860 0.875 1.000 0.833 CB 1.582 31 residues pruned to eliminate duplicates Z: 75 86.788 2.270 0.984 0.787 0.986 0.784 CB 1.763 75 residues pruned to eliminate duplicates Z: 9 8.729 1.906 0.567 0.460 0.875 0.500 CB 1.230 8 residues pruned to eliminate duplicates Z: 13 24.723 2.157 0.696 0.669 1.000 0.667 CA 1.669 10 residues pruned to eliminate duplicates Z: 6 2.216 1.375 0.362 0.445 0.800 0.600 CB 0.701 6 residues pruned to eliminate duplicates Z: 20 34.907 2.169 0.465 0.912 1.000 0.842 CA 1.785 20 residues pruned to eliminate duplicates Z: 6 6.692 1.844 0.664 0.827 0.800 0.600 CB 0.919 6 residues pruned to eliminate duplicates Z: 17 45.610 2.408 0.750 0.939 1.000 0.812 CB 1.881 17 residues pruned to eliminate duplicates Z: 8 9.636 2.063 0.288 0.503 1.000 0.857 CB 1.366 8 residues pruned to eliminate duplicates Z: 38 64.271 2.339 0.701 0.911 1.000 0.838 CB 1.883 38 residues pruned to eliminate duplicates Z: 13 8.469 1.573 0.408 0.540 1.000 0.750 CB 1.062 13 residues pruned to eliminate duplicates Z: 10 14.557 2.177 0.683 0.533 0.889 0.667 CB 1.443 10 residues pruned to eliminate duplicates Z: 11 11.505 1.703 0.718 0.616 0.900 0.600 CB 1.237 11 residues pruned to eliminate duplicates Z: 56 66.123 2.335 0.959 0.721 0.945 0.745 CB 1.689 56 residues pruned to eliminate duplicates Z: 44 40.848 2.077 0.829 0.547 0.953 0.721 CB 1.642 44 residues pruned to eliminate duplicates Z: 77 85.741 2.281 0.902 0.775 0.987 0.803 CB 1.802 77 residues pruned to eliminate duplicates Z: 9 13.636 1.748 0.888 0.818 1.000 0.750 CB 1.108 9 residues pruned to eliminate duplicates Z: 49 43.922 2.223 0.591 0.596 0.938 0.729 CB 1.745 49 residues pruned to eliminate duplicates Z: 10 16.575 1.960 0.631 0.703 0.889 0.778 CA 1.616 10 residues pruned to eliminate duplicates Z: 12 15.613 1.912 0.476 0.538 1.000 0.818 C 1.607 12 residues pruned to eliminate duplicates Z: 22 49.887 2.275 1.162 0.954 0.905 0.905 CB 1.682 22 residues pruned to eliminate duplicates Z: 14 14.691 1.815 0.333 0.780 0.923 0.385 CA 1.426 14 residues pruned to eliminate duplicates Z: 28 39.940 2.245 0.694 0.651 0.963 0.667 C 1.824 28 residues pruned to eliminate duplicates Z: 7 7.974 1.813 0.339 0.534 1.000 0.667 CA 1.297 7 residues pruned to eliminate duplicates Z: 20 38.610 2.348 1.001 0.639 0.895 0.632 C 1.851 20 residues pruned to eliminate duplicates Z: 9 10.770 1.764 0.399 0.614 1.000 0.625 CA 1.384 9 residues pruned to eliminate duplicates Z: 38 50.396 2.300 0.496 0.903 0.946 0.892 CB 1.814 38 residues pruned to eliminate duplicates Z: 56 42.994 2.229 0.566 0.578 0.909 0.691 CB 1.694 56 residues pruned to eliminate duplicates Z: 83 73.069 2.333 0.626 0.761 0.963 0.805 CB 1.752 83 residues pruned to eliminate duplicates Z: 16 20.137 2.066 0.358 0.890 0.867 0.800 CB 1.538 16 residues pruned to eliminate duplicates Z: 16 36.891 2.265 0.954 0.717 1.000 0.667 CA 1.768 16 residues pruned to eliminate duplicates Z: 15 25.283 2.151 0.714 0.607 0.929 0.929 CA 1.784 15 residues pruned to eliminate duplicates Z: 7 10.914 1.826 0.433 0.664 1.000 0.833 CA 1.462 7 residues pruned to eliminate duplicates Z: 10 11.465 1.848 0.536 0.654 0.889 0.778 C 1.313 10 residues pruned to eliminate duplicates Z: 103 73.695 2.291 0.529 0.750 0.961 0.814 CB 1.735 103 residues pruned to eliminate duplicates Z: 11 17.557 1.903 0.564 0.671 1.000 0.600 CB 1.592 11 residues pruned to eliminate duplicates Z: 10 16.277 1.898 0.666 0.795 0.889 0.667 CB 1.490 10 residues pruned to eliminate duplicates Z: 31 45.372 2.049 0.920 0.870 1.000 0.733 CB 1.537 31 residues pruned to eliminate duplicates Z: 29 38.480 2.278 0.736 0.672 0.964 0.750 CB 1.627 29 residues pruned to eliminate duplicates Z: 9 9.310 1.992 0.141 0.700 0.875 0.625 CB 1.380 9 residues pruned to eliminate duplicates Z: 40 43.398 2.258 0.622 0.648 0.949 0.718 CB 1.742 40 residues pruned to eliminate duplicates Z: 24 29.419 1.999 0.542 0.890 0.957 0.783 CB 1.496 24 residues pruned to eliminate duplicates Z: 12 20.788 1.977 1.136 0.562 0.909 0.727 CA 1.537 12 residues pruned to eliminate duplicates Z: 119 91.948 2.283 0.930 0.714 0.932 0.695 CB 1.697 119 residues pruned to eliminate duplicates Z: 9 9.857 1.651 0.527 0.773 1.000 0.750 CB 1.085 9 residues pruned to eliminate duplicates Z: 9 10.336 2.110 0.349 0.474 0.875 0.625 CB 1.505 9 residues pruned to eliminate duplicates Z: 32 39.490 2.305 0.137 0.943 1.000 1.000 CB 1.874 32 residues pruned to eliminate duplicates Z: 69 91.999 2.331 1.061 0.808 1.000 0.676 CB 1.776 69 residues pruned to eliminate duplicates Z: 12 12.868 1.600 0.541 0.908 1.000 0.636 CB 1.118 12 residues pruned to eliminate duplicates Z: 8 6.559 2.056 0.235 0.267 0.857 0.571 CB 1.485 8 residues pruned to eliminate duplicates Z: 33 37.865 2.243 0.555 0.616 0.969 0.625 CB 1.776 33 residues pruned to eliminate duplicates Z: 19 51.738 2.211 1.355 0.890 0.944 0.722 C 1.784 19 residues pruned to eliminate duplicates Z: 9 10.614 1.732 0.615 0.478 1.000 0.250 C 1.372 Z: 21 35.193 2.072 0.889 0.878 0.950 0.600 CB 1.536 21 residues pruned to eliminate duplicates Z: 25 44.418 2.112 0.941 0.894 0.958 0.833 C 1.655 25 residues pruned to eliminate duplicates Z: 29 26.937 2.065 0.484 0.600 0.929 0.679 CB 1.627 29 residues pruned to eliminate duplicates Z: 23 46.853 2.294 1.032 0.948 1.000 0.818 CB 1.480 23 residues pruned to eliminate duplicates Z: 15 16.170 1.839 0.560 0.605 0.929 0.714 CB 1.468 15 residues pruned to eliminate duplicates Z: 8 12.128 1.786 0.692 0.775 1.000 0.571 CB 1.190 8 residues pruned to eliminate duplicates Z: 36 43.627 2.155 0.982 0.712 0.914 0.800 CB 1.559 36 residues pruned to eliminate duplicates Z: 32 26.359 2.097 0.643 0.399 0.935 0.710 CB 1.634 32 residues pruned to eliminate duplicates Z: 25 23.371 1.959 0.658 0.629 0.958 0.625 CB 1.358 25 residues pruned to eliminate duplicates Z: 24 21.866 2.125 0.432 0.616 0.870 0.565 CB 1.544 24 residues pruned to eliminate duplicates Z: 28 40.157 2.049 0.837 0.877 0.926 0.667 C 1.610 28 residues pruned to eliminate duplicates Z: 15 38.775 1.989 1.239 0.889 1.000 0.929 CA 1.675 15 residues pruned to eliminate duplicates Z: 7 10.255 2.123 -0.003 0.749 1.000 0.167 CB 1.584 7 residues pruned to eliminate duplicates Z: 6 7.026 1.484 0.366 0.830 1.000 0.800 CB 1.166 6 residues pruned to eliminate duplicates Z: 15 11.518 1.904 0.458 0.366 0.857 0.500 CB 1.494 15 residues pruned to eliminate duplicates Z: 21 47.728 2.135 1.151 0.869 1.000 0.650 CB 1.698 21 residues pruned to eliminate duplicates Z: 30 42.941 2.257 0.850 0.595 1.000 0.586 CB 1.744 30 residues pruned to eliminate duplicates Z: 111 86.305 2.232 0.895 0.729 0.955 0.727 CB 1.658 240 residues pruned to eliminate duplicates Z: 8 13.215 1.945 0.566 0.765 1.000 0.857 CB 1.296 8 residues pruned to eliminate duplicates Z: 6 2.013 1.331 0.452 0.462 0.600 0.600 CB 0.807 Z: 18 40.674 2.408 0.558 0.888 1.000 0.941 CA 1.895 Z: 27 40.275 2.318 0.714 0.739 0.923 0.731 CB 1.738 27 residues pruned to eliminate duplicates Z: 22 19.285 1.986 0.983 0.432 0.952 0.619 CB 1.204 29 residues pruned to eliminate duplicates Z: 90 100.004 2.328 1.032 0.791 0.978 0.787 CB 1.777 90 residues pruned to eliminate duplicates Z: 21 43.513 2.311 1.299 0.786 0.950 0.750 CB 1.499 21 residues pruned to eliminate duplicates Z: 18 24.714 2.054 0.757 0.635 0.941 0.765 CB 1.555 Z: 20 19.103 2.048 0.550 0.497 0.947 0.579 CB 1.462 20 residues pruned to eliminate duplicates Z: 12 12.513 1.810 0.113 0.927 1.000 1.000 CB 1.312 12 residues pruned to eliminate duplicates Z: 26 36.491 2.098 1.149 0.607 0.960 0.560 CB 1.524 26 residues pruned to eliminate duplicates Z: 26 48.336 2.265 0.873 0.855 0.920 0.680 CA 1.828 26 residues pruned to eliminate duplicates Z: 18 33.985 2.152 0.865 0.753 1.000 0.765 CA 1.639 18 residues pruned to eliminate duplicates Z: 18 25.195 2.083 1.026 0.516 1.000 0.765 CB 1.425 18 residues pruned to eliminate duplicates Z: 11 17.891 2.000 0.688 0.681 0.900 0.800 C 1.577 11 residues pruned to eliminate duplicates Z: 14 29.810 2.208 0.788 0.685 1.000 0.769 CA 1.767 14 residues pruned to eliminate duplicates Z: 21 40.171 2.307 0.977 0.688 0.900 0.750 C 1.841 12 residues pruned to eliminate duplicates Z: 61 68.152 2.308 0.820 0.739 0.967 0.783 CB 1.749 61 residues pruned to eliminate duplicates Z: 8 4.957 1.495 0.465 0.397 0.857 0.714 CA 1.113 8 residues pruned to eliminate duplicates Z: 92 94.123 2.311 1.012 0.784 0.956 0.791 CB 1.729 93 residues pruned to eliminate duplicates Z: 8 7.096 1.749 0.508 0.381 0.857 0.571 CB 1.346 8 residues pruned to eliminate duplicates Z: 9 9.352 1.743 0.410 0.751 0.875 0.625 CA 1.229 9 residues pruned to eliminate duplicates Z: 23 38.586 2.145 0.717 0.935 0.955 0.909 CB 1.631 23 residues pruned to eliminate duplicates Z: 30 53.223 2.410 0.937 0.642 0.966 0.690 CB 1.920 Z: 18 18.878 1.942 0.817 0.557 0.765 0.647 CA 1.606 18 residues pruned to eliminate duplicates Z: 20 38.640 2.273 0.801 0.898 0.947 0.684 CB 1.634 20 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 32 40.165 2.276 0.626 0.644 0.935 0.710 CB 1.821 32 residues pruned to eliminate duplicates Z: 32 40.661 2.266 0.614 0.648 0.968 0.742 CB 1.798 32 residues pruned to eliminate duplicates Z: 6 8.070 1.603 1.220 0.394 1.000 0.600 CA 1.135 6 residues pruned to eliminate duplicates Z: 43 42.607 2.245 0.548 0.600 0.952 0.667 CB 1.806 43 residues pruned to eliminate duplicates Z: 31 39.923 2.328 0.562 0.662 0.933 0.767 CB 1.848 31 residues pruned to eliminate duplicates Z: 45 40.216 2.190 0.501 0.594 0.932 0.705 C 1.809 45 residues pruned to eliminate duplicates Z: 10 19.567 2.213 0.630 0.621 0.889 0.889 C 1.814 10 residues pruned to eliminate duplicates Z: 32 39.244 2.278 0.531 0.669 0.935 0.710 CB 1.847 32 residues pruned to eliminate duplicates Z: 42 49.686 2.298 0.594 0.689 0.951 0.805 CB 1.873 42 residues pruned to eliminate duplicates Z: 12 24.929 2.282 0.814 0.606 0.909 0.909 C 1.806 12 residues pruned to eliminate duplicates Z: 19 42.918 2.405 0.623 0.873 1.000 0.778 CB 1.887 19 residues pruned to eliminate duplicates Z: 32 39.332 2.234 0.640 0.659 0.935 0.710 CB 1.777 32 residues pruned to eliminate duplicates Z: 34 38.450 2.225 0.580 0.576 0.970 0.667 C 1.826 34 residues pruned to eliminate duplicates Z: 43 44.548 2.239 0.671 0.614 0.905 0.690 C 1.823 43 residues pruned to eliminate duplicates Z: 34 38.019 2.199 0.570 0.633 0.970 0.667 C 1.744 34 residues pruned to eliminate duplicates Z: 43 46.547 2.231 0.733 0.633 0.929 0.690 CB 1.766 43 residues pruned to eliminate duplicates Z: 32 41.692 2.298 0.658 0.651 0.935 0.710 CB 1.826 32 residues pruned to eliminate duplicates Z: 28 45.715 2.338 0.815 0.700 0.926 0.852 CB 1.866 28 residues pruned to eliminate duplicates Z: 43 51.596 2.292 0.697 0.649 0.952 0.762 CB 1.871 43 residues pruned to eliminate duplicates Z: 43 46.336 2.202 0.606 0.652 0.976 0.690 CB 1.797 43 residues pruned to eliminate duplicates Z: 34 35.727 2.228 0.572 0.642 0.909 0.727 CB 1.711 34 residues pruned to eliminate duplicates Z: 44 51.514 2.202 0.820 0.660 0.930 0.651 CB 1.817 44 residues pruned to eliminate duplicates Z: 42 52.849 2.317 0.771 0.672 0.927 0.756 CB 1.852 42 residues pruned to eliminate duplicates Z: 43 48.160 2.253 0.703 0.606 0.952 0.738 CB 1.839 43 residues pruned to eliminate duplicates Z: 34 37.300 2.208 0.601 0.639 0.970 0.818 CB 1.664 34 residues pruned to eliminate duplicates Z: 34 40.539 2.283 0.645 0.642 0.909 0.788 CB 1.809 34 residues pruned to eliminate duplicates Z: 44 48.634 2.240 0.701 0.663 0.953 0.721 CB 1.756 44 residues pruned to eliminate duplicates Z: 42 53.558 2.305 0.700 0.677 0.976 0.780 CB 1.858 42 residues pruned to eliminate duplicates Z: 10 22.050 2.151 0.818 0.641 1.000 0.667 CA 1.648 11 residues pruned to eliminate duplicates Z: 10 17.114 1.979 0.686 0.678 0.889 0.111 N 1.634 10 residues pruned to eliminate duplicates Z: 43 58.170 2.250 0.879 0.686 0.976 0.786 CB 1.835 43 residues pruned to eliminate duplicates Z: 44 49.314 2.224 0.722 0.667 0.930 0.721 CB 1.809 44 residues pruned to eliminate duplicates Z: 43 56.210 2.281 0.801 0.678 0.952 0.714 CB 1.881 43 residues pruned to eliminate duplicates Z: 7 26.000 2.302 0.836 0.822 1.000 0.833 C 1.900 7 residues pruned to eliminate duplicates Z: 43 54.105 2.258 0.760 0.683 0.976 0.762 CB 1.820 43 residues pruned to eliminate duplicates Z: 44 47.012 2.213 0.735 0.692 0.907 0.791 CB 1.727 44 residues pruned to eliminate duplicates Z: 26 24.988 2.015 0.731 0.577 0.920 0.600 CB 1.446 26 residues pruned to eliminate duplicates Z: 25 27.095 2.051 0.717 0.650 0.958 0.667 CB 1.425 25 residues pruned to eliminate duplicates Z: 15 12.372 1.965 0.899 0.387 0.857 0.429 CB 1.166 15 residues pruned to eliminate duplicates Z: 25 27.308 2.038 0.755 0.614 1.000 0.583 CB 1.398 25 residues pruned to eliminate duplicates Z: 25 30.961 2.015 1.023 0.665 0.958 0.792 CB 1.389 25 residues pruned to eliminate duplicates Z: 25 30.652 2.039 0.938 0.620 1.000 0.583 CB 1.414 25 residues pruned to eliminate duplicates Z: 26 29.069 2.034 0.874 0.582 1.000 0.760 CB 1.410 26 residues pruned to eliminate duplicates Z: 24 31.697 2.113 0.936 0.634 0.957 0.739 CB 1.489 24 residues pruned to eliminate duplicates Z: 19 25.346 2.168 0.742 0.628 1.000 0.611 CB 1.402 19 residues pruned to eliminate duplicates Z: 26 28.750 2.039 0.854 0.611 0.960 0.680 CB 1.426 26 residues pruned to eliminate duplicates Z: 15 21.672 1.982 0.559 0.724 1.000 0.500 CB 1.532 15 residues pruned to eliminate duplicates Z: 23 34.520 2.135 0.995 0.640 1.000 0.682 CB 1.516 25 residues pruned to eliminate duplicates Z: 14 22.310 1.877 0.584 0.851 1.000 0.769 CA 1.540 14 residues pruned to eliminate duplicates Z: 26 28.261 1.974 0.913 0.610 0.960 0.760 CB 1.404 26 residues pruned to eliminate duplicates Z: 26 28.357 2.036 0.793 0.621 1.000 0.680 CB 1.385 26 residues pruned to eliminate duplicates Z: 25 30.693 2.043 0.924 0.628 1.000 0.708 CB 1.413 25 residues pruned to eliminate duplicates Z: 15 19.352 1.994 0.549 0.783 0.929 0.643 CB 1.405 15 residues pruned to eliminate duplicates Z: 25 30.989 2.050 0.948 0.623 1.000 0.792 CB 1.411 25 residues pruned to eliminate duplicates Z: 26 31.266 2.031 0.948 0.613 1.000 0.720 CB 1.420 26 residues pruned to eliminate duplicates Z: 25 27.857 2.022 0.832 0.632 1.000 0.792 CB 1.355 25 residues pruned to eliminate duplicates Z: 25 30.053 2.056 0.819 0.626 1.000 0.792 CB 1.457 24 residues pruned to eliminate duplicates Z: 13 25.459 1.926 0.731 0.896 1.000 0.667 CB 1.579 13 residues pruned to eliminate duplicates Z: 29 40.080 2.105 0.840 0.714 0.964 0.500 CB 1.671 29 residues pruned to eliminate duplicates Z: 37 45.076 2.085 0.669 0.776 1.000 0.694 CB 1.692 37 residues pruned to eliminate duplicates Z: 6 8.739 1.774 0.436 0.566 1.000 0.600 CA 1.439 5 residues pruned to eliminate duplicates Z: 8 8.374 1.786 0.435 0.423 1.000 0.714 CA 1.339 8 residues pruned to eliminate duplicates Z: 38 42.038 2.054 0.729 0.771 0.946 0.622 CB 1.619 38 residues pruned to eliminate duplicates Z: 20 41.641 2.214 0.860 0.857 0.947 0.684 CB 1.803 20 residues pruned to eliminate duplicates Z: 38 43.065 2.049 0.773 0.768 0.946 0.622 CB 1.625 38 residues pruned to eliminate duplicates Z: 38 42.482 2.053 0.630 0.758 1.000 0.757 CB 1.659 38 residues pruned to eliminate duplicates Z: 37 47.318 2.107 0.729 0.801 1.000 0.667 CB 1.663 37 residues pruned to eliminate duplicates Z: 37 46.188 2.110 0.711 0.782 1.000 0.528 CB 1.665 37 residues pruned to eliminate duplicates Z: 36 41.131 2.009 0.801 0.714 1.000 0.600 CB 1.583 36 residues pruned to eliminate duplicates Z: 37 44.090 2.085 0.761 0.792 0.972 0.722 CB 1.592 38 residues pruned to eliminate duplicates Z: 18 44.711 2.233 0.971 0.889 1.000 0.824 CB 1.773 18 residues pruned to eliminate duplicates Z: 39 40.183 2.000 0.660 0.705 1.000 0.737 CB 1.629 39 residues pruned to eliminate duplicates Z: 37 44.147 2.102 0.696 0.763 0.972 0.722 CB 1.681 37 residues pruned to eliminate duplicates Z: 38 40.891 2.055 0.760 0.725 0.919 0.649 CB 1.651 38 residues pruned to eliminate duplicates Z: 38 42.318 2.052 0.644 0.752 1.000 0.676 CB 1.648 38 residues pruned to eliminate duplicates Z: 38 43.104 2.057 0.700 0.758 0.973 0.730 CB 1.655 38 residues pruned to eliminate duplicates Z: 21 37.256 2.145 0.859 0.851 0.950 0.750 CB 1.628 21 residues pruned to eliminate duplicates Z: 39 43.237 2.010 0.710 0.754 1.000 0.632 CB 1.628 39 residues pruned to eliminate duplicates Z: 25 44.031 2.159 0.940 0.787 0.958 0.667 CB 1.739 25 residues pruned to eliminate duplicates Z: 40 36.281 1.916 0.769 0.693 0.974 0.641 CB 1.474 40 residues pruned to eliminate duplicates Z: 36 46.245 2.084 0.804 0.761 1.000 0.600 CB 1.649 36 residues pruned to eliminate duplicates Z: 37 44.548 2.074 0.750 0.766 0.972 0.750 CB 1.662 37 residues pruned to eliminate duplicates Z: 37 45.926 2.088 0.737 0.758 1.000 0.611 CB 1.678 37 residues pruned to eliminate duplicates Z: 38 43.185 2.062 0.676 0.750 1.000 0.757 CB 1.644 38 residues pruned to eliminate duplicates Z: 37 43.131 2.101 0.629 0.777 1.000 0.694 CB 1.645 37 residues pruned to eliminate duplicates Z: 42 38.804 1.942 0.735 0.696 0.976 0.659 CB 1.541 42 residues pruned to eliminate duplicates Z: 37 47.186 2.096 0.731 0.795 1.000 0.806 CB 1.674 37 residues pruned to eliminate duplicates Z: 37 46.609 2.093 0.733 0.792 1.000 0.833 CB 1.658 37 residues pruned to eliminate duplicates Z: 41 36.068 1.975 0.656 0.711 0.950 0.675 CB 1.516 41 residues pruned to eliminate duplicates Z: 37 44.438 2.096 0.727 0.778 0.972 0.667 CB 1.647 37 residues pruned to eliminate duplicates Z: 38 45.637 2.053 0.755 0.774 1.000 0.703 CB 1.634 38 residues pruned to eliminate duplicates Z: 38 43.530 2.071 0.705 0.755 1.000 0.649 CB 1.615 38 residues pruned to eliminate duplicates Z: 37 45.643 2.084 0.768 0.801 0.972 0.639 CB 1.632 37 residues pruned to eliminate duplicates Z: 33 46.387 2.065 0.959 0.834 0.906 0.500 CB 1.677 33 residues pruned to eliminate duplicates Z: 10 14.589 1.952 0.612 0.617 1.000 0.667 CA 1.383 10 residues pruned to eliminate duplicates Z: 34 47.690 2.030 0.866 0.836 1.000 0.727 CB 1.640 34 residues pruned to eliminate duplicates Z: 23 41.459 2.219 0.768 0.791 0.955 0.818 C 1.829 23 residues pruned to eliminate duplicates Z: 33 49.388 2.077 0.892 0.839 1.000 0.719 CB 1.660 33 residues pruned to eliminate duplicates Z: 23 44.028 2.210 0.898 0.797 0.955 0.682 CA 1.807 23 residues pruned to eliminate duplicates Z: 33 50.942 2.060 0.995 0.855 0.969 0.594 CB 1.668 33 residues pruned to eliminate duplicates Z: 33 49.534 2.066 0.924 0.825 1.000 0.688 CB 1.662 33 residues pruned to eliminate duplicates Z: 33 48.474 2.056 0.917 0.834 1.000 0.750 CB 1.629 33 residues pruned to eliminate duplicates Z: 33 49.059 2.064 0.901 0.831 1.000 0.656 CB 1.661 33 residues pruned to eliminate duplicates Z: 34 48.324 2.028 0.929 0.833 0.970 0.576 CB 1.664 34 residues pruned to eliminate duplicates Z: 23 46.765 2.237 0.996 0.790 0.955 0.682 CA 1.813 23 residues pruned to eliminate duplicates Z: 33 49.214 2.062 0.910 0.851 1.000 0.625 CB 1.635 33 residues pruned to eliminate duplicates Z: 33 47.697 2.062 0.884 0.839 0.969 0.750 CB 1.674 33 residues pruned to eliminate duplicates Z: 34 46.793 2.018 0.940 0.817 0.970 0.636 CB 1.629 34 residues pruned to eliminate duplicates Z: 23 47.654 2.210 0.997 0.770 1.000 0.636 C 1.813 23 residues pruned to eliminate duplicates Z: 22 51.783 2.266 1.040 0.830 1.000 0.810 CA 1.838 22 residues pruned to eliminate duplicates Z: 34 46.242 1.996 1.004 0.810 0.939 0.576 CB 1.635 34 residues pruned to eliminate duplicates Z: 33 47.400 2.064 0.870 0.840 0.969 0.625 CB 1.673 33 residues pruned to eliminate duplicates Z: 34 49.030 2.015 1.002 0.831 0.970 0.576 CB 1.639 34 residues pruned to eliminate duplicates Z: 23 50.651 2.251 0.996 0.816 1.000 0.727 CA 1.827 23 residues pruned to eliminate duplicates Z: 25 39.155 2.136 0.747 0.771 0.958 0.667 CA 1.759 25 residues pruned to eliminate duplicates Z: 33 44.820 2.055 0.786 0.846 0.969 0.625 CB 1.656 33 residues pruned to eliminate duplicates Z: 33 49.317 2.059 0.922 0.833 1.000 0.531 CB 1.653 33 residues pruned to eliminate duplicates Z: 12 13.903 1.644 0.817 0.890 0.909 0.455 CB 1.110 12 residues pruned to eliminate duplicates Z: 33 48.546 2.066 0.871 0.839 1.000 0.750 CB 1.658 33 residues pruned to eliminate duplicates Z: 34 45.367 2.021 0.860 0.815 1.000 0.636 CB 1.597 34 residues pruned to eliminate duplicates Z: 11 14.599 1.742 0.559 0.907 1.000 0.400 CB 1.209 11 residues pruned to eliminate duplicates Z: 33 50.352 2.061 0.961 0.835 1.000 0.688 CB 1.649 33 residues pruned to eliminate duplicates Z: 34 45.167 2.014 0.861 0.815 1.000 0.727 CB 1.595 34 residues pruned to eliminate duplicates Z: 43 53.296 2.331 0.687 0.691 0.952 0.667 CB 1.844 45 residues pruned to eliminate duplicates Z: 6 6.586 1.796 0.805 0.359 0.800 0.800 CB 1.322 6 residues pruned to eliminate duplicates Z: 35 37.941 2.172 0.773 0.567 0.882 0.588 CB 1.795 35 residues pruned to eliminate duplicates Z: 6 5.148 1.866 1.009 0.178 0.800 0.400 CA 1.133 6 residues pruned to eliminate duplicates Z: 28 46.676 2.362 0.805 0.711 0.889 0.630 CA 1.958 29 residues pruned to eliminate duplicates Z: 21 33.664 2.293 0.726 0.700 0.850 0.500 C 1.865 21 residues pruned to eliminate duplicates Z: 43 60.125 2.333 0.850 0.697 0.952 0.738 CB 1.886 42 residues pruned to eliminate duplicates Z: 18 48.771 2.459 0.748 0.886 1.000 0.824 CA 1.986 18 residues pruned to eliminate duplicates Z: 44 59.197 2.317 0.835 0.690 0.953 0.814 CB 1.871 44 residues pruned to eliminate duplicates Z: 48 51.719 2.227 0.748 0.600 0.979 0.681 CB 1.800 48 residues pruned to eliminate duplicates Z: 27 51.953 2.425 0.946 0.730 0.885 0.654 C 1.983 27 residues pruned to eliminate duplicates Z: 30 48.075 2.301 0.839 0.705 0.931 0.690 C 1.881 30 residues pruned to eliminate duplicates Z: 44 58.111 2.328 0.794 0.669 0.953 0.721 C 1.904 44 residues pruned to eliminate duplicates Z: 19 43.037 2.352 0.752 0.844 0.944 0.722 CA 1.939 19 residues pruned to eliminate duplicates Z: 42 64.316 2.365 0.865 0.718 0.976 0.707 CB 1.916 43 residues pruned to eliminate duplicates Z: 19 50.517 2.329 0.971 0.876 1.000 0.833 C 1.884 19 residues pruned to eliminate duplicates Z: 52 49.777 2.193 0.793 0.613 0.902 0.686 CB 1.765 51 residues pruned to eliminate duplicates Z: 19 41.582 2.310 0.678 0.872 1.000 0.778 C 1.842 19 residues pruned to eliminate duplicates Z: 30 47.247 2.291 0.822 0.719 0.931 0.759 C 1.851 30 residues pruned to eliminate duplicates Z: 43 60.662 2.327 0.841 0.689 0.976 0.762 CB 1.883 43 residues pruned to eliminate duplicates Z: 27 48.753 2.400 0.981 0.743 0.846 0.692 C 1.912 27 residues pruned to eliminate duplicates Z: 41 62.631 2.402 0.844 0.711 0.950 0.750 CB 1.944 42 residues pruned to eliminate duplicates Z: 11 20.169 2.052 0.762 0.722 1.000 1.000 CA 1.444 11 residues pruned to eliminate duplicates Z: 42 64.789 2.376 0.930 0.704 0.951 0.805 CB 1.927 42 residues pruned to eliminate duplicates Z: 43 53.842 2.332 0.716 0.692 0.952 0.762 CB 1.829 43 residues pruned to eliminate duplicates Z: 44 62.033 2.329 0.871 0.680 0.977 0.767 CB 1.884 43 residues pruned to eliminate duplicates Z: 6 5.873 1.708 0.299 0.399 1.000 0.600 C 1.317 6 residues pruned to eliminate duplicates Z: 42 59.912 2.376 0.878 0.699 0.902 0.756 CB 1.937 42 residues pruned to eliminate duplicates Z: 42 58.605 2.368 0.830 0.684 0.927 0.805 CB 1.926 42 residues pruned to eliminate duplicates Z: 44 57.846 2.312 0.867 0.686 0.953 0.791 CB 1.807 43 residues pruned to eliminate duplicates Z: 10 25.983 2.321 0.768 0.728 1.000 1.000 CB 1.719 10 residues pruned to eliminate duplicates Z: 45 59.524 2.299 0.814 0.663 0.977 0.773 CB 1.893 45 residues pruned to eliminate duplicates Z: 43 54.083 2.328 0.788 0.687 0.929 0.738 CB 1.820 43 residues pruned to eliminate duplicates Z: 19 24.880 2.139 0.617 0.594 1.000 0.667 CB 1.550 19 residues pruned to eliminate duplicates Z: 12 12.992 2.096 0.496 0.529 0.909 0.545 CB 1.335 12 residues pruned to eliminate duplicates Z: 7 15.002 2.150 0.268 0.878 1.000 0.833 CB 1.630 7 residues pruned to eliminate duplicates Z: 74 66.394 2.287 0.838 0.639 0.945 0.699 CB 1.718 118 residues pruned to eliminate duplicates Z: 184 94.242 2.276 0.684 0.635 0.945 0.760 CB 1.693 184 residues pruned to eliminate duplicates Z: 49 46.019 2.279 0.774 0.643 0.875 0.646 CB 1.643 49 residues pruned to eliminate duplicates Z: 58 40.133 2.153 0.754 0.514 0.912 0.667 CB 1.522 58 residues pruned to eliminate duplicates Z: 102 70.955 2.218 0.866 0.578 0.960 0.703 CB 1.649 102 residues pruned to eliminate duplicates Z: 63 37.077 2.106 0.738 0.484 0.887 0.629 CB 1.473 63 residues pruned to eliminate duplicates Z: 35 37.679 2.133 0.916 0.573 1.000 0.676 CB 1.473 35 residues pruned to eliminate duplicates Z: 62 47.199 2.145 0.819 0.531 0.967 0.721 CB 1.552 62 residues pruned to eliminate duplicates Z: 175 88.252 2.270 0.672 0.645 0.943 0.741 CB 1.633 175 residues pruned to eliminate duplicates Z: 40 38.901 2.123 0.898 0.628 0.949 0.641 CB 1.444 40 residues pruned to eliminate duplicates Z: 175 92.335 2.273 0.731 0.647 0.948 0.713 CB 1.636 175 residues pruned to eliminate duplicates Z: 62 44.964 2.129 0.828 0.510 0.951 0.590 CB 1.539 62 residues pruned to eliminate duplicates Z: 14 19.150 2.104 0.723 0.605 1.000 0.769 CB 1.325 14 residues pruned to eliminate duplicates Z: 61 44.997 2.148 0.795 0.516 0.950 0.683 CB 1.561 61 residues pruned to eliminate duplicates Z: 174 85.765 2.226 0.704 0.621 0.960 0.751 CB 1.599 174 residues pruned to eliminate duplicates Z: 62 48.221 2.142 0.823 0.519 0.984 0.656 CB 1.578 62 residues pruned to eliminate duplicates Z: 30 36.299 2.120 1.103 0.552 0.931 0.690 CB 1.544 30 residues pruned to eliminate duplicates Z: 171 90.429 2.248 0.762 0.636 0.941 0.700 CB 1.637 171 residues pruned to eliminate duplicates Z: 91 65.877 2.228 0.812 0.593 0.978 0.700 CB 1.609 91 residues pruned to eliminate duplicates Z: 34 32.766 2.096 0.938 0.519 0.939 0.636 CB 1.468 34 residues pruned to eliminate duplicates Z: 62 49.338 2.142 0.960 0.528 0.967 0.623 CB 1.513 62 residues pruned to eliminate duplicates Z: 36 35.458 2.139 0.946 0.608 0.914 0.600 CB 1.422 36 residues pruned to eliminate duplicates Z: 101 72.044 2.245 0.889 0.585 0.950 0.680 CB 1.649 101 residues pruned to eliminate duplicates Z: 55 46.000 2.160 0.901 0.537 0.963 0.648 CB 1.527 55 residues pruned to eliminate duplicates Z: 60 48.941 2.143 0.937 0.540 0.966 0.695 CB 1.527 60 residues pruned to eliminate duplicates Z: 33 38.036 2.223 0.984 0.588 0.938 0.594 CB 1.494 33 residues pruned to eliminate duplicates Z: 63 45.038 2.145 0.823 0.507 0.952 0.694 CB 1.526 63 residues pruned to eliminate duplicates Z: 73 72.265 2.307 0.949 0.656 0.972 0.708 CB 1.685 73 residues pruned to eliminate duplicates Z: 64 45.053 2.098 0.887 0.503 0.968 0.651 CB 1.475 64 residues pruned to eliminate duplicates Z: 57 45.462 2.125 0.894 0.532 0.982 0.625 CB 1.490 57 residues pruned to eliminate duplicates Z: 104 70.047 2.205 0.874 0.582 0.971 0.728 CB 1.589 104 residues pruned to eliminate duplicates Z: 186 96.033 2.280 0.717 0.635 0.946 0.735 CB 1.681 186 residues pruned to eliminate duplicates Z: 70 53.423 2.172 0.885 0.531 0.971 0.667 CB 1.570 70 residues pruned to eliminate duplicates Z: 67 42.614 2.092 0.889 0.465 0.909 0.636 CB 1.512 67 residues pruned to eliminate duplicates Z: 62 46.653 2.140 0.816 0.516 0.984 0.639 CB 1.538 62 residues pruned to eliminate duplicates Z: 64 45.837 2.119 0.862 0.504 0.952 0.635 CB 1.530 64 residues pruned to eliminate duplicates Z: 16 22.890 2.092 0.899 0.416 1.000 0.533 CA 1.625 16 residues pruned to eliminate duplicates Z: 28 26.388 2.061 0.739 0.444 0.926 0.630 CB 1.621 28 residues pruned to eliminate duplicates Z: 28 25.809 2.091 0.772 0.430 0.889 0.593 CB 1.622 28 residues pruned to eliminate duplicates Z: 30 23.269 1.999 0.719 0.394 0.897 0.552 CB 1.568 30 residues pruned to eliminate duplicates Z: 29 25.562 2.041 0.702 0.403 0.964 0.571 CB 1.598 29 residues pruned to eliminate duplicates Z: 28 27.989 2.095 0.694 0.424 1.000 0.556 CB 1.643 28 residues pruned to eliminate duplicates Z: 35 23.815 2.093 0.628 0.349 0.912 0.500 CB 1.548 35 residues pruned to eliminate duplicates Z: 144 74.597 2.248 0.681 0.606 0.916 0.685 CB 1.629 144 residues pruned to eliminate duplicates Z: 22 26.262 2.108 0.727 0.458 0.952 0.667 C 1.726 22 residues pruned to eliminate duplicates Z: 28 25.659 2.096 0.713 0.425 0.889 0.630 CB 1.672 28 residues pruned to eliminate duplicates Z: 34 21.313 1.960 0.642 0.356 0.879 0.515 CB 1.533 34 residues pruned to eliminate duplicates Z: 28 27.626 2.107 0.882 0.440 0.852 0.630 CB 1.674 28 residues pruned to eliminate duplicates Z: 97 59.943 2.239 0.557 0.632 0.927 0.750 CB 1.672 97 residues pruned to eliminate duplicates Z: 26 24.811 2.082 0.607 0.458 0.920 0.640 CA 1.683 26 residues pruned to eliminate duplicates Z: 28 25.790 2.103 0.563 0.425 0.963 0.667 CB 1.695 28 residues pruned to eliminate duplicates Z: 31 22.053 2.090 0.488 0.382 0.900 0.633 CB 1.630 31 residues pruned to eliminate duplicates Z: 29 25.731 2.087 0.690 0.445 0.893 0.679 CB 1.633 29 residues pruned to eliminate duplicates Z: 27 25.609 2.109 0.627 0.470 0.923 0.654 CB 1.634 27 residues pruned to eliminate duplicates Z: 30 26.016 2.038 0.790 0.421 0.897 0.517 CB 1.605 30 residues pruned to eliminate duplicates Z: 28 24.699 2.115 0.702 0.410 0.889 0.593 CB 1.632 28 residues pruned to eliminate duplicates Z: 28 26.898 2.060 0.792 0.444 0.926 0.667 CB 1.604 28 residues pruned to eliminate duplicates Z: 30 26.324 2.023 0.791 0.440 0.897 0.552 CB 1.600 30 residues pruned to eliminate duplicates Z: 34 23.835 1.924 0.705 0.367 0.939 0.606 CB 1.553 34 residues pruned to eliminate duplicates Z: 29 27.423 2.060 0.734 0.436 0.929 0.679 CB 1.669 29 residues pruned to eliminate duplicates Z: 59 44.117 2.112 0.885 0.454 0.966 0.534 CB 1.580 59 residues pruned to eliminate duplicates Z: 33 23.077 2.004 0.628 0.395 0.906 0.594 CB 1.541 33 residues pruned to eliminate duplicates Z: 37 22.544 2.051 0.574 0.367 0.833 0.639 CB 1.611 37 residues pruned to eliminate duplicates Z: 37 23.769 2.083 0.590 0.376 0.833 0.500 CB 1.638 37 residues pruned to eliminate duplicates Z: 35 22.303 2.085 0.590 0.371 0.853 0.676 CB 1.553 35 residues pruned to eliminate duplicates Z: 9 3.576 1.973 0.107 0.244 0.625 0.250 CB 1.245 9 residues pruned to eliminate duplicates Z: 100 67.736 2.255 0.621 0.668 0.949 0.778 CB 1.680 100 residues pruned to eliminate duplicates Z: 126 80.805 2.309 0.641 0.670 0.944 0.784 CB 1.727 126 residues pruned to eliminate duplicates Z: 11 4.373 1.885 0.196 0.168 0.700 0.400 CB 1.311 11 residues pruned to eliminate duplicates Z: 39 24.717 2.039 0.705 0.382 0.842 0.605 CB 1.553 39 residues pruned to eliminate duplicates Z: 50 55.607 2.329 0.846 0.701 0.939 0.673 CB 1.639 50 residues pruned to eliminate duplicates Z: 105 81.977 2.341 0.715 0.727 0.962 0.750 CB 1.697 105 residues pruned to eliminate duplicates Z: 105 87.798 2.370 0.677 0.746 0.981 0.779 CB 1.772 105 residues pruned to eliminate duplicates Z: 64 64.387 2.304 0.642 0.789 0.968 0.762 CB 1.717 64 residues pruned to eliminate duplicates Z: 110 75.692 2.292 0.670 0.660 0.954 0.771 CB 1.711 110 residues pruned to eliminate duplicates Z: 77 74.143 2.380 0.650 0.765 0.974 0.842 CB 1.758 77 residues pruned to eliminate duplicates Z: 100 82.366 2.375 0.665 0.753 0.949 0.788 CB 1.760 100 residues pruned to eliminate duplicates Z: 108 89.428 2.363 0.732 0.758 0.963 0.794 CB 1.745 108 residues pruned to eliminate duplicates Z: 132 87.310 2.329 0.651 0.722 0.954 0.771 CB 1.701 132 residues pruned to eliminate duplicates Z: 74 64.907 2.283 0.601 0.757 0.973 0.808 CB 1.700 74 residues pruned to eliminate duplicates Z: 126 87.135 2.307 0.723 0.677 0.952 0.768 CB 1.750 126 residues pruned to eliminate duplicates Z: 66 74.077 2.335 0.748 0.819 1.000 0.846 CB 1.707 66 residues pruned to eliminate duplicates Z: 101 86.593 2.346 0.753 0.744 0.970 0.780 CB 1.745 101 residues pruned to eliminate duplicates Z: 67 72.358 2.311 0.778 0.805 0.970 0.773 CB 1.714 67 residues pruned to eliminate duplicates Z: 79 75.036 2.314 0.796 0.751 0.974 0.808 CB 1.677 79 residues pruned to eliminate duplicates Z: 97 73.167 2.269 0.702 0.741 0.927 0.771 CB 1.681 97 residues pruned to eliminate duplicates Z: 79 72.929 2.343 0.740 0.750 0.949 0.821 CB 1.708 79 residues pruned to eliminate duplicates Z: 102 81.561 2.360 0.744 0.744 0.921 0.792 CB 1.721 102 residues pruned to eliminate duplicates Z: 109 84.973 2.356 0.720 0.741 0.954 0.787 CB 1.705 109 residues pruned to eliminate duplicates Z: 100 89.455 2.388 0.777 0.760 0.960 0.848 CB 1.752 100 residues pruned to eliminate duplicates Z: 60 80.979 2.357 0.967 0.822 0.983 0.864 CB 1.750 60 residues pruned to eliminate duplicates Z: 119 87.903 2.342 0.748 0.716 0.924 0.754 CB 1.760 119 residues pruned to eliminate duplicates Z: 93 85.145 2.370 0.763 0.776 0.946 0.761 CB 1.761 93 residues pruned to eliminate duplicates Z: 46 46.076 2.262 0.450 0.773 0.933 0.844 CB 1.763 46 residues pruned to eliminate duplicates Z: 94 87.388 2.378 0.776 0.775 0.957 0.828 CB 1.758 94 residues pruned to eliminate duplicates Z: 38 52.645 2.290 1.074 0.711 0.946 0.757 CB 1.590 38 residues pruned to eliminate duplicates Z: 98 71.403 2.299 0.628 0.674 0.938 0.742 CB 1.758 98 residues pruned to eliminate duplicates Z: 93 83.913 2.364 0.702 0.784 0.957 0.815 CB 1.770 93 residues pruned to eliminate duplicates Z: 109 85.644 2.340 0.737 0.748 0.926 0.722 CB 1.754 109 residues pruned to eliminate duplicates Z: 131 82.317 2.305 0.720 0.681 0.900 0.685 CB 1.713 131 residues pruned to eliminate duplicates Z: 66 72.908 2.327 0.784 0.820 0.923 0.738 CB 1.788 66 residues pruned to eliminate duplicates Z: 69 75.634 2.304 0.843 0.795 0.956 0.779 CB 1.745 69 residues pruned to eliminate duplicates Z: 100 92.281 2.361 0.872 0.761 0.960 0.737 CB 1.735 100 residues pruned to eliminate duplicates Z: 43 62.034 2.291 0.794 0.807 0.976 0.667 CB 1.825 43 residues pruned to eliminate duplicates Z: 46 72.118 2.339 1.164 0.803 0.956 0.822 CB 1.706 46 residues pruned to eliminate duplicates Z: 79 83.583 2.342 0.926 0.742 0.962 0.795 CB 1.757 79 residues pruned to eliminate duplicates Z: 66 82.979 2.340 1.021 0.815 0.954 0.738 CB 1.735 66 residues pruned to eliminate duplicates Z: 115 89.949 2.337 0.743 0.744 0.947 0.772 CB 1.754 115 residues pruned to eliminate duplicates Z: 61 84.207 2.353 1.049 0.836 0.950 0.733 CB 1.777 61 residues pruned to eliminate duplicates Z: 102 95.863 2.359 0.903 0.770 0.960 0.723 CB 1.742 102 residues pruned to eliminate duplicates Z: 72 80.302 2.313 0.941 0.780 0.958 0.831 CB 1.731 72 residues pruned to eliminate duplicates Z: 109 98.715 2.337 0.946 0.748 0.963 0.694 CB 1.737 109 residues pruned to eliminate duplicates Z: 86 77.918 2.304 0.835 0.727 0.929 0.635 CB 1.753 86 residues pruned to eliminate duplicates Z: 58 69.260 2.300 0.880 0.754 0.947 0.702 CB 1.785 58 residues pruned to eliminate duplicates Z: 67 87.622 2.351 1.044 0.815 0.970 0.788 CB 1.760 67 residues pruned to eliminate duplicates Z: 100 92.600 2.342 0.968 0.764 0.929 0.717 CB 1.719 100 residues pruned to eliminate duplicates Z: 68 78.673 2.301 0.982 0.808 0.955 0.776 CB 1.687 68 residues pruned to eliminate duplicates Z: 85 79.397 2.317 0.844 0.718 0.964 0.619 CB 1.726 85 residues pruned to eliminate duplicates Z: 65 93.434 2.358 1.131 0.833 0.969 0.703 CB 1.800 65 residues pruned to eliminate duplicates Z: 130 96.114 2.290 0.898 0.728 0.938 0.690 CB 1.691 130 residues pruned to eliminate duplicates Z: 53 75.751 2.314 1.006 0.757 0.962 0.750 CB 1.873 53 residues pruned to eliminate duplicates Z: 107 100.733 2.343 0.980 0.768 0.962 0.708 CB 1.729 107 residues pruned to eliminate duplicates Z: 113 97.475 2.342 0.917 0.730 0.964 0.688 CB 1.730 113 residues pruned to eliminate duplicates Z: 43 66.580 2.264 0.961 0.824 0.976 0.714 C 1.790 43 residues pruned to eliminate duplicates Z: 63 91.223 2.339 1.093 0.842 0.984 0.774 CB 1.792 63 residues pruned to eliminate duplicates Z: 92 90.369 2.321 1.005 0.745 0.945 0.736 CB 1.730 92 residues pruned to eliminate duplicates Z: 94 94.834 2.337 0.926 0.768 0.957 0.796 CB 1.801 94 residues pruned to eliminate duplicates Z: 108 98.074 2.352 0.899 0.760 0.972 0.701 CB 1.733 108 residues pruned to eliminate duplicates Z: 105 95.626 2.350 0.928 0.733 0.952 0.673 CB 1.763 105 residues pruned to eliminate duplicates Z: 107 103.487 2.363 0.954 0.761 0.981 0.717 CB 1.760 107 residues pruned to eliminate duplicates Z: 100 94.318 2.345 0.955 0.756 0.949 0.737 CB 1.733 100 residues pruned to eliminate duplicates Z: 76 86.758 2.349 1.040 0.770 0.947 0.733 CB 1.738 76 residues pruned to eliminate duplicates Z: 98 95.276 2.345 0.955 0.755 0.959 0.784 CB 1.754 98 residues pruned to eliminate duplicates Z: 110 93.404 2.344 0.948 0.724 0.927 0.743 CB 1.727 110 residues pruned to eliminate duplicates Z: 85 77.255 2.315 0.838 0.713 0.940 0.726 CB 1.736 85 residues pruned to eliminate duplicates Z: 137 93.827 2.312 0.863 0.705 0.919 0.647 CB 1.686 137 residues pruned to eliminate duplicates Z: 100 95.810 2.353 1.012 0.766 0.939 0.717 CB 1.710 100 residues pruned to eliminate duplicates Z: 93 102.082 2.360 1.064 0.786 0.967 0.783 CB 1.755 93 residues pruned to eliminate duplicates Z: 107 97.261 2.359 0.920 0.751 0.962 0.698 CB 1.732 107 residues pruned to eliminate duplicates Z: 92 100.955 2.364 0.989 0.791 0.978 0.769 CB 1.782 92 residues pruned to eliminate duplicates Z: 108 99.412 2.364 0.979 0.747 0.944 0.692 CB 1.744 108 residues pruned to eliminate duplicates Z: 126 95.211 2.309 0.916 0.730 0.928 0.624 CB 1.687 126 residues pruned to eliminate duplicates Z: 54 71.766 2.322 0.938 0.747 0.981 0.755 CB 1.790 54 residues pruned to eliminate duplicates Z: 93 94.432 2.350 1.012 0.771 0.946 0.739 CB 1.733 93 residues pruned to eliminate duplicates Z: 83 87.548 2.323 1.034 0.757 0.963 0.646 CB 1.690 83 residues pruned to eliminate duplicates Z: 108 97.137 2.312 1.000 0.735 0.944 0.729 CB 1.741 108 residues pruned to eliminate duplicates Z: 94 94.061 2.347 0.974 0.776 0.946 0.806 CB 1.744 94 residues pruned to eliminate duplicates Z: 108 97.081 2.320 0.947 0.745 0.963 0.664 CB 1.733 108 residues pruned to eliminate duplicates Z: 19 26.083 2.321 0.636 0.630 0.833 0.611 CB 1.719 19 residues pruned to eliminate duplicates Z: 116 94.266 2.298 1.009 0.707 0.922 0.626 CB 1.711 116 residues pruned to eliminate duplicates Z: 76 86.025 2.358 0.892 0.764 0.973 0.760 CB 1.810 76 residues pruned to eliminate duplicates Z: 92 101.151 2.374 1.012 0.798 0.967 0.703 CB 1.769 92 residues pruned to eliminate duplicates Z: 110 95.592 2.342 1.014 0.738 0.927 0.661 CB 1.691 110 residues pruned to eliminate duplicates Z: 109 102.137 2.358 1.018 0.744 0.963 0.676 CB 1.725 109 residues pruned to eliminate duplicates Z: 100 98.023 2.371 0.943 0.755 0.960 0.737 CB 1.775 100 residues pruned to eliminate duplicates Z: 127 93.566 2.269 0.983 0.677 0.944 0.690 CB 1.666 127 residues pruned to eliminate duplicates Z: 69 89.064 2.362 0.978 0.772 0.985 0.691 CB 1.845 69 residues pruned to eliminate duplicates Z: 95 107.260 2.387 1.083 0.784 0.968 0.755 CB 1.790 95 residues pruned to eliminate duplicates Z: 148 94.281 2.263 0.851 0.690 0.932 0.673 CB 1.673 148 residues pruned to eliminate duplicates Z: 17 23.548 2.249 0.778 0.509 1.000 0.562 CB 1.459 17 residues pruned to eliminate duplicates Z: 85 90.459 2.339 0.947 0.746 0.964 0.690 CB 1.804 85 residues pruned to eliminate duplicates Z: 18 17.697 2.123 0.752 0.475 0.882 0.294 CB 1.341 18 residues pruned to eliminate duplicates Z: 76 83.972 2.354 0.894 0.754 0.973 0.747 CB 1.782 76 residues pruned to eliminate duplicates Z: 110 95.127 2.324 0.993 0.736 0.954 0.697 CB 1.668 110 residues pruned to eliminate duplicates Z: 16 19.873 2.239 0.578 0.486 1.000 0.400 CB 1.474 16 residues pruned to eliminate duplicates Z: 120 97.934 2.341 0.889 0.723 0.933 0.689 CB 1.780 120 residues pruned to eliminate duplicates Z: 135 96.600 2.293 0.907 0.720 0.925 0.701 CB 1.691 135 residues pruned to eliminate duplicates Z: 9 23.031 2.292 0.855 0.634 1.000 0.625 CA 1.689 9 residues pruned to eliminate duplicates Z: 14 13.060 2.137 0.459 0.561 0.769 0.538 CB 1.424 14 residues pruned to eliminate duplicates Z: 11 11.902 2.058 0.666 0.514 0.800 0.400 CA 1.354 11 residues pruned to eliminate duplicates Z: 55 49.162 2.227 0.698 0.634 0.926 0.685 CB 1.685 55 residues pruned to eliminate duplicates Z: 20 17.102 2.138 0.218 0.534 0.895 0.632 CB 1.629 20 residues pruned to eliminate duplicates Z: 54 46.023 2.213 0.634 0.632 0.906 0.660 CB 1.706 54 residues pruned to eliminate duplicates Z: 46 43.249 2.173 0.757 0.610 0.933 0.711 CB 1.629 46 residues pruned to eliminate duplicates Z: 53 52.292 2.242 0.785 0.633 0.923 0.712 CB 1.733 53 residues pruned to eliminate duplicates Z: 18 24.892 2.271 0.647 0.560 0.882 0.471 CB 1.727 18 residues pruned to eliminate duplicates Z: 13 10.607 2.054 0.128 0.516 0.833 0.583 C 1.561 13 residues pruned to eliminate duplicates Z: 49 39.618 2.099 0.577 0.605 0.958 0.729 CB 1.631 49 residues pruned to eliminate duplicates Z: 27 25.681 2.203 0.511 0.540 0.846 0.654 CB 1.720 27 residues pruned to eliminate duplicates Z: 18 10.902 1.971 0.395 0.396 0.765 0.412 CB 1.403 18 residues pruned to eliminate duplicates Z: 46 50.535 2.227 0.793 0.657 0.978 0.733 CB 1.668 46 residues pruned to eliminate duplicates Z: 51 44.805 2.147 0.772 0.594 0.940 0.620 CB 1.620 51 residues pruned to eliminate duplicates Z: 55 51.678 2.194 0.838 0.621 0.963 0.648 CB 1.615 55 residues pruned to eliminate duplicates Z: 46 48.937 2.208 0.788 0.641 0.956 0.644 CB 1.694 46 residues pruned to eliminate duplicates Z: 53 59.385 2.224 0.882 0.655 0.981 0.712 CB 1.736 53 residues pruned to eliminate duplicates Z: 37 50.608 2.184 1.009 0.668 0.972 0.750 CB 1.693 37 residues pruned to eliminate duplicates Z: 9 25.638 2.161 1.421 0.653 0.875 0.875 CA 1.718 9 residues pruned to eliminate duplicates Z: 37 48.096 2.177 1.060 0.658 0.944 0.667 CB 1.634 37 residues pruned to eliminate duplicates Z: 47 50.320 2.200 0.839 0.629 0.957 0.652 CB 1.698 47 residues pruned to eliminate duplicates Z: 37 48.287 2.183 0.966 0.635 0.972 0.694 CB 1.699 37 residues pruned to eliminate duplicates Z: 54 53.707 2.230 0.894 0.611 0.943 0.623 CB 1.665 54 residues pruned to eliminate duplicates Z: 36 48.474 2.198 0.974 0.667 0.971 0.714 CB 1.666 36 residues pruned to eliminate duplicates Z: 35 41.227 2.165 0.868 0.642 0.971 0.706 CB 1.578 35 residues pruned to eliminate duplicates Z: 37 46.460 2.154 1.007 0.654 0.944 0.722 CB 1.643 37 residues pruned to eliminate duplicates Z: 37 41.076 2.159 0.836 0.624 0.944 0.694 CB 1.627 37 residues pruned to eliminate duplicates Z: 53 57.772 2.238 0.906 0.637 0.962 0.673 CB 1.718 53 residues pruned to eliminate duplicates Z: 17 29.169 2.127 0.589 0.875 1.000 0.688 CB 1.570 17 residues pruned to eliminate duplicates Z: 36 49.879 2.209 0.992 0.635 0.971 0.771 CB 1.738 36 residues pruned to eliminate duplicates Z: 37 44.635 2.150 0.946 0.643 0.944 0.722 CB 1.647 37 residues pruned to eliminate duplicates Z: 46 52.471 2.218 0.910 0.645 0.956 0.667 CB 1.688 46 residues pruned to eliminate duplicates Z: 44 52.059 2.230 0.849 0.630 0.977 0.744 CB 1.745 44 residues pruned to eliminate duplicates Z: 38 45.447 2.195 0.993 0.625 0.946 0.703 CB 1.605 38 residues pruned to eliminate duplicates Z: 46 51.365 2.226 0.874 0.636 0.956 0.711 CB 1.691 46 residues pruned to eliminate duplicates Z: 62 48.856 2.174 0.785 0.587 0.934 0.689 CB 1.587 62 residues pruned to eliminate duplicates Z: 58 51.456 2.214 0.829 0.617 0.930 0.719 CB 1.621 58 residues pruned to eliminate duplicates Z: 45 56.390 2.241 0.956 0.635 0.977 0.705 CB 1.747 45 residues pruned to eliminate duplicates Z: 45 53.504 2.238 0.922 0.643 0.955 0.659 CB 1.719 45 residues pruned to eliminate duplicates Z: 37 52.667 2.189 1.160 0.663 0.944 0.694 CB 1.690 37 residues pruned to eliminate duplicates Z: 36 45.097 2.153 0.910 0.647 0.971 0.686 CB 1.664 36 residues pruned to eliminate duplicates Z: 38 48.699 2.147 0.947 0.627 1.000 0.730 CB 1.699 38 residues pruned to eliminate duplicates Z: 53 55.462 2.215 0.858 0.638 0.962 0.654 CB 1.708 53 residues pruned to eliminate duplicates Z: 36 48.864 2.216 0.952 0.670 0.971 0.771 CB 1.680 36 residues pruned to eliminate duplicates Z: 36 55.448 2.235 1.105 0.674 0.971 0.800 CB 1.747 36 residues pruned to eliminate duplicates Z: 6 4.993 1.478 0.696 0.374 1.000 0.600 C 1.019 6 residues pruned to eliminate duplicates Z: 55 54.831 2.184 0.857 0.629 0.963 0.667 CB 1.693 55 residues pruned to eliminate duplicates Z: 8 15.436 2.222 0.576 0.466 1.000 0.714 CA 1.725 8 residues pruned to eliminate duplicates Z: 58 38.032 2.129 0.604 0.551 0.860 0.632 CB 1.633 58 residues pruned to eliminate duplicates Z: 38 44.822 2.248 0.675 0.657 0.919 0.595 CA 1.840 38 residues pruned to eliminate duplicates Z: 9 8.122 1.868 0.398 0.357 1.000 0.375 CA 1.282 9 residues pruned to eliminate duplicates Z: 10 8.293 1.960 0.082 0.403 1.000 0.556 CB 1.444 10 residues pruned to eliminate duplicates Z: 8 10.649 2.155 0.326 0.554 0.857 0.857 CA 1.558 8 residues pruned to eliminate duplicates Z: 11 8.825 1.953 0.329 0.395 0.900 0.600 CB 1.335 11 residues pruned to eliminate duplicates Z: 21 16.626 2.051 0.406 0.441 0.900 0.550 CB 1.523 21 residues pruned to eliminate duplicates Z: 13 15.737 2.126 0.597 0.480 0.833 0.500 CB 1.638 13 residues pruned to eliminate duplicates Z: 29 48.057 2.364 0.685 0.765 0.929 0.714 C 1.942 29 residues pruned to eliminate duplicates Z: 34 39.755 2.279 0.667 0.705 0.848 0.667 CB 1.782 34 residues pruned to eliminate duplicates Z: 13 10.364 1.945 0.413 0.389 0.833 0.417 CA 1.470 13 residues pruned to eliminate duplicates Z: 19 21.726 2.173 0.621 0.473 0.944 0.611 CB 1.583 19 residues pruned to eliminate duplicates Z: 40 46.432 2.258 0.754 0.670 0.897 0.564 CB 1.788 40 residues pruned to eliminate duplicates Z: 19 18.238 2.138 0.483 0.421 0.889 0.611 CB 1.655 19 residues pruned to eliminate duplicates Z: 32 43.857 2.239 0.691 0.729 0.935 0.710 CB 1.809 32 residues pruned to eliminate duplicates Z: 21 23.037 2.151 0.510 0.503 0.950 0.350 CB 1.664 21 residues pruned to eliminate duplicates Z: 41 34.922 2.160 0.593 0.586 0.875 0.575 CB 1.688 41 residues pruned to eliminate duplicates Z: 39 44.974 2.268 0.691 0.669 0.895 0.632 CB 1.818 39 residues pruned to eliminate duplicates Z: 37 43.571 2.262 0.678 0.661 0.944 0.639 CB 1.745 37 residues pruned to eliminate duplicates Z: 37 34.159 2.151 0.590 0.634 0.889 0.556 CB 1.652 37 residues pruned to eliminate duplicates Z: 33 38.511 2.236 0.610 0.665 0.906 0.625 CB 1.791 33 residues pruned to eliminate duplicates Z: 31 47.559 2.289 0.848 0.702 0.967 0.633 CA 1.766 31 residues pruned to eliminate duplicates Z: 24 33.672 2.310 0.553 0.767 0.870 0.739 CA 1.776 24 residues pruned to eliminate duplicates Z: 52 41.217 2.159 0.640 0.595 0.941 0.647 CB 1.582 54 residues pruned to eliminate duplicates Z: 18 43.888 2.368 0.769 0.890 0.941 0.882 CA 1.942 18 residues pruned to eliminate duplicates Z: 42 36.327 2.154 0.607 0.583 0.902 0.634 CB 1.678 35 residues pruned to eliminate duplicates Z: 25 47.362 2.346 0.814 0.853 0.875 0.750 CB 1.919 25 residues pruned to eliminate duplicates Z: 32 48.365 2.245 0.823 0.695 0.968 0.645 CB 1.835 32 residues pruned to eliminate duplicates Z: 33 43.132 2.215 0.770 0.685 0.906 0.594 CB 1.811 33 residues pruned to eliminate duplicates Z: 47 39.530 2.138 0.598 0.607 0.913 0.587 CB 1.687 47 residues pruned to eliminate duplicates Z: 45 41.957 2.186 0.689 0.597 0.909 0.705 CB 1.717 45 residues pruned to eliminate duplicates Z: 58 37.866 2.104 0.556 0.555 0.912 0.579 CB 1.593 59 residues pruned to eliminate duplicates Z: 18 44.845 2.294 0.918 0.925 0.941 0.824 C 1.843 18 residues pruned to eliminate duplicates Z: 51 36.976 2.151 0.573 0.571 0.860 0.640 CB 1.677 51 residues pruned to eliminate duplicates Z: 32 41.604 2.238 0.809 0.696 0.871 0.613 CA 1.771 32 residues pruned to eliminate duplicates Z: 34 39.479 2.142 0.733 0.675 0.939 0.606 CB 1.678 39 residues pruned to eliminate duplicates Z: 6 4.254 1.974 0.120 0.484 0.800 0.600 CA 1.092 6 residues pruned to eliminate duplicates Z: 59 41.405 2.143 0.603 0.572 0.914 0.621 CB 1.616 59 residues pruned to eliminate duplicates Z: 40 37.121 2.176 0.701 0.587 0.897 0.641 CB 1.646 40 residues pruned to eliminate duplicates Z: 37 34.446 2.102 0.653 0.576 0.917 0.528 CB 1.675 37 residues pruned to eliminate duplicates Z: 48 37.286 2.122 0.529 0.624 0.936 0.660 CB 1.593 48 residues pruned to eliminate duplicates Z: 23 9.971 1.827 0.249 0.389 0.864 0.545 CB 1.213 16 residues pruned to eliminate duplicates Z: 11 11.592 1.614 0.587 0.552 1.000 0.500 CB 1.360 11 residues pruned to eliminate duplicates Z: 42 34.813 2.187 0.519 0.607 0.927 0.561 CB 1.595 42 residues pruned to eliminate duplicates Z: 18 13.137 1.957 0.480 0.464 0.824 0.471 CB 1.386 18 residues pruned to eliminate duplicates Z: 40 37.275 2.156 0.588 0.573 0.974 0.641 CB 1.668 40 residues pruned to eliminate duplicates Z: 24 12.040 1.836 0.447 0.350 0.870 0.478 CB 1.278 26 residues pruned to eliminate duplicates Z: 10 9.865 1.546 0.682 0.743 1.000 0.556 CB 1.017 10 residues pruned to eliminate duplicates Z: 59 41.207 2.111 0.663 0.586 0.914 0.621 CB 1.552 59 residues pruned to eliminate duplicates Z: 61 39.616 2.106 0.617 0.561 0.900 0.600 CB 1.573 60 residues pruned to eliminate duplicates Z: 10 8.429 1.738 0.562 0.615 0.778 0.444 CB 1.194 10 residues pruned to eliminate duplicates Z: 96 68.414 2.252 0.762 0.591 0.926 0.632 CB 1.751 88 residues pruned to eliminate duplicates Z: 6 5.834 1.591 0.586 0.457 1.000 0.800 CA 1.080 5 residues pruned to eliminate duplicates Z: 6 4.245 1.367 0.892 0.287 1.000 0.600 CB 0.934 4 residues pruned to eliminate duplicates Z: 25 44.203 2.195 0.814 0.841 1.000 0.917 CB 1.690 26 residues pruned to eliminate duplicates Z: 23 45.209 2.203 0.927 0.907 0.955 0.727 CB 1.690 23 residues pruned to eliminate duplicates Z: 100 81.033 2.338 0.655 0.762 0.949 0.788 CB 1.756 101 residues pruned to eliminate duplicates Z: 25 48.705 2.123 1.034 0.928 0.958 0.875 CA 1.682 25 residues pruned to eliminate duplicates Z: 103 74.351 2.277 0.671 0.746 0.931 0.745 CB 1.668 103 residues pruned to eliminate duplicates Z: 134 82.756 2.310 0.604 0.726 0.925 0.744 CB 1.709 169 residues pruned to eliminate duplicates Z: 24 54.162 2.150 1.255 0.936 0.957 0.783 C 1.696 24 residues pruned to eliminate duplicates Z: 93 79.561 2.336 0.648 0.789 0.957 0.826 CB 1.748 93 residues pruned to eliminate duplicates Z: 94 84.755 2.304 0.791 0.767 0.968 0.774 CB 1.737 94 residues pruned to eliminate duplicates Z: 93 78.457 2.313 0.692 0.784 0.957 0.761 CB 1.702 93 residues pruned to eliminate duplicates Z: 93 77.585 2.325 0.615 0.776 0.978 0.804 CB 1.726 93 residues pruned to eliminate duplicates Z: 75 74.690 2.289 0.726 0.770 0.973 0.784 CB 1.779 75 residues pruned to eliminate duplicates Z: 75 67.729 2.268 0.640 0.765 0.946 0.784 CB 1.769 75 residues pruned to eliminate duplicates Z: 93 71.838 2.281 0.680 0.741 0.935 0.739 CB 1.685 93 residues pruned to eliminate duplicates Z: 94 84.005 2.329 0.760 0.763 0.957 0.774 CB 1.759 94 residues pruned to eliminate duplicates Z: 93 82.831 2.325 0.723 0.773 0.967 0.837 CB 1.751 93 residues pruned to eliminate duplicates Z: 65 75.935 2.303 0.755 0.830 0.984 0.875 CB 1.794 65 residues pruned to eliminate duplicates Z: 93 81.588 2.345 0.713 0.768 0.946 0.815 CB 1.767 93 residues pruned to eliminate duplicates Z: 62 69.627 2.300 0.742 0.819 0.984 0.803 CB 1.715 62 residues pruned to eliminate duplicates Z: 94 78.573 2.304 0.689 0.775 0.946 0.763 CB 1.736 94 residues pruned to eliminate duplicates Z: 100 84.394 2.332 0.730 0.764 0.960 0.768 CB 1.733 100 residues pruned to eliminate duplicates Z: 99 73.909 2.248 0.670 0.725 0.939 0.704 CB 1.729 99 residues pruned to eliminate duplicates Z: 94 79.953 2.282 0.765 0.738 0.957 0.763 CB 1.737 94 residues pruned to eliminate duplicates Z: 94 78.669 2.323 0.667 0.774 0.957 0.828 CB 1.729 94 residues pruned to eliminate duplicates Z: 73 72.189 2.261 0.699 0.786 0.972 0.792 CB 1.772 73 residues pruned to eliminate duplicates Z: 73 60.372 2.272 0.551 0.740 0.958 0.819 CB 1.699 73 residues pruned to eliminate duplicates Z: 43 46.112 2.317 0.380 0.804 0.952 0.810 CB 1.791 43 residues pruned to eliminate duplicates Z: 109 78.654 2.315 0.671 0.732 0.926 0.759 CB 1.715 109 residues pruned to eliminate duplicates Z: 109 82.057 2.307 0.698 0.747 0.926 0.685 CB 1.746 109 residues pruned to eliminate duplicates Z: 78 76.410 2.327 0.774 0.759 0.974 0.818 CB 1.721 78 residues pruned to eliminate duplicates Z: 123 80.701 2.337 0.612 0.710 0.910 0.705 CB 1.762 123 residues pruned to eliminate duplicates Z: 78 74.604 2.306 0.780 0.764 0.948 0.805 CB 1.728 78 residues pruned to eliminate duplicates Z: 79 63.667 2.301 0.598 0.723 0.936 0.756 CB 1.714 79 residues pruned to eliminate duplicates Z: 106 86.605 2.336 0.779 0.733 0.952 0.790 CB 1.732 112 residues pruned to eliminate duplicates Z: 97 84.144 2.272 0.824 0.763 0.948 0.812 CB 1.732 97 residues pruned to eliminate duplicates Z: 54 54.241 2.311 0.580 0.729 0.962 0.717 CB 1.726 54 residues pruned to eliminate duplicates Z: 93 88.905 2.320 0.837 0.780 0.967 0.815 CB 1.756 93 residues pruned to eliminate duplicates Z: 110 91.850 2.326 0.818 0.742 0.954 0.780 CB 1.756 110 residues pruned to eliminate duplicates Z: 76 79.625 2.229 0.923 0.754 0.947 0.773 CB 1.807 76 residues pruned to eliminate duplicates Z: 70 70.553 2.330 0.681 0.769 0.986 0.812 CB 1.734 70 residues pruned to eliminate duplicates Z: 99 89.328 2.344 0.843 0.777 0.929 0.786 CB 1.761 99 residues pruned to eliminate duplicates Z: 94 88.338 2.333 0.839 0.765 0.968 0.774 CB 1.745 94 residues pruned to eliminate duplicates Z: 96 83.061 2.285 0.758 0.767 0.958 0.705 CB 1.748 96 residues pruned to eliminate duplicates Z: 90 92.401 2.343 0.853 0.808 0.966 0.798 CB 1.786 90 residues pruned to eliminate duplicates Z: 94 89.831 2.324 0.916 0.772 0.935 0.774 CB 1.759 94 residues pruned to eliminate duplicates Z: 93 95.015 2.335 0.919 0.785 0.978 0.783 CB 1.758 93 residues pruned to eliminate duplicates Z: 102 83.832 2.311 0.827 0.746 0.911 0.772 CB 1.741 102 residues pruned to eliminate duplicates Z: 76 74.920 2.330 0.823 0.726 0.933 0.800 CB 1.780 76 residues pruned to eliminate duplicates Z: 71 78.090 2.237 0.948 0.767 0.971 0.700 CB 1.740 71 residues pruned to eliminate duplicates Z: 109 94.996 2.346 0.852 0.757 0.954 0.722 CB 1.755 109 residues pruned to eliminate duplicates Z: 55 62.882 2.296 0.852 0.727 0.944 0.796 CB 1.737 55 residues pruned to eliminate duplicates Z: 101 90.733 2.314 0.921 0.752 0.940 0.790 CB 1.734 101 residues pruned to eliminate duplicates Z: 101 89.639 2.318 0.838 0.754 0.960 0.760 CB 1.748 101 residues pruned to eliminate duplicates Z: 98 88.411 2.312 0.889 0.765 0.938 0.794 CB 1.732 98 residues pruned to eliminate duplicates Z: 79 73.997 2.289 0.820 0.723 0.936 0.731 CB 1.757 79 residues pruned to eliminate duplicates Z: 108 99.071 2.360 0.877 0.764 0.972 0.701 CB 1.760 108 residues pruned to eliminate duplicates Z: 85 79.939 2.347 0.764 0.727 0.964 0.786 CB 1.781 85 residues pruned to eliminate duplicates Z: 99 84.638 2.321 0.865 0.752 0.939 0.745 CB 1.680 99 residues pruned to eliminate duplicates Z: 74 81.870 2.286 0.892 0.779 0.973 0.808 CB 1.780 74 residues pruned to eliminate duplicates Z: 96 92.074 2.334 0.911 0.775 0.947 0.811 CB 1.754 96 residues pruned to eliminate duplicates Z: 96 90.459 2.336 0.899 0.769 0.937 0.800 CB 1.759 96 residues pruned to eliminate duplicates Z: 94 94.329 2.316 0.963 0.779 0.968 0.796 CB 1.739 94 residues pruned to eliminate duplicates Z: 100 93.043 2.338 0.903 0.764 0.939 0.707 CB 1.770 100 residues pruned to eliminate duplicates Z: 110 85.594 2.300 0.817 0.718 0.927 0.697 CB 1.738 110 residues pruned to eliminate duplicates Z: 70 80.285 2.331 0.885 0.777 0.986 0.841 CB 1.748 70 residues pruned to eliminate duplicates Z: 75 74.757 2.373 0.706 0.754 0.959 0.838 CB 1.785 75 residues pruned to eliminate duplicates Z: 95 91.174 2.311 0.949 0.767 0.957 0.787 CB 1.721 95 residues pruned to eliminate duplicates Z: 78 81.569 2.288 0.984 0.762 0.948 0.701 CB 1.712 78 residues pruned to eliminate duplicates Z: 103 91.113 2.308 0.928 0.746 0.941 0.755 CB 1.729 103 residues pruned to eliminate duplicates Z: 87 73.838 2.277 0.754 0.721 0.953 0.721 CB 1.713 87 residues pruned to eliminate duplicates Z: 115 95.426 2.331 0.900 0.740 0.947 0.754 CB 1.718 115 residues pruned to eliminate duplicates Z: 95 91.375 2.308 0.937 0.773 0.957 0.787 CB 1.730 95 residues pruned to eliminate duplicates Z: 78 84.209 2.313 0.974 0.771 0.961 0.818 CB 1.721 78 residues pruned to eliminate duplicates Z: 29 32.180 2.342 0.684 0.648 0.857 0.750 CB 1.567 29 residues pruned to eliminate duplicates Z: 94 95.817 2.311 0.958 0.773 0.978 0.731 CB 1.763 94 residues pruned to eliminate duplicates Z: 94 87.300 2.318 0.915 0.776 0.935 0.774 CB 1.708 94 residues pruned to eliminate duplicates Z: 101 92.176 2.310 0.906 0.753 0.970 0.680 CB 1.722 101 residues pruned to eliminate duplicates Z: 46 37.021 2.240 0.691 0.559 0.822 0.578 CB 1.674 14 residues pruned to eliminate duplicates Z: 20 36.537 2.339 0.732 0.873 0.947 0.789 CB 1.591 20 residues pruned to eliminate duplicates Z: 21 30.065 2.201 0.611 0.878 0.900 0.750 CB 1.529 21 residues pruned to eliminate duplicates Z: 29 31.883 2.322 0.662 0.623 0.857 0.679 CB 1.623 28 residues pruned to eliminate duplicates Z: 20 33.927 2.316 0.618 0.900 0.947 0.895 CB 1.567 20 residues pruned to eliminate duplicates Z: 110 93.748 2.317 0.916 0.741 0.936 0.771 CB 1.743 110 residues pruned to eliminate duplicates Z: 100 95.636 2.326 0.972 0.766 0.949 0.747 CB 1.743 100 residues pruned to eliminate duplicates Z: 30 35.158 2.237 0.932 0.607 0.897 0.690 CB 1.522 28 residues pruned to eliminate duplicates Z: 19 41.491 2.261 0.916 0.905 0.944 0.667 CB 1.701 22 residues pruned to eliminate duplicates Z: 20 50.059 2.308 1.220 0.894 1.000 0.684 CB 1.608 20 residues pruned to eliminate duplicates Z: 19 46.631 2.273 0.928 0.925 1.000 0.722 CB 1.761 18 residues pruned to eliminate duplicates Z: 20 45.721 2.349 1.042 0.889 0.947 0.737 CB 1.662 20 residues pruned to eliminate duplicates Z: 100 93.801 2.337 0.942 0.751 0.939 0.747 CB 1.768 100 residues pruned to eliminate duplicates Z: 109 94.599 2.343 0.929 0.743 0.917 0.750 CB 1.768 109 residues pruned to eliminate duplicates Z: 29 34.602 2.307 0.834 0.652 0.821 0.679 CB 1.634 29 residues pruned to eliminate duplicates Z: 121 92.379 2.337 0.833 0.711 0.933 0.708 CB 1.741 121 residues pruned to eliminate duplicates Z: 110 91.339 2.327 0.858 0.739 0.963 0.743 CB 1.695 110 residues pruned to eliminate duplicates Z: 84 80.566 2.346 0.783 0.733 0.976 0.651 CB 1.757 84 residues pruned to eliminate duplicates Z: 18 17.904 2.136 0.565 0.565 0.941 0.529 CB 1.296 18 residues pruned to eliminate duplicates Z: 18 17.084 2.152 0.551 0.545 0.882 0.353 CB 1.346 18 residues pruned to eliminate duplicates Z: 9 23.504 2.480 0.468 0.673 1.000 0.500 CB 1.945 9 residues pruned to eliminate duplicates Z: 44 43.240 2.196 0.758 0.598 0.907 0.581 CB 1.715 44 residues pruned to eliminate duplicates Z: 11 19.123 2.291 0.716 0.610 0.900 0.400 CB 1.540 11 residues pruned to eliminate duplicates Z: 10 14.640 2.362 0.434 0.574 0.778 0.778 C 1.726 10 residues pruned to eliminate duplicates Z: 85 80.590 2.346 0.821 0.730 0.952 0.762 CB 1.757 85 residues pruned to eliminate duplicates Z: 108 94.412 2.285 1.017 0.732 0.953 0.645 CB 1.686 34 residues pruned to eliminate duplicates Z: 9 12.899 2.089 0.460 0.775 0.750 0.250 C 1.564 9 residues pruned to eliminate duplicates Z: 9 20.996 2.481 0.461 0.660 1.000 0.875 CB 1.766 9 residues pruned to eliminate duplicates Z: 36 20.593 2.153 0.451 0.415 0.857 0.400 CB 1.422 36 residues pruned to eliminate duplicates Z: 18 27.968 2.276 0.555 0.528 0.941 0.706 C 1.983 18 residues pruned to eliminate duplicates Z: 45 61.251 2.416 0.899 0.608 0.955 0.636 CB 1.904 45 residues pruned to eliminate duplicates Z: 114 93.544 2.334 0.876 0.726 0.920 0.646 CB 1.781 114 residues pruned to eliminate duplicates Z: 24 20.980 2.170 0.409 0.536 0.826 0.565 CB 1.671 24 residues pruned to eliminate duplicates Z: 14 15.566 2.139 0.588 0.498 0.769 0.538 CB 1.656 14 residues pruned to eliminate duplicates Z: 22 21.214 2.159 0.459 0.510 0.952 0.571 CB 1.527 22 residues pruned to eliminate duplicates Z: 14 19.987 2.155 0.689 0.498 0.923 0.692 CB 1.653 14 residues pruned to eliminate duplicates Z: 47 60.678 2.341 0.934 0.633 0.978 0.717 CB 1.783 47 residues pruned to eliminate duplicates Z: 45 56.622 2.388 0.883 0.619 0.932 0.705 CB 1.820 45 residues pruned to eliminate duplicates Z: 52 61.855 2.399 0.792 0.637 0.961 0.627 CB 1.844 52 residues pruned to eliminate duplicates Z: 37 58.370 2.353 1.097 0.631 0.944 0.639 CB 1.845 37 residues pruned to eliminate duplicates Z: 47 62.815 2.357 0.930 0.642 0.957 0.609 CB 1.865 47 residues pruned to eliminate duplicates Z: 46 67.547 2.393 1.037 0.642 1.000 0.689 CB 1.808 46 residues pruned to eliminate duplicates Z: 54 54.227 2.334 0.755 0.611 0.925 0.642 CB 1.770 54 residues pruned to eliminate duplicates Z: 53 62.441 2.348 0.865 0.607 0.942 0.731 CB 1.896 53 residues pruned to eliminate duplicates Z: 39 59.333 2.357 1.081 0.625 0.974 0.658 CB 1.792 39 residues pruned to eliminate duplicates Z: 35 56.248 2.404 0.959 0.631 0.971 0.676 CB 1.867 35 residues pruned to eliminate duplicates Z: 54 61.073 2.402 0.846 0.582 0.943 0.585 CB 1.854 54 residues pruned to eliminate duplicates Z: 47 50.979 2.257 0.854 0.599 1.000 0.652 CB 1.634 47 residues pruned to eliminate duplicates Z: 36 64.397 2.422 1.086 0.645 0.971 0.743 CB 1.937 36 residues pruned to eliminate duplicates Z: 37 60.611 2.346 1.072 0.630 1.000 0.639 CB 1.840 37 residues pruned to eliminate duplicates Z: 46 61.973 2.352 1.059 0.604 0.956 0.756 CB 1.808 46 residues pruned to eliminate duplicates Z: 47 69.480 2.382 1.050 0.639 1.000 0.717 CB 1.841 47 residues pruned to eliminate duplicates Z: 35 62.213 2.398 1.173 0.647 0.971 0.647 CB 1.840 35 residues pruned to eliminate duplicates Z: 53 68.228 2.387 0.911 0.621 0.981 0.750 CB 1.887 53 residues pruned to eliminate duplicates Z: 39 54.209 2.304 1.029 0.608 0.974 0.658 CB 1.743 39 residues pruned to eliminate duplicates Z: 59 61.317 2.338 0.848 0.619 0.948 0.655 CB 1.756 59 residues pruned to eliminate duplicates Z: 37 54.858 2.338 1.047 0.606 0.972 0.667 CB 1.777 37 residues pruned to eliminate duplicates Z: 37 59.551 2.356 1.117 0.621 0.972 0.639 CB 1.825 37 residues pruned to eliminate duplicates Z: 36 65.919 2.381 1.185 0.665 0.971 0.743 CB 1.892 36 residues pruned to eliminate duplicates Z: 37 59.765 2.346 1.035 0.613 0.972 0.611 CB 1.929 37 residues pruned to eliminate duplicates Z: 55 64.879 2.391 0.973 0.596 0.926 0.667 CB 1.844 55 residues pruned to eliminate duplicates Z: 37 57.536 2.352 1.049 0.626 0.944 0.750 CB 1.872 37 residues pruned to eliminate duplicates Z: 54 63.745 2.344 0.901 0.616 1.000 0.642 CB 1.761 54 residues pruned to eliminate duplicates Z: 48 57.358 2.304 0.973 0.583 1.000 0.596 CB 1.700 48 residues pruned to eliminate duplicates Z: 46 62.692 2.371 1.024 0.605 0.956 0.644 CB 1.844 46 residues pruned to eliminate duplicates Z: 37 67.228 2.410 1.187 0.674 0.944 0.722 CB 1.919 37 residues pruned to eliminate duplicates Z: 36 58.635 2.359 1.020 0.647 0.971 0.571 CB 1.866 36 residues pruned to eliminate duplicates Z: 47 63.334 2.325 1.083 0.634 0.957 0.609 CB 1.777 47 residues pruned to eliminate duplicates Z: 47 56.488 2.322 0.932 0.579 0.957 0.630 CB 1.798 47 residues pruned to eliminate duplicates Z: 47 63.625 2.350 1.046 0.610 0.957 0.717 CB 1.837 47 residues pruned to eliminate duplicates Z: 47 63.548 2.361 1.046 0.628 0.957 0.696 CB 1.798 47 residues pruned to eliminate duplicates Z: 36 57.790 2.369 1.028 0.633 0.971 0.714 CB 1.847 36 residues pruned to eliminate duplicates Z: 9 6.352 1.775 0.317 0.301 0.875 0.500 CB 1.370 Z: 97 69.510 2.282 0.617 0.720 0.938 0.802 CB 1.682 106 residues pruned to eliminate duplicates Z: 11 5.173 1.746 0.555 0.183 0.800 0.400 CB 1.103 5 residues pruned to eliminate duplicates Z: 8 5.498 1.627 0.320 0.430 1.000 0.571 CB 1.039 8 residues pruned to eliminate duplicates Z: 59 42.160 2.200 0.523 0.570 0.931 0.621 CB 1.658 59 residues pruned to eliminate duplicates Z: 9 11.577 1.987 0.508 0.519 0.875 0.625 CB 1.532 9 residues pruned to eliminate duplicates Z: 39 37.713 2.223 0.518 0.679 0.895 0.684 CB 1.718 39 residues pruned to eliminate duplicates Z: 56 40.164 2.215 0.578 0.529 0.891 0.673 CB 1.689 56 residues pruned to eliminate duplicates Z: 58 44.336 2.247 0.507 0.585 0.930 0.632 CB 1.719 59 residues pruned to eliminate duplicates Z: 27 31.227 2.232 0.258 0.774 0.923 0.769 CA 1.855 27 residues pruned to eliminate duplicates Z: 17 15.854 2.058 0.330 0.453 0.938 0.625 CB 1.621 17 residues pruned to eliminate duplicates Z: 60 47.151 2.209 0.610 0.576 0.949 0.644 CB 1.690 59 residues pruned to eliminate duplicates Z: 25 42.823 2.376 0.511 0.869 0.958 0.792 CB 1.857 25 residues pruned to eliminate duplicates Z: 34 36.206 2.233 0.518 0.682 0.909 0.697 CB 1.730 34 residues pruned to eliminate duplicates Z: 38 39.940 2.232 0.499 0.688 0.946 0.784 CB 1.746 38 residues pruned to eliminate duplicates Z: 27 41.418 2.332 0.450 0.824 0.962 0.769 CB 1.887 27 residues pruned to eliminate duplicates Z: 33 34.594 2.267 0.445 0.690 0.906 0.750 CB 1.733 33 residues pruned to eliminate duplicates Z: 38 44.146 2.339 0.659 0.652 0.865 0.622 CB 1.877 38 residues pruned to eliminate duplicates Z: 54 46.128 2.268 0.583 0.567 0.943 0.642 CB 1.754 54 residues pruned to eliminate duplicates Z: 37 34.301 2.160 0.396 0.656 0.917 0.750 CB 1.789 37 residues pruned to eliminate duplicates Z: 55 45.218 2.264 0.565 0.584 0.926 0.685 CB 1.730 55 residues pruned to eliminate duplicates Z: 58 40.194 2.210 0.549 0.556 0.895 0.684 CB 1.646 58 residues pruned to eliminate duplicates Z: 34 33.804 2.226 0.476 0.679 0.909 0.758 CB 1.671 34 residues pruned to eliminate duplicates Z: 34 37.365 2.259 0.517 0.610 0.939 0.667 CB 1.820 34 residues pruned to eliminate duplicates Z: 58 48.908 2.237 0.716 0.565 0.930 0.632 CB 1.704 58 residues pruned to eliminate duplicates Z: 60 39.944 2.138 0.639 0.530 0.898 0.559 CB 1.603 60 residues pruned to eliminate duplicates Z: 29 41.845 2.263 0.671 0.750 0.929 0.714 CB 1.801 29 residues pruned to eliminate duplicates Z: 61 43.303 2.138 0.651 0.534 0.933 0.617 CB 1.641 61 residues pruned to eliminate duplicates Z: 56 38.350 2.184 0.537 0.551 0.873 0.673 CB 1.680 55 residues pruned to eliminate duplicates Z: 23 38.983 2.154 0.634 0.884 0.955 0.773 C 1.787 23 residues pruned to eliminate duplicates Z: 28 38.133 2.307 0.664 0.732 0.852 0.778 CB 1.821 28 residues pruned to eliminate duplicates Z: 51 43.605 2.261 0.625 0.583 0.900 0.660 CB 1.723 52 residues pruned to eliminate duplicates Z: 25 45.753 2.311 0.646 0.891 0.958 0.833 CB 1.841 25 residues pruned to eliminate duplicates Z: 60 43.055 2.182 0.623 0.559 0.898 0.593 CB 1.664 59 residues pruned to eliminate duplicates Z: 26 41.032 2.259 0.735 0.801 0.960 0.680 CB 1.676 26 residues pruned to eliminate duplicates Z: 56 44.951 2.214 0.667 0.557 0.927 0.600 CB 1.675 56 residues pruned to eliminate duplicates Z: 56 47.072 2.244 0.594 0.553 0.964 0.673 CB 1.749 56 residues pruned to eliminate duplicates Z: 54 44.022 2.219 0.615 0.556 0.943 0.679 CB 1.693 55 residues pruned to eliminate duplicates Z: 6 8.677 1.837 0.653 0.495 1.000 0.200 C 1.285 6 residues pruned to eliminate duplicates Z: 55 48.368 2.232 0.679 0.583 0.963 0.611 CB 1.684 55 residues pruned to eliminate duplicates Z: 12 20.718 2.095 1.046 0.551 0.818 0.727 CB 1.695 12 residues pruned to eliminate duplicates Z: 43 48.243 2.316 0.776 0.594 0.905 0.548 CB 1.828 43 residues pruned to eliminate duplicates Z: 55 45.477 2.255 0.630 0.571 0.907 0.667 CB 1.731 55 residues pruned to eliminate duplicates Z: 58 46.802 2.236 0.656 0.563 0.930 0.649 CB 1.693 58 residues pruned to eliminate duplicates Z: 50 51.009 2.227 0.849 0.590 0.939 0.653 CB 1.729 50 residues pruned to eliminate duplicates Z: 60 44.925 2.209 0.612 0.545 0.932 0.627 CB 1.686 60 residues pruned to eliminate duplicates Z: 55 44.805 2.233 0.607 0.575 0.926 0.704 CB 1.707 55 residues pruned to eliminate duplicates Z: 11 18.052 1.955 0.816 0.705 1.000 0.700 CB 1.334 11 residues pruned to eliminate duplicates Z: 59 46.025 2.224 0.580 0.577 0.931 0.690 CB 1.716 59 residues pruned to eliminate duplicates Z: 60 47.499 2.207 0.697 0.569 0.915 0.678 CB 1.687 60 residues pruned to eliminate duplicates Z: 59 45.458 2.228 0.598 0.561 0.931 0.707 CB 1.697 59 residues pruned to eliminate duplicates Z: 25 18.571 2.059 0.519 0.402 0.917 0.542 CB 1.466 25 residues pruned to eliminate duplicates 613 residues left after pruning, divided into chains as follows: A: 41 B: 24 C: 37 D: 33 E: 6 F: 15 G: 6 H: 392 I: 59 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 34.81 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.369, Connect. = 0.719 for dens.mod. cycle 1 = 0.300, Contrast = 0.425, Connect. = 0.745 for dens.mod. cycle 2 = 0.300, Contrast = 0.500, Connect. = 0.779 for dens.mod. cycle 3 = 0.300, Contrast = 0.506, Connect. = 0.781 for dens.mod. cycle 4 = 0.300, Contrast = 0.517, Connect. = 0.784 for dens.mod. cycle 5 = 0.300, Contrast = 0.524, Connect. = 0.786 for dens.mod. cycle 6 = 0.300, Contrast = 0.532, Connect. = 0.788 for dens.mod. cycle 7 = 0.300, Contrast = 0.538, Connect. = 0.790 for dens.mod. cycle 8 = 0.300, Contrast = 0.544, Connect. = 0.791 for dens.mod. cycle 9 = 0.300, Contrast = 0.548, Connect. = 0.792 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5468 peaks > 0.5 sigma used to seed fragment search Space for about 755 unique residues taking solvent into account 1032 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 18 35.888 2.270 0.674 0.836 0.941 0.647 CB 1.820 B: 22 59.943 2.343 1.145 0.943 1.000 0.905 CB 1.804 C: 20 36.358 2.211 0.860 0.808 0.895 0.737 CB 1.733 18 residues pruned to eliminate duplicates D: 19 43.892 2.297 0.965 0.877 0.944 0.722 CB 1.763 E: 17 48.977 2.480 0.798 0.874 1.000 0.812 CB 1.998 19 residues pruned to eliminate duplicates F: 17 40.935 2.373 0.766 0.938 1.000 0.812 CB 1.699 17 residues pruned to eliminate duplicates G: 9 19.163 2.125 0.350 0.889 1.000 1.000 CA 1.701 H: 24 56.900 2.197 1.224 0.943 1.000 0.870 CB 1.682 23 residues pruned to eliminate duplicates I: 20 36.113 2.331 0.455 0.896 1.000 0.895 CB 1.749 J: 112 95.993 2.371 0.864 0.743 0.937 0.685 CB 1.770 K: 38 61.437 2.275 0.836 0.899 0.946 0.757 C 1.826 38 residues pruned to eliminate duplicates L: 15 32.352 2.066 0.959 0.917 1.000 0.929 CB 1.508 M: 19 41.233 2.218 0.957 0.890 1.000 0.889 CB 1.611 17 residues pruned to eliminate duplicates N: 11 22.065 2.118 1.472 0.593 0.800 0.700 CB 1.524 O: 8 18.074 2.153 0.463 0.866 1.000 0.857 CA 1.588 8 residues pruned to eliminate duplicates P: 13 24.593 2.096 0.550 0.865 0.917 0.583 CA 1.747 13 residues pruned to eliminate duplicates Q: 19 37.651 2.246 0.584 0.921 1.000 0.889 CB 1.755 19 residues pruned to eliminate duplicates R: 39 48.998 2.327 0.362 0.873 0.974 0.842 CB 1.876 S: 25 38.874 2.305 0.508 0.854 0.917 0.750 CB 1.840 T: 24 39.919 2.373 0.334 0.869 1.000 0.826 CB 1.922 25 residues pruned to eliminate duplicates U: 20 39.964 2.326 0.820 0.882 0.947 0.737 CB 1.654 20 residues pruned to eliminate duplicates V: 11 21.755 2.141 0.518 0.867 1.000 0.700 CA 1.549 12 residues pruned to eliminate duplicates W: 19 47.407 2.406 0.943 0.894 1.000 0.722 CB 1.715 21 residues pruned to eliminate duplicates X: 37 45.329 2.206 0.842 0.667 0.917 0.722 CB 1.738 11 residues pruned to eliminate duplicates Y: 20 36.107 2.355 0.474 0.863 0.947 0.737 C 1.849 20 residues pruned to eliminate duplicates Z: 19 34.306 2.235 0.684 0.856 0.889 0.667 CA 1.783 19 residues pruned to eliminate duplicates Z: 18 44.662 2.332 0.901 0.864 1.000 0.647 CB 1.792 18 residues pruned to eliminate duplicates Z: 21 44.362 2.255 0.903 0.832 0.950 0.650 CA 1.827 Z: 95 100.759 2.382 0.939 0.779 0.979 0.745 CB 1.799 94 residues pruned to eliminate duplicates Z: 21 41.664 2.244 0.835 0.881 0.900 0.750 CA 1.820 21 residues pruned to eliminate duplicates Z: 36 61.460 2.266 0.850 0.915 0.971 0.800 CB 1.803 36 residues pruned to eliminate duplicates Z: 23 52.639 2.265 0.929 0.957 1.000 0.864 CB 1.764 23 residues pruned to eliminate duplicates Z: 39 50.402 2.329 0.339 0.884 1.000 0.895 CB 1.895 39 residues pruned to eliminate duplicates Z: 39 58.117 2.305 0.682 0.898 0.947 0.711 CB 1.836 39 residues pruned to eliminate duplicates Z: 24 48.497 2.186 0.937 0.937 0.957 0.913 CB 1.737 24 residues pruned to eliminate duplicates Z: 11 24.534 2.343 0.375 0.819 0.900 0.700 CA 2.029 11 residues pruned to eliminate duplicates Z: 40 44.000 2.323 0.183 0.873 1.000 0.846 CB 1.868 39 residues pruned to eliminate duplicates Z: 19 34.506 2.255 0.792 0.860 0.833 0.667 CA 1.776 19 residues pruned to eliminate duplicates Z: 22 40.680 2.366 0.732 0.932 0.952 0.952 CB 1.589 22 residues pruned to eliminate duplicates Z: 17 40.291 2.331 0.629 0.894 1.000 0.812 CA 1.904 17 residues pruned to eliminate duplicates Z: 24 43.431 2.244 0.788 0.869 0.957 0.696 C 1.724 Z: 19 41.589 2.423 0.544 0.892 1.000 0.833 CB 1.882 19 residues pruned to eliminate duplicates Z: 8 16.101 2.027 0.478 0.858 1.000 0.857 CB 1.496 8 residues pruned to eliminate duplicates Z: 24 49.515 2.199 0.951 0.946 0.957 0.870 CB 1.739 24 residues pruned to eliminate duplicates Z: 43 72.422 2.434 1.088 0.666 0.976 0.714 CB 1.932 18 residues pruned to eliminate duplicates Z: 21 37.503 2.167 0.828 0.811 0.950 0.800 CA 1.700 21 residues pruned to eliminate duplicates Z: 87 70.464 2.293 0.751 0.629 0.953 0.616 CB 1.758 69 residues pruned to eliminate duplicates Z: 39 51.922 2.340 0.382 0.907 0.974 0.895 CB 1.900 40 residues pruned to eliminate duplicates Z: 21 39.363 2.220 0.743 0.893 1.000 0.800 CB 1.633 21 residues pruned to eliminate duplicates Z: 17 35.221 2.273 0.935 0.928 0.938 0.875 CB 1.495 17 residues pruned to eliminate duplicates Z: 12 25.824 2.296 0.335 0.932 1.000 0.909 CA 1.774 12 residues pruned to eliminate duplicates Z: 26 44.678 2.327 0.515 0.880 0.960 0.840 CB 1.913 24 residues pruned to eliminate duplicates Z: 9 10.321 1.670 0.469 0.755 1.000 0.500 CB 1.184 9 residues pruned to eliminate duplicates Z: 13 11.838 2.080 0.046 0.865 0.833 0.833 CB 1.381 13 residues pruned to eliminate duplicates Z: 16 41.790 2.397 0.763 0.916 0.933 0.867 CA 1.933 16 residues pruned to eliminate duplicates Z: 19 37.860 2.267 0.618 0.907 1.000 0.667 CB 1.729 18 residues pruned to eliminate duplicates Z: 25 50.147 2.183 0.975 0.945 0.958 0.833 C 1.715 25 residues pruned to eliminate duplicates Z: 20 43.261 2.384 0.590 0.885 1.000 0.789 C 1.890 19 residues pruned to eliminate duplicates Z: 25 33.996 2.343 0.197 0.860 0.958 0.750 CA 1.899 25 residues pruned to eliminate duplicates Z: 7 6.855 2.018 -0.057 0.827 0.833 0.667 CB 1.330 7 residues pruned to eliminate duplicates Z: 39 63.990 2.303 0.731 0.902 1.000 0.737 CB 1.857 39 residues pruned to eliminate duplicates Z: 31 47.847 2.083 0.849 0.895 1.000 0.633 CB 1.626 21 residues pruned to eliminate duplicates Z: 18 43.300 2.261 0.815 0.925 1.000 0.882 CB 1.796 18 residues pruned to eliminate duplicates Z: 19 42.352 2.412 0.552 0.889 1.000 0.833 C 1.920 20 residues pruned to eliminate duplicates Z: 26 47.180 2.314 0.491 0.923 1.000 0.920 CB 1.922 26 residues pruned to eliminate duplicates Z: 20 43.261 2.341 0.875 0.886 1.000 0.684 CB 1.631 20 residues pruned to eliminate duplicates Z: 41 63.701 2.265 0.879 0.882 0.950 0.700 CB 1.803 41 residues pruned to eliminate duplicates Z: 40 67.951 2.325 0.762 0.916 1.000 0.821 CB 1.877 40 residues pruned to eliminate duplicates Z: 19 45.268 2.477 0.589 0.874 1.000 0.833 CB 1.974 19 residues pruned to eliminate duplicates Z: 17 36.701 2.400 0.684 0.868 0.875 0.750 CB 1.896 17 residues pruned to eliminate duplicates Z: 26 36.940 2.297 0.308 0.860 0.960 0.800 CA 1.884 26 residues pruned to eliminate duplicates Z: 10 23.852 2.201 0.872 0.862 0.889 0.778 CB 1.594 9 residues pruned to eliminate duplicates Z: 20 44.088 2.348 0.690 0.880 1.000 0.842 C 1.848 20 residues pruned to eliminate duplicates Z: 9 14.525 1.950 0.454 0.844 0.875 0.875 C 1.540 9 residues pruned to eliminate duplicates Z: 24 45.121 2.251 1.036 0.929 0.913 0.783 CB 1.574 24 residues pruned to eliminate duplicates Z: 9 26.452 2.384 0.590 0.915 1.000 0.750 CB 1.744 Z: 33 42.246 2.302 0.638 0.649 0.969 0.719 CB 1.780 19 residues pruned to eliminate duplicates Z: 54 63.374 2.332 0.979 0.625 0.887 0.642 CB 1.891 52 residues pruned to eliminate duplicates Z: 17 29.822 2.179 0.581 0.908 0.938 0.688 CB 1.640 9 residues pruned to eliminate duplicates Z: 19 42.539 2.272 0.689 0.917 1.000 0.833 C 1.845 19 residues pruned to eliminate duplicates Z: 20 39.648 2.279 0.773 0.908 0.947 0.789 CB 1.688 20 residues pruned to eliminate duplicates Z: 20 34.370 2.177 0.611 0.906 1.000 0.842 CB 1.598 19 residues pruned to eliminate duplicates Z: 40 65.620 2.299 0.736 0.909 1.000 0.744 CB 1.869 40 residues pruned to eliminate duplicates Z: 18 37.688 2.310 0.600 0.936 1.000 0.824 CB 1.722 19 residues pruned to eliminate duplicates Z: 25 35.826 2.362 0.215 0.861 0.958 0.875 CB 1.953 25 residues pruned to eliminate duplicates Z: 41 58.925 2.283 0.685 0.866 0.975 0.750 CB 1.818 41 residues pruned to eliminate duplicates Z: 16 14.800 1.831 0.527 0.732 0.800 0.600 CB 1.387 15 residues pruned to eliminate duplicates Z: 23 42.572 2.240 0.672 0.946 1.000 1.000 CB 1.676 23 residues pruned to eliminate duplicates Z: 8 16.625 1.841 0.990 0.843 1.000 0.714 CB 1.277 8 residues pruned to eliminate duplicates Z: 14 32.947 2.081 0.912 0.924 1.000 1.000 CB 1.613 14 residues pruned to eliminate duplicates Z: 15 22.733 2.207 0.163 0.930 1.000 0.929 CB 1.655 15 residues pruned to eliminate duplicates Z: 21 40.705 2.253 0.694 0.853 0.950 0.800 CA 1.855 21 residues pruned to eliminate duplicates Z: 15 29.046 2.183 0.715 0.836 1.000 0.714 C 1.553 15 residues pruned to eliminate duplicates Z: 19 42.544 2.242 0.839 0.933 1.000 0.833 CB 1.698 19 residues pruned to eliminate duplicates Z: 10 19.453 2.212 0.546 0.869 0.889 0.889 CA 1.558 16 residues pruned to eliminate duplicates Z: 28 33.544 2.236 0.712 0.560 0.963 0.778 CB 1.652 14 residues pruned to eliminate duplicates Z: 22 60.362 2.419 1.198 0.948 1.000 0.905 CB 1.711 25 residues pruned to eliminate duplicates Z: 18 45.974 2.388 0.909 0.872 0.941 0.765 CB 1.893 18 residues pruned to eliminate duplicates Z: 9 7.542 1.889 -0.014 0.777 0.875 0.500 CB 1.281 9 residues pruned to eliminate duplicates Z: 20 39.860 2.199 0.576 0.902 1.000 0.895 CB 1.883 20 residues pruned to eliminate duplicates Z: 45 65.513 2.422 0.925 0.673 0.955 0.682 CB 1.892 46 residues pruned to eliminate duplicates Z: 8 8.549 2.016 0.127 0.721 0.857 0.571 CA 1.360 8 residues pruned to eliminate duplicates Z: 19 32.740 2.395 0.383 0.883 0.944 0.889 CB 1.783 20 residues pruned to eliminate duplicates Z: 8 16.325 2.088 0.653 0.871 0.857 0.857 CA 1.521 Z: 32 66.423 2.353 0.854 0.953 1.000 0.903 CB 1.882 32 residues pruned to eliminate duplicates Z: 20 41.417 2.188 0.802 0.927 1.000 1.000 C 1.689 20 residues pruned to eliminate duplicates Z: 10 24.048 2.299 0.500 0.882 1.000 0.667 CB 1.682 10 residues pruned to eliminate duplicates Z: 23 50.639 2.334 1.035 0.923 0.955 0.955 CB 1.674 23 residues pruned to eliminate duplicates Z: 20 47.261 2.232 0.933 0.877 1.000 0.842 C 1.826 20 residues pruned to eliminate duplicates Z: 31 43.197 2.058 0.725 0.889 0.967 0.733 CB 1.654 31 residues pruned to eliminate duplicates Z: 23 43.110 2.279 1.025 0.906 0.955 0.773 CB 1.484 23 residues pruned to eliminate duplicates Z: 56 62.448 2.370 0.932 0.617 0.927 0.636 CB 1.776 56 residues pruned to eliminate duplicates Z: 41 69.336 2.278 0.992 0.872 0.975 0.625 C 1.806 41 residues pruned to eliminate duplicates Z: 33 54.954 2.368 0.476 0.935 1.000 0.969 CB 1.937 33 residues pruned to eliminate duplicates Z: 7 20.482 2.214 0.773 0.822 1.000 0.667 CA 1.612 13 residues pruned to eliminate duplicates Z: 22 48.785 2.394 0.865 0.942 1.000 0.857 CB 1.654 22 residues pruned to eliminate duplicates Z: 19 43.331 2.300 0.963 0.838 0.944 0.722 CA 1.790 19 residues pruned to eliminate duplicates Z: 24 51.541 2.203 1.082 0.931 0.957 0.783 CB 1.712 24 residues pruned to eliminate duplicates Z: 15 32.379 1.994 0.989 0.914 1.000 1.000 CA 1.543 15 residues pruned to eliminate duplicates Z: 19 40.652 2.375 0.791 0.901 0.944 0.833 CB 1.702 19 residues pruned to eliminate duplicates Z: 19 47.664 2.475 0.669 0.877 1.000 0.833 C 1.974 19 residues pruned to eliminate duplicates Z: 39 66.808 2.342 0.748 0.886 1.000 0.816 CB 1.910 39 residues pruned to eliminate duplicates Z: 21 42.890 2.227 0.831 0.861 0.950 0.850 CA 1.819 21 residues pruned to eliminate duplicates Z: 18 47.670 2.426 0.685 0.947 1.000 0.941 CA 1.955 18 residues pruned to eliminate duplicates Z: 24 46.484 2.179 0.843 0.937 0.957 0.870 CB 1.757 24 residues pruned to eliminate duplicates Z: 19 29.703 1.974 0.990 0.872 0.889 0.722 CB 1.462 18 residues pruned to eliminate duplicates Z: 20 45.380 2.224 1.049 0.920 1.000 0.737 CB 1.609 20 residues pruned to eliminate duplicates Z: 20 49.225 2.310 0.982 0.851 0.947 0.579 CA 1.927 20 residues pruned to eliminate duplicates Z: 11 23.347 2.096 0.561 0.893 1.000 0.900 CB 1.619 11 residues pruned to eliminate duplicates Z: 15 21.631 2.304 0.126 0.762 0.929 0.429 C 1.902 17 residues pruned to eliminate duplicates Z: 14 34.954 2.091 1.002 0.912 1.000 0.923 CA 1.641 14 residues pruned to eliminate duplicates Z: 25 37.707 2.368 0.340 0.852 0.958 0.708 CB 1.873 25 residues pruned to eliminate duplicates Z: 22 49.057 2.283 0.866 0.946 1.000 0.905 CB 1.739 22 residues pruned to eliminate duplicates Z: 10 15.305 1.800 0.558 0.857 1.000 0.778 CA 1.341 10 residues pruned to eliminate duplicates Z: 38 67.260 2.349 0.739 0.906 1.000 0.757 CB 1.926 38 residues pruned to eliminate duplicates Z: 41 59.484 2.310 0.575 0.889 1.000 0.900 CB 1.861 41 residues pruned to eliminate duplicates Z: 46 60.007 2.383 0.847 0.625 0.956 0.667 CB 1.890 46 residues pruned to eliminate duplicates Z: 7 10.796 1.879 0.261 0.819 1.000 0.833 CB 1.410 5 residues pruned to eliminate duplicates Z: 40 55.238 2.295 0.496 0.890 1.000 0.872 CB 1.853 40 residues pruned to eliminate duplicates Z: 8 14.834 2.199 0.300 0.804 0.857 0.857 C 1.754 8 residues pruned to eliminate duplicates Z: 17 31.897 2.190 0.529 0.902 0.938 0.750 C 1.813 17 residues pruned to eliminate duplicates Z: 19 42.928 2.415 0.587 0.894 1.000 0.667 C 1.894 19 residues pruned to eliminate duplicates Z: 26 43.484 2.310 0.588 0.858 0.960 0.800 CB 1.820 26 residues pruned to eliminate duplicates Z: 36 65.394 2.304 0.905 0.924 0.971 0.714 CB 1.821 36 residues pruned to eliminate duplicates Z: 24 51.943 2.202 1.347 0.913 0.957 0.870 CB 1.551 24 residues pruned to eliminate duplicates Z: 24 36.559 2.397 0.286 0.850 0.957 0.870 CB 1.915 24 residues pruned to eliminate duplicates Z: 17 25.472 2.130 0.496 0.885 0.938 0.812 CB 1.539 17 residues pruned to eliminate duplicates Z: 8 10.512 1.992 0.423 0.733 0.857 0.429 CB 1.327 8 residues pruned to eliminate duplicates Z: 24 44.516 2.236 0.841 0.924 0.957 0.870 CB 1.655 24 residues pruned to eliminate duplicates Z: 36 66.959 2.255 1.070 0.897 0.971 0.714 C 1.787 36 residues pruned to eliminate duplicates Z: 42 18.212 1.985 0.507 0.317 0.805 0.463 CB 1.446 Z: 23 42.052 2.354 0.699 0.923 1.000 0.909 CB 1.574 23 residues pruned to eliminate duplicates Z: 39 62.328 2.356 0.641 0.882 1.000 0.816 CB 1.892 39 residues pruned to eliminate duplicates Z: 41 58.851 2.243 0.708 0.907 0.950 0.825 CB 1.817 41 residues pruned to eliminate duplicates Z: 10 18.113 2.229 0.630 0.793 0.778 0.444 CB 1.653 8 residues pruned to eliminate duplicates Z: 16 31.715 1.989 0.956 0.910 1.000 0.933 CB 1.493 16 residues pruned to eliminate duplicates Z: 9 12.830 1.692 0.694 0.728 1.000 0.875 C 1.288 9 residues pruned to eliminate duplicates Z: 17 28.341 2.151 0.558 0.865 1.000 0.750 CB 1.549 17 residues pruned to eliminate duplicates Z: 33 70.836 2.292 1.044 0.946 1.000 0.688 CB 1.849 33 residues pruned to eliminate duplicates Z: 52 71.223 2.399 1.013 0.645 0.980 0.667 CB 1.840 52 residues pruned to eliminate duplicates Z: 25 37.227 2.172 0.584 0.819 0.958 0.792 CA 1.747 25 residues pruned to eliminate duplicates Z: 39 62.702 2.339 0.677 0.894 0.974 0.789 CB 1.910 39 residues pruned to eliminate duplicates Z: 113 97.663 2.355 0.933 0.720 0.946 0.705 CB 1.756 113 residues pruned to eliminate duplicates Z: 19 31.241 2.228 0.408 0.854 0.944 0.833 CA 1.836 19 residues pruned to eliminate duplicates Z: 33 59.634 2.295 0.720 0.925 1.000 0.844 CA 1.875 33 residues pruned to eliminate duplicates Z: 18 29.445 2.116 0.481 0.912 0.941 0.765 C 1.715 18 residues pruned to eliminate duplicates Z: 39 49.969 2.358 0.294 0.888 1.000 0.895 CB 1.914 39 residues pruned to eliminate duplicates Z: 18 32.044 2.196 0.410 0.904 1.000 0.824 CA 1.788 18 residues pruned to eliminate duplicates Z: 21 42.269 2.141 0.949 0.899 0.950 0.750 CB 1.705 10 residues pruned to eliminate duplicates Z: 25 50.389 2.184 1.070 0.922 1.000 0.792 CB 1.601 25 residues pruned to eliminate duplicates Z: 19 32.351 2.235 0.424 0.923 1.000 0.889 CB 1.684 19 residues pruned to eliminate duplicates Z: 32 45.194 2.028 0.906 0.900 0.935 0.548 CB 1.604 32 residues pruned to eliminate duplicates Z: 20 38.461 2.317 0.551 0.873 1.000 0.842 CB 1.789 20 residues pruned to eliminate duplicates Z: 110 90.631 2.319 0.819 0.734 0.945 0.697 CB 1.765 129 residues pruned to eliminate duplicates Z: 23 51.995 2.247 0.942 0.955 1.000 0.864 CB 1.745 23 residues pruned to eliminate duplicates Z: 43 56.990 2.350 0.723 0.699 0.952 0.738 CB 1.903 37 residues pruned to eliminate duplicates Z: 26 42.454 2.289 0.499 0.856 0.960 0.720 CB 1.901 27 residues pruned to eliminate duplicates Z: 19 33.903 2.297 0.598 0.751 1.000 0.667 CB 1.741 19 residues pruned to eliminate duplicates Z: 25 44.645 2.360 0.502 0.880 0.958 0.792 CB 1.944 25 residues pruned to eliminate duplicates Z: 40 64.470 2.320 0.812 0.908 0.949 0.769 CB 1.838 40 residues pruned to eliminate duplicates Z: 15 29.272 2.000 0.834 0.888 1.000 1.000 CB 1.536 15 residues pruned to eliminate duplicates Z: 40 66.570 2.307 0.872 0.880 0.949 0.795 CB 1.885 40 residues pruned to eliminate duplicates Z: 21 42.571 2.170 0.901 0.898 1.000 0.700 C 1.651 21 residues pruned to eliminate duplicates Z: 22 28.750 2.099 0.495 0.851 0.905 0.905 CB 1.637 22 residues pruned to eliminate duplicates Z: 41 62.898 2.290 0.780 0.863 0.975 0.675 C 1.837 41 residues pruned to eliminate duplicates Z: 7 6.199 1.970 0.101 0.761 0.667 0.667 CB 1.388 Z: 31 40.514 2.103 0.559 0.870 1.000 0.767 CB 1.647 20 residues pruned to eliminate duplicates Z: 41 47.544 2.243 0.425 0.873 0.975 0.900 CB 1.756 41 residues pruned to eliminate duplicates Z: 23 47.370 2.247 0.864 0.935 0.955 0.864 C 1.759 23 residues pruned to eliminate duplicates Z: 54 65.502 2.362 0.883 0.634 0.962 0.698 CB 1.855 54 residues pruned to eliminate duplicates Z: 35 50.901 2.278 0.516 0.904 0.971 0.912 CB 1.854 35 residues pruned to eliminate duplicates Z: 12 24.991 2.321 0.301 0.871 1.000 0.727 C 1.820 12 residues pruned to eliminate duplicates Z: 34 67.923 2.295 0.960 0.930 1.000 0.697 CB 1.838 34 residues pruned to eliminate duplicates Z: 22 40.819 2.321 0.691 0.945 1.000 0.905 CB 1.571 22 residues pruned to eliminate duplicates Z: 10 20.546 2.101 0.676 0.805 0.889 0.667 CB 1.676 Z: 23 53.726 2.260 1.151 0.930 0.955 0.909 C 1.726 23 residues pruned to eliminate duplicates Z: 25 32.320 2.074 0.913 0.638 1.000 0.708 CB 1.461 Z: 39 60.627 2.301 0.663 0.907 1.000 0.842 CB 1.828 39 residues pruned to eliminate duplicates Z: 40 52.877 2.311 0.424 0.899 1.000 0.846 CB 1.839 40 residues pruned to eliminate duplicates Z: 18 21.746 2.209 0.193 0.806 0.882 0.588 CB 1.736 18 residues pruned to eliminate duplicates Z: 40 69.035 2.312 0.844 0.884 1.000 0.641 CB 1.874 40 residues pruned to eliminate duplicates Z: 40 40.840 2.257 0.241 0.900 0.949 0.872 CB 1.757 40 residues pruned to eliminate duplicates Z: 33 39.768 2.319 0.548 0.636 0.969 0.625 CB 1.781 33 residues pruned to eliminate duplicates Z: 21 46.079 2.282 0.909 0.928 1.000 0.950 CB 1.657 21 residues pruned to eliminate duplicates Z: 20 43.307 2.224 0.970 0.856 0.947 0.737 CB 1.766 20 residues pruned to eliminate duplicates Z: 91 89.423 2.354 0.795 0.784 0.956 0.778 CB 1.817 91 residues pruned to eliminate duplicates Z: 23 52.429 2.307 1.092 0.927 0.955 0.909 CB 1.700 23 residues pruned to eliminate duplicates Z: 40 58.124 2.293 0.626 0.879 0.974 0.821 CB 1.858 40 residues pruned to eliminate duplicates Z: 23 50.464 2.304 1.088 0.922 0.955 0.727 CB 1.648 23 residues pruned to eliminate duplicates Z: 8 15.540 2.118 0.216 0.852 1.000 0.857 CA 1.687 8 residues pruned to eliminate duplicates Z: 35 75.569 2.302 1.160 0.936 1.000 0.765 C 1.815 35 residues pruned to eliminate duplicates Z: 39 65.360 2.353 0.703 0.879 1.000 0.789 CB 1.919 39 residues pruned to eliminate duplicates Z: 17 23.534 2.005 0.754 0.577 1.000 0.812 CA 1.553 17 residues pruned to eliminate duplicates Z: 10 35.076 2.360 0.904 0.916 1.000 0.778 C 1.837 10 residues pruned to eliminate duplicates Z: 24 48.751 2.268 1.094 0.922 0.957 0.783 CB 1.574 24 residues pruned to eliminate duplicates Z: 21 43.468 2.202 0.786 0.890 1.000 0.850 C 1.778 Z: 25 38.662 2.087 0.800 0.921 0.958 0.833 CB 1.543 25 residues pruned to eliminate duplicates Z: 135 90.915 2.298 0.754 0.707 0.918 0.657 CB 1.758 128 residues pruned to eliminate duplicates Z: 11 16.911 2.095 0.463 0.854 0.800 0.700 CB 1.611 11 residues pruned to eliminate duplicates Z: 18 36.824 2.242 0.692 0.881 0.941 0.706 CB 1.811 18 residues pruned to eliminate duplicates Z: 37 51.960 2.337 0.397 0.901 1.000 0.889 CA 1.892 37 residues pruned to eliminate duplicates Z: 20 55.027 2.310 1.118 0.899 1.000 0.684 CA 1.845 20 residues pruned to eliminate duplicates Z: 34 62.780 2.274 0.936 0.923 0.970 0.788 C 1.799 34 residues pruned to eliminate duplicates Z: 32 35.716 2.072 0.459 0.870 0.968 0.839 CB 1.601 32 residues pruned to eliminate duplicates Z: 23 52.451 2.235 0.992 0.945 1.000 0.818 CB 1.739 23 residues pruned to eliminate duplicates Z: 9 27.788 2.375 0.890 0.905 0.875 0.750 CB 1.780 9 residues pruned to eliminate duplicates Z: 7 11.150 1.948 0.311 0.689 1.000 0.500 CA 1.499 7 residues pruned to eliminate duplicates Z: 17 28.330 2.146 0.513 0.875 1.000 0.688 CB 1.586 17 residues pruned to eliminate duplicates Z: 11 26.490 2.202 0.595 0.938 1.000 0.900 CB 1.658 11 residues pruned to eliminate duplicates Z: 23 42.782 2.311 0.718 0.930 0.955 0.909 CB 1.683 23 residues pruned to eliminate duplicates Z: 17 32.710 2.170 0.492 0.917 1.000 0.875 C 1.781 17 residues pruned to eliminate duplicates Z: 10 18.806 2.295 0.457 0.859 0.889 0.889 CB 1.552 10 residues pruned to eliminate duplicates Z: 29 26.652 2.068 0.753 0.408 0.929 0.571 CB 1.648 42 residues pruned to eliminate duplicates Z: 15 30.980 2.038 0.898 0.901 1.000 0.857 CB 1.528 15 residues pruned to eliminate duplicates Z: 9 10.041 1.920 0.544 0.480 0.875 0.500 CB 1.397 9 residues pruned to eliminate duplicates Z: 25 46.246 2.381 0.531 0.878 0.958 0.875 CB 1.962 25 residues pruned to eliminate duplicates Z: 33 59.732 2.313 0.718 0.942 1.000 0.906 CA 1.842 33 residues pruned to eliminate duplicates Z: 14 30.619 2.041 0.929 0.891 1.000 0.923 CB 1.549 14 residues pruned to eliminate duplicates Z: 40 53.772 2.299 0.562 0.914 0.974 0.923 CB 1.740 40 residues pruned to eliminate duplicates Z: 19 40.937 2.447 0.483 0.877 1.000 0.944 C 1.932 19 residues pruned to eliminate duplicates Z: 40 49.417 2.290 0.354 0.876 1.000 0.821 CB 1.854 40 residues pruned to eliminate duplicates Z: 16 24.366 2.128 0.552 0.861 0.933 0.667 CB 1.500 16 residues pruned to eliminate duplicates Z: 26 39.095 2.292 0.453 0.867 0.960 0.800 CB 1.789 26 residues pruned to eliminate duplicates Z: 39 49.641 2.318 0.373 0.902 0.974 0.868 CB 1.853 39 residues pruned to eliminate duplicates Z: 25 32.548 2.180 0.334 0.862 0.958 0.708 CA 1.750 25 residues pruned to eliminate duplicates Z: 15 36.040 2.326 0.731 0.906 1.000 0.929 C 1.701 15 residues pruned to eliminate duplicates Z: 20 30.980 2.290 0.575 0.900 0.947 0.789 CB 1.486 20 residues pruned to eliminate duplicates Z: 10 6.713 1.565 0.026 0.747 1.000 0.778 CA 1.118 10 residues pruned to eliminate duplicates Z: 40 61.392 2.291 0.667 0.894 0.974 0.795 CA 1.896 40 residues pruned to eliminate duplicates Z: 19 35.711 2.243 0.525 0.881 1.000 0.722 CA 1.783 19 residues pruned to eliminate duplicates Z: 13 25.184 1.955 0.645 0.904 1.000 0.917 CB 1.610 13 residues pruned to eliminate duplicates Z: 9 5.687 1.736 0.584 0.241 0.750 0.500 CA 1.316 9 residues pruned to eliminate duplicates Z: 10 20.828 2.007 0.724 0.811 1.000 0.889 CA 1.531 10 residues pruned to eliminate duplicates Z: 19 31.620 2.245 0.500 0.874 1.000 0.778 CB 1.611 19 residues pruned to eliminate duplicates Z: 25 44.090 2.357 0.489 0.866 0.958 0.875 CB 1.959 32 residues pruned to eliminate duplicates Z: 24 49.317 2.181 0.880 0.949 1.000 0.913 CB 1.731 24 residues pruned to eliminate duplicates Z: 38 58.170 2.318 0.553 0.908 1.000 0.784 CB 1.886 38 residues pruned to eliminate duplicates Z: 18 29.597 2.096 0.504 0.880 1.000 0.765 CB 1.649 18 residues pruned to eliminate duplicates Z: 35 47.603 2.247 0.477 0.883 0.971 0.882 CB 1.832 35 residues pruned to eliminate duplicates Z: 40 48.215 2.284 0.849 0.619 0.923 0.744 CB 1.770 40 residues pruned to eliminate duplicates Z: 19 26.252 2.209 0.149 0.905 1.000 0.944 CB 1.735 19 residues pruned to eliminate duplicates Z: 15 15.616 1.836 0.621 0.472 1.000 0.714 CB 1.443 15 residues pruned to eliminate duplicates Z: 46 70.011 2.378 1.055 0.652 1.000 0.689 CB 1.854 46 residues pruned to eliminate duplicates Z: 9 12.497 2.012 0.488 0.814 0.750 0.375 C 1.497 9 residues pruned to eliminate duplicates Z: 7 16.036 2.110 0.446 0.761 1.000 0.833 CA 1.702 7 residues pruned to eliminate duplicates Z: 23 57.148 2.277 1.209 0.926 0.955 0.818 CB 1.779 23 residues pruned to eliminate duplicates Z: 8 12.382 2.119 0.228 0.717 0.857 0.571 C 1.723 8 residues pruned to eliminate duplicates Z: 20 47.054 2.289 0.855 0.894 1.000 0.737 CA 1.823 20 residues pruned to eliminate duplicates Z: 18 45.782 2.377 0.758 0.889 1.000 0.824 C 1.912 18 residues pruned to eliminate duplicates Z: 16 26.951 2.145 0.559 0.843 1.000 0.867 CB 1.549 16 residues pruned to eliminate duplicates Z: 8 7.095 1.867 0.194 0.740 1.000 0.857 CB 0.971 8 residues pruned to eliminate duplicates Z: 24 46.358 2.318 1.026 0.870 0.913 0.870 CB 1.646 24 residues pruned to eliminate duplicates Z: 78 80.107 2.323 0.835 0.765 0.961 0.766 CB 1.761 78 residues pruned to eliminate duplicates Z: 7 16.229 2.351 0.661 0.865 1.000 0.667 CB 1.243 7 residues pruned to eliminate duplicates Z: 13 22.108 1.949 0.750 0.820 1.000 0.667 C 1.417 13 residues pruned to eliminate duplicates Z: 31 44.711 2.084 0.764 0.893 0.967 0.600 CB 1.650 31 residues pruned to eliminate duplicates Z: 18 28.185 2.099 0.600 0.799 0.941 0.824 CB 1.664 18 residues pruned to eliminate duplicates Z: 39 60.049 2.295 0.622 0.906 1.000 0.842 CB 1.862 39 residues pruned to eliminate duplicates Z: 13 16.792 1.909 0.260 0.924 1.000 0.917 CB 1.415 12 residues pruned to eliminate duplicates Z: 19 51.384 2.368 0.897 0.900 1.000 0.778 C 1.926 19 residues pruned to eliminate duplicates Z: 36 61.569 2.201 0.973 0.934 0.971 0.629 CB 1.721 36 residues pruned to eliminate duplicates Z: 29 21.572 2.148 0.395 0.530 0.857 0.536 CB 1.540 29 residues pruned to eliminate duplicates Z: 36 57.074 2.288 0.709 0.895 0.971 0.800 CB 1.820 36 residues pruned to eliminate duplicates Z: 28 36.314 2.258 0.769 0.597 0.926 0.778 CB 1.722 21 residues pruned to eliminate duplicates Z: 40 74.387 2.295 1.011 0.910 1.000 0.718 C 1.830 40 residues pruned to eliminate duplicates Z: 36 67.875 2.271 1.015 0.927 0.971 0.800 C 1.809 36 residues pruned to eliminate duplicates Z: 7 15.881 2.143 0.562 0.890 0.833 0.833 CA 1.671 7 residues pruned to eliminate duplicates Z: 28 36.759 2.231 0.924 0.596 0.963 0.704 CB 1.561 30 residues pruned to eliminate duplicates Z: 40 70.952 2.263 1.107 0.873 0.974 0.692 C 1.781 40 residues pruned to eliminate duplicates Z: 12 18.674 2.165 0.374 0.773 0.909 0.636 CB 1.634 12 residues pruned to eliminate duplicates Z: 24 39.222 2.179 0.703 0.856 0.913 0.739 CB 1.781 24 residues pruned to eliminate duplicates Z: 40 54.413 2.308 0.569 0.876 0.949 0.821 CB 1.844 40 residues pruned to eliminate duplicates Z: 28 28.337 2.021 0.731 0.642 0.889 0.593 CB 1.535 17 residues pruned to eliminate duplicates Z: 39 50.346 2.313 0.362 0.892 1.000 0.974 CB 1.862 39 residues pruned to eliminate duplicates Z: 47 52.786 2.224 0.885 0.635 0.957 0.739 CB 1.711 47 residues pruned to eliminate duplicates Z: 30 42.969 2.064 0.790 0.888 0.966 0.759 CB 1.611 31 residues pruned to eliminate duplicates Z: 108 100.103 2.366 0.918 0.751 0.963 0.692 CB 1.770 108 residues pruned to eliminate duplicates Z: 39 67.361 2.303 0.871 0.896 0.974 0.737 CB 1.866 39 residues pruned to eliminate duplicates Z: 19 39.537 2.344 0.702 0.906 0.944 0.778 CB 1.759 19 residues pruned to eliminate duplicates Z: 15 12.520 1.744 0.864 0.432 0.929 0.500 CB 1.189 Z: 9 17.770 2.014 0.624 0.873 0.875 0.750 CB 1.598 Z: 21 60.435 2.392 1.288 0.949 1.000 0.950 CB 1.704 21 residues pruned to eliminate duplicates Z: 46 62.139 2.309 1.033 0.657 0.978 0.711 CB 1.744 46 residues pruned to eliminate duplicates Z: 25 42.937 2.196 0.707 0.871 0.958 0.833 CA 1.779 25 residues pruned to eliminate duplicates Z: 20 52.998 2.247 1.194 0.924 0.947 0.684 C 1.828 20 residues pruned to eliminate duplicates Z: 39 45.720 2.283 0.320 0.924 0.947 0.868 CB 1.824 39 residues pruned to eliminate duplicates Z: 18 34.304 2.401 0.412 0.888 1.000 0.765 CB 1.770 18 residues pruned to eliminate duplicates Z: 13 20.689 2.055 0.745 0.863 0.833 0.667 CB 1.466 13 residues pruned to eliminate duplicates Z: 45 55.534 2.278 0.822 0.653 0.977 0.750 CB 1.789 46 residues pruned to eliminate duplicates Z: 40 63.391 2.264 0.910 0.895 0.949 0.821 CB 1.774 40 residues pruned to eliminate duplicates Z: 19 45.215 2.324 0.877 0.876 1.000 0.667 CA 1.775 19 residues pruned to eliminate duplicates Z: 10 8.476 1.528 0.676 0.554 0.889 0.667 CB 1.178 10 residues pruned to eliminate duplicates Z: 25 43.351 2.379 0.575 0.852 0.917 0.833 CB 1.906 25 residues pruned to eliminate duplicates Z: 18 33.856 2.271 0.649 0.876 0.882 0.706 CB 1.806 18 residues pruned to eliminate duplicates Z: 40 58.970 2.297 0.683 0.893 0.949 0.744 CB 1.849 40 residues pruned to eliminate duplicates Z: 11 34.492 2.233 1.248 0.910 1.000 0.700 C 1.541 11 residues pruned to eliminate duplicates Z: 24 47.478 2.271 0.945 0.934 0.957 0.870 CB 1.634 24 residues pruned to eliminate duplicates Z: 8 7.999 1.865 0.148 0.819 1.000 0.714 CB 1.071 8 residues pruned to eliminate duplicates Z: 24 31.451 2.076 0.500 0.876 0.957 0.739 CB 1.600 25 residues pruned to eliminate duplicates Z: 22 39.024 2.301 0.578 0.845 0.905 0.762 C 1.927 22 residues pruned to eliminate duplicates Z: 7 14.372 2.108 0.823 0.646 0.833 0.500 C 1.600 7 residues pruned to eliminate duplicates Z: 23 27.435 2.044 0.415 0.899 0.955 0.864 CB 1.514 23 residues pruned to eliminate duplicates Z: 18 27.723 2.070 0.563 0.867 0.941 0.706 CB 1.616 18 residues pruned to eliminate duplicates Z: 32 47.683 2.318 0.388 0.926 1.000 0.871 CB 1.867 32 residues pruned to eliminate duplicates Z: 15 41.277 2.399 0.661 0.915 1.000 0.929 CA 1.956 15 residues pruned to eliminate duplicates Z: 54 62.363 2.348 0.858 0.646 0.943 0.679 CB 1.816 54 residues pruned to eliminate duplicates Z: 19 34.895 1.989 0.928 0.855 1.000 0.778 C 1.583 19 residues pruned to eliminate duplicates Z: 39 63.058 2.285 0.777 0.902 0.974 0.816 CB 1.845 39 residues pruned to eliminate duplicates Z: 14 23.593 1.917 0.538 0.892 1.000 0.923 CB 1.595 14 residues pruned to eliminate duplicates Z: 17 18.890 2.164 0.498 0.514 0.938 0.438 CB 1.532 17 residues pruned to eliminate duplicates Z: 26 37.651 2.289 0.325 0.864 0.960 0.880 CA 1.897 26 residues pruned to eliminate duplicates Z: 23 60.703 2.258 1.193 0.957 1.000 0.909 CB 1.794 23 residues pruned to eliminate duplicates Z: 18 39.182 2.207 0.807 0.899 1.000 0.824 C 1.704 18 residues pruned to eliminate duplicates Z: 19 36.925 2.225 0.664 0.918 1.000 0.944 CB 1.657 19 residues pruned to eliminate duplicates Z: 34 67.044 2.268 0.948 0.933 1.000 0.727 CB 1.844 34 residues pruned to eliminate duplicates Z: 19 41.720 2.157 0.875 0.919 1.000 0.556 CB 1.714 19 residues pruned to eliminate duplicates Z: 40 64.082 2.310 0.749 0.885 1.000 0.795 CB 1.834 40 residues pruned to eliminate duplicates Z: 23 51.846 2.260 1.019 0.936 0.955 0.909 CB 1.767 23 residues pruned to eliminate duplicates Z: 77 88.895 2.381 0.989 0.762 0.961 0.776 CB 1.776 75 residues pruned to eliminate duplicates Z: 18 51.305 2.397 0.861 0.890 1.000 0.824 CA 2.007 18 residues pruned to eliminate duplicates Z: 14 20.701 1.913 0.442 0.886 1.000 0.846 CB 1.502 14 residues pruned to eliminate duplicates Z: 55 54.991 2.309 0.808 0.595 0.926 0.648 CB 1.769 55 residues pruned to eliminate duplicates Z: 15 41.159 2.468 0.711 0.902 0.929 0.857 CA 2.002 15 residues pruned to eliminate duplicates Z: 20 45.033 2.291 0.811 0.915 1.000 0.947 CB 1.759 20 residues pruned to eliminate duplicates Z: 24 55.970 2.269 1.100 0.942 1.000 0.870 CB 1.698 24 residues pruned to eliminate duplicates Z: 15 25.167 2.095 0.499 0.913 0.929 0.929 CB 1.633 15 residues pruned to eliminate duplicates Z: 8 10.215 2.003 0.204 0.835 0.857 0.714 CA 1.399 8 residues pruned to eliminate duplicates Z: 8 13.902 2.138 0.365 0.841 0.857 0.571 CA 1.566 8 residues pruned to eliminate duplicates Z: 32 40.847 2.102 0.530 0.897 1.000 0.839 CB 1.632 31 residues pruned to eliminate duplicates Z: 16 29.661 1.913 0.857 0.897 1.000 1.000 CB 1.543 16 residues pruned to eliminate duplicates Z: 39 59.865 2.328 0.624 0.907 0.974 0.868 CB 1.874 39 residues pruned to eliminate duplicates Z: 7 9.467 2.183 -0.024 0.786 0.833 0.833 CB 1.693 7 residues pruned to eliminate duplicates Z: 10 11.282 1.874 0.285 0.805 0.889 0.778 CA 1.346 10 residues pruned to eliminate duplicates Z: 39 54.656 2.260 0.636 0.900 0.974 0.737 CB 1.760 39 residues pruned to eliminate duplicates Z: 39 63.492 2.345 0.681 0.885 1.000 0.789 CB 1.886 39 residues pruned to eliminate duplicates Z: 9 15.226 1.946 0.318 0.890 1.000 1.000 CB 1.510 9 residues pruned to eliminate duplicates Z: 23 45.347 2.290 0.768 0.938 1.000 0.909 CB 1.660 23 residues pruned to eliminate duplicates Z: 40 66.658 2.263 0.893 0.902 0.974 0.718 C 1.824 40 residues pruned to eliminate duplicates Z: 26 45.501 2.294 0.584 0.867 0.960 0.720 C 1.908 26 residues pruned to eliminate duplicates Z: 7 7.621 1.781 0.361 0.868 0.833 0.667 CB 1.126 7 residues pruned to eliminate duplicates Z: 10 7.749 1.770 0.551 0.451 0.889 0.556 CB 1.114 Z: 30 27.328 1.984 0.525 0.717 0.897 0.690 CB 1.537 30 residues pruned to eliminate duplicates Z: 24 55.417 2.215 1.164 0.898 1.000 0.870 CB 1.723 24 residues pruned to eliminate duplicates Z: 20 49.228 2.311 0.956 0.875 0.947 0.632 CA 1.918 20 residues pruned to eliminate duplicates Z: 20 41.294 2.207 0.815 0.936 1.000 0.947 C 1.646 20 residues pruned to eliminate duplicates Z: 31 42.920 2.085 0.527 0.917 1.000 0.867 CA 1.737 31 residues pruned to eliminate duplicates Z: 46 54.582 2.253 0.882 0.649 0.978 0.711 CB 1.708 46 residues pruned to eliminate duplicates Z: 39 63.835 2.316 0.719 0.878 1.000 0.895 CB 1.888 39 residues pruned to eliminate duplicates Z: 19 44.596 2.297 0.832 0.869 1.000 0.667 C 1.825 19 residues pruned to eliminate duplicates Z: 24 18.027 1.931 0.622 0.465 0.957 0.609 CB 1.300 15 residues pruned to eliminate duplicates Z: 11 25.305 2.220 0.536 0.921 1.000 0.800 C 1.652 11 residues pruned to eliminate duplicates Z: 18 34.911 2.113 0.774 0.883 1.000 0.824 C 1.633 18 residues pruned to eliminate duplicates Z: 42 58.188 2.368 0.719 0.705 0.976 0.780 CB 1.899 42 residues pruned to eliminate duplicates Z: 19 44.259 2.452 0.621 0.864 1.000 0.833 C 1.923 19 residues pruned to eliminate duplicates Z: 22 47.254 2.399 0.811 0.937 1.000 0.952 CB 1.651 22 residues pruned to eliminate duplicates Z: 23 61.249 2.223 1.306 0.959 1.000 0.773 CB 1.746 23 residues pruned to eliminate duplicates Z: 13 23.493 1.984 0.521 0.895 1.000 0.917 CA 1.611 14 residues pruned to eliminate duplicates Z: 17 25.647 2.087 0.439 0.899 1.000 0.875 CB 1.526 17 residues pruned to eliminate duplicates Z: 37 45.358 2.146 0.590 0.793 0.972 0.750 CB 1.763 32 residues pruned to eliminate duplicates Z: 38 51.346 2.242 0.999 0.614 0.946 0.676 CB 1.787 38 residues pruned to eliminate duplicates Z: 14 21.840 2.017 0.675 0.662 0.923 0.769 CB 1.672 9 residues pruned to eliminate duplicates Z: 18 27.381 2.049 0.666 0.881 0.941 0.824 CB 1.497 18 residues pruned to eliminate duplicates Z: 31 47.743 2.102 0.804 0.886 1.000 0.667 CB 1.658 31 residues pruned to eliminate duplicates Z: 32 34.873 2.043 0.558 0.886 0.903 0.742 CB 1.572 32 residues pruned to eliminate duplicates Z: 7 7.655 1.986 0.303 0.465 1.000 0.500 CB 1.251 Z: 31 41.918 2.086 0.653 0.892 0.967 0.667 CB 1.649 31 residues pruned to eliminate duplicates Z: 25 35.337 2.178 0.480 0.862 0.917 0.792 C 1.792 25 residues pruned to eliminate duplicates Z: 35 49.576 2.308 0.472 0.898 0.971 0.882 CB 1.844 35 residues pruned to eliminate duplicates Z: 33 46.567 2.338 0.336 0.929 1.000 0.906 CB 1.844 33 residues pruned to eliminate duplicates Z: 10 29.426 2.286 0.690 0.894 1.000 0.667 C 1.821 10 residues pruned to eliminate duplicates Z: 26 32.511 2.018 0.925 0.651 1.000 0.600 CB 1.455 25 residues pruned to eliminate duplicates Z: 18 32.388 2.028 0.873 0.890 1.000 0.706 CB 1.488 18 residues pruned to eliminate duplicates Z: 9 13.790 1.985 0.437 0.795 0.875 0.875 CA 1.508 9 residues pruned to eliminate duplicates Z: 39 68.409 2.355 0.777 0.898 1.000 0.816 CB 1.897 39 residues pruned to eliminate duplicates Z: 18 39.477 2.204 0.820 0.922 1.000 0.765 CB 1.679 18 residues pruned to eliminate duplicates Z: 9 14.261 2.031 0.439 0.743 0.875 0.500 CA 1.586 9 residues pruned to eliminate duplicates Z: 37 68.890 2.291 0.953 0.891 0.972 0.667 CB 1.897 37 residues pruned to eliminate duplicates Z: 18 12.323 2.010 0.155 0.494 0.882 0.588 CB 1.468 17 residues pruned to eliminate duplicates Z: 26 31.075 2.024 0.830 0.642 1.000 0.600 CB 1.469 26 residues pruned to eliminate duplicates Z: 43 48.196 2.248 0.716 0.636 0.952 0.690 CB 1.781 43 residues pruned to eliminate duplicates Z: 19 37.015 2.261 0.701 0.868 0.944 0.667 CA 1.756 19 residues pruned to eliminate duplicates Z: 18 32.018 2.118 0.653 0.923 0.941 0.824 C 1.656 18 residues pruned to eliminate duplicates Z: 24 47.409 2.259 0.791 0.879 0.957 0.739 C 1.852 31 residues pruned to eliminate duplicates Z: 12 24.497 2.036 0.758 0.918 1.000 0.909 CB 1.456 12 residues pruned to eliminate duplicates Z: 39 70.816 2.348 0.862 0.869 1.000 0.816 C 1.920 39 residues pruned to eliminate duplicates Z: 22 46.785 2.354 0.931 0.941 1.000 0.952 CB 1.558 22 residues pruned to eliminate duplicates Z: 31 42.564 2.119 0.628 0.875 0.967 0.833 CB 1.695 31 residues pruned to eliminate duplicates Z: 29 28.170 2.156 0.682 0.412 0.964 0.679 CB 1.669 29 residues pruned to eliminate duplicates Z: 26 16.235 1.829 0.655 0.429 0.960 0.640 CB 1.202 26 residues pruned to eliminate duplicates Z: 22 43.230 2.381 0.665 0.939 1.000 0.905 CB 1.654 22 residues pruned to eliminate duplicates Z: 31 43.293 2.119 0.646 0.878 0.967 0.800 CB 1.702 31 residues pruned to eliminate duplicates Z: 23 49.520 2.209 0.992 0.933 0.955 0.864 CB 1.754 23 residues pruned to eliminate duplicates Z: 45 67.242 2.434 0.953 0.633 0.977 0.682 CB 1.925 45 residues pruned to eliminate duplicates Z: 54 48.429 2.279 0.681 0.571 0.906 0.623 CB 1.791 42 residues pruned to eliminate duplicates Z: 18 35.021 2.170 0.638 0.877 1.000 0.647 CB 1.735 18 residues pruned to eliminate duplicates Z: 116 92.249 2.344 0.815 0.731 0.939 0.748 CB 1.749 116 residues pruned to eliminate duplicates Z: 30 28.688 1.990 0.654 0.685 0.862 0.655 CB 1.585 30 residues pruned to eliminate duplicates Z: 15 15.994 1.751 0.279 0.847 1.000 0.786 CB 1.417 15 residues pruned to eliminate duplicates Z: 39 61.995 2.349 0.648 0.888 0.974 0.842 CB 1.922 39 residues pruned to eliminate duplicates Z: 6 11.325 2.125 0.246 0.830 0.800 0.800 C 1.798 6 residues pruned to eliminate duplicates Z: 33 42.521 2.236 0.366 0.895 1.000 0.875 CB 1.765 33 residues pruned to eliminate duplicates Z: 19 40.945 2.212 0.922 0.876 0.944 0.667 CB 1.746 19 residues pruned to eliminate duplicates Z: 40 47.730 2.296 0.337 0.899 1.000 0.846 CB 1.780 40 residues pruned to eliminate duplicates Z: 21 48.755 2.241 1.094 0.822 0.950 0.750 CB 1.849 21 residues pruned to eliminate duplicates Z: 23 55.764 2.284 1.216 0.944 0.955 0.864 CB 1.704 23 residues pruned to eliminate duplicates Z: 9 15.960 2.005 0.518 0.849 0.875 0.750 CB 1.571 9 residues pruned to eliminate duplicates Z: 20 52.521 2.320 0.990 0.887 1.000 0.737 CB 1.882 20 residues pruned to eliminate duplicates Z: 24 45.928 2.222 0.791 0.890 1.000 0.783 C 1.731 24 residues pruned to eliminate duplicates Z: 12 24.753 2.333 0.484 0.874 0.909 0.727 CB 1.726 12 residues pruned to eliminate duplicates Z: 42 52.299 2.324 0.658 0.673 0.976 0.805 CB 1.852 42 residues pruned to eliminate duplicates Z: 7 9.879 2.043 0.366 0.724 0.833 0.667 CB 1.418 7 residues pruned to eliminate duplicates Z: 29 25.410 2.128 0.664 0.404 0.893 0.536 CB 1.681 30 residues pruned to eliminate duplicates Z: 18 30.725 2.299 0.629 0.867 0.824 0.706 CB 1.767 18 residues pruned to eliminate duplicates Z: 36 24.789 2.113 0.557 0.377 0.886 0.686 CB 1.640 27 residues pruned to eliminate duplicates Z: 7 4.718 1.950 0.036 0.556 0.667 0.333 CB 1.354 7 residues pruned to eliminate duplicates Z: 37 48.906 2.122 0.755 0.818 0.972 0.583 CB 1.708 37 residues pruned to eliminate duplicates Z: 16 23.252 1.997 0.427 0.914 1.000 0.800 CB 1.490 16 residues pruned to eliminate duplicates Z: 25 16.830 1.927 0.565 0.433 0.958 0.625 CB 1.274 25 residues pruned to eliminate duplicates Z: 24 17.098 1.923 0.564 0.464 0.913 0.652 CB 1.346 24 residues pruned to eliminate duplicates Z: 19 33.195 2.113 0.695 0.903 0.944 0.778 CA 1.649 19 residues pruned to eliminate duplicates Z: 32 39.270 2.036 0.714 0.869 0.935 0.677 CB 1.577 32 residues pruned to eliminate duplicates Z: 20 48.682 2.305 1.143 0.836 0.895 0.684 CA 1.892 20 residues pruned to eliminate duplicates Z: 18 34.628 2.137 0.672 0.862 1.000 0.588 C 1.726 18 residues pruned to eliminate duplicates Z: 31 40.759 2.124 0.718 0.835 0.933 0.833 CB 1.636 31 residues pruned to eliminate duplicates Z: 26 31.185 2.278 0.609 0.568 0.880 0.560 CB 1.812 26 residues pruned to eliminate duplicates Z: 33 44.129 2.346 0.220 0.941 1.000 1.000 CB 1.891 33 residues pruned to eliminate duplicates Z: 23 52.411 2.217 0.988 0.934 1.000 0.909 CB 1.769 23 residues pruned to eliminate duplicates Z: 18 39.809 2.349 0.684 0.893 0.941 0.765 CB 1.861 18 residues pruned to eliminate duplicates Z: 20 58.838 2.317 1.213 0.894 1.000 0.737 CB 1.888 20 residues pruned to eliminate duplicates Z: 12 18.529 1.919 0.343 0.924 1.000 0.909 CB 1.523 12 residues pruned to eliminate duplicates Z: 18 35.329 2.089 0.903 0.912 0.941 0.706 C 1.622 18 residues pruned to eliminate duplicates Z: 35 37.439 2.087 0.748 0.706 0.941 0.765 CB 1.551 34 residues pruned to eliminate duplicates Z: 35 48.855 2.303 0.364 0.927 1.000 0.971 CB 1.869 35 residues pruned to eliminate duplicates Z: 19 27.218 2.232 0.414 0.825 0.889 0.722 CA 1.727 19 residues pruned to eliminate duplicates Z: 8 7.715 1.941 -0.082 0.723 1.000 0.714 CB 1.337 8 residues pruned to eliminate duplicates Z: 10 7.633 1.742 0.502 0.470 0.889 0.556 CB 1.127 10 residues pruned to eliminate duplicates Z: 24 37.445 1.999 0.675 0.893 1.000 0.652 CB 1.673 24 residues pruned to eliminate duplicates Z: 15 28.704 2.080 0.732 0.848 1.000 0.857 CA 1.580 15 residues pruned to eliminate duplicates Z: 13 21.034 1.931 0.401 0.915 1.000 0.833 CA 1.586 13 residues pruned to eliminate duplicates Z: 37 53.144 2.316 0.803 0.706 0.944 0.833 CB 1.861 37 residues pruned to eliminate duplicates Z: 20 42.587 2.288 0.727 0.905 1.000 0.684 CB 1.760 20 residues pruned to eliminate duplicates Z: 50 44.197 2.298 0.503 0.612 0.898 0.694 CB 1.830 50 residues pruned to eliminate duplicates Z: 20 46.497 2.185 1.056 0.894 1.000 0.737 CB 1.703 20 residues pruned to eliminate duplicates Z: 21 52.737 2.256 1.053 0.873 1.000 0.750 CB 1.854 21 residues pruned to eliminate duplicates Z: 52 55.196 2.238 0.769 0.630 0.980 0.686 CB 1.763 52 residues pruned to eliminate duplicates Z: 28 35.098 2.066 0.751 0.734 0.926 0.704 CB 1.634 28 residues pruned to eliminate duplicates Z: 36 49.120 2.238 0.894 0.647 0.971 0.743 CB 1.758 35 residues pruned to eliminate duplicates Z: 6 8.461 1.926 0.340 0.661 0.800 0.600 CA 1.579 6 residues pruned to eliminate duplicates Z: 13 5.479 1.427 0.525 0.410 0.917 0.500 CB 0.872 11 residues pruned to eliminate duplicates Z: 8 15.218 2.013 0.839 0.592 1.000 0.714 CB 1.422 8 residues pruned to eliminate duplicates Z: 10 26.819 2.286 0.492 0.920 1.000 0.889 CB 1.846 10 residues pruned to eliminate duplicates Z: 10 12.447 1.853 0.549 0.749 0.889 0.778 CA 1.301 10 residues pruned to eliminate duplicates Z: 44 46.840 2.238 0.646 0.671 0.930 0.744 CB 1.781 44 residues pruned to eliminate duplicates Z: 63 38.554 2.183 0.556 0.530 0.887 0.661 CB 1.578 66 residues pruned to eliminate duplicates Z: 26 48.307 2.300 0.671 0.851 0.960 0.720 CA 1.938 26 residues pruned to eliminate duplicates Z: 6 8.085 1.659 0.333 0.874 1.000 0.800 C 1.190 6 residues pruned to eliminate duplicates Z: 36 50.267 2.236 0.928 0.681 0.943 0.714 CB 1.770 36 residues pruned to eliminate duplicates Z: 25 41.966 2.377 0.441 0.870 0.958 0.750 CB 1.904 25 residues pruned to eliminate duplicates Z: 7 9.549 2.109 -0.103 0.779 1.000 0.667 CB 1.611 7 residues pruned to eliminate duplicates Z: 9 16.104 2.166 0.604 0.844 0.875 0.750 CB 1.394 9 residues pruned to eliminate duplicates Z: 25 37.436 2.287 0.783 0.572 1.000 0.708 CB 1.748 25 residues pruned to eliminate duplicates Z: 35 58.819 2.290 0.772 0.927 0.971 0.912 CB 1.795 35 residues pruned to eliminate duplicates Z: 8 8.842 1.743 0.603 0.578 1.000 0.571 CB 1.109 8 residues pruned to eliminate duplicates Z: 33 43.981 2.206 0.973 0.616 1.000 0.719 CB 1.600 27 residues pruned to eliminate duplicates Z: 12 25.079 2.092 0.626 0.937 1.000 1.000 CB 1.548 12 residues pruned to eliminate duplicates Z: 12 18.009 1.922 0.283 0.922 1.000 0.909 CB 1.548 12 residues pruned to eliminate duplicates Z: 13 18.215 1.932 0.368 0.888 0.917 0.833 CA 1.563 13 residues pruned to eliminate duplicates Z: 17 30.324 2.145 0.540 0.889 1.000 0.812 CB 1.653 17 residues pruned to eliminate duplicates Z: 25 31.250 2.343 0.193 0.821 0.958 0.792 CB 1.803 25 residues pruned to eliminate duplicates Z: 16 20.154 1.996 0.481 0.598 0.933 0.733 CA 1.718 16 residues pruned to eliminate duplicates Z: 18 29.690 2.065 0.666 0.881 0.941 0.706 C 1.611 18 residues pruned to eliminate duplicates Z: 102 61.565 2.124 0.782 0.570 0.970 0.663 CB 1.559 107 residues pruned to eliminate duplicates Z: 25 30.352 2.069 0.782 0.624 1.000 0.750 CB 1.494 25 residues pruned to eliminate duplicates Z: 6 12.245 2.242 0.525 0.676 0.800 0.400 CA 1.702 6 residues pruned to eliminate duplicates Z: 14 14.668 1.821 0.175 0.900 0.923 0.692 CA 1.471 14 residues pruned to eliminate duplicates Z: 20 51.161 2.335 1.042 0.850 0.947 0.789 CA 1.925 20 residues pruned to eliminate duplicates Z: 69 41.328 2.108 0.739 0.469 0.926 0.574 CB 1.524 69 residues pruned to eliminate duplicates Z: 81 70.777 2.248 0.875 0.693 0.925 0.788 CB 1.701 81 residues pruned to eliminate duplicates Z: 16 15.603 1.832 0.342 0.816 0.933 0.733 CB 1.335 16 residues pruned to eliminate duplicates Z: 7 14.890 2.148 0.440 0.859 0.833 0.500 CA 1.735 7 residues pruned to eliminate duplicates Z: 8 12.450 1.945 0.409 0.777 1.000 0.857 CB 1.345 8 residues pruned to eliminate duplicates Z: 19 29.611 2.038 0.560 0.886 1.000 0.944 CB 1.584 19 residues pruned to eliminate duplicates Z: 10 14.076 1.737 0.550 0.858 1.000 0.889 CB 1.283 10 residues pruned to eliminate duplicates Z: 24 37.483 2.213 0.883 0.703 0.913 0.522 CB 1.707 24 residues pruned to eliminate duplicates Z: 43 32.416 1.907 0.829 0.578 0.905 0.667 CB 1.471 43 residues pruned to eliminate duplicates Z: 18 32.443 2.281 0.545 0.819 1.000 0.824 CB 1.694 18 residues pruned to eliminate duplicates Z: 9 11.335 1.904 0.824 0.395 1.000 0.875 CB 1.289 9 residues pruned to eliminate duplicates Z: 39 69.202 2.313 0.869 0.888 1.000 0.789 CB 1.871 39 residues pruned to eliminate duplicates Z: 40 53.241 2.295 0.453 0.888 1.000 0.923 CB 1.842 40 residues pruned to eliminate duplicates Z: 24 17.508 1.912 0.696 0.479 0.913 0.609 CB 1.259 24 residues pruned to eliminate duplicates Z: 25 33.925 2.112 0.477 0.930 0.958 0.958 CB 1.620 25 residues pruned to eliminate duplicates Z: 63 55.899 2.299 0.797 0.579 0.935 0.661 CB 1.702 63 residues pruned to eliminate duplicates Z: 56 67.741 2.307 0.829 0.807 0.945 0.818 CB 1.752 56 residues pruned to eliminate duplicates Z: 34 68.311 2.323 0.940 0.939 1.000 0.818 C 1.833 34 residues pruned to eliminate duplicates Z: 8 9.123 1.950 0.333 0.592 0.857 0.571 CB 1.418 8 residues pruned to eliminate duplicates Z: 19 44.859 2.248 0.943 0.931 1.000 0.667 C 1.692 19 residues pruned to eliminate duplicates Z: 16 17.496 2.036 0.531 0.580 0.867 0.533 CA 1.549 16 residues pruned to eliminate duplicates Z: 40 51.063 2.290 0.437 0.880 1.000 0.923 CB 1.800 40 residues pruned to eliminate duplicates Z: 35 48.959 2.265 0.401 0.943 1.000 0.912 CB 1.834 35 residues pruned to eliminate duplicates Z: 18 27.497 2.107 0.464 0.860 1.000 0.765 CB 1.589 18 residues pruned to eliminate duplicates Z: 18 32.187 2.106 0.664 0.879 1.000 0.824 CB 1.615 18 residues pruned to eliminate duplicates Z: 33 62.027 2.286 0.907 0.935 0.938 0.812 CA 1.869 33 residues pruned to eliminate duplicates Z: 26 35.332 2.204 0.380 0.866 0.920 0.760 CA 1.849 26 residues pruned to eliminate duplicates Z: 16 28.309 2.180 0.577 0.874 0.933 0.933 CB 1.659 16 residues pruned to eliminate duplicates Z: 18 16.005 1.916 0.586 0.489 0.824 0.588 C 1.569 18 residues pruned to eliminate duplicates Z: 43 39.660 2.023 0.784 0.675 0.952 0.738 CB 1.515 42 residues pruned to eliminate duplicates Z: 18 28.928 2.113 0.486 0.863 1.000 0.765 CB 1.639 18 residues pruned to eliminate duplicates Z: 25 40.290 2.204 0.734 0.828 0.917 0.667 CA 1.768 25 residues pruned to eliminate duplicates Z: 13 24.305 1.997 0.540 0.901 1.000 1.000 CA 1.628 13 residues pruned to eliminate duplicates Z: 12 28.264 2.097 0.666 0.905 1.000 0.818 C 1.736 12 residues pruned to eliminate duplicates Z: 26 42.265 2.261 0.658 0.839 0.920 0.840 CB 1.831 26 residues pruned to eliminate duplicates Z: 6 12.817 2.001 0.651 0.625 1.000 0.600 C 1.542 6 residues pruned to eliminate duplicates Z: 20 42.641 2.361 0.620 0.878 1.000 0.842 C 1.856 20 residues pruned to eliminate duplicates Z: 17 29.867 2.143 0.660 0.792 1.000 0.750 CB 1.625 17 residues pruned to eliminate duplicates Z: 23 20.490 2.106 0.501 0.501 0.818 0.591 CB 1.688 18 residues pruned to eliminate duplicates Z: 28 28.064 2.134 0.667 0.451 0.963 0.630 CB 1.658 28 residues pruned to eliminate duplicates Z: 11 3.719 1.501 0.313 0.189 0.700 0.300 CB 1.238 11 residues pruned to eliminate duplicates Z: 21 31.526 2.158 0.608 0.876 1.000 0.750 CB 1.476 21 residues pruned to eliminate duplicates Z: 72 69.779 2.281 0.802 0.742 0.944 0.732 CB 1.719 72 residues pruned to eliminate duplicates Z: 13 27.748 2.051 0.691 0.910 1.000 0.833 CB 1.638 13 residues pruned to eliminate duplicates Z: 20 14.789 1.934 0.603 0.479 0.789 0.526 CB 1.416 20 residues pruned to eliminate duplicates Z: 19 35.158 2.131 0.662 0.917 1.000 0.833 C 1.651 19 residues pruned to eliminate duplicates Z: 54 42.549 2.184 0.834 0.509 0.925 0.679 CB 1.564 54 residues pruned to eliminate duplicates Z: 12 16.878 1.772 0.516 0.816 1.000 0.727 CB 1.439 12 residues pruned to eliminate duplicates Z: 9 17.742 2.047 0.570 0.725 1.000 0.875 C 1.594 9 residues pruned to eliminate duplicates Z: 7 9.679 1.976 0.364 0.757 0.833 0.667 CA 1.400 7 residues pruned to eliminate duplicates Z: 31 47.100 2.109 0.830 0.867 0.967 0.667 CB 1.686 31 residues pruned to eliminate duplicates Z: 150 107.279 2.308 0.934 0.725 0.926 0.658 CB 1.735 150 residues pruned to eliminate duplicates Z: 17 25.382 2.095 0.494 0.875 0.938 0.812 CB 1.573 17 residues pruned to eliminate duplicates Z: 39 66.298 2.307 0.854 0.913 0.974 0.842 CB 1.828 39 residues pruned to eliminate duplicates Z: 8 7.053 1.915 0.126 0.663 0.857 0.429 CB 1.241 8 residues pruned to eliminate duplicates Z: 15 27.014 1.962 0.949 0.906 0.857 0.714 CB 1.566 15 residues pruned to eliminate duplicates Z: 16 42.273 2.263 1.052 0.922 1.000 0.800 CB 1.652 16 residues pruned to eliminate duplicates Z: 21 49.761 2.309 0.954 0.929 1.000 0.950 CB 1.725 21 residues pruned to eliminate duplicates Z: 15 19.614 2.032 0.891 0.460 1.000 0.643 CB 1.421 15 residues pruned to eliminate duplicates Z: 8 13.740 1.978 0.582 0.876 0.857 0.714 CA 1.407 8 residues pruned to eliminate duplicates Z: 7 10.736 2.086 0.254 0.750 1.000 1.000 CB 1.341 7 residues pruned to eliminate duplicates Z: 9 17.800 1.982 0.514 0.837 1.000 0.750 CB 1.568 9 residues pruned to eliminate duplicates Z: 38 24.595 2.111 0.576 0.371 0.865 0.595 CB 1.613 38 residues pruned to eliminate duplicates Z: 32 38.621 2.091 0.718 0.858 0.871 0.774 CB 1.633 32 residues pruned to eliminate duplicates Z: 20 34.722 2.258 0.902 0.594 1.000 0.684 CB 1.696 20 residues pruned to eliminate duplicates Z: 16 26.678 2.113 0.397 0.930 1.000 0.867 CB 1.632 16 residues pruned to eliminate duplicates Z: 19 36.000 2.254 0.822 0.869 0.833 0.667 C 1.812 19 residues pruned to eliminate duplicates Z: 12 5.613 1.825 0.347 0.453 0.818 0.818 CB 0.883 12 residues pruned to eliminate duplicates Z: 36 50.692 2.249 0.531 0.907 1.000 0.829 CB 1.769 36 residues pruned to eliminate duplicates Z: 12 21.721 2.208 0.362 0.836 0.909 0.818 CB 1.793 12 residues pruned to eliminate duplicates Z: 7 15.728 2.455 0.196 0.823 0.833 0.833 C 1.984 7 residues pruned to eliminate duplicates Z: 42 40.839 2.084 0.785 0.690 0.927 0.732 CB 1.555 42 residues pruned to eliminate duplicates Z: 16 27.941 2.054 0.683 0.941 0.933 0.800 CB 1.552 16 residues pruned to eliminate duplicates Z: 39 49.840 2.312 0.362 0.903 1.000 0.921 CB 1.831 39 residues pruned to eliminate duplicates Z: 21 39.324 2.105 0.930 0.865 1.000 0.800 CB 1.586 21 residues pruned to eliminate duplicates Z: 25 36.227 2.275 0.369 0.863 0.958 0.625 CB 1.817 25 residues pruned to eliminate duplicates Z: 12 12.584 1.665 0.414 0.912 0.909 0.818 CB 1.256 12 residues pruned to eliminate duplicates Z: 26 39.685 2.241 0.577 0.851 0.960 0.720 CB 1.732 26 residues pruned to eliminate duplicates Z: 49 45.282 2.207 0.970 0.478 0.938 0.688 CB 1.640 49 residues pruned to eliminate duplicates Z: 16 31.918 2.134 0.716 0.885 1.000 0.867 CB 1.625 16 residues pruned to eliminate duplicates Z: 19 34.126 2.007 0.954 0.845 1.000 0.833 CB 1.524 19 residues pruned to eliminate duplicates Z: 18 37.975 2.145 0.840 0.908 0.941 0.824 C 1.761 18 residues pruned to eliminate duplicates Z: 24 38.575 2.226 0.730 0.895 1.000 0.870 CB 1.497 24 residues pruned to eliminate duplicates Z: 33 36.399 2.211 0.828 0.589 0.938 0.719 CB 1.559 33 residues pruned to eliminate duplicates Z: 23 44.091 2.277 0.998 0.920 0.955 0.909 CB 1.524 23 residues pruned to eliminate duplicates Z: 12 16.841 1.924 0.257 0.925 1.000 0.909 CB 1.473 12 residues pruned to eliminate duplicates Z: 6 10.329 2.030 0.477 0.614 1.000 0.600 CB 1.384 6 residues pruned to eliminate duplicates Z: 16 25.977 2.068 0.872 0.833 0.867 0.667 CB 1.500 16 residues pruned to eliminate duplicates Z: 6 12.451 2.140 0.227 0.859 1.000 0.800 CA 1.560 6 residues pruned to eliminate duplicates Z: 23 23.047 2.115 0.121 0.873 1.000 0.909 CB 1.509 23 residues pruned to eliminate duplicates Z: 18 39.760 2.309 0.645 0.938 1.000 0.882 C 1.766 18 residues pruned to eliminate duplicates Z: 17 16.428 2.098 0.628 0.443 0.875 0.500 CB 1.457 18 residues pruned to eliminate duplicates Z: 37 35.679 2.091 0.659 0.692 0.917 0.778 CB 1.569 37 residues pruned to eliminate duplicates Z: 47 42.692 2.183 0.592 0.626 0.935 0.696 CB 1.721 47 residues pruned to eliminate duplicates Z: 101 85.609 2.311 0.845 0.736 0.930 0.740 CB 1.746 101 residues pruned to eliminate duplicates Z: 26 30.444 2.207 0.226 0.862 0.920 0.840 CB 1.795 26 residues pruned to eliminate duplicates Z: 12 31.114 2.086 0.807 0.906 1.000 1.000 CA 1.770 12 residues pruned to eliminate duplicates Z: 39 60.506 2.294 0.690 0.876 1.000 0.737 C 1.840 39 residues pruned to eliminate duplicates Z: 13 13.400 1.574 0.496 0.915 1.000 0.417 CB 1.161 13 residues pruned to eliminate duplicates Z: 13 10.192 1.589 0.371 0.867 0.750 0.417 CB 1.317 13 residues pruned to eliminate duplicates Z: 61 51.314 2.171 0.850 0.569 0.983 0.700 CB 1.569 61 residues pruned to eliminate duplicates Z: 7 9.904 1.754 0.302 0.756 1.000 0.667 CB 1.409 7 residues pruned to eliminate duplicates Z: 7 13.695 2.159 0.129 0.812 1.000 0.667 CA 1.749 7 residues pruned to eliminate duplicates Z: 25 42.556 2.315 0.457 0.873 1.000 0.833 CB 1.875 25 residues pruned to eliminate duplicates Z: 17 21.221 2.033 0.296 0.881 0.938 0.812 CB 1.555 17 residues pruned to eliminate duplicates Z: 68 77.939 2.366 0.775 0.769 0.985 0.836 CB 1.813 68 residues pruned to eliminate duplicates Z: 20 44.366 2.231 0.763 0.923 1.000 0.947 CB 1.818 20 residues pruned to eliminate duplicates Z: 12 14.166 1.671 0.532 0.904 1.000 0.727 CB 1.189 12 residues pruned to eliminate duplicates Z: 127 78.048 2.303 0.635 0.668 0.921 0.762 CB 1.716 127 residues pruned to eliminate duplicates Z: 26 22.417 2.255 0.431 0.524 0.840 0.520 CB 1.615 26 residues pruned to eliminate duplicates Z: 23 40.970 2.289 0.701 0.922 0.955 0.864 CB 1.653 23 residues pruned to eliminate duplicates Z: 17 26.951 2.072 0.570 0.857 1.000 0.688 CB 1.526 17 residues pruned to eliminate duplicates Z: 9 15.853 1.942 0.807 0.853 0.875 0.750 CB 1.348 9 residues pruned to eliminate duplicates Z: 10 15.992 2.035 0.962 0.525 0.889 0.556 CA 1.465 10 residues pruned to eliminate duplicates Z: 41 40.106 2.098 0.697 0.705 0.925 0.700 CB 1.598 41 residues pruned to eliminate duplicates Z: 11 38.654 2.322 0.970 0.930 1.000 0.800 C 1.868 11 residues pruned to eliminate duplicates Z: 9 18.335 2.030 0.744 0.724 1.000 0.500 C 1.496 9 residues pruned to eliminate duplicates Z: 30 29.532 1.974 0.610 0.694 0.897 0.724 CB 1.611 29 residues pruned to eliminate duplicates Z: 18 10.819 1.991 0.071 0.492 0.824 0.647 CB 1.507 18 residues pruned to eliminate duplicates Z: 25 23.115 1.938 0.969 0.482 0.833 0.417 CB 1.512 25 residues pruned to eliminate duplicates Z: 8 9.056 1.766 0.550 0.616 0.857 0.857 CA 1.307 8 residues pruned to eliminate duplicates Z: 16 12.681 1.932 0.341 0.428 0.867 0.800 CB 1.571 16 residues pruned to eliminate duplicates Z: 14 20.816 2.004 0.599 0.762 1.000 0.692 CB 1.428 14 residues pruned to eliminate duplicates Z: 8 8.446 1.855 -0.023 0.886 1.000 1.000 CB 1.270 8 residues pruned to eliminate duplicates Z: 44 54.578 2.288 0.729 0.691 0.930 0.698 C 1.899 44 residues pruned to eliminate duplicates Z: 138 74.401 2.279 0.575 0.623 0.934 0.737 CB 1.689 138 residues pruned to eliminate duplicates Z: 8 10.898 1.949 0.475 0.802 0.857 0.714 CB 1.284 8 residues pruned to eliminate duplicates Z: 8 10.900 2.028 0.032 0.858 1.000 0.857 CB 1.451 8 residues pruned to eliminate duplicates Z: 25 41.405 2.355 0.522 0.856 0.958 0.750 CB 1.815 25 residues pruned to eliminate duplicates Z: 16 18.116 2.201 0.616 0.555 0.867 0.400 CB 1.439 16 residues pruned to eliminate duplicates Z: 10 10.280 1.686 0.472 0.805 0.778 0.778 C 1.360 10 residues pruned to eliminate duplicates Z: 37 55.384 2.350 0.965 0.634 0.944 0.667 CB 1.868 37 residues pruned to eliminate duplicates Z: 24 17.206 1.892 0.643 0.497 0.957 0.783 CB 1.210 24 residues pruned to eliminate duplicates Z: 12 15.223 1.900 0.152 0.910 1.000 0.818 CB 1.487 12 residues pruned to eliminate duplicates Z: 55 50.161 2.283 0.666 0.584 0.926 0.704 CB 1.789 55 residues pruned to eliminate duplicates Z: 8 16.471 2.185 0.247 0.863 1.000 0.857 CA 1.676 8 residues pruned to eliminate duplicates Z: 69 87.005 2.331 1.016 0.804 0.971 0.735 CB 1.773 69 residues pruned to eliminate duplicates Z: 11 15.702 1.981 0.195 0.911 1.000 1.000 CB 1.487 11 residues pruned to eliminate duplicates Z: 22 42.802 2.360 0.691 0.946 1.000 0.952 CB 1.619 22 residues pruned to eliminate duplicates Z: 25 32.896 2.070 0.892 0.642 1.000 0.500 CB 1.501 25 residues pruned to eliminate duplicates Z: 20 45.500 2.331 0.783 0.873 1.000 0.842 CB 1.830 20 residues pruned to eliminate duplicates Z: 19 35.919 2.217 0.690 0.836 0.944 0.722 CA 1.791 19 residues pruned to eliminate duplicates Z: 19 37.939 2.343 0.606 0.917 1.000 0.889 CB 1.677 19 residues pruned to eliminate duplicates Z: 16 28.082 2.130 0.465 0.909 1.000 0.933 CB 1.649 16 residues pruned to eliminate duplicates Z: 8 19.640 2.103 0.657 0.892 1.000 0.857 CB 1.530 8 residues pruned to eliminate duplicates Z: 30 46.294 2.177 0.627 0.880 1.000 0.897 CB 1.759 30 residues pruned to eliminate duplicates Z: 33 40.811 2.219 0.607 0.674 0.969 0.688 CB 1.779 33 residues pruned to eliminate duplicates Z: 18 42.342 2.204 0.860 0.917 1.000 0.765 CA 1.768 18 residues pruned to eliminate duplicates Z: 35 47.107 2.290 0.378 0.911 1.000 0.912 CB 1.814 35 residues pruned to eliminate duplicates Z: 8 11.556 1.985 0.433 0.714 0.857 0.571 CA 1.475 8 residues pruned to eliminate duplicates Z: 9 10.038 1.784 0.068 0.815 1.000 0.875 CA 1.416 9 residues pruned to eliminate duplicates Z: 34 45.117 2.320 0.305 0.916 1.000 0.909 CB 1.832 34 residues pruned to eliminate duplicates Z: 40 62.511 2.266 0.842 0.896 0.949 0.795 C 1.811 40 residues pruned to eliminate duplicates Z: 18 25.850 1.945 0.643 0.904 0.941 0.647 CB 1.484 18 residues pruned to eliminate duplicates Z: 14 17.599 1.829 0.360 0.873 1.000 1.000 CB 1.428 14 residues pruned to eliminate duplicates Z: 19 29.622 2.342 0.573 0.600 0.944 0.833 CB 1.825 19 residues pruned to eliminate duplicates Z: 11 16.602 2.061 0.670 0.641 0.900 0.500 C 1.486 11 residues pruned to eliminate duplicates Z: 16 28.064 2.117 0.539 0.887 1.000 0.800 CB 1.604 16 residues pruned to eliminate duplicates Z: 8 15.353 2.027 0.507 0.858 1.000 0.714 CB 1.398 8 residues pruned to eliminate duplicates Z: 23 47.236 2.204 0.905 0.948 1.000 0.818 CB 1.656 23 residues pruned to eliminate duplicates Z: 36 42.674 2.156 0.768 0.696 0.914 0.686 C 1.731 36 residues pruned to eliminate duplicates Z: 22 59.642 2.306 1.301 0.943 0.952 0.762 CB 1.785 22 residues pruned to eliminate duplicates Z: 9 11.315 1.900 0.685 0.532 0.875 0.750 CA 1.384 9 residues pruned to eliminate duplicates Z: 18 48.302 2.254 1.051 0.890 1.000 0.882 C 1.823 18 residues pruned to eliminate duplicates Z: 7 9.145 1.928 0.011 0.767 1.000 0.833 CB 1.511 7 residues pruned to eliminate duplicates Z: 13 16.417 1.870 0.242 0.903 1.000 0.750 CB 1.455 13 residues pruned to eliminate duplicates Z: 71 80.921 2.269 1.008 0.804 0.971 0.686 CB 1.675 71 residues pruned to eliminate duplicates Z: 23 35.094 2.213 0.519 0.881 0.909 0.818 C 1.773 23 residues pruned to eliminate duplicates Z: 23 46.845 2.309 0.808 0.943 1.000 0.955 CB 1.657 23 residues pruned to eliminate duplicates Z: 9 16.361 2.164 0.714 0.575 0.875 0.625 CB 1.657 9 residues pruned to eliminate duplicates Z: 9 18.682 2.174 0.587 0.775 0.875 0.625 CB 1.715 9 residues pruned to eliminate duplicates Z: 18 29.183 2.077 0.571 0.838 1.000 0.824 CB 1.622 18 residues pruned to eliminate duplicates Z: 10 37.605 2.248 1.298 0.915 1.000 0.778 CB 1.716 10 residues pruned to eliminate duplicates Z: 12 20.583 2.024 0.826 0.581 1.000 0.818 CA 1.553 12 residues pruned to eliminate duplicates Z: 12 13.641 1.880 0.104 0.906 1.000 0.909 CB 1.409 12 residues pruned to eliminate duplicates Z: 25 46.012 2.237 1.181 0.709 0.958 0.750 CB 1.661 25 residues pruned to eliminate duplicates Z: 24 20.066 1.942 0.672 0.500 0.957 0.652 CB 1.347 24 residues pruned to eliminate duplicates Z: 23 18.344 1.961 0.414 0.556 0.909 0.818 CB 1.470 23 residues pruned to eliminate duplicates Z: 34 75.707 2.294 1.223 0.949 1.000 0.697 C 1.784 34 residues pruned to eliminate duplicates Z: 21 65.169 2.267 1.526 0.932 1.000 0.550 CB 1.777 21 residues pruned to eliminate duplicates Z: 23 43.605 2.170 0.872 0.936 0.955 0.818 CB 1.669 23 residues pruned to eliminate duplicates Z: 18 37.384 2.139 0.829 0.867 1.000 0.647 CB 1.696 18 residues pruned to eliminate duplicates Z: 24 51.751 2.206 1.035 0.920 1.000 0.783 CB 1.693 24 residues pruned to eliminate duplicates Z: 12 4.240 1.631 0.241 0.416 0.727 0.455 CB 0.947 12 residues pruned to eliminate duplicates Z: 18 27.825 2.181 0.176 0.933 1.000 0.941 CB 1.836 18 residues pruned to eliminate duplicates Z: 14 33.918 2.170 1.134 0.906 0.923 0.769 C 1.565 14 residues pruned to eliminate duplicates Z: 13 10.734 1.559 0.366 0.890 0.917 0.917 CB 1.142 13 residues pruned to eliminate duplicates Z: 16 24.944 2.027 0.455 0.898 1.000 0.933 CB 1.562 16 residues pruned to eliminate duplicates Z: 10 22.242 2.040 0.664 0.834 1.000 0.889 CB 1.636 10 residues pruned to eliminate duplicates Z: 16 47.782 2.395 0.984 0.901 1.000 0.867 CB 1.853 16 residues pruned to eliminate duplicates Z: 40 52.249 2.226 0.550 0.910 0.974 0.872 CB 1.765 40 residues pruned to eliminate duplicates Z: 24 54.141 2.213 1.156 0.937 1.000 0.870 CB 1.647 24 residues pruned to eliminate duplicates Z: 28 14.925 1.986 0.404 0.336 0.889 0.407 CB 1.386 28 residues pruned to eliminate duplicates Z: 65 44.003 2.116 0.806 0.509 0.922 0.594 CB 1.548 65 residues pruned to eliminate duplicates Z: 20 40.209 2.247 0.619 0.896 1.000 0.737 CB 1.817 20 residues pruned to eliminate duplicates Z: 16 33.091 2.154 0.867 0.873 1.000 0.667 CB 1.547 16 residues pruned to eliminate duplicates Z: 9 17.625 1.776 0.989 0.840 1.000 0.875 CB 1.318 9 residues pruned to eliminate duplicates Z: 18 50.029 2.278 1.099 0.917 1.000 0.647 CB 1.791 18 residues pruned to eliminate duplicates Z: 10 7.865 1.989 0.377 0.274 0.889 0.667 CB 1.392 10 residues pruned to eliminate duplicates Z: 28 23.749 2.091 0.644 0.441 0.889 0.630 CB 1.590 28 residues pruned to eliminate duplicates Z: 19 27.909 2.263 0.628 0.521 1.000 0.667 CA 1.748 19 residues pruned to eliminate duplicates Z: 86 76.170 2.268 0.783 0.707 0.941 0.600 CB 1.797 86 residues pruned to eliminate duplicates Z: 12 40.926 2.239 1.253 0.947 1.000 1.000 C 1.691 12 residues pruned to eliminate duplicates Z: 19 34.501 2.222 0.703 0.833 0.944 0.667 CB 1.708 19 residues pruned to eliminate duplicates Z: 25 37.862 2.153 0.748 0.835 0.875 0.750 C 1.759 25 residues pruned to eliminate duplicates Z: 24 47.074 2.276 0.758 0.875 0.957 0.783 CA 1.865 24 residues pruned to eliminate duplicates Z: 15 35.013 2.020 0.995 0.898 1.000 0.786 CB 1.661 15 residues pruned to eliminate duplicates Z: 23 59.152 2.254 1.213 0.952 1.000 0.818 CB 1.741 23 residues pruned to eliminate duplicates Z: 18 33.620 2.065 0.885 0.895 0.941 0.529 CB 1.596 18 residues pruned to eliminate duplicates Z: 22 47.944 2.325 0.984 0.928 1.000 0.857 CB 1.588 22 residues pruned to eliminate duplicates Z: 29 23.627 2.114 0.448 0.417 0.964 0.571 CB 1.650 29 residues pruned to eliminate duplicates Z: 8 18.810 1.994 0.717 0.722 1.000 1.000 C 1.700 8 residues pruned to eliminate duplicates Z: 8 12.094 2.030 0.500 0.405 1.000 0.429 CA 1.660 8 residues pruned to eliminate duplicates Z: 28 46.524 2.393 0.626 0.739 0.963 0.778 CB 1.929 28 residues pruned to eliminate duplicates Z: 18 44.466 2.437 0.719 0.869 1.000 0.765 C 1.880 18 residues pruned to eliminate duplicates Z: 22 67.909 2.318 1.419 0.965 1.000 0.905 C 1.804 22 residues pruned to eliminate duplicates Z: 11 13.378 2.011 0.467 0.510 1.000 0.800 CB 1.420 11 residues pruned to eliminate duplicates Z: 10 11.347 2.065 0.179 0.537 1.000 0.778 CB 1.498 10 residues pruned to eliminate duplicates Z: 64 40.976 2.154 0.681 0.503 0.905 0.603 CB 1.571 64 residues pruned to eliminate duplicates Z: 20 36.167 2.208 0.702 0.851 1.000 0.789 CB 1.635 20 residues pruned to eliminate duplicates Z: 70 82.961 2.283 0.949 0.785 0.971 0.739 CB 1.799 70 residues pruned to eliminate duplicates Z: 21 44.067 2.375 0.712 0.930 1.000 1.000 CB 1.696 21 residues pruned to eliminate duplicates Z: 8 10.850 2.245 0.200 0.500 1.000 0.857 CA 1.522 8 residues pruned to eliminate duplicates Z: 35 44.495 2.284 0.652 0.674 0.941 0.765 CB 1.831 35 residues pruned to eliminate duplicates Z: 21 34.329 2.198 0.619 0.878 0.950 0.850 CB 1.647 21 residues pruned to eliminate duplicates Z: 12 13.058 2.109 -0.026 0.777 0.818 0.818 CB 1.834 12 residues pruned to eliminate duplicates Z: 62 37.267 2.055 0.694 0.553 0.902 0.672 CB 1.445 62 residues pruned to eliminate duplicates Z: 19 27.955 2.032 0.455 0.872 1.000 0.833 CB 1.624 19 residues pruned to eliminate duplicates Z: 17 21.426 2.178 0.014 0.897 1.000 0.875 CB 1.736 17 residues pruned to eliminate duplicates Z: 11 15.745 1.839 0.644 0.697 0.900 0.900 CA 1.529 11 residues pruned to eliminate duplicates Z: 32 44.442 2.083 0.872 0.839 0.935 0.581 CB 1.634 32 residues pruned to eliminate duplicates Z: 15 38.702 2.171 1.104 0.853 1.000 0.929 CB 1.674 15 residues pruned to eliminate duplicates Z: 13 12.572 2.088 0.278 0.741 0.667 0.583 CA 1.644 13 residues pruned to eliminate duplicates Z: 13 11.684 1.511 0.456 0.894 0.917 0.667 CB 1.200 13 residues pruned to eliminate duplicates Z: 15 33.050 2.050 0.930 0.914 0.929 0.857 CB 1.700 15 residues pruned to eliminate duplicates Z: 34 48.896 2.343 0.657 0.705 0.970 0.758 CB 1.876 34 residues pruned to eliminate duplicates Z: 19 36.690 2.193 0.570 0.898 1.000 0.833 CA 1.796 19 residues pruned to eliminate duplicates Z: 16 14.318 1.947 0.516 0.545 1.000 0.600 CB 1.199 16 residues pruned to eliminate duplicates Z: 25 37.420 2.359 0.292 0.866 0.958 0.792 CA 1.915 25 residues pruned to eliminate duplicates Z: 32 31.283 2.311 0.526 0.665 0.871 0.710 CB 1.570 32 residues pruned to eliminate duplicates Z: 25 29.021 2.016 0.973 0.667 0.917 0.625 CB 1.393 25 residues pruned to eliminate duplicates Z: 55 48.044 2.254 0.651 0.591 0.926 0.667 CB 1.739 55 residues pruned to eliminate duplicates Z: 18 30.187 2.060 0.609 0.889 1.000 0.882 CB 1.590 18 residues pruned to eliminate duplicates Z: 21 15.206 2.010 0.225 0.460 0.900 0.550 C 1.598 21 residues pruned to eliminate duplicates Z: 53 59.011 2.242 0.658 0.753 0.962 0.808 CB 1.827 53 residues pruned to eliminate duplicates Z: 76 83.437 2.312 0.886 0.770 0.973 0.787 CB 1.788 76 residues pruned to eliminate duplicates Z: 33 44.869 2.321 0.754 0.677 0.906 0.750 CB 1.826 33 residues pruned to eliminate duplicates Z: 7 3.815 1.155 0.499 0.484 1.000 0.500 O 0.914 Z: 36 48.839 2.166 0.911 0.760 0.971 0.771 CB 1.629 36 residues pruned to eliminate duplicates Z: 9 11.422 2.319 0.229 0.451 0.875 0.750 CA 1.703 9 residues pruned to eliminate duplicates Z: 28 42.337 2.290 0.647 0.717 0.926 0.741 CA 1.917 28 residues pruned to eliminate duplicates Z: 12 13.427 1.675 0.405 0.915 1.000 0.727 CB 1.216 12 residues pruned to eliminate duplicates Z: 21 18.029 2.039 0.348 0.538 0.850 0.600 CA 1.663 21 residues pruned to eliminate duplicates Z: 20 39.373 2.327 0.811 0.900 0.947 0.895 CB 1.616 20 residues pruned to eliminate duplicates Z: 17 16.843 1.919 0.433 0.555 0.938 0.750 CB 1.548 17 residues pruned to eliminate duplicates Z: 54 42.992 2.258 0.549 0.573 0.906 0.604 CB 1.738 54 residues pruned to eliminate duplicates Z: 7 8.176 1.882 -0.141 0.835 1.000 0.500 CB 1.547 7 residues pruned to eliminate duplicates Z: 9 9.639 1.758 0.619 0.569 0.875 0.500 CB 1.280 9 residues pruned to eliminate duplicates Z: 29 35.113 2.211 0.474 0.750 0.929 0.750 CB 1.754 29 residues pruned to eliminate duplicates Z: 22 54.550 2.360 1.059 0.949 1.000 0.905 CB 1.690 22 residues pruned to eliminate duplicates Z: 14 19.842 1.819 0.456 0.943 1.000 1.000 CB 1.440 14 residues pruned to eliminate duplicates Z: 12 16.732 1.979 0.278 0.857 0.909 0.545 C 1.618 12 residues pruned to eliminate duplicates Z: 9 7.868 2.071 0.404 0.420 0.875 0.625 CB 1.188 9 residues pruned to eliminate duplicates Z: 6 9.275 2.107 0.586 0.444 0.800 0.600 CA 1.645 6 residues pruned to eliminate duplicates Z: 14 34.062 2.059 0.980 0.889 1.000 0.769 C 1.669 14 residues pruned to eliminate duplicates Z: 39 70.358 2.334 0.830 0.895 1.000 0.711 CB 1.916 39 residues pruned to eliminate duplicates Z: 10 10.923 1.650 0.800 0.545 0.889 0.778 CB 1.319 10 residues pruned to eliminate duplicates Z: 6 3.128 1.250 0.716 0.625 0.800 0.800 O 0.725 Z: 11 13.911 1.776 0.261 0.877 1.000 0.800 CB 1.427 11 residues pruned to eliminate duplicates Z: 8 10.057 1.947 0.537 0.878 0.857 0.714 CB 1.075 7 residues pruned to eliminate duplicates Z: 42 57.161 2.371 0.697 0.699 0.976 0.829 CB 1.898 42 residues pruned to eliminate duplicates Z: 20 38.685 2.309 0.688 0.906 0.947 0.842 CB 1.709 20 residues pruned to eliminate duplicates Z: 9 15.014 1.553 1.321 0.712 1.000 0.875 C 1.215 11 residues pruned to eliminate duplicates Z: 12 11.166 2.007 0.670 0.403 0.818 0.364 CB 1.360 12 residues pruned to eliminate duplicates Z: 34 25.716 2.109 0.682 0.389 0.879 0.697 CB 1.615 34 residues pruned to eliminate duplicates Z: 6 8.770 1.596 0.594 0.676 1.000 0.600 CB 1.310 6 residues pruned to eliminate duplicates Z: 19 57.711 2.338 1.153 0.918 1.000 0.722 C 1.907 20 residues pruned to eliminate duplicates Z: 9 16.223 1.946 0.593 0.869 0.875 0.875 C 1.544 9 residues pruned to eliminate duplicates Z: 10 18.458 1.812 1.331 0.569 1.000 0.778 CB 1.363 10 residues pruned to eliminate duplicates Z: 6 8.266 1.780 0.411 0.766 1.000 0.800 CB 1.163 6 residues pruned to eliminate duplicates Z: 37 36.563 2.143 0.597 0.659 0.917 0.750 CB 1.676 37 residues pruned to eliminate duplicates Z: 8 12.672 2.037 0.512 0.820 0.857 0.714 CB 1.375 8 residues pruned to eliminate duplicates Z: 51 47.394 2.241 0.667 0.599 0.920 0.560 CB 1.774 51 residues pruned to eliminate duplicates Z: 8 13.381 2.067 0.343 0.838 1.000 0.714 CB 1.362 8 residues pruned to eliminate duplicates Z: 6 10.898 1.664 0.705 0.769 1.000 0.800 CB 1.354 6 residues pruned to eliminate duplicates Z: 6 4.695 1.689 0.229 0.314 1.000 0.400 CB 1.242 6 residues pruned to eliminate duplicates Z: 6 9.012 2.231 -0.175 0.808 1.000 0.800 C 1.674 6 residues pruned to eliminate duplicates Z: 19 50.128 2.305 0.899 0.951 1.000 0.833 CA 1.862 19 residues pruned to eliminate duplicates Z: 53 58.509 2.357 0.518 0.765 0.962 0.885 CB 1.865 53 residues pruned to eliminate duplicates Z: 8 4.425 1.615 -0.070 0.372 1.000 0.286 C 1.278 Z: 12 12.561 1.867 0.117 0.876 0.909 0.818 CB 1.451 12 residues pruned to eliminate duplicates Z: 25 47.720 2.377 0.875 0.794 0.958 0.792 CB 1.763 25 residues pruned to eliminate duplicates Z: 39 41.475 2.268 0.514 0.643 0.921 0.658 CB 1.862 39 residues pruned to eliminate duplicates Z: 8 2.573 1.473 0.288 0.458 0.857 0.429 CB 0.624 Z: 9 8.132 1.860 0.532 0.429 0.875 0.750 CB 1.241 8 residues pruned to eliminate duplicates Z: 24 28.299 2.141 0.986 0.448 0.913 0.565 CB 1.604 24 residues pruned to eliminate duplicates Z: 6 5.768 1.553 0.708 0.693 0.800 0.600 N 1.019 6 residues pruned to eliminate duplicates Z: 16 31.165 1.966 1.067 0.863 0.933 0.800 CB 1.556 16 residues pruned to eliminate duplicates Z: 36 40.439 2.045 0.584 0.769 1.000 0.743 CB 1.664 36 residues pruned to eliminate duplicates Z: 11 6.609 1.873 0.351 0.330 0.900 0.600 CB 1.106 11 residues pruned to eliminate duplicates Z: 10 23.779 2.221 0.438 0.832 1.000 0.444 CA 1.863 10 residues pruned to eliminate duplicates Z: 12 16.030 1.698 0.652 0.899 1.000 0.818 CB 1.232 12 residues pruned to eliminate duplicates Z: 23 56.779 2.248 1.146 0.933 1.000 0.909 C 1.752 23 residues pruned to eliminate duplicates Z: 46 44.868 2.238 0.596 0.642 0.933 0.711 CB 1.757 46 residues pruned to eliminate duplicates Z: 54 51.952 2.218 0.783 0.595 0.943 0.642 CB 1.748 54 residues pruned to eliminate duplicates Z: 9 18.427 2.199 0.659 0.886 0.875 0.625 CB 1.473 9 residues pruned to eliminate duplicates Z: 9 14.399 2.204 0.942 0.519 0.750 0.500 CB 1.557 9 residues pruned to eliminate duplicates Z: 6 8.945 2.198 -0.179 0.837 1.000 0.800 C 1.657 6 residues pruned to eliminate duplicates Z: 8 11.381 1.810 0.797 0.805 0.714 0.429 CA 1.418 8 residues pruned to eliminate duplicates Z: 30 26.513 2.072 0.747 0.429 0.897 0.655 CB 1.634 30 residues pruned to eliminate duplicates Z: 33 22.247 2.021 0.478 0.511 0.875 0.656 CB 1.487 41 residues pruned to eliminate duplicates Z: 23 44.418 2.203 0.845 0.941 1.000 0.909 CB 1.616 23 residues pruned to eliminate duplicates Z: 6 13.460 2.289 0.402 0.836 0.800 0.400 C 1.755 6 residues pruned to eliminate duplicates Z: 12 16.566 2.096 0.578 0.802 1.000 0.818 CB 1.160 12 residues pruned to eliminate duplicates Z: 16 28.808 2.297 0.471 0.867 0.867 0.733 CA 1.857 16 residues pruned to eliminate duplicates Z: 16 41.026 2.277 0.675 0.914 1.000 0.867 CA 1.964 16 residues pruned to eliminate duplicates Z: 11 14.658 1.701 0.673 0.649 1.000 0.800 C 1.418 10 residues pruned to eliminate duplicates Z: 13 12.008 1.529 0.499 0.913 0.917 0.833 CB 1.168 13 residues pruned to eliminate duplicates Z: 14 12.573 1.809 0.371 0.586 0.846 0.538 CA 1.531 11 residues pruned to eliminate duplicates Z: 16 17.943 1.992 0.893 0.400 0.933 0.600 CB 1.464 16 residues pruned to eliminate duplicates Z: 15 23.273 1.800 0.787 0.842 0.929 0.786 CB 1.552 15 residues pruned to eliminate duplicates Z: 16 36.631 2.240 0.987 0.788 1.000 0.933 CB 1.650 16 residues pruned to eliminate duplicates Z: 19 52.542 2.277 1.034 0.959 1.000 0.667 CB 1.833 19 residues pruned to eliminate duplicates Z: 6 4.848 1.695 0.044 0.811 1.000 0.600 CB 0.934 6 residues pruned to eliminate duplicates Z: 26 39.527 2.034 0.785 0.883 0.960 0.720 CB 1.639 26 residues pruned to eliminate duplicates Z: 77 65.131 2.351 0.566 0.742 0.934 0.789 CB 1.749 77 residues pruned to eliminate duplicates Z: 95 95.938 2.362 0.946 0.780 0.957 0.809 CB 1.756 95 residues pruned to eliminate duplicates Z: 19 11.134 1.944 0.147 0.444 0.889 0.667 CB 1.402 19 residues pruned to eliminate duplicates Z: 74 76.271 2.250 0.954 0.745 0.959 0.753 CB 1.700 74 residues pruned to eliminate duplicates Z: 14 21.223 1.900 0.620 0.701 1.000 0.385 CB 1.592 14 residues pruned to eliminate duplicates Z: 54 70.203 2.249 0.924 0.765 1.000 0.604 CB 1.762 54 residues pruned to eliminate duplicates Z: 23 41.227 2.302 0.735 0.932 1.000 0.955 CB 1.537 23 residues pruned to eliminate duplicates Z: 10 15.637 1.827 0.635 0.886 0.889 0.778 C 1.417 10 residues pruned to eliminate duplicates Z: 43 40.477 2.066 0.889 0.669 0.905 0.690 CB 1.513 43 residues pruned to eliminate duplicates Z: 11 14.718 2.022 0.278 0.699 0.900 0.800 C 1.668 11 residues pruned to eliminate duplicates Z: 27 40.096 2.216 0.603 0.855 0.962 0.808 CB 1.699 27 residues pruned to eliminate duplicates Z: 11 19.918 2.211 0.561 0.553 1.000 0.800 C 1.733 11 residues pruned to eliminate duplicates Z: 12 21.365 2.037 1.140 0.562 0.909 0.636 CA 1.531 12 residues pruned to eliminate duplicates Z: 28 19.157 1.883 0.751 0.528 0.889 0.630 CB 1.224 28 residues pruned to eliminate duplicates Z: 30 23.266 1.821 0.340 0.748 1.000 0.655 CB 1.419 30 residues pruned to eliminate duplicates Z: 117 86.708 2.282 0.773 0.716 0.931 0.690 CB 1.757 117 residues pruned to eliminate duplicates Z: 23 34.708 2.101 0.439 0.890 1.000 0.727 CA 1.761 23 residues pruned to eliminate duplicates Z: 32 48.947 2.301 0.952 0.619 0.935 0.645 CB 1.870 32 residues pruned to eliminate duplicates Z: 13 18.285 2.137 0.701 0.569 0.917 0.417 CB 1.483 13 residues pruned to eliminate duplicates Z: 6 5.271 1.322 0.480 0.830 1.000 0.800 CA 0.905 Z: 9 4.127 1.953 0.435 0.222 0.625 0.500 CB 1.154 9 residues pruned to eliminate duplicates Z: 17 29.857 2.233 0.428 0.923 0.938 0.938 CB 1.755 17 residues pruned to eliminate duplicates Z: 67 62.500 2.333 0.804 0.704 0.924 0.697 CB 1.643 67 residues pruned to eliminate duplicates Z: 36 46.323 2.350 0.866 0.653 0.914 0.657 CB 1.693 36 residues pruned to eliminate duplicates Z: 42 51.592 2.322 0.746 0.722 0.976 0.854 CB 1.667 42 residues pruned to eliminate duplicates Z: 24 21.424 1.970 1.017 0.440 0.957 0.522 CB 1.251 24 residues pruned to eliminate duplicates Z: 44 61.006 2.220 0.944 0.785 0.953 0.767 CB 1.759 44 residues pruned to eliminate duplicates Z: 59 42.174 2.216 0.558 0.567 0.862 0.534 CB 1.744 59 residues pruned to eliminate duplicates Z: 36 50.531 2.220 0.836 0.676 1.000 0.771 CB 1.782 36 residues pruned to eliminate duplicates Z: 6 7.416 1.678 0.196 0.834 1.000 0.600 CB 1.240 6 residues pruned to eliminate duplicates Z: 7 9.600 2.029 0.219 0.725 0.833 0.667 CA 1.552 7 residues pruned to eliminate duplicates Z: 6 6.327 1.737 0.351 0.738 1.000 0.800 CA 0.974 6 residues pruned to eliminate duplicates Z: 82 64.817 2.262 0.656 0.705 0.938 0.728 CB 1.701 140 residues pruned to eliminate duplicates Z: 17 43.357 2.258 0.959 0.934 1.000 0.688 CA 1.708 17 residues pruned to eliminate duplicates Z: 9 12.753 2.113 0.426 0.570 0.875 0.750 C 1.598 9 residues pruned to eliminate duplicates Z: 86 84.740 2.338 0.884 0.766 0.929 0.729 CB 1.773 86 residues pruned to eliminate duplicates Z: 59 77.318 2.338 0.909 0.818 0.983 0.862 CB 1.755 59 residues pruned to eliminate duplicates Z: 32 49.540 2.315 0.917 0.727 1.000 0.839 CB 1.633 32 residues pruned to eliminate duplicates Z: 22 16.686 2.021 0.562 0.480 0.857 0.524 CB 1.373 22 residues pruned to eliminate duplicates Z: 6 2.255 1.682 0.108 0.100 0.800 0.400 CA 1.127 6 residues pruned to eliminate duplicates Z: 24 36.550 1.961 0.856 0.844 0.957 0.739 C 1.629 24 residues pruned to eliminate duplicates Z: 13 5.555 1.592 0.738 0.251 0.750 0.500 CB 1.029 13 residues pruned to eliminate duplicates Z: 26 25.599 1.947 0.819 0.468 0.920 0.640 CA 1.624 26 residues pruned to eliminate duplicates Z: 17 25.101 2.175 0.789 0.663 0.875 0.750 CB 1.585 17 residues pruned to eliminate duplicates Z: 25 43.905 2.248 0.684 0.873 0.958 0.708 C 1.799 25 residues pruned to eliminate duplicates Z: 14 25.685 2.118 0.621 0.680 1.000 0.538 CA 1.759 14 residues pruned to eliminate duplicates Z: 61 45.001 2.174 0.738 0.514 0.967 0.633 CB 1.570 61 residues pruned to eliminate duplicates Z: 20 28.531 2.318 0.909 0.449 0.947 0.632 CB 1.645 20 residues pruned to eliminate duplicates Z: 35 49.619 2.370 0.948 0.554 0.941 0.559 CB 1.857 35 residues pruned to eliminate duplicates Z: 71 73.761 2.306 0.729 0.741 0.986 0.743 CB 1.807 71 residues pruned to eliminate duplicates Z: 24 31.822 2.057 0.809 0.752 0.913 0.826 CB 1.560 24 residues pruned to eliminate duplicates Z: 61 64.468 2.293 0.814 0.714 0.950 0.717 CB 1.735 61 residues pruned to eliminate duplicates Z: 37 58.997 2.303 0.731 0.903 0.972 0.750 CB 1.809 37 residues pruned to eliminate duplicates Z: 16 32.565 2.280 0.620 0.882 0.933 0.867 CB 1.766 16 residues pruned to eliminate duplicates Z: 40 19.519 2.006 0.505 0.325 0.846 0.462 CB 1.482 40 residues pruned to eliminate duplicates 6 1.300 1.117 0.393 0.297 0.600 0.400 CB 0.782 ? Z: 16 42.822 2.254 1.078 0.935 1.000 0.600 CB 1.645 16 residues pruned to eliminate duplicates Z: 17 35.743 2.308 0.749 0.733 1.000 0.688 CA 1.796 17 residues pruned to eliminate duplicates Z: 17 22.788 2.058 0.874 0.718 0.875 0.812 CB 1.386 17 residues pruned to eliminate duplicates Z: 13 22.206 2.103 0.786 0.819 0.750 0.667 CB 1.726 13 residues pruned to eliminate duplicates Z: 21 24.735 2.302 0.216 0.631 0.950 0.700 CB 1.838 Z: 15 19.447 2.032 0.656 0.675 0.929 0.643 CB 1.416 15 residues pruned to eliminate duplicates Z: 10 15.042 1.932 0.919 0.590 1.000 0.667 CB 1.242 10 residues pruned to eliminate duplicates Z: 70 80.791 2.276 0.871 0.798 0.971 0.812 CB 1.812 70 residues pruned to eliminate duplicates Z: 15 42.265 2.040 1.352 0.882 1.000 0.929 CA 1.703 15 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 6 3.997 1.546 0.752 0.337 1.000 0.600 N 0.789 6 residues pruned to eliminate duplicates Z: 20 37.463 2.359 0.750 0.688 0.895 0.789 C 1.958 20 residues pruned to eliminate duplicates Z: 27 44.244 2.415 0.596 0.725 0.923 0.808 C 1.991 27 residues pruned to eliminate duplicates Z: 44 53.180 2.296 0.720 0.667 0.930 0.767 CB 1.892 44 residues pruned to eliminate duplicates Z: 30 42.996 2.334 0.662 0.659 0.931 0.690 CB 1.908 30 residues pruned to eliminate duplicates Z: 32 43.406 2.311 0.625 0.666 0.968 0.774 CB 1.840 32 residues pruned to eliminate duplicates Z: 33 39.081 2.283 0.581 0.647 0.938 0.750 CB 1.780 33 residues pruned to eliminate duplicates Z: 43 51.785 2.338 0.643 0.639 0.952 0.714 CB 1.917 43 residues pruned to eliminate duplicates Z: 29 43.112 2.337 0.698 0.693 0.929 0.750 C 1.853 29 residues pruned to eliminate duplicates Z: 42 57.299 2.375 0.722 0.692 0.951 0.732 CB 1.930 42 residues pruned to eliminate duplicates Z: 32 48.897 2.334 0.803 0.659 0.968 0.645 C 1.861 32 residues pruned to eliminate duplicates Z: 65 55.462 2.158 0.718 0.627 0.984 0.734 CB 1.686 86 residues pruned to eliminate duplicates Z: 20 37.933 2.341 0.530 0.865 1.000 0.737 CB 1.780 20 residues pruned to eliminate duplicates Z: 43 51.725 2.314 0.660 0.677 0.952 0.762 CB 1.854 43 residues pruned to eliminate duplicates Z: 44 51.879 2.280 0.733 0.658 0.930 0.744 C 1.859 44 residues pruned to eliminate duplicates Z: 31 47.366 2.403 0.673 0.661 0.967 0.833 CB 1.917 31 residues pruned to eliminate duplicates Z: 38 38.817 2.211 0.616 0.595 0.892 0.703 CB 1.828 38 residues pruned to eliminate duplicates Z: 43 58.856 2.318 0.868 0.686 0.929 0.690 CB 1.904 43 residues pruned to eliminate duplicates Z: 33 45.340 2.263 0.774 0.652 0.969 0.719 CB 1.790 33 residues pruned to eliminate duplicates Z: 46 46.053 2.134 0.699 0.630 0.933 0.667 CB 1.794 46 residues pruned to eliminate duplicates Z: 43 48.041 2.296 0.605 0.646 0.952 0.714 CB 1.843 43 residues pruned to eliminate duplicates Z: 33 41.400 2.303 0.657 0.608 0.969 0.656 CB 1.786 33 residues pruned to eliminate duplicates Z: 41 57.240 2.401 0.696 0.688 0.975 0.775 CB 1.920 41 residues pruned to eliminate duplicates Z: 42 57.526 2.373 0.697 0.682 0.976 0.707 CB 1.933 42 residues pruned to eliminate duplicates Z: 36 50.647 2.318 0.776 0.677 0.943 0.771 CB 1.873 36 residues pruned to eliminate duplicates Z: 43 53.763 2.291 0.735 0.674 0.952 0.690 CB 1.865 43 residues pruned to eliminate duplicates Z: 19 29.212 2.104 0.914 0.598 0.944 0.667 CB 1.648 19 residues pruned to eliminate duplicates Z: 44 50.009 2.294 0.668 0.659 0.907 0.698 CB 1.896 44 residues pruned to eliminate duplicates Z: 15 29.441 2.145 0.800 0.657 1.000 0.571 CA 1.762 15 residues pruned to eliminate duplicates Z: 44 50.229 2.255 0.729 0.679 0.907 0.744 CB 1.838 44 residues pruned to eliminate duplicates Z: 44 53.344 2.273 0.805 0.669 0.930 0.767 CB 1.824 44 residues pruned to eliminate duplicates Z: 15 32.536 2.145 0.997 0.686 1.000 0.643 C 1.711 15 residues pruned to eliminate duplicates Z: 43 61.164 2.306 0.861 0.697 0.976 0.762 CB 1.882 43 residues pruned to eliminate duplicates Z: 44 46.875 2.285 0.616 0.641 0.953 0.791 CB 1.780 44 residues pruned to eliminate duplicates Z: 16 22.635 2.054 0.717 0.587 0.933 0.800 C 1.634 16 residues pruned to eliminate duplicates Z: 15 21.738 2.147 0.526 0.708 0.857 0.857 CA 1.711 15 residues pruned to eliminate duplicates Z: 43 54.464 2.370 0.686 0.666 0.929 0.786 CB 1.944 43 residues pruned to eliminate duplicates Z: 25 32.700 2.091 0.876 0.634 1.000 0.625 CB 1.500 25 residues pruned to eliminate duplicates Z: 26 33.223 2.016 0.928 0.651 1.000 0.800 CB 1.485 26 residues pruned to eliminate duplicates Z: 25 31.739 2.086 0.847 0.623 1.000 0.583 CB 1.498 25 residues pruned to eliminate duplicates Z: 24 31.731 2.114 0.918 0.619 0.957 0.696 CB 1.525 24 residues pruned to eliminate duplicates Z: 25 26.035 1.991 0.748 0.596 0.958 0.667 CB 1.453 25 residues pruned to eliminate duplicates Z: 26 31.527 2.032 0.937 0.657 0.960 0.720 CB 1.443 26 residues pruned to eliminate duplicates Z: 25 34.099 2.075 0.980 0.652 1.000 0.542 CB 1.471 25 residues pruned to eliminate duplicates Z: 26 33.387 2.025 0.965 0.639 1.000 0.640 CB 1.473 26 residues pruned to eliminate duplicates Z: 25 29.629 2.074 0.810 0.626 1.000 0.667 CB 1.430 25 residues pruned to eliminate duplicates Z: 24 30.610 2.138 0.739 0.629 1.000 0.696 CB 1.520 24 residues pruned to eliminate duplicates Z: 26 32.565 2.072 0.944 0.626 0.960 0.680 CB 1.496 26 residues pruned to eliminate duplicates Z: 27 30.023 1.991 0.803 0.625 1.000 0.654 CB 1.459 27 residues pruned to eliminate duplicates Z: 25 31.868 2.077 0.910 0.616 1.000 0.625 CB 1.469 25 residues pruned to eliminate duplicates Z: 26 26.056 2.071 0.755 0.591 0.920 0.600 CB 1.428 26 residues pruned to eliminate duplicates Z: 24 27.449 2.001 0.945 0.605 0.957 0.739 CB 1.391 24 residues pruned to eliminate duplicates Z: 14 29.045 1.886 0.918 0.907 1.000 0.923 CB 1.583 14 residues pruned to eliminate duplicates Z: 26 30.698 2.022 0.941 0.650 0.960 0.680 CB 1.417 26 residues pruned to eliminate duplicates Z: 25 31.411 2.075 0.945 0.647 0.917 0.792 CB 1.510 25 residues pruned to eliminate duplicates Z: 25 32.140 2.073 0.945 0.640 0.958 0.750 CB 1.489 25 residues pruned to eliminate duplicates Z: 23 37.847 2.136 1.043 0.675 1.000 0.773 CB 1.573 23 residues pruned to eliminate duplicates Z: 25 28.424 2.021 0.917 0.608 0.917 0.542 CB 1.474 25 residues pruned to eliminate duplicates Z: 42 32.975 1.951 0.798 0.583 0.976 0.756 CB 1.390 68 residues pruned to eliminate duplicates Z: 27 45.351 2.191 0.790 0.755 1.000 0.692 CB 1.807 27 residues pruned to eliminate duplicates Z: 6 6.248 1.650 0.413 0.601 1.000 0.600 CA 1.089 5 residues pruned to eliminate duplicates Z: 6 6.661 1.913 0.322 0.411 1.000 0.600 CA 1.293 6 residues pruned to eliminate duplicates Z: 37 48.427 2.138 0.671 0.805 1.000 0.667 CB 1.731 38 residues pruned to eliminate duplicates Z: 32 43.560 2.150 0.595 0.850 0.968 0.710 CB 1.746 32 residues pruned to eliminate duplicates Z: 75 70.555 2.199 0.849 0.754 0.959 0.676 CB 1.678 75 residues pruned to eliminate duplicates Z: 39 45.669 2.049 0.727 0.763 0.974 0.632 CB 1.702 39 residues pruned to eliminate duplicates Z: 37 48.935 2.139 0.740 0.802 0.972 0.667 CB 1.730 37 residues pruned to eliminate duplicates Z: 38 49.437 2.102 0.799 0.783 0.973 0.676 CB 1.721 37 residues pruned to eliminate duplicates Z: 9 21.094 2.079 1.005 0.820 0.875 0.750 CB 1.549 9 residues pruned to eliminate duplicates Z: 37 48.809 2.131 0.716 0.790 1.000 0.611 CB 1.725 37 residues pruned to eliminate duplicates Z: 39 46.367 2.054 0.746 0.769 1.000 0.579 CB 1.653 39 residues pruned to eliminate duplicates Z: 38 48.089 2.104 0.735 0.774 1.000 0.622 CB 1.700 37 residues pruned to eliminate duplicates Z: 20 39.912 2.192 0.926 0.867 0.947 0.737 CB 1.675 20 residues pruned to eliminate duplicates Z: 37 49.000 2.133 0.715 0.796 1.000 0.694 CB 1.723 38 residues pruned to eliminate duplicates Z: 32 42.196 2.074 0.782 0.880 0.935 0.710 CB 1.588 32 residues pruned to eliminate duplicates Z: 26 45.157 2.140 0.893 0.749 1.000 0.600 CB 1.785 26 residues pruned to eliminate duplicates Z: 37 49.833 2.137 0.733 0.799 1.000 0.639 CB 1.726 37 residues pruned to eliminate duplicates Z: 31 43.957 2.127 0.716 0.884 0.933 0.733 CB 1.703 31 residues pruned to eliminate duplicates Z: 39 43.890 2.049 0.749 0.751 0.947 0.605 CB 1.676 39 residues pruned to eliminate duplicates Z: 37 50.800 2.141 0.800 0.788 1.000 0.667 CB 1.705 37 residues pruned to eliminate duplicates Z: 40 44.830 2.008 0.727 0.753 1.000 0.538 CB 1.652 40 residues pruned to eliminate duplicates Z: 39 43.864 2.060 0.676 0.753 1.000 0.658 CB 1.645 39 residues pruned to eliminate duplicates Z: 53 38.696 2.007 0.592 0.677 0.923 0.577 CB 1.546 53 residues pruned to eliminate duplicates Z: 37 45.011 2.123 0.686 0.784 0.972 0.750 CB 1.680 37 residues pruned to eliminate duplicates Z: 34 47.632 2.140 0.727 0.804 1.000 0.697 CB 1.720 34 residues pruned to eliminate duplicates Z: 40 41.074 2.030 0.594 0.740 1.000 0.692 CB 1.639 38 residues pruned to eliminate duplicates Z: 14 15.684 1.827 0.291 0.901 0.923 0.846 CB 1.426 14 residues pruned to eliminate duplicates Z: 38 46.330 2.090 0.763 0.759 0.973 0.703 CB 1.687 38 residues pruned to eliminate duplicates Z: 38 45.254 2.094 0.680 0.772 1.000 0.730 CB 1.663 38 residues pruned to eliminate duplicates Z: 38 47.795 2.097 0.764 0.773 1.000 0.730 CB 1.668 38 residues pruned to eliminate duplicates Z: 39 44.301 2.062 0.795 0.719 0.974 0.605 CB 1.636 39 residues pruned to eliminate duplicates Z: 37 47.207 2.134 0.766 0.773 0.972 0.639 CB 1.687 37 residues pruned to eliminate duplicates Z: 37 49.892 2.130 0.764 0.791 1.000 0.667 CB 1.714 37 residues pruned to eliminate duplicates Z: 38 43.598 2.084 0.660 0.774 0.973 0.622 CB 1.671 38 residues pruned to eliminate duplicates Z: 34 52.512 2.076 0.958 0.837 1.000 0.576 CB 1.682 33 residues pruned to eliminate duplicates Z: 26 40.151 2.137 0.950 0.750 0.920 0.560 CA 1.676 26 residues pruned to eliminate duplicates Z: 23 48.389 2.232 1.022 0.759 1.000 0.727 CA 1.815 23 residues pruned to eliminate duplicates Z: 34 50.597 2.070 0.921 0.810 1.000 0.697 CB 1.690 35 residues pruned to eliminate duplicates Z: 21 40.485 2.197 0.753 0.904 0.950 0.800 CB 1.763 21 residues pruned to eliminate duplicates Z: 34 48.757 2.074 0.916 0.802 0.970 0.758 CB 1.692 34 residues pruned to eliminate duplicates Z: 35 45.879 2.036 0.878 0.797 0.971 0.676 CB 1.634 35 residues pruned to eliminate duplicates Z: 33 51.118 2.117 0.906 0.842 0.969 0.594 CB 1.722 33 residues pruned to eliminate duplicates Z: 21 51.490 2.246 1.132 0.860 0.950 0.650 CB 1.861 21 residues pruned to eliminate duplicates Z: 33 52.985 2.129 0.915 0.848 0.969 0.719 CB 1.759 33 residues pruned to eliminate duplicates Z: 32 50.250 2.133 0.868 0.833 0.968 0.645 CB 1.756 32 residues pruned to eliminate duplicates Z: 34 46.251 2.066 0.830 0.803 0.970 0.576 CB 1.685 34 residues pruned to eliminate duplicates Z: 24 47.418 2.232 0.935 0.779 0.957 0.826 CA 1.872 24 residues pruned to eliminate duplicates Z: 35 48.315 2.029 0.941 0.798 0.971 0.618 CB 1.670 35 residues pruned to eliminate duplicates Z: 23 44.936 2.233 0.906 0.810 0.955 0.773 CA 1.800 23 residues pruned to eliminate duplicates Z: 33 51.311 2.101 0.898 0.854 0.969 0.531 CB 1.734 33 residues pruned to eliminate duplicates Z: 33 52.102 2.110 0.880 0.851 1.000 0.625 CB 1.719 33 residues pruned to eliminate duplicates Z: 19 54.286 2.368 0.979 0.906 1.000 1.000 CB 1.943 19 residues pruned to eliminate duplicates Z: 23 46.822 2.260 0.938 0.760 1.000 0.773 C 1.808 23 residues pruned to eliminate duplicates Z: 34 49.365 2.063 0.920 0.816 0.970 0.667 CB 1.699 34 residues pruned to eliminate duplicates Z: 33 42.173 2.075 0.748 0.759 0.969 0.688 CB 1.685 33 residues pruned to eliminate duplicates Z: 33 50.469 2.114 0.793 0.839 1.000 0.625 CB 1.757 33 residues pruned to eliminate duplicates Z: 33 50.437 2.116 0.849 0.849 0.969 0.500 CB 1.743 33 residues pruned to eliminate duplicates Z: 35 42.195 2.016 0.836 0.787 0.941 0.588 CB 1.613 35 residues pruned to eliminate duplicates Z: 33 55.567 2.114 0.993 0.846 1.000 0.594 CB 1.732 33 residues pruned to eliminate duplicates Z: 11 15.137 1.663 0.741 0.903 1.000 0.600 CB 1.178 11 residues pruned to eliminate duplicates Z: 34 48.839 2.067 0.863 0.811 1.000 0.727 CB 1.684 34 residues pruned to eliminate duplicates Z: 33 51.317 2.113 0.969 0.822 0.969 0.594 CB 1.703 33 residues pruned to eliminate duplicates Z: 33 54.694 2.122 0.975 0.840 1.000 0.625 CB 1.722 33 residues pruned to eliminate duplicates Z: 33 50.270 2.118 0.902 0.839 0.969 0.656 CB 1.701 33 residues pruned to eliminate duplicates Z: 35 44.964 2.030 0.776 0.799 1.000 0.676 CB 1.647 35 residues pruned to eliminate duplicates Z: 25 15.615 1.879 0.589 0.435 0.875 0.750 CB 1.305 25 residues pruned to eliminate duplicates Z: 24 16.523 1.927 0.629 0.460 0.870 0.696 CB 1.314 24 residues pruned to eliminate duplicates Z: 12 15.007 1.829 1.079 0.572 0.909 0.727 CB 1.221 12 residues pruned to eliminate duplicates Z: 16 16.663 1.920 0.711 0.527 0.933 0.600 CB 1.367 16 residues pruned to eliminate duplicates Z: 46 26.836 1.839 0.650 0.572 0.911 0.600 CB 1.350 46 residues pruned to eliminate duplicates Z: 25 16.396 1.885 0.496 0.474 0.917 0.708 CB 1.330 25 residues pruned to eliminate duplicates Z: 25 16.825 1.906 0.546 0.431 0.917 0.667 CB 1.366 25 residues pruned to eliminate duplicates Z: 24 18.833 1.951 0.645 0.466 0.957 0.739 CB 1.324 24 residues pruned to eliminate duplicates Z: 24 17.989 1.930 0.542 0.477 0.957 0.696 CB 1.349 24 residues pruned to eliminate duplicates Z: 24 18.617 1.946 0.539 0.486 1.000 0.609 CB 1.315 24 residues pruned to eliminate duplicates Z: 26 15.379 1.871 0.572 0.432 0.920 0.760 CB 1.220 26 residues pruned to eliminate duplicates Z: 25 16.847 1.891 0.500 0.473 0.958 0.667 CB 1.300 24 residues pruned to eliminate duplicates Z: 6 4.949 1.636 0.619 0.440 1.000 0.600 CA 0.890 6 residues pruned to eliminate duplicates Z: 19 33.396 2.261 0.701 0.860 1.000 0.722 CB 1.505 19 residues pruned to eliminate duplicates Z: 71 78.261 2.335 0.761 0.770 0.986 0.700 CB 1.817 71 residues pruned to eliminate duplicates Z: 85 78.751 2.304 0.764 0.735 0.964 0.667 CB 1.776 85 residues pruned to eliminate duplicates Z: 109 95.270 2.342 0.915 0.751 0.944 0.741 CB 1.729 109 residues pruned to eliminate duplicates Z: 90 100.586 2.353 0.979 0.793 0.978 0.708 CB 1.812 90 residues pruned to eliminate duplicates Z: 122 91.663 2.285 0.796 0.720 0.959 0.711 CB 1.736 122 residues pruned to eliminate duplicates Z: 72 69.316 2.296 0.706 0.738 0.944 0.732 CB 1.797 72 residues pruned to eliminate duplicates Z: 70 77.228 2.353 0.844 0.752 0.957 0.754 CB 1.790 70 residues pruned to eliminate duplicates Z: 98 96.334 2.336 0.954 0.750 0.959 0.763 CB 1.788 98 residues pruned to eliminate duplicates Z: 94 94.741 2.342 0.946 0.770 0.957 0.763 CB 1.773 94 residues pruned to eliminate duplicates Z: 94 94.267 2.331 0.969 0.775 0.957 0.763 CB 1.745 94 residues pruned to eliminate duplicates Z: 102 90.519 2.336 0.893 0.732 0.941 0.663 CB 1.758 102 residues pruned to eliminate duplicates Z: 107 94.196 2.351 0.866 0.747 0.943 0.623 CB 1.774 107 residues pruned to eliminate duplicates Z: 99 92.268 2.363 0.921 0.737 0.929 0.704 CB 1.788 99 residues pruned to eliminate duplicates Z: 109 92.396 2.345 0.865 0.735 0.926 0.694 CB 1.778 109 residues pruned to eliminate duplicates Z: 9 7.567 2.156 0.502 0.315 0.625 0.250 CB 1.621 9 residues pruned to eliminate duplicates Z: 85 74.864 2.349 0.761 0.709 0.929 0.643 CB 1.760 85 residues pruned to eliminate duplicates Z: 102 84.060 2.322 0.838 0.739 0.901 0.693 CB 1.755 102 residues pruned to eliminate duplicates Z: 9 5.391 2.214 0.529 0.270 0.500 0.500 CB 1.463 9 residues pruned to eliminate duplicates Z: 9 5.979 1.983 0.357 0.349 0.625 0.375 CB 1.481 9 residues pruned to eliminate duplicates Z: 8 9.528 2.032 0.481 0.514 0.857 0.571 CB 1.377 8 residues pruned to eliminate duplicates Z: 9 10.614 2.008 0.572 0.430 0.875 0.500 CB 1.460 9 residues pruned to eliminate duplicates Z: 27 39.485 2.340 0.792 0.728 0.885 0.769 CB 1.700 27 residues pruned to eliminate duplicates Z: 108 91.955 2.309 0.882 0.730 0.953 0.710 CB 1.745 108 residues pruned to eliminate duplicates Z: 17 13.154 1.933 0.554 0.435 0.875 0.250 CB 1.338 17 residues pruned to eliminate duplicates Z: 28 18.971 2.156 0.562 0.451 0.741 0.370 CB 1.540 28 residues pruned to eliminate duplicates Z: 24 23.576 2.288 0.599 0.463 0.826 0.391 CB 1.689 24 residues pruned to eliminate duplicates Z: 11 12.766 2.133 0.533 0.456 0.800 0.500 C 1.614 11 residues pruned to eliminate duplicates Z: 56 58.849 2.382 0.760 0.592 0.927 0.600 CB 1.869 56 residues pruned to eliminate duplicates Z: 23 22.852 2.297 0.530 0.431 0.864 0.500 CB 1.726 23 residues pruned to eliminate duplicates Z: 14 10.350 2.203 0.272 0.353 0.692 0.462 CB 1.734 14 residues pruned to eliminate duplicates Z: 24 17.779 2.139 0.367 0.493 0.826 0.522 CB 1.545 24 residues pruned to eliminate duplicates Z: 27 20.817 2.210 0.522 0.427 0.808 0.462 CB 1.621 27 residues pruned to eliminate duplicates Z: 21 20.163 2.252 0.608 0.470 0.750 0.500 CA 1.711 21 residues pruned to eliminate duplicates Z: 27 13.262 2.031 0.183 0.381 0.846 0.577 CB 1.451 27 residues pruned to eliminate duplicates Z: 14 13.333 2.273 0.348 0.484 0.769 0.538 C 1.594 14 residues pruned to eliminate duplicates Z: 22 20.366 2.134 0.526 0.475 0.857 0.619 CB 1.633 22 residues pruned to eliminate duplicates Z: 22 21.998 2.225 0.492 0.550 0.857 0.619 CB 1.607 22 residues pruned to eliminate duplicates Z: 19 20.493 2.118 0.752 0.494 0.889 0.556 CB 1.474 19 residues pruned to eliminate duplicates Z: 37 55.393 2.340 1.138 0.641 0.889 0.694 CB 1.819 37 residues pruned to eliminate duplicates Z: 36 68.974 2.422 1.219 0.667 0.971 0.714 CB 1.914 36 residues pruned to eliminate duplicates Z: 129 95.981 2.337 0.817 0.682 0.945 0.664 CB 1.788 129 residues pruned to eliminate duplicates Z: 35 63.740 2.438 1.044 0.665 0.971 0.706 CB 1.941 35 residues pruned to eliminate duplicates Z: 54 58.660 2.370 0.817 0.598 0.906 0.642 CB 1.882 54 residues pruned to eliminate duplicates Z: 45 63.081 2.420 0.907 0.615 0.955 0.659 CB 1.937 45 residues pruned to eliminate duplicates Z: 34 61.326 2.361 1.193 0.658 0.970 0.636 CB 1.836 34 residues pruned to eliminate duplicates Z: 45 58.753 2.333 1.028 0.616 0.955 0.636 CB 1.758 45 residues pruned to eliminate duplicates Z: 36 69.314 2.389 1.214 0.675 1.000 0.714 CB 1.885 36 residues pruned to eliminate duplicates Z: 38 65.094 2.391 1.192 0.656 0.946 0.703 CB 1.867 38 residues pruned to eliminate duplicates Z: 37 59.735 2.342 1.075 0.633 0.972 0.639 CB 1.860 37 residues pruned to eliminate duplicates Z: 58 51.206 2.288 0.717 0.577 0.930 0.614 CB 1.724 58 residues pruned to eliminate duplicates Z: 46 55.822 2.347 0.781 0.604 0.978 0.689 CB 1.845 46 residues pruned to eliminate duplicates Z: 44 74.540 2.462 1.100 0.656 0.977 0.767 CB 1.948 44 residues pruned to eliminate duplicates Z: 36 70.238 2.394 1.190 0.661 1.000 0.743 CB 1.951 36 residues pruned to eliminate duplicates Z: 45 60.213 2.402 0.955 0.592 0.955 0.614 CB 1.854 45 residues pruned to eliminate duplicates Z: 36 67.602 2.409 1.214 0.655 0.971 0.657 CB 1.909 36 residues pruned to eliminate duplicates Z: 55 61.995 2.355 0.927 0.611 0.926 0.685 CB 1.807 55 residues pruned to eliminate duplicates Z: 59 65.494 2.366 0.924 0.616 0.966 0.690 CB 1.753 59 residues pruned to eliminate duplicates Z: 55 55.185 2.321 0.720 0.570 0.944 0.611 CB 1.862 55 residues pruned to eliminate duplicates Z: 46 70.850 2.391 1.075 0.647 0.978 0.667 CB 1.898 46 residues pruned to eliminate duplicates Z: 45 67.571 2.430 1.008 0.640 0.955 0.636 CB 1.919 45 residues pruned to eliminate duplicates Z: 37 57.743 2.302 1.068 0.612 0.972 0.556 CB 1.871 37 residues pruned to eliminate duplicates Z: 36 70.401 2.426 1.190 0.678 1.000 0.714 CB 1.902 36 residues pruned to eliminate duplicates Z: 56 60.598 2.392 0.776 0.579 0.964 0.618 CB 1.850 56 residues pruned to eliminate duplicates Z: 34 72.149 2.474 1.178 0.670 1.000 0.636 CB 1.992 34 residues pruned to eliminate duplicates Z: 54 64.815 2.369 0.903 0.614 0.943 0.642 CB 1.879 54 residues pruned to eliminate duplicates Z: 49 50.418 2.225 0.852 0.583 0.958 0.562 CB 1.702 49 residues pruned to eliminate duplicates Z: 38 65.703 2.369 1.166 0.642 0.973 0.676 CB 1.894 38 residues pruned to eliminate duplicates Z: 46 57.230 2.320 0.990 0.606 0.933 0.600 CB 1.789 46 residues pruned to eliminate duplicates Z: 35 61.280 2.406 1.118 0.659 0.941 0.735 CA 1.890 35 residues pruned to eliminate duplicates Z: 64 58.554 2.314 0.741 0.562 0.921 0.603 CB 1.873 64 residues pruned to eliminate duplicates Z: 84 72.175 2.276 0.847 0.614 0.928 0.602 CB 1.824 50 residues pruned to eliminate duplicates Z: 27 39.265 2.219 0.639 0.790 0.923 0.577 CA 1.777 27 residues pruned to eliminate duplicates Z: 15 18.946 2.195 0.562 0.516 0.857 0.571 CA 1.696 15 residues pruned to eliminate duplicates Z: 12 13.099 2.175 0.415 0.408 0.818 0.364 CB 1.727 12 residues pruned to eliminate duplicates Z: 41 34.842 2.120 0.577 0.619 0.925 0.650 CB 1.591 41 residues pruned to eliminate duplicates Z: 32 42.803 2.215 0.648 0.746 0.968 0.677 C 1.747 32 residues pruned to eliminate duplicates Z: 42 30.874 2.068 0.520 0.604 0.854 0.634 CB 1.628 42 residues pruned to eliminate duplicates Z: 42 31.321 2.049 0.577 0.586 0.878 0.659 CB 1.587 42 residues pruned to eliminate duplicates Z: 34 30.641 2.082 0.575 0.661 0.848 0.636 CB 1.651 34 residues pruned to eliminate duplicates Z: 30 41.254 2.246 0.675 0.734 0.931 0.793 CB 1.773 30 residues pruned to eliminate duplicates Z: 32 32.802 2.170 0.533 0.682 0.871 0.613 CB 1.720 32 residues pruned to eliminate duplicates Z: 35 38.424 2.196 0.670 0.704 0.882 0.647 CB 1.691 35 residues pruned to eliminate duplicates Z: 31 39.272 2.182 0.617 0.708 0.967 0.700 CA 1.739 31 residues pruned to eliminate duplicates Z: 34 37.668 2.188 0.538 0.737 0.909 0.636 CB 1.732 34 residues pruned to eliminate duplicates Z: 19 33.264 2.118 0.943 0.811 0.833 0.833 C 1.743 19 residues pruned to eliminate duplicates Z: 19 43.655 2.291 0.859 0.873 0.944 0.722 C 1.862 19 residues pruned to eliminate duplicates Z: 46 31.905 2.108 0.497 0.608 0.844 0.622 CB 1.610 46 residues pruned to eliminate duplicates Z: 25 27.457 2.190 0.544 0.618 0.875 0.542 CA 1.693 25 residues pruned to eliminate duplicates Z: 26 25.035 2.104 0.491 0.569 0.920 0.520 CB 1.624 26 residues pruned to eliminate duplicates Z: 79 70.768 2.322 0.602 0.747 0.974 0.821 CB 1.772 79 residues pruned to eliminate duplicates Z: 94 75.431 2.335 0.536 0.764 0.957 0.796 CB 1.802 94 residues pruned to eliminate duplicates Z: 96 75.553 2.312 0.575 0.752 0.958 0.821 CB 1.776 96 residues pruned to eliminate duplicates Z: 109 77.770 2.339 0.621 0.728 0.907 0.778 CB 1.771 109 residues pruned to eliminate duplicates Z: 93 82.150 2.353 0.675 0.777 0.957 0.793 CB 1.778 93 residues pruned to eliminate duplicates Z: 98 74.678 2.313 0.600 0.736 0.948 0.763 CB 1.748 98 residues pruned to eliminate duplicates Z: 110 77.192 2.281 0.614 0.726 0.954 0.752 CB 1.717 110 residues pruned to eliminate duplicates Z: 78 73.327 2.316 0.678 0.771 0.961 0.779 CB 1.759 78 residues pruned to eliminate duplicates Z: 95 75.703 2.310 0.618 0.755 0.957 0.809 CB 1.739 95 residues pruned to eliminate duplicates Z: 91 80.961 2.354 0.639 0.783 0.956 0.811 CB 1.805 91 residues pruned to eliminate duplicates Z: 25 49.784 2.273 1.033 0.818 0.958 0.792 CB 1.742 25 residues pruned to eliminate duplicates Z: 101 84.530 2.336 0.746 0.735 0.960 0.780 CB 1.749 101 residues pruned to eliminate duplicates Z: 93 78.138 2.342 0.605 0.776 0.957 0.804 CB 1.775 93 residues pruned to eliminate duplicates Z: 75 68.652 2.323 0.612 0.761 0.932 0.784 CB 1.812 75 residues pruned to eliminate duplicates Z: 93 82.250 2.351 0.656 0.767 0.978 0.815 CB 1.776 93 residues pruned to eliminate duplicates Z: 103 76.929 2.301 0.646 0.740 0.941 0.765 CB 1.723 103 residues pruned to eliminate duplicates Z: 91 79.989 2.322 0.672 0.751 0.978 0.789 CB 1.775 91 residues pruned to eliminate duplicates Z: 30 44.131 2.257 0.871 0.751 0.966 0.793 CB 1.607 30 residues pruned to eliminate duplicates Z: 114 76.842 2.327 0.625 0.720 0.912 0.726 CB 1.719 114 residues pruned to eliminate duplicates Z: 73 64.499 2.281 0.601 0.766 0.958 0.819 CB 1.715 73 residues pruned to eliminate duplicates Z: 79 68.006 2.281 0.576 0.737 0.987 0.808 CB 1.755 79 residues pruned to eliminate duplicates Z: 94 82.068 2.345 0.670 0.767 0.968 0.806 CB 1.772 94 residues pruned to eliminate duplicates Z: 101 77.166 2.322 0.664 0.736 0.920 0.720 CB 1.757 101 residues pruned to eliminate duplicates Z: 40 54.107 2.300 0.807 0.754 0.949 0.769 CB 1.752 40 residues pruned to eliminate duplicates Z: 74 72.192 2.317 0.681 0.755 0.959 0.767 CB 1.802 74 residues pruned to eliminate duplicates Z: 130 85.792 2.310 0.679 0.701 0.930 0.729 CB 1.743 130 residues pruned to eliminate duplicates Z: 79 60.567 2.330 0.511 0.708 0.910 0.782 CB 1.770 79 residues pruned to eliminate duplicates Z: 94 78.300 2.342 0.621 0.769 0.946 0.774 CB 1.782 94 residues pruned to eliminate duplicates Z: 93 84.846 2.344 0.758 0.775 0.946 0.804 CB 1.781 93 residues pruned to eliminate duplicates Z: 49 65.799 2.352 0.695 0.830 0.958 0.896 CB 1.869 49 residues pruned to eliminate duplicates Z: 109 83.561 2.346 0.673 0.743 0.917 0.750 CB 1.799 109 residues pruned to eliminate duplicates Z: 45 46.191 2.251 0.347 0.800 0.977 0.795 CB 1.808 45 residues pruned to eliminate duplicates Z: 75 68.990 2.285 0.629 0.782 0.946 0.811 CB 1.776 75 residues pruned to eliminate duplicates Z: 124 78.775 2.290 0.561 0.724 0.935 0.764 CB 1.737 124 residues pruned to eliminate duplicates Z: 77 65.228 2.338 0.550 0.746 0.934 0.724 CB 1.774 77 residues pruned to eliminate duplicates Z: 78 61.593 2.320 0.477 0.743 0.935 0.766 CB 1.763 78 residues pruned to eliminate duplicates Z: 93 61.850 2.284 0.543 0.680 0.880 0.685 CB 1.761 93 residues pruned to eliminate duplicates Z: 93 89.077 2.339 0.794 0.782 0.967 0.837 CB 1.785 93 residues pruned to eliminate duplicates Z: 93 85.324 2.331 0.780 0.778 0.935 0.739 CB 1.794 93 residues pruned to eliminate duplicates Z: 75 80.386 2.304 0.741 0.787 0.986 0.730 CB 1.835 75 residues pruned to eliminate duplicates Z: 97 85.126 2.330 0.809 0.757 0.938 0.812 CB 1.750 97 residues pruned to eliminate duplicates Z: 112 89.505 2.366 0.762 0.741 0.928 0.694 CB 1.769 112 residues pruned to eliminate duplicates Z: 94 90.695 2.348 0.814 0.781 0.968 0.785 CB 1.780 94 residues pruned to eliminate duplicates Z: 68 70.769 2.365 0.688 0.771 0.970 0.776 CB 1.756 68 residues pruned to eliminate duplicates Z: 85 70.587 2.322 0.603 0.741 0.929 0.750 CB 1.796 85 residues pruned to eliminate duplicates Z: 112 88.035 2.351 0.740 0.721 0.946 0.748 CB 1.768 112 residues pruned to eliminate duplicates Z: 68 78.232 2.305 0.811 0.810 0.940 0.776 CB 1.859 68 residues pruned to eliminate duplicates Z: 68 72.954 2.363 0.661 0.783 0.970 0.821 CB 1.824 68 residues pruned to eliminate duplicates Z: 76 73.741 2.372 0.700 0.739 0.960 0.680 CB 1.776 76 residues pruned to eliminate duplicates Z: 91 96.758 2.347 0.927 0.793 0.944 0.744 CB 1.846 91 residues pruned to eliminate duplicates Z: 71 71.533 2.300 0.751 0.740 0.971 0.657 CB 1.762 71 residues pruned to eliminate duplicates Z: 68 79.089 2.354 0.844 0.769 0.970 0.731 CB 1.809 68 residues pruned to eliminate duplicates Z: 54 63.171 2.327 0.774 0.730 0.962 0.811 CB 1.776 54 residues pruned to eliminate duplicates Z: 71 73.131 2.281 0.758 0.769 0.957 0.743 CB 1.794 71 residues pruned to eliminate duplicates Z: 94 86.713 2.311 0.847 0.764 0.925 0.677 CB 1.802 94 residues pruned to eliminate duplicates Z: 93 91.693 2.352 0.858 0.781 0.967 0.783 CB 1.766 93 residues pruned to eliminate duplicates Z: 93 92.240 2.359 0.864 0.781 0.957 0.761 CB 1.784 93 residues pruned to eliminate duplicates Z: 101 86.734 2.338 0.796 0.760 0.930 0.730 CB 1.763 101 residues pruned to eliminate duplicates Z: 93 92.975 2.347 0.877 0.789 0.957 0.772 CB 1.784 93 residues pruned to eliminate duplicates Z: 104 84.054 2.275 0.866 0.734 0.922 0.699 CB 1.715 104 residues pruned to eliminate duplicates Z: 92 97.392 2.362 0.908 0.771 0.967 0.758 CB 1.844 92 residues pruned to eliminate duplicates Z: 95 91.012 2.330 0.887 0.756 0.957 0.723 CB 1.775 95 residues pruned to eliminate duplicates Z: 71 77.644 2.321 0.851 0.766 0.957 0.786 CB 1.784 71 residues pruned to eliminate duplicates Z: 75 80.987 2.288 0.899 0.775 0.946 0.811 CB 1.797 75 residues pruned to eliminate duplicates Z: 76 73.954 2.351 0.735 0.739 0.947 0.733 CB 1.786 76 residues pruned to eliminate duplicates Z: 72 69.208 2.356 0.629 0.751 0.958 0.775 CB 1.787 72 residues pruned to eliminate duplicates Z: 103 83.754 2.285 0.875 0.732 0.902 0.716 CB 1.741 103 residues pruned to eliminate duplicates Z: 100 89.285 2.360 0.820 0.761 0.919 0.747 CB 1.801 100 residues pruned to eliminate duplicates Z: 93 95.228 2.350 0.857 0.779 0.989 0.783 CB 1.798 93 residues pruned to eliminate duplicates Z: 100 80.768 2.293 0.787 0.733 0.949 0.758 CB 1.691 100 residues pruned to eliminate duplicates Z: 70 75.582 2.342 0.721 0.758 0.986 0.739 CB 1.820 70 residues pruned to eliminate duplicates Z: 78 69.529 2.328 0.683 0.716 0.948 0.675 CB 1.755 78 residues pruned to eliminate duplicates Z: 110 91.473 2.321 0.865 0.736 0.936 0.670 CB 1.751 110 residues pruned to eliminate duplicates Z: 34 41.037 2.390 0.640 0.661 0.939 0.545 CB 1.670 34 residues pruned to eliminate duplicates Z: 79 78.488 2.315 0.875 0.753 0.936 0.782 CB 1.747 79 residues pruned to eliminate duplicates Z: 76 80.091 2.291 0.866 0.768 0.960 0.747 CB 1.778 76 residues pruned to eliminate duplicates Z: 228 112.886 2.305 0.674 0.673 0.965 0.692 CB 1.716 404 residues pruned to eliminate duplicates Z: 9 9.801 1.790 0.543 0.723 0.875 0.625 C 1.172 9 residues pruned to eliminate duplicates Z: 60 43.310 2.182 0.717 0.524 0.932 0.610 CB 1.577 60 residues pruned to eliminate duplicates Z: 63 43.736 2.166 0.798 0.505 0.903 0.645 CB 1.572 63 residues pruned to eliminate duplicates Z: 34 42.166 2.202 0.988 0.627 1.000 0.606 CB 1.488 34 residues pruned to eliminate duplicates Z: 73 44.245 2.137 0.769 0.473 0.917 0.583 CB 1.546 73 residues pruned to eliminate duplicates Z: 34 38.005 2.196 0.827 0.575 0.970 0.636 CB 1.582 34 residues pruned to eliminate duplicates Z: 34 40.326 2.208 0.879 0.582 0.970 0.576 CB 1.612 34 residues pruned to eliminate duplicates Z: 46 36.961 2.120 0.798 0.553 0.956 0.556 CB 1.437 46 residues pruned to eliminate duplicates Z: 63 44.205 2.160 0.831 0.495 0.903 0.645 CB 1.580 63 residues pruned to eliminate duplicates Z: 20 16.736 2.131 0.605 0.445 0.842 0.684 CB 1.411 20 residues pruned to eliminate duplicates Z: 14 19.935 2.134 0.595 0.583 1.000 0.846 CB 1.500 14 residues pruned to eliminate duplicates Z: 35 33.030 2.123 0.836 0.563 0.882 0.618 CB 1.550 35 residues pruned to eliminate duplicates Z: 181 93.926 2.283 0.682 0.644 0.950 0.711 CB 1.677 181 residues pruned to eliminate duplicates Z: 37 34.404 2.061 0.873 0.611 0.972 0.722 CB 1.375 37 residues pruned to eliminate duplicates Z: 47 34.852 2.098 0.843 0.560 0.891 0.630 CB 1.407 47 residues pruned to eliminate duplicates Z: 33 37.496 2.227 0.871 0.604 0.938 0.719 CB 1.537 33 residues pruned to eliminate duplicates Z: 103 59.942 2.139 0.805 0.574 0.931 0.667 CB 1.537 103 residues pruned to eliminate duplicates Z: 73 41.605 2.098 0.823 0.465 0.903 0.653 CB 1.471 73 residues pruned to eliminate duplicates Z: 51 49.586 2.232 0.887 0.544 0.980 0.720 CB 1.627 51 residues pruned to eliminate duplicates Z: 36 35.551 2.132 0.959 0.594 0.914 0.714 CB 1.438 36 residues pruned to eliminate duplicates Z: 35 40.901 2.185 0.921 0.602 0.971 0.676 CB 1.563 35 residues pruned to eliminate duplicates Z: 35 32.599 2.165 0.813 0.578 0.882 0.588 CB 1.497 35 residues pruned to eliminate duplicates Z: 26 48.355 2.266 1.153 0.686 1.000 0.760 CB 1.672 26 residues pruned to eliminate duplicates Z: 64 44.246 2.155 0.810 0.508 0.921 0.571 CB 1.539 64 residues pruned to eliminate duplicates Z: 34 41.826 2.165 1.126 0.603 0.939 0.697 CB 1.527 34 residues pruned to eliminate duplicates Z: 64 44.429 2.157 0.829 0.504 0.937 0.683 CB 1.510 64 residues pruned to eliminate duplicates Z: 62 48.958 2.163 0.911 0.512 0.934 0.705 CB 1.603 62 residues pruned to eliminate duplicates Z: 37 30.526 2.065 0.864 0.552 0.917 0.639 CB 1.371 37 residues pruned to eliminate duplicates Z: 75 48.037 2.102 0.832 0.554 0.959 0.622 CB 1.434 75 residues pruned to eliminate duplicates Z: 105 61.151 2.118 0.863 0.564 0.933 0.663 CB 1.532 105 residues pruned to eliminate duplicates Z: 71 41.894 2.121 0.731 0.458 0.943 0.600 CB 1.510 71 residues pruned to eliminate duplicates Z: 55 49.824 2.165 0.966 0.537 0.963 0.704 CB 1.596 55 residues pruned to eliminate duplicates Z: 58 47.685 2.162 0.923 0.498 0.965 0.632 CB 1.578 58 residues pruned to eliminate duplicates Z: 141 74.083 2.233 0.588 0.638 0.957 0.771 CB 1.621 141 residues pruned to eliminate duplicates Z: 30 25.939 2.101 0.635 0.401 0.931 0.586 CB 1.671 30 residues pruned to eliminate duplicates Z: 29 26.705 2.102 0.745 0.417 0.929 0.571 CB 1.616 29 residues pruned to eliminate duplicates Z: 39 25.456 2.102 0.564 0.375 0.868 0.605 CB 1.653 39 residues pruned to eliminate duplicates Z: 69 46.430 2.175 0.770 0.474 0.956 0.618 CB 1.571 69 residues pruned to eliminate duplicates Z: 60 45.335 2.223 0.678 0.561 0.915 0.661 CB 1.629 60 residues pruned to eliminate duplicates Z: 17 11.910 1.958 0.510 0.338 0.812 0.375 CB 1.479 17 residues pruned to eliminate duplicates Z: 38 24.801 2.076 0.653 0.351 0.892 0.568 CB 1.565 38 residues pruned to eliminate duplicates Z: 38 25.984 2.113 0.640 0.362 0.892 0.514 CB 1.604 38 residues pruned to eliminate duplicates Z: 29 31.654 2.157 0.835 0.431 0.964 0.679 CB 1.684 29 residues pruned to eliminate duplicates Z: 28 32.318 2.165 0.780 0.447 1.000 0.593 CB 1.705 28 residues pruned to eliminate duplicates Z: 29 30.847 2.107 0.743 0.424 1.000 0.643 CB 1.718 29 residues pruned to eliminate duplicates Z: 137 77.617 2.318 0.556 0.651 0.926 0.743 CB 1.732 137 residues pruned to eliminate duplicates Z: 28 25.759 2.166 0.611 0.423 0.926 0.556 CB 1.663 28 residues pruned to eliminate duplicates Z: 40 23.847 2.029 0.665 0.360 0.872 0.487 CB 1.507 40 residues pruned to eliminate duplicates Z: 31 24.481 2.079 0.699 0.394 0.900 0.567 CB 1.572 31 residues pruned to eliminate duplicates Z: 39 22.222 2.104 0.559 0.340 0.842 0.579 CB 1.553 39 residues pruned to eliminate duplicates Z: 28 27.603 2.153 0.683 0.441 0.926 0.704 CB 1.683 28 residues pruned to eliminate duplicates Z: 70 46.732 2.150 0.843 0.510 0.928 0.652 CB 1.516 70 residues pruned to eliminate duplicates Z: 30 28.532 2.103 0.737 0.411 0.966 0.621 CB 1.649 30 residues pruned to eliminate duplicates Z: 30 29.459 2.125 0.790 0.422 0.931 0.621 CB 1.676 30 residues pruned to eliminate duplicates Z: 29 29.040 2.143 0.776 0.433 0.929 0.643 CB 1.664 29 residues pruned to eliminate duplicates Z: 143 77.697 2.299 0.586 0.648 0.923 0.711 CB 1.689 143 residues pruned to eliminate duplicates Z: 29 27.841 2.066 0.752 0.456 0.929 0.607 CB 1.638 29 residues pruned to eliminate duplicates Z: 105 67.900 2.274 0.613 0.623 0.952 0.769 CB 1.698 105 residues pruned to eliminate duplicates Z: 85 55.051 2.137 0.851 0.533 0.940 0.702 CB 1.563 85 residues pruned to eliminate duplicates Z: 36 28.364 2.160 0.712 0.381 0.914 0.629 CB 1.609 36 residues pruned to eliminate duplicates Z: 101 64.634 2.270 0.538 0.652 0.950 0.770 CB 1.692 101 residues pruned to eliminate duplicates Z: 154 83.470 2.292 0.626 0.642 0.954 0.732 CB 1.662 154 residues pruned to eliminate duplicates Z: 127 75.631 2.351 0.506 0.681 0.913 0.714 CB 1.765 127 residues pruned to eliminate duplicates Z: 12 5.502 1.925 0.198 0.250 0.818 0.455 CB 1.172 12 residues pruned to eliminate duplicates Z: 10 5.812 1.941 0.349 0.221 0.778 0.444 CA 1.321 10 residues pruned to eliminate duplicates Z: 9 7.376 2.028 0.254 0.245 0.875 0.500 CA 1.575 9 residues pruned to eliminate duplicates Z: 110 70.683 2.304 0.572 0.615 0.963 0.789 CB 1.741 110 residues pruned to eliminate duplicates Z: 174 91.915 2.291 0.663 0.627 0.960 0.676 CB 1.696 174 residues pruned to eliminate duplicates Z: 97 72.733 2.328 0.535 0.732 0.969 0.792 CB 1.740 97 residues pruned to eliminate duplicates Z: 81 61.639 2.300 0.491 0.705 0.988 0.762 CB 1.688 81 residues pruned to eliminate duplicates Z: 61 69.812 2.348 0.658 0.816 0.983 0.833 CB 1.788 61 residues pruned to eliminate duplicates Z: 109 86.559 2.376 0.623 0.753 0.972 0.778 CB 1.773 109 residues pruned to eliminate duplicates Z: 78 67.034 2.351 0.529 0.757 0.961 0.831 CB 1.759 78 residues pruned to eliminate duplicates Z: 108 85.589 2.384 0.624 0.752 0.963 0.785 CB 1.774 108 residues pruned to eliminate duplicates Z: 53 57.307 2.347 0.528 0.801 0.981 0.865 CB 1.736 53 residues pruned to eliminate duplicates Z: 75 70.097 2.385 0.564 0.772 0.959 0.865 CB 1.790 75 residues pruned to eliminate duplicates Z: 108 81.015 2.385 0.579 0.743 0.953 0.757 CB 1.755 108 residues pruned to eliminate duplicates Z: 103 65.339 2.217 0.638 0.642 0.931 0.755 CB 1.674 103 residues pruned to eliminate duplicates Z: 79 79.230 2.396 0.750 0.760 0.936 0.821 CB 1.814 79 residues pruned to eliminate duplicates Z: 126 79.503 2.339 0.596 0.710 0.928 0.728 CB 1.696 147 residues pruned to eliminate duplicates Z: 63 69.029 2.374 0.561 0.833 0.984 0.871 CB 1.804 63 residues pruned to eliminate duplicates Z: 107 91.847 2.393 0.718 0.760 0.962 0.792 CB 1.790 107 residues pruned to eliminate duplicates Z: 79 71.564 2.387 0.587 0.752 0.974 0.821 CB 1.753 79 residues pruned to eliminate duplicates Z: 107 80.294 2.372 0.639 0.727 0.953 0.830 CB 1.716 107 residues pruned to eliminate duplicates Z: 78 81.399 2.400 0.758 0.770 0.974 0.857 CB 1.777 78 residues pruned to eliminate duplicates Z: 108 90.915 2.379 0.739 0.767 0.953 0.813 CB 1.760 108 residues pruned to eliminate duplicates Z: 114 77.093 2.323 0.626 0.657 0.956 0.752 CB 1.737 114 residues pruned to eliminate duplicates Z: 83 72.344 2.378 0.613 0.728 0.951 0.768 CB 1.783 83 residues pruned to eliminate duplicates Z: 68 68.754 2.333 0.712 0.796 0.955 0.821 CB 1.699 68 residues pruned to eliminate duplicates Z: 146 80.322 2.256 0.697 0.630 0.945 0.710 CB 1.632 146 residues pruned to eliminate duplicates Z: 74 66.211 2.366 0.458 0.750 0.959 0.822 CB 1.873 74 residues pruned to eliminate duplicates Z: 149 84.607 2.326 0.580 0.677 0.932 0.770 CB 1.724 149 residues pruned to eliminate duplicates Z: 68 70.147 2.342 0.659 0.808 0.955 0.851 CB 1.765 68 residues pruned to eliminate duplicates Z: 91 70.497 2.318 0.617 0.715 0.944 0.811 CB 1.729 91 residues pruned to eliminate duplicates Z: 77 82.243 2.376 0.767 0.774 0.974 0.855 CB 1.812 77 residues pruned to eliminate duplicates Z: 107 88.090 2.392 0.690 0.747 0.943 0.755 CB 1.799 107 residues pruned to eliminate duplicates Z: 105 78.726 2.336 0.647 0.727 0.952 0.740 CB 1.719 105 residues pruned to eliminate duplicates Z: 110 79.573 2.344 0.661 0.730 0.927 0.752 CB 1.718 110 residues pruned to eliminate duplicates Z: 85 61.114 2.273 0.515 0.695 0.952 0.750 CB 1.701 85 residues pruned to eliminate duplicates Z: 109 89.810 2.379 0.777 0.733 0.935 0.778 CB 1.773 109 residues pruned to eliminate duplicates Z: 94 84.297 2.359 0.724 0.777 0.946 0.839 CB 1.779 94 residues pruned to eliminate duplicates Z: 66 69.846 2.352 0.674 0.831 0.938 0.892 CB 1.761 66 residues pruned to eliminate duplicates Z: 93 86.104 2.390 0.705 0.773 0.957 0.815 CB 1.810 93 residues pruned to eliminate duplicates Z: 79 74.316 2.358 0.719 0.742 0.949 0.821 CB 1.762 79 residues pruned to eliminate duplicates Z: 68 78.945 2.320 0.809 0.806 1.000 0.866 CB 1.760 68 residues pruned to eliminate duplicates Z: 109 86.915 2.332 0.777 0.726 0.954 0.741 CB 1.725 109 residues pruned to eliminate duplicates Z: 98 70.748 2.334 0.585 0.679 0.928 0.680 CB 1.775 98 residues pruned to eliminate duplicates Z: 71 79.722 2.371 0.752 0.779 0.957 0.743 CB 1.874 71 residues pruned to eliminate duplicates Z: 79 77.668 2.370 0.805 0.752 0.936 0.769 CB 1.754 79 residues pruned to eliminate duplicates Z: 72 69.409 2.328 0.717 0.776 0.915 0.789 CB 1.764 72 residues pruned to eliminate duplicates Z: 104 86.752 2.372 0.828 0.747 0.922 0.680 CB 1.713 104 residues pruned to eliminate duplicates Z: 43 59.136 2.288 0.651 0.827 0.976 0.786 CB 1.865 43 residues pruned to eliminate duplicates Z: 108 93.872 2.373 0.808 0.738 0.953 0.692 CB 1.792 108 residues pruned to eliminate duplicates Z: 67 79.716 2.358 0.887 0.811 0.955 0.712 CB 1.763 67 residues pruned to eliminate duplicates Z: 80 85.026 2.360 0.883 0.756 0.962 0.810 CB 1.782 80 residues pruned to eliminate duplicates Z: 69 83.443 2.344 1.012 0.788 0.941 0.735 CB 1.769 69 residues pruned to eliminate duplicates Z: 115 93.005 2.355 0.838 0.728 0.939 0.711 CB 1.747 115 residues pruned to eliminate duplicates Z: 84 75.013 2.306 0.801 0.739 0.916 0.578 CB 1.747 84 residues pruned to eliminate duplicates Z: 105 100.821 2.373 0.918 0.757 0.962 0.760 CB 1.797 105 residues pruned to eliminate duplicates Z: 114 95.933 2.329 0.945 0.735 0.938 0.735 CB 1.720 114 residues pruned to eliminate duplicates Z: 176 105.229 2.286 0.907 0.647 0.954 0.674 CB 1.667 176 residues pruned to eliminate duplicates Z: 160 101.869 2.298 0.890 0.662 0.950 0.717 CB 1.686 160 residues pruned to eliminate duplicates Z: 95 93.983 2.377 0.885 0.767 0.947 0.755 CB 1.804 95 residues pruned to eliminate duplicates Z: 153 102.700 2.314 0.802 0.698 0.947 0.691 CB 1.760 153 residues pruned to eliminate duplicates Z: 55 73.953 2.379 0.893 0.743 0.981 0.741 CB 1.832 55 residues pruned to eliminate duplicates Z: 92 101.837 2.386 0.971 0.788 0.978 0.736 CB 1.801 92 residues pruned to eliminate duplicates Z: 74 89.686 2.363 1.000 0.788 0.959 0.699 CB 1.798 74 residues pruned to eliminate duplicates Z: 114 96.632 2.353 0.879 0.729 0.947 0.673 CB 1.767 114 residues pruned to eliminate duplicates Z: 55 70.106 2.315 0.982 0.727 0.944 0.704 CB 1.794 55 residues pruned to eliminate duplicates Z: 84 82.962 2.328 1.017 0.714 0.928 0.651 CB 1.722 84 residues pruned to eliminate duplicates Z: 94 95.268 2.369 0.917 0.763 0.957 0.774 CB 1.799 94 residues pruned to eliminate duplicates Z: 93 98.746 2.369 0.988 0.779 0.967 0.728 CB 1.767 93 residues pruned to eliminate duplicates Z: 145 95.733 2.286 0.866 0.644 0.944 0.667 CB 1.731 145 residues pruned to eliminate duplicates Z: 148 95.210 2.325 0.812 0.685 0.912 0.639 CB 1.725 148 residues pruned to eliminate duplicates Z: 79 85.192 2.328 1.027 0.756 0.936 0.769 CB 1.739 79 residues pruned to eliminate duplicates Z: 109 93.843 2.346 0.900 0.746 0.944 0.704 CB 1.722 109 residues pruned to eliminate duplicates Z: 77 94.404 2.389 1.052 0.771 0.961 0.776 CB 1.808 77 residues pruned to eliminate duplicates Z: 70 80.819 2.371 0.841 0.767 0.971 0.768 CB 1.813 70 residues pruned to eliminate duplicates Z: 86 84.382 2.345 0.861 0.728 0.965 0.682 CB 1.770 86 residues pruned to eliminate duplicates Z: 108 103.646 2.378 0.956 0.751 0.953 0.748 CB 1.807 108 residues pruned to eliminate duplicates Z: 135 95.341 2.339 0.799 0.725 0.933 0.694 CB 1.713 135 residues pruned to eliminate duplicates Z: 108 100.451 2.367 0.874 0.765 0.972 0.710 CB 1.781 108 residues pruned to eliminate duplicates Z: 160 95.063 2.311 0.799 0.641 0.912 0.686 CB 1.743 160 residues pruned to eliminate duplicates Z: 81 89.064 2.374 1.004 0.767 0.950 0.762 CB 1.739 81 residues pruned to eliminate duplicates Z: 96 97.388 2.357 0.992 0.756 0.958 0.747 CB 1.768 96 residues pruned to eliminate duplicates Z: 27 37.284 2.330 0.645 0.641 0.962 0.615 CB 1.739 27 residues pruned to eliminate duplicates Z: 19 29.653 2.405 0.604 0.654 0.889 0.722 CB 1.766 19 residues pruned to eliminate duplicates Z: 108 102.386 2.370 0.925 0.757 0.972 0.710 CB 1.775 108 residues pruned to eliminate duplicates Z: 97 101.360 2.369 1.001 0.769 0.948 0.740 CB 1.814 97 residues pruned to eliminate duplicates Z: 109 96.084 2.363 0.857 0.751 0.954 0.759 CB 1.765 109 residues pruned to eliminate duplicates Z: 106 99.200 2.386 0.865 0.764 0.962 0.724 CB 1.789 106 residues pruned to eliminate duplicates Z: 100 96.582 2.384 0.956 0.750 0.939 0.717 CB 1.773 100 residues pruned to eliminate duplicates Z: 96 100.847 2.386 0.919 0.774 0.979 0.779 CB 1.812 96 residues pruned to eliminate duplicates Z: 119 92.561 2.353 0.831 0.713 0.932 0.661 CB 1.750 119 residues pruned to eliminate duplicates Z: 114 99.010 2.350 0.903 0.725 0.965 0.646 CB 1.763 114 residues pruned to eliminate duplicates Z: 105 101.734 2.360 0.983 0.741 0.971 0.779 CB 1.769 105 residues pruned to eliminate duplicates Z: 123 97.151 2.302 0.952 0.695 0.959 0.680 CB 1.707 123 residues pruned to eliminate duplicates Z: 116 94.956 2.358 0.881 0.733 0.930 0.713 CB 1.740 116 residues pruned to eliminate duplicates Z: 19 7.843 1.910 0.222 0.279 0.889 0.500 CB 1.144 19 residues pruned to eliminate duplicates Z: 15 15.106 2.171 0.437 0.554 0.929 0.714 CB 1.322 15 residues pruned to eliminate duplicates Z: 108 99.588 2.369 0.917 0.752 0.944 0.682 CB 1.794 108 residues pruned to eliminate duplicates Z: 8 6.840 2.110 0.704 0.369 0.857 0.286 CB 0.965 8 residues pruned to eliminate duplicates Z: 20 19.443 2.285 0.462 0.539 0.842 0.421 CB 1.525 20 residues pruned to eliminate duplicates Z: 109 97.473 2.349 0.924 0.770 0.944 0.713 CB 1.730 109 residues pruned to eliminate duplicates Z: 129 91.231 2.318 0.748 0.693 0.961 0.711 CB 1.737 129 residues pruned to eliminate duplicates Z: 11 16.409 2.239 0.440 0.641 0.900 0.700 CB 1.568 11 residues pruned to eliminate duplicates Z: 17 21.089 2.081 0.817 0.530 0.875 0.375 CB 1.547 17 residues pruned to eliminate duplicates Z: 34 26.863 2.226 0.543 0.466 0.909 0.667 CB 1.551 34 residues pruned to eliminate duplicates Z: 22 21.682 2.147 0.537 0.444 0.857 0.714 CB 1.771 22 residues pruned to eliminate duplicates Z: 46 28.739 2.032 0.630 0.514 0.844 0.489 CB 1.510 46 residues pruned to eliminate duplicates Z: 18 17.704 2.181 0.345 0.465 0.882 0.706 CA 1.720 18 residues pruned to eliminate duplicates Z: 27 19.748 2.145 0.401 0.480 0.808 0.577 CB 1.628 27 residues pruned to eliminate duplicates Z: 54 43.227 2.206 0.589 0.583 0.925 0.642 CB 1.692 54 residues pruned to eliminate duplicates Z: 20 22.267 2.197 0.437 0.530 0.895 0.632 CA 1.756 20 residues pruned to eliminate duplicates Z: 18 25.150 2.224 0.492 0.601 0.941 0.765 CA 1.774 18 residues pruned to eliminate duplicates Z: 47 45.572 2.221 0.647 0.630 0.957 0.630 CB 1.700 47 residues pruned to eliminate duplicates Z: 19 24.021 2.155 0.540 0.523 0.944 0.667 CA 1.766 19 residues pruned to eliminate duplicates Z: 32 31.068 2.236 0.667 0.503 0.903 0.452 CB 1.652 32 residues pruned to eliminate duplicates Z: 19 32.730 2.228 0.715 0.622 1.000 0.833 CB 1.799 19 residues pruned to eliminate duplicates Z: 28 33.501 2.221 0.686 0.564 0.889 0.667 CB 1.820 28 residues pruned to eliminate duplicates Z: 54 53.266 2.237 0.792 0.640 0.943 0.698 CB 1.697 54 residues pruned to eliminate duplicates Z: 152 111.809 2.339 0.878 0.728 0.967 0.742 CB 1.744 152 residues pruned to eliminate duplicates Z: 37 47.549 2.226 0.869 0.644 0.944 0.722 CB 1.763 37 residues pruned to eliminate duplicates Z: 56 47.356 2.159 0.708 0.589 0.945 0.636 CB 1.682 56 residues pruned to eliminate duplicates Z: 12 15.176 1.946 0.824 0.411 1.000 0.727 CA 1.414 12 residues pruned to eliminate duplicates Z: 46 55.190 2.248 0.860 0.653 0.978 0.711 CB 1.745 46 residues pruned to eliminate duplicates Z: 36 45.669 2.177 0.950 0.662 0.943 0.800 CB 1.659 36 residues pruned to eliminate duplicates Z: 37 42.535 2.202 0.762 0.629 0.944 0.722 CB 1.714 37 residues pruned to eliminate duplicates Z: 47 49.810 2.216 0.863 0.642 0.935 0.652 CB 1.666 47 residues pruned to eliminate duplicates Z: 56 53.350 2.207 0.816 0.630 0.964 0.673 CB 1.648 56 residues pruned to eliminate duplicates Z: 38 49.326 2.182 0.932 0.649 0.973 0.757 CB 1.721 38 residues pruned to eliminate duplicates Z: 39 40.487 2.125 0.851 0.628 0.947 0.684 CB 1.562 39 residues pruned to eliminate duplicates Z: 45 59.144 2.286 0.939 0.657 0.977 0.727 CB 1.778 45 residues pruned to eliminate duplicates Z: 54 50.743 2.206 0.828 0.620 0.925 0.698 CB 1.670 54 residues pruned to eliminate duplicates Z: 46 55.341 2.269 0.832 0.641 0.978 0.711 CB 1.779 46 residues pruned to eliminate duplicates Z: 37 43.963 2.132 0.957 0.630 0.944 0.750 CB 1.647 37 residues pruned to eliminate duplicates Z: 38 43.327 2.192 0.708 0.625 0.973 0.757 CA 1.738 38 residues pruned to eliminate duplicates Z: 55 54.239 2.253 0.788 0.622 0.963 0.722 CB 1.696 55 residues pruned to eliminate duplicates Z: 39 46.418 2.132 0.966 0.632 0.947 0.711 CB 1.675 39 residues pruned to eliminate duplicates Z: 38 45.529 2.169 0.880 0.622 0.946 0.676 CB 1.730 38 residues pruned to eliminate duplicates Z: 46 53.399 2.257 0.744 0.637 1.000 0.756 CB 1.779 46 residues pruned to eliminate duplicates Z: 16 29.785 2.159 0.677 0.871 1.000 0.867 CB 1.550 16 residues pruned to eliminate duplicates Z: 46 55.123 2.261 0.859 0.650 0.978 0.667 CB 1.739 46 residues pruned to eliminate duplicates Z: 46 52.782 2.243 0.908 0.639 0.933 0.711 CB 1.730 46 residues pruned to eliminate duplicates Z: 45 61.118 2.288 0.916 0.649 1.000 0.750 CB 1.830 45 residues pruned to eliminate duplicates Z: 37 46.052 2.179 0.906 0.636 0.944 0.722 CB 1.723 37 residues pruned to eliminate duplicates Z: 45 61.452 2.293 0.948 0.650 1.000 0.727 CB 1.803 46 residues pruned to eliminate duplicates Z: 7 6.816 1.726 0.488 0.372 1.000 0.833 N 1.243 7 residues pruned to eliminate duplicates Z: 36 43.450 2.173 0.912 0.622 0.943 0.714 CB 1.671 36 residues pruned to eliminate duplicates Z: 35 39.968 2.158 0.824 0.612 0.971 0.676 CB 1.613 35 residues pruned to eliminate duplicates Z: 37 52.985 2.214 0.988 0.666 1.000 0.694 CA 1.720 37 residues pruned to eliminate duplicates Z: 36 46.151 2.205 0.881 0.649 0.971 0.686 CB 1.684 36 residues pruned to eliminate duplicates Z: 47 41.961 2.119 0.673 0.597 1.000 0.674 CB 1.590 47 residues pruned to eliminate duplicates Z: 9 10.943 1.956 0.762 0.496 0.875 0.500 CB 1.288 Z: 6 6.823 2.007 0.281 0.521 0.800 0.800 CB 1.453 6 residues pruned to eliminate duplicates Z: 59 39.865 2.198 0.495 0.550 0.879 0.586 CB 1.726 9 residues pruned to eliminate duplicates Z: 27 37.218 2.286 0.433 0.788 0.923 0.731 C 1.874 27 residues pruned to eliminate duplicates Z: 13 10.057 1.932 0.128 0.377 1.000 0.417 CB 1.519 13 residues pruned to eliminate duplicates Z: 59 45.239 2.221 0.610 0.553 0.897 0.638 CB 1.760 59 residues pruned to eliminate duplicates Z: 26 40.587 2.305 0.511 0.855 0.920 0.680 CB 1.869 26 residues pruned to eliminate duplicates Z: 58 45.052 2.264 0.631 0.555 0.860 0.596 CB 1.781 59 residues pruned to eliminate duplicates Z: 26 38.725 2.308 0.470 0.864 0.920 0.760 CB 1.819 26 residues pruned to eliminate duplicates Z: 55 42.831 2.253 0.508 0.573 0.889 0.556 CB 1.798 55 residues pruned to eliminate duplicates Z: 59 46.732 2.240 0.591 0.575 0.914 0.586 CB 1.753 59 residues pruned to eliminate duplicates Z: 25 37.101 2.352 0.327 0.864 0.958 0.750 CB 1.855 25 residues pruned to eliminate duplicates Z: 39 36.910 2.243 0.477 0.675 0.895 0.632 CB 1.719 39 residues pruned to eliminate duplicates Z: 33 36.382 2.256 0.434 0.689 0.938 0.688 CB 1.782 33 residues pruned to eliminate duplicates Z: 39 36.345 2.210 0.505 0.634 0.895 0.684 CB 1.747 39 residues pruned to eliminate duplicates Z: 48 48.141 2.325 0.627 0.583 0.915 0.638 CB 1.873 48 residues pruned to eliminate duplicates Z: 26 38.934 2.296 0.403 0.861 0.960 0.760 CB 1.850 26 residues pruned to eliminate duplicates Z: 58 42.950 2.263 0.532 0.545 0.895 0.632 CB 1.755 58 residues pruned to eliminate duplicates Z: 87 81.048 2.282 0.857 0.747 0.942 0.733 CB 1.756 145 residues pruned to eliminate duplicates Z: 55 39.031 2.196 0.518 0.541 0.889 0.648 CB 1.722 Z: 27 43.191 2.220 0.673 0.845 0.962 0.731 CB 1.764 27 residues pruned to eliminate duplicates Z: 33 42.731 2.321 0.529 0.694 0.969 0.750 CB 1.840 34 residues pruned to eliminate duplicates Z: 26 45.505 2.294 0.607 0.867 0.960 0.760 CB 1.881 26 residues pruned to eliminate duplicates Z: 58 48.690 2.260 0.661 0.573 0.912 0.614 CB 1.755 54 residues pruned to eliminate duplicates Z: 26 44.683 2.314 0.545 0.875 0.960 0.840 CB 1.893 26 residues pruned to eliminate duplicates Z: 36 34.617 2.244 0.538 0.622 0.829 0.543 CB 1.823 36 residues pruned to eliminate duplicates Z: 50 45.266 2.287 0.645 0.567 0.878 0.571 CB 1.835 50 residues pruned to eliminate duplicates Z: 26 44.412 2.381 0.586 0.783 0.960 0.760 CB 1.910 26 residues pruned to eliminate duplicates Z: 53 43.062 2.224 0.583 0.569 0.885 0.615 CB 1.793 53 residues pruned to eliminate duplicates Z: 54 50.512 2.284 0.698 0.567 0.925 0.547 CB 1.814 54 residues pruned to eliminate duplicates Z: 8 7.475 1.703 0.284 0.555 1.000 0.571 CB 1.225 8 residues pruned to eliminate duplicates Z: 54 43.368 2.267 0.567 0.559 0.887 0.547 CB 1.785 54 residues pruned to eliminate duplicates Z: 55 49.361 2.286 0.623 0.570 0.926 0.685 CB 1.827 55 residues pruned to eliminate duplicates Z: 53 45.739 2.295 0.588 0.568 0.904 0.519 CB 1.803 53 residues pruned to eliminate duplicates Z: 13 17.922 1.870 0.885 0.566 0.917 0.500 CA 1.502 13 residues pruned to eliminate duplicates Z: 54 46.824 2.286 0.665 0.553 0.887 0.679 CB 1.811 54 residues pruned to eliminate duplicates Z: 48 50.076 2.322 0.761 0.591 0.894 0.681 CB 1.832 48 residues pruned to eliminate duplicates Z: 53 47.533 2.282 0.640 0.564 0.923 0.712 CB 1.793 54 residues pruned to eliminate duplicates Z: 9 22.144 2.095 0.945 0.785 0.875 0.500 C 1.709 9 residues pruned to eliminate duplicates Z: 54 50.641 2.275 0.678 0.566 0.943 0.604 CB 1.812 54 residues pruned to eliminate duplicates Z: 58 44.780 2.267 0.586 0.552 0.895 0.667 CB 1.752 58 residues pruned to eliminate duplicates Z: 56 37.749 2.225 0.461 0.544 0.891 0.636 CB 1.683 56 residues pruned to eliminate duplicates Z: 59 51.002 2.254 0.591 0.591 0.966 0.724 CB 1.773 59 residues pruned to eliminate duplicates Z: 10 20.909 2.091 0.835 0.599 1.000 0.667 CA 1.653 12 residues pruned to eliminate duplicates Z: 12 8.057 1.553 0.451 0.504 0.909 0.545 CB 1.182 10 residues pruned to eliminate duplicates Z: 6 5.186 1.836 0.278 0.366 1.000 0.800 C 1.141 6 residues pruned to eliminate duplicates 487 residues left after pruning, divided into chains as follows: A: 8 B: 38 C: 33 D: 25 E: 326 F: 57 CC for partial structure against native data = 26.71 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.386, Connect. = 0.702 for dens.mod. cycle 1 = 0.300, Contrast = 0.446, Connect. = 0.729 for dens.mod. cycle 2 = 0.300, Contrast = 0.511, Connect. = 0.765 for dens.mod. cycle 3 = 0.300, Contrast = 0.513, Connect. = 0.769 for dens.mod. cycle 4 = 0.300, Contrast = 0.521, Connect. = 0.774 for dens.mod. cycle 5 = 0.300, Contrast = 0.527, Connect. = 0.778 for dens.mod. cycle 6 = 0.300, Contrast = 0.534, Connect. = 0.781 for dens.mod. cycle 7 = 0.300, Contrast = 0.540, Connect. = 0.784 for dens.mod. cycle 8 = 0.300, Contrast = 0.545, Connect. = 0.786 for dens.mod. cycle 9 = 0.300, Contrast = 0.549, Connect. = 0.787 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5588 peaks > 0.5 sigma used to seed fragment search Space for about 755 unique residues taking solvent into account 1013 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 25 40.388 2.388 0.351 0.844 0.958 0.875 CB 1.984 B: 23 60.856 2.360 1.038 0.930 1.000 0.955 CB 1.887 C: 24 47.238 2.411 0.728 0.888 0.957 0.913 CB 1.780 D: 24 43.762 2.415 0.525 0.927 1.000 0.913 CB 1.737 24 residues pruned to eliminate duplicates E: 23 54.817 2.339 0.929 0.941 0.955 0.818 CB 1.884 23 residues pruned to eliminate duplicates F: 21 64.673 2.422 1.194 0.949 1.000 0.900 CB 1.878 22 residues pruned to eliminate duplicates G: 22 54.543 2.360 0.909 0.944 1.000 0.810 CB 1.830 21 residues pruned to eliminate duplicates H: 21 42.940 2.221 0.877 0.900 0.950 0.750 CB 1.731 21 residues pruned to eliminate duplicates I: 34 46.660 2.220 0.477 0.920 1.000 0.970 CB 1.744 J: 24 49.729 2.385 0.912 0.874 0.957 0.870 CB 1.731 24 residues pruned to eliminate duplicates K: 31 50.787 2.215 0.790 0.907 0.967 0.733 C 1.719 L: 21 50.048 2.329 0.949 0.897 0.950 0.700 CB 1.857 M: 21 46.919 2.335 0.762 0.911 1.000 0.950 CB 1.807 21 residues pruned to eliminate duplicates N: 15 30.627 2.172 0.664 0.929 0.929 0.857 CB 1.707 O: 22 57.065 2.400 0.892 0.952 1.000 0.952 CB 1.888 22 residues pruned to eliminate duplicates P: 21 44.100 2.350 0.636 0.901 1.000 0.800 CB 1.831 21 residues pruned to eliminate duplicates Q: 24 57.022 2.281 1.051 0.932 0.957 0.870 CB 1.855 24 residues pruned to eliminate duplicates R: 109 102.537 2.414 0.876 0.756 0.944 0.676 CB 1.838 76 residues pruned to eliminate duplicates S: 24 53.701 2.258 0.906 0.938 1.000 0.913 CB 1.808 23 residues pruned to eliminate duplicates T: 39 50.726 2.372 0.304 0.885 1.000 0.921 CA 1.922 34 residues pruned to eliminate duplicates U: 25 42.603 2.214 0.632 0.919 1.000 0.875 CB 1.696 25 residues pruned to eliminate duplicates V: 22 45.807 2.537 0.556 0.941 1.000 1.000 CB 1.756 22 residues pruned to eliminate duplicates W: 22 59.040 2.569 0.918 0.947 1.000 1.000 CB 1.806 22 residues pruned to eliminate duplicates X: 23 56.176 2.360 0.988 0.952 0.955 0.864 CB 1.842 24 residues pruned to eliminate duplicates Y: 33 64.283 2.357 0.772 0.946 1.000 0.906 C 1.882 33 residues pruned to eliminate duplicates Z: 40 63.654 2.289 0.836 0.895 0.974 0.821 CB 1.784 40 residues pruned to eliminate duplicates Z: 24 38.231 2.453 0.228 0.848 0.957 0.913 CB 2.053 24 residues pruned to eliminate duplicates Z: 21 44.202 2.342 0.681 0.892 1.000 0.750 CB 1.804 21 residues pruned to eliminate duplicates Z: 15 30.650 2.146 0.762 0.807 1.000 0.786 CB 1.657 15 residues pruned to eliminate duplicates Z: 23 56.218 2.339 0.938 0.952 1.000 0.909 CB 1.821 23 residues pruned to eliminate duplicates Z: 16 37.816 2.111 0.945 0.884 0.933 0.800 CA 1.841 15 residues pruned to eliminate duplicates Z: 24 58.777 2.344 1.022 0.909 0.957 0.826 CB 1.918 22 residues pruned to eliminate duplicates Z: 15 36.497 2.110 0.963 0.891 0.929 0.857 C 1.822 15 residues pruned to eliminate duplicates Z: 25 41.205 2.345 0.404 0.865 0.958 0.833 CA 1.953 24 residues pruned to eliminate duplicates Z: 46 48.197 2.210 0.720 0.642 0.978 0.644 CB 1.693 Z: 21 44.185 2.332 0.723 0.885 1.000 0.800 CB 1.776 21 residues pruned to eliminate duplicates Z: 8 10.954 1.967 0.133 0.760 1.000 0.857 C 1.475 6 residues pruned to eliminate duplicates Z: 20 50.194 2.397 0.831 0.908 1.000 0.842 C 1.864 20 residues pruned to eliminate duplicates Z: 40 50.725 2.354 0.381 0.868 0.974 0.923 CB 1.875 39 residues pruned to eliminate duplicates Z: 15 33.585 2.112 0.633 0.924 1.000 0.929 CA 1.828 16 residues pruned to eliminate duplicates Z: 23 50.828 2.469 0.766 0.951 1.000 0.909 CB 1.713 23 residues pruned to eliminate duplicates Z: 25 41.376 2.409 0.406 0.852 0.958 0.708 CB 1.924 26 residues pruned to eliminate duplicates Z: 20 48.141 2.257 0.919 0.909 1.000 0.895 CB 1.810 Z: 19 39.505 2.353 0.528 0.922 1.000 0.667 C 1.821 19 residues pruned to eliminate duplicates Z: 8 9.362 2.000 0.446 0.521 0.857 0.714 CB 1.397 Z: 6 9.511 2.194 0.179 0.844 0.800 0.800 CB 1.530 6 residues pruned to eliminate duplicates Z: 8 12.591 2.135 -0.007 0.814 1.000 0.857 CB 1.708 8 residues pruned to eliminate duplicates Z: 15 32.982 2.132 0.644 0.908 1.000 0.857 CA 1.786 15 residues pruned to eliminate duplicates Z: 22 61.582 2.564 0.977 0.947 1.000 0.905 CB 1.833 22 residues pruned to eliminate duplicates Z: 19 50.085 2.359 0.834 0.897 1.000 0.833 CA 1.952 Z: 24 36.850 2.325 0.585 0.877 0.913 0.913 CB 1.659 24 residues pruned to eliminate duplicates Z: 9 15.719 2.060 0.574 0.801 0.875 0.500 CA 1.506 9 residues pruned to eliminate duplicates Z: 31 42.482 2.034 0.868 0.888 0.933 0.633 CB 1.575 19 residues pruned to eliminate duplicates Z: 18 56.335 2.364 1.275 0.900 1.000 0.882 CB 1.815 18 residues pruned to eliminate duplicates Z: 25 38.368 2.391 0.355 0.855 0.958 0.792 CB 1.863 25 residues pruned to eliminate duplicates Z: 21 44.946 2.272 0.936 0.874 1.000 0.850 CB 1.663 21 residues pruned to eliminate duplicates Z: 23 60.622 2.332 1.125 0.944 1.000 0.864 CB 1.807 23 residues pruned to eliminate duplicates Z: 16 40.996 2.071 1.078 0.895 1.000 0.867 C 1.763 16 residues pruned to eliminate duplicates Z: 40 46.406 2.341 0.242 0.882 0.974 0.897 CA 1.898 40 residues pruned to eliminate duplicates Z: 37 49.158 2.247 0.778 0.674 0.972 0.694 CB 1.797 37 residues pruned to eliminate duplicates Z: 22 42.650 2.260 0.837 0.885 0.905 0.667 C 1.789 22 residues pruned to eliminate duplicates Z: 19 34.658 2.247 0.621 0.908 0.944 0.722 CA 1.687 19 residues pruned to eliminate duplicates Z: 22 34.812 2.336 0.378 0.869 0.905 0.810 CB 1.905 22 residues pruned to eliminate duplicates Z: 16 28.396 2.187 0.339 0.908 1.000 0.933 CB 1.779 16 residues pruned to eliminate duplicates Z: 41 62.026 2.359 0.591 0.873 1.000 0.700 CA 1.903 40 residues pruned to eliminate duplicates Z: 24 50.946 2.364 0.783 0.945 1.000 0.913 CB 1.744 24 residues pruned to eliminate duplicates Z: 19 50.275 2.296 0.954 0.894 1.000 0.778 CB 1.894 19 residues pruned to eliminate duplicates Z: 40 69.367 2.324 0.877 0.886 0.974 0.641 C 1.885 40 residues pruned to eliminate duplicates Z: 8 12.960 2.132 0.349 0.821 0.857 0.714 CA 1.504 9 residues pruned to eliminate duplicates Z: 23 49.163 2.308 0.888 0.930 1.000 0.955 CB 1.683 23 residues pruned to eliminate duplicates Z: 26 49.519 2.293 0.798 0.896 0.960 0.760 C 1.793 26 residues pruned to eliminate duplicates Z: 31 36.981 2.036 0.561 0.873 1.000 0.733 CB 1.547 31 residues pruned to eliminate duplicates Z: 24 45.819 2.256 0.891 0.924 0.957 0.913 CB 1.645 24 residues pruned to eliminate duplicates Z: 78 90.918 2.387 0.926 0.752 0.974 0.662 CB 1.848 67 residues pruned to eliminate duplicates Z: 25 41.082 2.408 0.361 0.869 0.958 0.792 CA 1.951 25 residues pruned to eliminate duplicates Z: 7 7.855 1.996 0.154 0.728 0.833 0.167 CB 1.361 Z: 7 9.728 1.982 0.290 0.833 0.833 0.500 CB 1.397 7 residues pruned to eliminate duplicates Z: 8 18.253 2.121 0.738 0.863 0.857 0.714 CA 1.602 8 residues pruned to eliminate duplicates Z: 35 75.130 2.320 1.036 0.936 1.000 0.794 CB 1.899 35 residues pruned to eliminate duplicates Z: 82 88.043 2.400 0.892 0.742 0.938 0.704 CB 1.849 82 residues pruned to eliminate duplicates Z: 17 30.128 2.076 0.563 0.901 1.000 0.875 CB 1.657 17 residues pruned to eliminate duplicates Z: 21 37.984 2.248 0.614 0.911 1.000 0.750 CB 1.659 21 residues pruned to eliminate duplicates Z: 23 44.807 2.400 0.624 0.938 1.000 0.955 CB 1.705 23 residues pruned to eliminate duplicates Z: 42 68.973 2.296 0.949 0.871 0.976 0.707 C 1.800 42 residues pruned to eliminate duplicates Z: 32 59.377 2.334 0.663 0.924 1.000 0.839 CA 1.930 32 residues pruned to eliminate duplicates Z: 7 22.474 2.322 0.637 0.864 1.000 0.833 CA 1.769 7 residues pruned to eliminate duplicates Z: 15 34.043 2.115 0.854 0.917 1.000 0.786 CB 1.637 15 residues pruned to eliminate duplicates Z: 21 39.598 2.314 0.533 0.904 1.000 0.850 CB 1.777 21 residues pruned to eliminate duplicates Z: 25 43.027 2.183 0.626 0.898 1.000 0.750 CA 1.770 7 residues pruned to eliminate duplicates Z: 7 10.817 2.140 0.062 0.715 1.000 0.667 CB 1.598 6 residues pruned to eliminate duplicates Z: 20 43.906 2.236 0.810 0.912 1.000 0.842 CB 1.763 20 residues pruned to eliminate duplicates Z: 24 45.307 2.257 0.795 0.920 0.957 0.826 CB 1.717 24 residues pruned to eliminate duplicates Z: 24 54.177 2.317 0.873 0.937 1.000 0.826 CB 1.811 24 residues pruned to eliminate duplicates Z: 20 47.537 2.216 0.985 0.889 1.000 0.737 CB 1.784 20 residues pruned to eliminate duplicates Z: 8 13.641 2.093 0.310 0.734 1.000 0.571 CA 1.523 8 residues pruned to eliminate duplicates Z: 32 59.388 2.333 0.770 0.910 0.968 0.903 C 1.893 32 residues pruned to eliminate duplicates Z: 20 47.209 2.380 0.766 0.889 1.000 0.789 CB 1.855 20 residues pruned to eliminate duplicates Z: 39 67.878 2.404 0.672 0.901 1.000 0.816 CB 1.955 39 residues pruned to eliminate duplicates Z: 32 44.850 2.103 0.713 0.893 0.935 0.645 CB 1.716 20 residues pruned to eliminate duplicates Z: 40 69.669 2.384 0.786 0.876 0.974 0.744 CA 1.954 40 residues pruned to eliminate duplicates Z: 40 69.227 2.374 0.754 0.898 0.974 0.769 CA 1.954 40 residues pruned to eliminate duplicates Z: 33 52.214 2.335 0.538 0.921 0.969 0.906 CA 1.867 33 residues pruned to eliminate duplicates Z: 41 74.933 2.340 1.026 0.885 0.975 0.750 C 1.851 41 residues pruned to eliminate duplicates Z: 35 60.761 2.287 0.663 0.937 1.000 0.735 C 1.906 35 residues pruned to eliminate duplicates Z: 21 46.163 2.179 0.868 0.925 1.000 0.850 C 1.779 21 residues pruned to eliminate duplicates Z: 39 67.050 2.376 0.696 0.891 1.000 0.737 CB 1.941 39 residues pruned to eliminate duplicates Z: 30 43.029 2.077 0.843 0.889 0.966 0.690 CB 1.557 30 residues pruned to eliminate duplicates Z: 23 51.695 2.432 0.800 0.923 1.000 0.818 CB 1.769 23 residues pruned to eliminate duplicates Z: 24 42.929 2.268 0.669 0.873 0.957 0.783 C 1.801 24 residues pruned to eliminate duplicates Z: 41 64.178 2.279 0.756 0.909 0.975 0.775 C 1.846 41 residues pruned to eliminate duplicates Z: 20 46.187 2.305 0.803 0.907 1.000 0.789 C 1.813 19 residues pruned to eliminate duplicates Z: 29 29.079 2.196 0.613 0.439 0.929 0.571 C 1.781 Z: 86 86.551 2.372 0.821 0.725 0.941 0.659 CB 1.885 85 residues pruned to eliminate duplicates Z: 19 38.953 2.257 0.661 0.908 0.944 0.889 CB 1.842 19 residues pruned to eliminate duplicates Z: 30 47.262 2.086 0.877 0.898 0.966 0.724 CB 1.661 30 residues pruned to eliminate duplicates Z: 23 53.297 2.512 0.807 0.923 0.955 0.909 CB 1.843 23 residues pruned to eliminate duplicates Z: 37 52.916 2.267 0.905 0.685 0.972 0.750 CB 1.773 37 residues pruned to eliminate duplicates Z: 8 19.691 2.118 0.559 0.879 1.000 0.857 CA 1.634 8 residues pruned to eliminate duplicates Z: 31 47.182 2.161 0.667 0.875 1.000 0.733 CB 1.739 31 residues pruned to eliminate duplicates Z: 22 47.505 2.514 0.613 0.925 1.000 0.952 CB 1.794 22 residues pruned to eliminate duplicates Z: 92 85.772 2.391 0.874 0.698 0.923 0.659 CB 1.815 92 residues pruned to eliminate duplicates Z: 22 41.066 2.223 0.753 0.856 0.952 0.667 CB 1.781 22 residues pruned to eliminate duplicates Z: 21 70.570 2.503 1.420 0.959 1.000 1.000 CB 1.785 21 residues pruned to eliminate duplicates Z: 18 30.195 2.045 0.669 0.919 0.941 0.941 CA 1.607 18 residues pruned to eliminate duplicates Z: 40 49.054 2.371 0.266 0.869 1.000 0.872 CA 1.911 40 residues pruned to eliminate duplicates Z: 16 25.986 2.065 0.412 0.909 1.000 0.933 CB 1.632 16 residues pruned to eliminate duplicates Z: 40 62.176 2.335 0.697 0.893 0.949 0.821 CB 1.901 40 residues pruned to eliminate duplicates Z: 26 20.418 2.019 0.592 0.461 0.840 0.640 CB 1.574 Z: 12 16.154 2.001 0.370 0.889 0.909 0.636 CB 1.407 Z: 25 52.360 2.304 1.173 0.909 0.875 0.875 C 1.732 25 residues pruned to eliminate duplicates Z: 41 52.428 2.338 0.394 0.878 1.000 0.900 CB 1.846 41 residues pruned to eliminate duplicates Z: 8 16.279 2.070 1.021 0.789 1.000 0.571 CB 1.141 Z: 39 54.496 2.365 0.428 0.892 0.974 0.868 CA 1.932 39 residues pruned to eliminate duplicates Z: 36 63.558 2.261 0.929 0.902 0.971 0.771 C 1.809 36 residues pruned to eliminate duplicates Z: 26 55.465 2.397 0.742 0.924 0.960 0.840 CA 1.943 26 residues pruned to eliminate duplicates Z: 93 90.582 2.353 0.870 0.792 0.946 0.793 CB 1.757 78 residues pruned to eliminate duplicates Z: 94 96.394 2.327 0.937 0.780 0.968 0.688 CB 1.789 94 residues pruned to eliminate duplicates Z: 26 42.616 2.098 0.846 0.823 1.000 0.720 CB 1.665 25 residues pruned to eliminate duplicates Z: 24 41.739 2.435 0.410 0.853 0.957 0.783 CB 1.958 24 residues pruned to eliminate duplicates Z: 24 42.806 2.204 0.647 0.878 1.000 0.913 CA 1.785 24 residues pruned to eliminate duplicates Z: 20 38.238 2.327 0.540 0.909 1.000 0.947 C 1.737 20 residues pruned to eliminate duplicates Z: 35 57.678 2.252 0.724 0.924 1.000 0.824 C 1.789 35 residues pruned to eliminate duplicates Z: 29 29.729 2.170 0.741 0.440 0.929 0.536 CA 1.704 30 residues pruned to eliminate duplicates Z: 40 59.116 2.363 0.507 0.884 1.000 0.949 CA 1.921 40 residues pruned to eliminate duplicates Z: 19 34.147 2.181 0.569 0.882 0.944 0.833 CA 1.801 19 residues pruned to eliminate duplicates Z: 19 28.335 2.027 0.650 0.801 0.944 0.667 CB 1.625 19 residues pruned to eliminate duplicates Z: 41 61.246 2.308 0.696 0.891 0.925 0.800 C 1.923 41 residues pruned to eliminate duplicates Z: 20 42.363 2.231 0.748 0.890 1.000 0.947 CB 1.794 20 residues pruned to eliminate duplicates Z: 29 28.424 2.171 0.752 0.426 0.857 0.607 CA 1.779 29 residues pruned to eliminate duplicates Z: 19 24.205 2.004 0.302 0.886 1.000 0.778 CA 1.578 19 residues pruned to eliminate duplicates Z: 21 49.733 2.353 0.886 0.930 1.000 0.800 CB 1.752 21 residues pruned to eliminate duplicates Z: 40 64.001 2.384 0.653 0.863 1.000 0.795 CB 1.908 40 residues pruned to eliminate duplicates Z: 20 42.178 2.267 0.586 0.925 1.000 0.895 C 1.888 20 residues pruned to eliminate duplicates Z: 24 52.606 2.414 0.810 0.919 0.957 0.826 CB 1.850 24 residues pruned to eliminate duplicates Z: 33 48.456 2.261 0.485 0.907 1.000 0.844 C 1.813 33 residues pruned to eliminate duplicates Z: 38 50.613 2.337 0.335 0.913 1.000 0.811 CA 1.888 38 residues pruned to eliminate duplicates Z: 23 67.889 2.347 1.350 0.939 0.955 0.773 C 1.910 23 residues pruned to eliminate duplicates Z: 41 47.733 2.305 0.273 0.870 0.975 0.800 CB 1.925 41 residues pruned to eliminate duplicates Z: 7 8.985 2.163 -0.115 0.680 1.000 0.333 CB 1.622 7 residues pruned to eliminate duplicates Z: 26 42.634 2.314 0.492 0.875 0.960 0.840 CB 1.871 27 residues pruned to eliminate duplicates Z: 15 35.333 2.097 1.005 0.809 1.000 0.714 C 1.716 15 residues pruned to eliminate duplicates Z: 33 68.263 2.354 0.907 0.940 1.000 0.719 C 1.866 33 residues pruned to eliminate duplicates Z: 10 23.346 2.103 0.665 0.768 1.000 0.778 CB 1.752 8 residues pruned to eliminate duplicates Z: 77 95.527 2.463 0.926 0.784 0.961 0.697 CB 1.873 77 residues pruned to eliminate duplicates Z: 40 67.802 2.365 0.780 0.890 0.974 0.744 CB 1.905 40 residues pruned to eliminate duplicates Z: 40 51.352 2.347 0.447 0.868 0.949 0.718 CB 1.867 40 residues pruned to eliminate duplicates Z: 19 21.919 1.985 0.563 0.819 0.889 0.778 CB 1.420 Z: 41 66.389 2.346 0.736 0.865 1.000 0.825 CB 1.887 41 residues pruned to eliminate duplicates Z: 36 48.070 2.225 0.873 0.645 0.971 0.657 CB 1.753 36 residues pruned to eliminate duplicates Z: 36 63.122 2.291 0.804 0.911 0.971 0.714 CB 1.883 36 residues pruned to eliminate duplicates Z: 20 40.729 2.216 0.734 0.916 1.000 0.895 CB 1.717 20 residues pruned to eliminate duplicates Z: 24 63.190 2.285 1.322 0.931 0.957 0.783 C 1.814 24 residues pruned to eliminate duplicates Z: 24 54.729 2.358 1.098 0.927 1.000 0.826 CB 1.617 24 residues pruned to eliminate duplicates Z: 7 10.252 1.991 0.033 0.742 1.000 0.667 C 1.638 7 residues pruned to eliminate duplicates Z: 25 39.896 2.172 0.732 0.854 0.917 0.667 CA 1.743 26 residues pruned to eliminate duplicates Z: 11 22.867 2.098 0.653 0.745 1.000 0.600 CB 1.675 10 residues pruned to eliminate duplicates Z: 34 52.108 2.317 0.422 0.940 1.000 0.939 CB 1.912 34 residues pruned to eliminate duplicates Z: 18 45.839 2.266 1.104 0.861 1.000 0.588 CB 1.713 18 residues pruned to eliminate duplicates Z: 40 59.685 2.352 0.628 0.877 0.949 0.821 CA 1.911 40 residues pruned to eliminate duplicates Z: 21 61.935 2.538 1.177 0.926 0.950 0.900 CB 1.850 21 residues pruned to eliminate duplicates Z: 7 15.995 2.160 0.241 0.901 1.000 1.000 CA 1.738 Z: 35 56.381 2.304 0.586 0.910 1.000 0.824 CB 1.878 35 residues pruned to eliminate duplicates Z: 18 30.687 2.025 0.768 0.915 1.000 0.824 CB 1.470 18 residues pruned to eliminate duplicates Z: 36 49.049 2.257 0.434 0.921 0.971 0.914 C 1.855 36 residues pruned to eliminate duplicates Z: 25 45.189 2.439 0.445 0.878 0.958 0.833 CA 1.981 26 residues pruned to eliminate duplicates Z: 20 27.946 2.056 0.784 0.897 0.947 0.789 CB 1.321 20 residues pruned to eliminate duplicates Z: 8 15.535 2.092 0.249 0.853 1.000 1.000 C 1.661 8 residues pruned to eliminate duplicates Z: 85 67.519 2.257 0.675 0.729 0.952 0.679 CB 1.665 85 residues pruned to eliminate duplicates Z: 24 65.462 2.277 1.438 0.949 0.957 0.826 C 1.773 24 residues pruned to eliminate duplicates Z: 41 71.094 2.350 0.949 0.868 0.950 0.675 CA 1.888 41 residues pruned to eliminate duplicates Z: 23 63.041 2.464 1.191 0.927 0.955 0.818 C 1.828 23 residues pruned to eliminate duplicates Z: 19 28.993 1.905 0.783 0.886 1.000 0.833 CB 1.451 12 residues pruned to eliminate duplicates Z: 20 44.858 2.361 0.693 0.896 1.000 0.842 CB 1.845 20 residues pruned to eliminate duplicates Z: 19 46.687 2.318 0.844 0.889 1.000 0.778 CA 1.853 19 residues pruned to eliminate duplicates Z: 17 29.391 2.119 0.571 0.839 1.000 0.812 CB 1.648 17 residues pruned to eliminate duplicates Z: 6 7.239 1.732 0.462 0.690 0.800 0.400 CB 1.343 6 residues pruned to eliminate duplicates Z: 18 48.747 2.353 0.969 0.883 1.000 0.765 C 1.846 18 residues pruned to eliminate duplicates Z: 26 41.143 2.320 0.397 0.878 0.960 0.960 CA 1.920 26 residues pruned to eliminate duplicates Z: 8 16.196 2.195 0.521 0.859 0.857 0.571 CA 1.574 9 residues pruned to eliminate duplicates Z: 8 7.237 2.044 0.473 0.433 0.857 0.714 CB 1.136 8 residues pruned to eliminate duplicates Z: 19 51.733 2.284 1.048 0.903 1.000 0.667 CB 1.858 19 residues pruned to eliminate duplicates Z: 36 37.080 2.068 0.840 0.601 0.914 0.629 CB 1.636 19 residues pruned to eliminate duplicates Z: 40 71.760 2.312 0.961 0.908 0.974 0.718 CB 1.847 40 residues pruned to eliminate duplicates Z: 20 23.388 2.043 0.421 0.826 0.895 0.632 CB 1.557 Z: 24 49.843 2.367 0.878 0.946 0.957 0.957 CB 1.689 24 residues pruned to eliminate duplicates Z: 21 43.419 2.322 0.675 0.900 1.000 0.800 CB 1.783 21 residues pruned to eliminate duplicates Z: 25 43.120 2.358 0.526 0.866 0.958 0.750 CB 1.868 25 residues pruned to eliminate duplicates Z: 18 24.654 2.025 0.462 0.873 0.941 0.824 CB 1.563 18 residues pruned to eliminate duplicates Z: 19 59.148 2.373 1.135 0.897 1.000 0.778 CA 1.969 19 residues pruned to eliminate duplicates Z: 35 61.710 2.323 0.736 0.916 0.971 0.794 C 1.909 35 residues pruned to eliminate duplicates Z: 19 28.078 2.078 0.617 0.825 0.944 0.667 CA 1.574 19 residues pruned to eliminate duplicates Z: 10 15.788 2.097 0.718 0.770 0.778 0.667 C 1.479 10 residues pruned to eliminate duplicates Z: 40 53.425 2.331 0.397 0.880 1.000 0.872 CA 1.904 40 residues pruned to eliminate duplicates Z: 25 42.479 2.406 0.423 0.865 0.958 0.917 CB 1.937 25 residues pruned to eliminate duplicates Z: 22 31.164 1.954 0.701 0.895 0.952 0.762 CB 1.540 22 residues pruned to eliminate duplicates Z: 69 73.046 2.312 0.700 0.785 0.985 0.794 CB 1.779 69 residues pruned to eliminate duplicates Z: 7 6.524 1.808 0.387 0.717 0.667 0.667 C 1.309 7 residues pruned to eliminate duplicates Z: 16 29.743 2.094 0.555 0.885 1.000 0.800 CA 1.703 16 residues pruned to eliminate duplicates Z: 32 42.835 2.108 0.647 0.876 0.968 0.645 CB 1.663 32 residues pruned to eliminate duplicates Z: 92 96.689 2.361 0.886 0.800 0.967 0.802 CB 1.811 92 residues pruned to eliminate duplicates Z: 7 15.912 2.011 0.628 0.860 1.000 0.667 CB 1.460 7 residues pruned to eliminate duplicates Z: 35 67.598 2.324 0.939 0.916 0.971 0.882 C 1.871 35 residues pruned to eliminate duplicates Z: 24 39.648 2.366 0.670 0.899 0.913 0.826 CB 1.637 24 residues pruned to eliminate duplicates Z: 37 41.638 2.157 0.965 0.585 0.972 0.722 CB 1.553 16 residues pruned to eliminate duplicates Z: 39 72.921 2.354 0.928 0.910 0.974 0.763 C 1.899 39 residues pruned to eliminate duplicates Z: 39 57.616 2.366 0.526 0.893 0.974 0.816 CA 1.908 39 residues pruned to eliminate duplicates Z: 35 51.369 2.296 0.443 0.921 0.971 0.941 CB 1.927 35 residues pruned to eliminate duplicates Z: 23 56.829 2.357 1.021 0.935 0.955 0.818 CB 1.858 23 residues pruned to eliminate duplicates Z: 24 40.397 2.448 0.328 0.866 0.957 0.826 CB 1.984 24 residues pruned to eliminate duplicates Z: 39 65.176 2.396 0.680 0.887 0.974 0.658 CB 1.944 39 residues pruned to eliminate duplicates Z: 37 38.689 2.043 0.976 0.603 0.944 0.667 CB 1.533 36 residues pruned to eliminate duplicates Z: 39 75.585 2.409 0.863 0.889 1.000 0.816 C 1.966 39 residues pruned to eliminate duplicates Z: 35 48.536 2.154 0.983 0.664 1.000 0.706 CB 1.675 37 residues pruned to eliminate duplicates Z: 40 62.134 2.363 0.620 0.892 0.974 0.795 CA 1.917 40 residues pruned to eliminate duplicates Z: 25 24.728 2.057 0.618 0.494 0.958 0.583 CB 1.593 26 residues pruned to eliminate duplicates Z: 19 28.433 2.050 0.382 0.871 1.000 0.778 CA 1.725 19 residues pruned to eliminate duplicates Z: 41 42.263 2.306 0.163 0.867 0.975 0.750 CB 1.869 41 residues pruned to eliminate duplicates Z: 20 34.256 2.360 0.509 0.901 0.895 0.789 CB 1.760 20 residues pruned to eliminate duplicates Z: 22 60.997 2.527 0.996 0.937 1.000 0.810 CB 1.837 22 residues pruned to eliminate duplicates Z: 19 32.980 2.166 0.600 0.918 1.000 0.889 CA 1.582 19 residues pruned to eliminate duplicates Z: 21 38.355 2.212 0.774 0.862 0.950 0.650 CB 1.689 21 residues pruned to eliminate duplicates Z: 44 37.275 2.090 0.760 0.649 0.930 0.721 CB 1.446 44 residues pruned to eliminate duplicates Z: 7 11.410 2.081 0.236 0.717 0.833 0.500 CA 1.786 7 residues pruned to eliminate duplicates Z: 35 58.379 2.314 0.578 0.935 1.000 0.971 CB 1.910 35 residues pruned to eliminate duplicates Z: 30 43.058 2.089 0.762 0.879 0.966 0.621 CB 1.632 30 residues pruned to eliminate duplicates Z: 9 15.351 2.026 0.336 0.865 1.000 0.875 CA 1.468 10 residues pruned to eliminate duplicates Z: 19 29.245 2.090 0.458 0.890 1.000 0.889 CB 1.628 19 residues pruned to eliminate duplicates Z: 42 65.121 2.278 0.736 0.896 0.976 0.780 C 1.888 42 residues pruned to eliminate duplicates Z: 24 29.537 1.941 0.607 0.874 1.000 0.652 CB 1.436 24 residues pruned to eliminate duplicates Z: 40 58.715 2.341 0.579 0.880 0.974 0.795 CB 1.892 40 residues pruned to eliminate duplicates Z: 34 38.114 2.121 0.715 0.654 0.970 0.636 CB 1.630 34 residues pruned to eliminate duplicates Z: 41 66.299 2.338 0.801 0.881 0.950 0.625 CB 1.897 41 residues pruned to eliminate duplicates Z: 34 57.341 2.350 0.596 0.925 0.970 0.879 CB 1.927 34 residues pruned to eliminate duplicates Z: 12 28.248 2.198 0.628 0.921 1.000 0.818 CB 1.675 12 residues pruned to eliminate duplicates Z: 25 18.819 2.076 0.560 0.444 0.833 0.625 CB 1.508 25 residues pruned to eliminate duplicates Z: 16 32.181 2.168 0.609 0.864 1.000 0.733 CB 1.745 16 residues pruned to eliminate duplicates Z: 26 20.826 2.048 0.483 0.460 0.960 0.640 CB 1.488 26 residues pruned to eliminate duplicates Z: 33 46.651 2.077 0.732 0.868 1.000 0.594 CB 1.675 33 residues pruned to eliminate duplicates Z: 24 48.052 2.242 0.907 0.895 0.957 0.826 CB 1.757 24 residues pruned to eliminate duplicates Z: 36 60.315 2.310 0.736 0.905 0.971 0.771 C 1.862 36 residues pruned to eliminate duplicates Z: 40 68.631 2.374 0.774 0.879 0.974 0.718 CB 1.942 40 residues pruned to eliminate duplicates Z: 10 15.082 1.874 0.496 0.796 0.889 0.667 CB 1.557 10 residues pruned to eliminate duplicates Z: 9 11.150 1.684 0.302 0.834 1.000 0.875 CA 1.348 Z: 41 69.924 2.313 0.852 0.889 1.000 0.750 C 1.859 41 residues pruned to eliminate duplicates Z: 40 75.311 2.378 0.868 0.895 1.000 0.769 CA 1.945 40 residues pruned to eliminate duplicates Z: 12 15.631 1.911 0.231 0.875 0.909 0.727 CB 1.603 12 residues pruned to eliminate duplicates Z: 41 71.862 2.279 1.037 0.902 0.975 0.700 C 1.791 41 residues pruned to eliminate duplicates Z: 40 46.564 2.349 0.270 0.875 0.974 0.923 CB 1.865 40 residues pruned to eliminate duplicates Z: 9 23.599 2.192 0.874 0.907 0.875 0.625 C 1.650 9 residues pruned to eliminate duplicates Z: 30 41.183 2.084 0.683 0.874 0.966 0.655 CB 1.644 30 residues pruned to eliminate duplicates Z: 17 28.163 2.148 0.511 0.862 0.938 0.812 CB 1.699 17 residues pruned to eliminate duplicates Z: 17 29.164 2.125 0.679 0.876 1.000 0.812 CB 1.485 17 residues pruned to eliminate duplicates Z: 46 44.293 2.114 0.880 0.650 0.956 0.667 CB 1.512 36 residues pruned to eliminate duplicates Z: 39 69.061 2.398 0.728 0.886 1.000 0.684 CA 1.950 39 residues pruned to eliminate duplicates Z: 20 39.722 2.271 0.604 0.873 1.000 0.789 CA 1.821 20 residues pruned to eliminate duplicates Z: 55 49.219 2.271 0.661 0.565 0.907 0.574 CB 1.837 43 residues pruned to eliminate duplicates Z: 25 35.127 2.338 0.283 0.875 0.958 0.750 CB 1.814 25 residues pruned to eliminate duplicates Z: 20 39.910 2.126 0.984 0.832 0.947 0.579 CB 1.720 20 residues pruned to eliminate duplicates Z: 40 55.552 2.300 0.468 0.910 1.000 0.949 CB 1.869 40 residues pruned to eliminate duplicates Z: 22 63.130 2.411 1.154 0.941 0.952 0.857 CB 1.933 22 residues pruned to eliminate duplicates Z: 7 12.784 1.931 0.655 0.763 0.833 0.833 CA 1.553 7 residues pruned to eliminate duplicates Z: 94 57.586 2.262 0.639 0.558 0.914 0.667 CB 1.666 89 residues pruned to eliminate duplicates Z: 24 33.097 2.203 0.425 0.878 0.913 0.783 CA 1.748 24 residues pruned to eliminate duplicates Z: 40 67.980 2.345 0.841 0.886 0.949 0.718 CB 1.917 40 residues pruned to eliminate duplicates Z: 41 58.008 2.315 0.512 0.886 1.000 0.800 C 1.890 41 residues pruned to eliminate duplicates Z: 23 55.757 2.464 0.992 0.914 0.955 0.864 CB 1.794 23 residues pruned to eliminate duplicates Z: 14 24.468 1.942 0.607 0.883 1.000 0.846 CB 1.573 14 residues pruned to eliminate duplicates Z: 7 20.017 2.175 0.667 0.850 1.000 1.000 CA 1.670 7 residues pruned to eliminate duplicates Z: 32 37.324 1.999 0.691 0.849 0.935 0.516 CB 1.571 32 residues pruned to eliminate duplicates Z: 39 47.680 2.139 0.951 0.649 0.947 0.737 CB 1.702 39 residues pruned to eliminate duplicates Z: 35 74.802 2.308 1.123 0.925 0.971 0.765 C 1.894 35 residues pruned to eliminate duplicates Z: 17 24.554 2.106 0.577 0.924 0.938 0.750 CB 1.384 17 residues pruned to eliminate duplicates Z: 7 5.002 1.745 0.015 0.798 0.833 0.667 CB 1.066 6 residues pruned to eliminate duplicates Z: 24 55.448 2.271 1.035 0.923 0.957 0.913 C 1.839 24 residues pruned to eliminate duplicates Z: 20 53.260 2.296 1.181 0.855 0.947 0.684 CA 1.902 21 residues pruned to eliminate duplicates Z: 38 48.493 2.168 0.700 0.772 0.946 0.568 CB 1.798 32 residues pruned to eliminate duplicates Z: 20 25.210 1.991 0.551 0.824 1.000 0.895 CB 1.415 20 residues pruned to eliminate duplicates Z: 19 44.787 2.289 0.730 0.899 1.000 0.889 CB 1.905 19 residues pruned to eliminate duplicates Z: 31 44.749 2.123 0.627 0.886 0.967 0.767 CB 1.765 31 residues pruned to eliminate duplicates Z: 108 106.647 2.447 0.956 0.755 0.925 0.701 CB 1.855 107 residues pruned to eliminate duplicates Z: 16 26.986 2.089 0.719 0.866 0.933 0.733 CB 1.523 16 residues pruned to eliminate duplicates Z: 11 21.738 2.102 0.411 0.923 1.000 0.900 C 1.628 11 residues pruned to eliminate duplicates Z: 6 7.080 1.642 0.705 0.577 0.800 0.800 C 1.312 6 residues pruned to eliminate duplicates Z: 23 63.192 2.467 1.148 0.934 0.955 0.864 C 1.857 23 residues pruned to eliminate duplicates Z: 34 56.282 2.281 0.704 0.911 0.970 0.727 CA 1.843 34 residues pruned to eliminate duplicates Z: 35 60.256 2.343 0.688 0.923 0.971 0.941 CB 1.891 35 residues pruned to eliminate duplicates Z: 14 31.093 2.095 0.845 0.931 1.000 0.923 CB 1.559 14 residues pruned to eliminate duplicates Z: 20 27.437 1.884 0.731 0.916 0.947 0.895 CB 1.439 19 residues pruned to eliminate duplicates Z: 21 21.729 1.987 0.434 0.872 1.000 0.750 CB 1.243 21 residues pruned to eliminate duplicates Z: 8 12.678 2.176 0.179 0.828 0.857 0.571 CB 1.641 8 residues pruned to eliminate duplicates Z: 19 19.798 1.937 0.458 0.863 0.889 0.722 CB 1.364 19 residues pruned to eliminate duplicates Z: 10 10.290 1.754 0.605 0.467 0.889 0.667 C 1.417 Z: 17 28.764 2.094 0.479 0.858 1.000 0.750 CB 1.709 17 residues pruned to eliminate duplicates Z: 9 9.499 2.034 0.156 0.505 0.875 0.750 CB 1.624 9 residues pruned to eliminate duplicates Z: 25 46.290 2.371 0.570 0.862 0.958 0.708 CA 1.946 25 residues pruned to eliminate duplicates Z: 34 61.095 2.303 0.741 0.942 1.000 0.818 C 1.839 34 residues pruned to eliminate duplicates Z: 9 12.644 2.005 0.156 0.896 1.000 0.750 CB 1.381 9 residues pruned to eliminate duplicates Z: 24 40.681 2.220 0.740 0.830 0.913 0.652 CA 1.809 24 residues pruned to eliminate duplicates Z: 31 49.345 2.142 0.891 0.877 0.933 0.567 CB 1.730 31 residues pruned to eliminate duplicates Z: 17 28.526 2.138 0.369 0.892 1.000 0.812 CA 1.751 17 residues pruned to eliminate duplicates Z: 11 11.923 1.864 0.483 0.804 0.900 0.600 CB 1.162 11 residues pruned to eliminate duplicates Z: 8 10.070 2.066 0.158 0.668 0.857 0.429 CB 1.589 8 residues pruned to eliminate duplicates Z: 19 20.863 1.945 0.707 0.860 0.778 0.667 CB 1.401 19 residues pruned to eliminate duplicates Z: 40 75.196 2.336 1.008 0.921 0.974 0.821 C 1.853 40 residues pruned to eliminate duplicates Z: 41 38.119 2.043 0.596 0.679 0.975 0.625 CB 1.608 27 residues pruned to eliminate duplicates Z: 20 37.839 2.165 0.676 0.855 1.000 0.895 CA 1.766 20 residues pruned to eliminate duplicates Z: 36 59.135 2.269 0.774 0.901 0.971 0.771 C 1.825 36 residues pruned to eliminate duplicates Z: 9 14.381 1.975 0.284 0.833 1.000 0.625 CB 1.505 Z: 17 33.992 2.161 0.672 0.861 1.000 0.750 CB 1.727 17 residues pruned to eliminate duplicates Z: 52 41.321 2.277 0.460 0.564 0.902 0.667 CB 1.814 52 residues pruned to eliminate duplicates Z: 22 32.433 2.181 0.506 0.887 0.905 0.810 CB 1.717 22 residues pruned to eliminate duplicates Z: 34 45.861 2.320 0.261 0.937 1.000 0.909 CB 1.898 34 residues pruned to eliminate duplicates Z: 36 44.879 2.221 0.962 0.636 0.914 0.686 CB 1.677 36 residues pruned to eliminate duplicates Z: 24 52.344 2.247 0.798 0.929 1.000 0.913 CB 1.890 24 residues pruned to eliminate duplicates Z: 25 36.061 2.099 0.532 0.850 1.000 0.833 CB 1.696 25 residues pruned to eliminate duplicates Z: 28 30.251 2.182 0.747 0.430 0.926 0.593 CB 1.774 28 residues pruned to eliminate duplicates Z: 54 51.314 2.241 0.741 0.588 0.925 0.604 CB 1.796 59 residues pruned to eliminate duplicates Z: 25 32.860 2.368 0.123 0.876 0.958 0.875 CB 1.914 25 residues pruned to eliminate duplicates Z: 23 50.467 2.451 0.687 0.941 1.000 0.955 CB 1.806 23 residues pruned to eliminate duplicates Z: 6 11.732 2.198 0.045 0.863 1.000 1.000 CB 1.676 6 residues pruned to eliminate duplicates Z: 24 43.230 2.232 0.706 0.866 0.957 0.783 C 1.812 24 residues pruned to eliminate duplicates Z: 14 15.371 2.091 0.163 0.746 0.846 0.462 CA 1.663 14 residues pruned to eliminate duplicates Z: 8 7.746 1.871 0.233 0.543 1.000 0.714 CB 1.218 8 residues pruned to eliminate duplicates Z: 18 53.151 2.350 1.071 0.899 1.000 0.706 C 1.893 24 residues pruned to eliminate duplicates Z: 23 64.653 2.338 1.295 0.952 0.955 0.864 CB 1.854 23 residues pruned to eliminate duplicates Z: 19 20.589 1.972 0.389 0.853 0.944 0.722 CB 1.387 19 residues pruned to eliminate duplicates Z: 19 27.289 2.123 0.459 0.851 0.944 0.722 C 1.628 19 residues pruned to eliminate duplicates Z: 11 23.929 2.110 0.542 0.905 1.000 0.800 C 1.656 11 residues pruned to eliminate duplicates Z: 9 30.130 2.297 0.845 0.921 1.000 0.750 C 1.769 9 residues pruned to eliminate duplicates Z: 12 16.958 1.945 0.152 0.905 1.000 0.818 CB 1.625 12 residues pruned to eliminate duplicates Z: 19 27.293 2.075 0.357 0.873 1.000 0.889 CB 1.664 19 residues pruned to eliminate duplicates Z: 11 20.681 1.946 0.658 0.793 1.000 0.600 CB 1.569 11 residues pruned to eliminate duplicates Z: 24 42.116 2.227 0.671 0.878 0.957 0.826 CA 1.790 24 residues pruned to eliminate duplicates Z: 40 64.126 2.348 0.654 0.895 1.000 0.795 CA 1.894 40 residues pruned to eliminate duplicates Z: 32 74.524 2.408 0.964 0.932 1.000 0.774 C 1.976 32 residues pruned to eliminate duplicates Z: 8 12.545 1.988 0.449 0.792 0.857 0.857 CA 1.487 8 residues pruned to eliminate duplicates Z: 25 25.782 2.215 0.460 0.432 0.958 0.625 CB 1.822 25 residues pruned to eliminate duplicates Z: 61 54.676 2.214 0.936 0.512 0.967 0.600 CB 1.684 64 residues pruned to eliminate duplicates Z: 18 35.726 2.208 0.902 0.865 0.941 0.882 C 1.607 18 residues pruned to eliminate duplicates Z: 17 29.738 2.142 0.454 0.910 1.000 0.875 CA 1.693 17 residues pruned to eliminate duplicates Z: 26 39.482 2.255 0.448 0.863 1.000 0.680 CB 1.774 26 residues pruned to eliminate duplicates Z: 16 36.587 2.182 0.776 0.888 1.000 0.733 CB 1.756 16 residues pruned to eliminate duplicates Z: 17 35.639 2.148 0.838 0.920 0.938 0.812 C 1.696 17 residues pruned to eliminate duplicates Z: 23 48.064 2.467 0.800 0.923 0.955 0.864 CB 1.700 23 residues pruned to eliminate duplicates Z: 25 34.225 2.119 0.593 0.873 0.917 0.750 CB 1.645 25 residues pruned to eliminate duplicates Z: 37 38.382 2.084 0.857 0.637 0.944 0.639 CB 1.540 37 residues pruned to eliminate duplicates Z: 100 104.274 2.454 0.845 0.764 0.980 0.727 CB 1.869 100 residues pruned to eliminate duplicates Z: 8 10.411 2.088 0.053 0.755 1.000 0.571 CB 1.427 8 residues pruned to eliminate duplicates Z: 24 38.671 2.206 0.713 0.900 0.913 0.783 CB 1.669 24 residues pruned to eliminate duplicates Z: 16 31.972 2.187 0.609 0.885 1.000 0.867 CB 1.694 16 residues pruned to eliminate duplicates Z: 13 17.619 1.890 0.288 0.852 1.000 0.750 CA 1.546 13 residues pruned to eliminate duplicates Z: 18 27.159 2.137 0.437 0.853 1.000 0.824 CB 1.586 18 residues pruned to eliminate duplicates Z: 40 77.946 2.372 0.985 0.889 1.000 0.692 CA 1.909 40 residues pruned to eliminate duplicates Z: 18 24.906 2.009 0.642 0.862 0.941 0.706 CB 1.429 18 residues pruned to eliminate duplicates Z: 17 27.370 2.130 0.511 0.931 1.000 0.938 CB 1.486 17 residues pruned to eliminate duplicates Z: 19 30.173 2.264 0.646 0.625 0.944 0.722 C 1.796 19 residues pruned to eliminate duplicates Z: 18 36.287 2.051 0.983 0.933 1.000 0.882 CB 1.509 19 residues pruned to eliminate duplicates Z: 40 58.523 2.351 0.518 0.888 1.000 0.692 CA 1.892 40 residues pruned to eliminate duplicates Z: 24 57.163 2.267 1.189 0.935 0.957 0.913 CB 1.750 24 residues pruned to eliminate duplicates Z: 20 35.605 2.009 0.731 0.901 1.000 0.895 CA 1.677 20 residues pruned to eliminate duplicates Z: 9 10.139 1.894 0.287 0.827 0.875 0.750 CB 1.267 9 residues pruned to eliminate duplicates Z: 40 61.727 2.376 0.593 0.884 0.974 0.692 CB 1.937 40 residues pruned to eliminate duplicates Z: 22 77.711 2.417 1.499 0.958 1.000 0.857 CB 1.926 24 residues pruned to eliminate duplicates Z: 10 5.488 1.481 0.964 0.571 0.889 0.667 CB 0.660 Z: 40 45.384 2.095 0.731 0.736 0.923 0.564 CB 1.757 40 residues pruned to eliminate duplicates Z: 20 26.780 2.032 0.780 0.899 0.947 0.737 CB 1.282 20 residues pruned to eliminate duplicates Z: 37 47.997 2.237 0.901 0.652 0.944 0.722 CB 1.729 37 residues pruned to eliminate duplicates Z: 10 21.893 2.154 0.527 0.904 1.000 0.778 C 1.581 10 residues pruned to eliminate duplicates Z: 18 55.183 2.428 1.026 0.885 1.000 0.824 C 1.964 18 residues pruned to eliminate duplicates Z: 8 10.325 2.033 0.088 0.755 1.000 0.714 CA 1.407 8 residues pruned to eliminate duplicates Z: 34 58.419 2.337 0.629 0.934 1.000 0.879 CB 1.862 34 residues pruned to eliminate duplicates Z: 25 21.422 2.006 0.591 0.442 0.917 0.708 CB 1.587 25 residues pruned to eliminate duplicates Z: 15 42.594 2.216 0.914 0.943 1.000 0.857 CA 1.859 15 residues pruned to eliminate duplicates Z: 11 20.937 2.016 0.775 0.897 0.900 0.800 CB 1.471 11 residues pruned to eliminate duplicates Z: 40 67.825 2.349 0.822 0.878 0.974 0.795 CB 1.890 40 residues pruned to eliminate duplicates Z: 34 55.002 2.323 0.545 0.933 1.000 0.970 CB 1.862 34 residues pruned to eliminate duplicates Z: 24 41.099 2.327 0.715 0.924 0.957 0.913 CB 1.577 24 residues pruned to eliminate duplicates Z: 17 28.127 2.064 0.501 0.914 1.000 0.875 CB 1.606 17 residues pruned to eliminate duplicates Z: 25 18.910 2.026 0.484 0.444 0.875 0.625 CB 1.553 25 residues pruned to eliminate duplicates Z: 8 13.116 2.111 0.426 0.852 0.857 0.286 CA 1.421 8 residues pruned to eliminate duplicates Z: 44 52.347 2.231 1.196 0.522 0.977 0.628 CB 1.632 44 residues pruned to eliminate duplicates Z: 17 24.459 2.095 0.468 0.873 0.938 0.688 CB 1.545 17 residues pruned to eliminate duplicates Z: 9 16.759 1.994 0.429 0.867 1.000 0.875 CB 1.521 9 residues pruned to eliminate duplicates Z: 25 37.741 2.285 0.647 0.871 0.958 0.875 CB 1.558 25 residues pruned to eliminate duplicates Z: 19 35.291 2.135 0.738 0.911 1.000 0.944 C 1.588 19 residues pruned to eliminate duplicates Z: 63 52.519 2.218 0.901 0.526 0.935 0.645 CB 1.648 63 residues pruned to eliminate duplicates Z: 18 41.305 2.353 0.811 0.864 0.941 0.824 CB 1.832 18 residues pruned to eliminate duplicates Z: 16 23.884 2.160 0.343 0.863 0.933 0.867 CB 1.671 16 residues pruned to eliminate duplicates Z: 17 30.988 2.086 0.957 0.918 0.938 0.750 CB 1.427 17 residues pruned to eliminate duplicates Z: 8 11.594 1.858 0.342 0.708 1.000 0.429 CB 1.455 8 residues pruned to eliminate duplicates Z: 16 31.532 2.171 0.528 0.872 1.000 0.867 CB 1.789 16 residues pruned to eliminate duplicates Z: 19 24.746 2.052 0.424 0.869 1.000 0.667 C 1.458 19 residues pruned to eliminate duplicates Z: 9 13.280 1.825 0.613 0.788 0.875 0.500 CA 1.416 10 residues pruned to eliminate duplicates Z: 24 43.475 2.234 0.678 0.851 1.000 0.870 CA 1.791 24 residues pruned to eliminate duplicates Z: 19 24.860 1.988 0.498 0.896 1.000 0.833 CB 1.409 19 residues pruned to eliminate duplicates Z: 23 51.015 2.453 0.751 0.932 1.000 1.000 CB 1.769 23 residues pruned to eliminate duplicates Z: 10 11.383 1.900 0.195 0.892 0.889 0.778 C 1.350 10 residues pruned to eliminate duplicates Z: 25 22.311 2.059 0.577 0.505 0.917 0.750 CB 1.523 25 residues pruned to eliminate duplicates Z: 34 45.680 2.297 0.362 0.912 1.000 0.970 CB 1.800 34 residues pruned to eliminate duplicates Z: 6 10.137 2.054 0.434 0.706 0.800 0.600 CB 1.596 6 residues pruned to eliminate duplicates Z: 31 40.845 2.052 0.760 0.848 0.933 0.700 CB 1.641 31 residues pruned to eliminate duplicates Z: 11 19.412 1.984 0.363 0.915 1.000 0.900 CB 1.604 13 residues pruned to eliminate duplicates Z: 14 17.291 1.923 0.938 0.545 0.846 0.692 CA 1.455 14 residues pruned to eliminate duplicates Z: 25 44.222 2.391 0.488 0.849 0.958 0.750 CA 1.963 25 residues pruned to eliminate duplicates Z: 16 27.163 2.171 0.473 0.874 0.933 0.800 CB 1.709 16 residues pruned to eliminate duplicates Z: 25 44.104 2.298 0.575 0.877 0.958 0.792 CB 1.885 25 residues pruned to eliminate duplicates Z: 64 52.383 2.196 0.919 0.511 0.952 0.619 CB 1.627 62 residues pruned to eliminate duplicates Z: 30 53.718 2.319 0.676 0.921 0.966 0.793 CA 1.871 30 residues pruned to eliminate duplicates Z: 15 38.254 2.165 0.859 0.901 1.000 0.929 CA 1.814 15 residues pruned to eliminate duplicates Z: 22 63.646 2.418 1.152 0.959 0.952 0.905 CB 1.921 22 residues pruned to eliminate duplicates Z: 14 14.028 2.032 0.327 0.665 0.769 0.615 CA 1.610 14 residues pruned to eliminate duplicates Z: 74 89.126 2.345 0.958 0.772 0.973 0.740 CB 1.836 74 residues pruned to eliminate duplicates Z: 8 7.519 1.649 0.477 0.625 1.000 0.714 CB 1.037 8 residues pruned to eliminate duplicates Z: 61 53.183 2.201 0.908 0.537 0.967 0.550 CB 1.632 61 residues pruned to eliminate duplicates Z: 12 30.221 2.175 0.705 0.924 1.000 0.909 CB 1.725 12 residues pruned to eliminate duplicates Z: 17 25.699 2.085 0.536 0.935 1.000 0.875 CB 1.398 17 residues pruned to eliminate duplicates Z: 7 15.784 2.201 0.352 0.878 1.000 1.000 CB 1.571 10 residues pruned to eliminate duplicates Z: 13 13.465 1.814 0.140 0.908 0.917 0.667 CA 1.457 13 residues pruned to eliminate duplicates Z: 6 6.277 1.839 0.132 0.742 0.800 0.800 C 1.357 6 residues pruned to eliminate duplicates Z: 35 58.541 2.272 0.703 0.928 1.000 0.765 C 1.817 35 residues pruned to eliminate duplicates Z: 19 28.672 2.097 0.507 0.854 1.000 0.722 CB 1.580 19 residues pruned to eliminate duplicates Z: 11 26.020 2.159 0.585 0.893 1.000 0.900 CB 1.727 11 residues pruned to eliminate duplicates Z: 23 68.745 2.335 1.309 0.949 1.000 0.727 CB 1.877 23 residues pruned to eliminate duplicates Z: 26 41.557 2.222 0.673 0.734 0.960 0.760 C 1.888 26 residues pruned to eliminate duplicates Z: 11 19.489 1.849 0.632 0.813 1.000 0.800 C 1.555 11 residues pruned to eliminate duplicates Z: 49 51.796 2.200 0.741 0.655 0.979 0.729 CB 1.727 49 residues pruned to eliminate duplicates Z: 14 18.438 2.001 0.484 0.670 0.923 0.923 CB 1.596 14 residues pruned to eliminate duplicates Z: 121 84.414 2.375 0.628 0.686 0.908 0.700 CB 1.851 121 residues pruned to eliminate duplicates Z: 10 16.701 1.729 0.740 0.820 1.000 0.667 CA 1.402 10 residues pruned to eliminate duplicates Z: 15 32.928 2.195 0.650 0.865 1.000 0.857 CA 1.779 15 residues pruned to eliminate duplicates Z: 55 47.769 2.219 0.678 0.606 0.926 0.685 CB 1.705 55 residues pruned to eliminate duplicates Z: 18 34.016 2.485 0.425 0.898 0.882 0.824 C 1.889 18 residues pruned to eliminate duplicates Z: 37 54.914 2.221 1.027 0.645 0.972 0.667 CB 1.827 37 residues pruned to eliminate duplicates Z: 19 44.346 2.312 0.740 0.897 1.000 0.889 C 1.860 19 residues pruned to eliminate duplicates Z: 24 44.330 2.215 0.785 0.858 0.957 0.870 CA 1.800 25 residues pruned to eliminate duplicates Z: 9 13.681 1.903 0.552 0.575 1.000 0.500 CB 1.523 10 residues pruned to eliminate duplicates Z: 15 36.724 2.177 0.781 0.937 1.000 0.929 CB 1.762 15 residues pruned to eliminate duplicates Z: 13 14.682 1.870 0.219 0.828 0.917 0.750 CA 1.527 13 residues pruned to eliminate duplicates Z: 7 5.641 1.938 0.168 0.717 0.667 0.500 CB 1.254 9 residues pruned to eliminate duplicates Z: 25 61.453 2.236 1.164 0.929 1.000 0.792 C 1.814 25 residues pruned to eliminate duplicates Z: 6 6.955 2.007 -0.018 0.719 0.800 0.600 CB 1.619 6 residues pruned to eliminate duplicates Z: 10 14.492 1.828 0.693 0.881 0.889 0.778 C 1.271 10 residues pruned to eliminate duplicates Z: 14 26.379 2.235 0.519 0.819 0.923 0.769 CB 1.771 14 residues pruned to eliminate duplicates Z: 25 51.717 2.375 0.741 0.876 0.958 0.792 CB 1.935 25 residues pruned to eliminate duplicates Z: 26 21.466 2.045 0.651 0.475 0.880 0.640 CB 1.482 26 residues pruned to eliminate duplicates Z: 24 23.672 1.808 0.947 0.670 1.000 0.783 CB 1.198 Z: 24 50.890 2.328 0.972 0.882 0.957 0.739 C 1.748 24 residues pruned to eliminate duplicates Z: 17 21.651 2.081 0.388 0.915 0.938 0.875 CB 1.412 17 residues pruned to eliminate duplicates Z: 8 9.698 1.848 0.457 0.571 0.857 0.714 CB 1.483 8 residues pruned to eliminate duplicates Z: 20 46.740 2.226 0.986 0.857 1.000 0.737 CB 1.787 20 residues pruned to eliminate duplicates Z: 35 32.236 2.041 0.531 0.696 0.971 0.824 CB 1.523 35 residues pruned to eliminate duplicates Z: 10 12.179 2.264 0.044 0.701 0.778 0.778 CB 1.837 10 residues pruned to eliminate duplicates Z: 21 64.050 2.302 1.339 0.943 1.000 0.550 CB 1.843 21 residues pruned to eliminate duplicates Z: 8 16.308 2.170 0.457 0.828 1.000 0.714 CB 1.468 9 residues pruned to eliminate duplicates Z: 16 25.658 2.090 0.569 0.883 0.933 0.867 CB 1.565 16 residues pruned to eliminate duplicates Z: 14 16.512 1.763 0.382 0.911 1.000 0.846 CA 1.332 14 residues pruned to eliminate duplicates Z: 24 15.700 1.857 0.861 0.418 0.826 0.565 CB 1.248 24 residues pruned to eliminate duplicates Z: 19 30.584 2.113 0.522 0.872 1.000 0.833 CB 1.634 19 residues pruned to eliminate duplicates Z: 26 16.935 1.722 0.690 0.582 1.000 0.800 CB 1.076 26 residues pruned to eliminate duplicates Z: 28 27.510 1.958 0.652 0.735 0.926 0.704 CB 1.431 29 residues pruned to eliminate duplicates Z: 18 31.060 2.018 0.744 0.887 1.000 0.706 CB 1.543 18 residues pruned to eliminate duplicates Z: 8 11.973 1.849 0.566 0.815 0.857 0.857 C 1.387 8 residues pruned to eliminate duplicates Z: 13 15.300 1.839 0.234 0.837 1.000 0.833 CB 1.457 13 residues pruned to eliminate duplicates Z: 10 10.730 1.772 0.502 0.537 1.000 0.778 CB 1.296 Z: 26 19.745 2.107 0.715 0.391 0.920 0.480 CB 1.334 26 residues pruned to eliminate duplicates Z: 41 76.075 2.317 1.045 0.897 0.975 0.725 C 1.864 41 residues pruned to eliminate duplicates Z: 26 45.799 2.299 0.623 0.869 0.960 0.800 CB 1.868 26 residues pruned to eliminate duplicates Z: 30 39.847 2.101 0.634 0.879 0.897 0.517 CA 1.743 30 residues pruned to eliminate duplicates Z: 17 32.555 2.071 0.821 0.900 0.938 0.688 CB 1.644 17 residues pruned to eliminate duplicates Z: 14 32.572 2.089 0.816 0.896 1.000 0.923 C 1.707 14 residues pruned to eliminate duplicates Z: 39 74.490 2.326 0.947 0.899 1.000 0.474 C 1.908 39 residues pruned to eliminate duplicates Z: 19 26.047 2.086 0.600 0.896 0.944 0.889 CB 1.396 19 residues pruned to eliminate duplicates Z: 12 22.457 1.930 0.677 0.921 1.000 1.000 CB 1.473 12 residues pruned to eliminate duplicates Z: 10 14.140 2.074 0.616 0.782 0.889 0.667 CB 1.235 10 residues pruned to eliminate duplicates Z: 11 20.358 2.080 0.461 0.888 1.000 1.000 CB 1.527 11 residues pruned to eliminate duplicates Z: 20 41.347 2.211 0.683 0.894 1.000 0.737 CB 1.829 20 residues pruned to eliminate duplicates Z: 64 48.122 2.191 0.817 0.510 0.952 0.667 CB 1.582 64 residues pruned to eliminate duplicates Z: 21 50.113 2.293 0.991 0.879 1.000 0.850 C 1.779 21 residues pruned to eliminate duplicates Z: 10 21.597 2.124 0.668 0.811 1.000 0.889 CB 1.550 10 residues pruned to eliminate duplicates Z: 9 14.918 2.190 0.566 0.778 1.000 0.750 CB 1.204 9 residues pruned to eliminate duplicates Z: 8 7.557 1.913 0.248 0.718 0.714 0.429 C 1.376 8 residues pruned to eliminate duplicates Z: 14 15.351 1.794 0.260 0.874 1.000 0.615 CA 1.371 13 residues pruned to eliminate duplicates Z: 26 40.834 2.294 0.453 0.849 0.960 0.760 C 1.892 26 residues pruned to eliminate duplicates Z: 18 30.082 2.009 0.680 0.884 1.000 0.882 C 1.561 18 residues pruned to eliminate duplicates Z: 97 70.130 2.255 0.739 0.692 0.938 0.688 CB 1.634 90 residues pruned to eliminate duplicates Z: 18 26.175 1.967 0.613 0.834 1.000 0.706 CB 1.501 18 residues pruned to eliminate duplicates Z: 41 33.201 1.989 0.721 0.677 0.925 0.700 CB 1.408 44 residues pruned to eliminate duplicates Z: 31 49.598 2.156 0.866 0.870 0.933 0.533 CB 1.760 31 residues pruned to eliminate duplicates Z: 24 46.103 2.204 0.884 0.933 1.000 0.783 CB 1.615 24 residues pruned to eliminate duplicates Z: 15 15.286 2.029 0.387 0.595 1.000 0.500 CB 1.327 15 residues pruned to eliminate duplicates Z: 11 23.957 1.976 0.883 0.899 1.000 0.700 CB 1.455 11 residues pruned to eliminate duplicates Z: 8 14.621 1.945 0.451 0.859 1.000 0.429 C 1.440 8 residues pruned to eliminate duplicates Z: 40 66.658 2.313 0.808 0.901 1.000 0.564 C 1.822 40 residues pruned to eliminate duplicates Z: 22 47.551 2.307 0.729 0.942 1.000 0.905 CB 1.805 22 residues pruned to eliminate duplicates Z: 16 32.744 2.191 0.688 0.877 0.933 0.733 CB 1.778 16 residues pruned to eliminate duplicates Z: 18 24.091 2.073 0.500 0.869 0.941 0.765 CB 1.458 18 residues pruned to eliminate duplicates Z: 22 54.564 2.536 0.810 0.954 0.952 0.952 CB 1.874 22 residues pruned to eliminate duplicates Z: 20 23.145 2.067 0.095 0.868 1.000 0.842 CA 1.715 20 residues pruned to eliminate duplicates Z: 10 11.840 1.881 0.490 0.532 0.889 0.667 C 1.535 10 residues pruned to eliminate duplicates Z: 9 6.876 1.550 0.944 0.578 0.875 0.875 CB 0.855 9 residues pruned to eliminate duplicates Z: 29 29.787 2.084 0.797 0.503 0.929 0.571 CB 1.615 29 residues pruned to eliminate duplicates Z: 33 50.800 2.338 0.396 0.930 1.000 0.938 C 1.924 33 residues pruned to eliminate duplicates Z: 31 40.123 2.049 0.801 0.877 0.933 0.700 CB 1.545 31 residues pruned to eliminate duplicates Z: 16 35.621 2.136 0.694 0.922 1.000 0.867 CA 1.787 16 residues pruned to eliminate duplicates Z: 35 36.165 2.154 0.500 0.654 0.941 0.706 CA 1.768 35 residues pruned to eliminate duplicates Z: 23 66.343 2.353 1.186 0.957 1.000 0.955 CB 1.888 23 residues pruned to eliminate duplicates Z: 16 12.213 2.016 0.373 0.387 0.733 0.533 C 1.751 16 residues pruned to eliminate duplicates Z: 18 21.715 1.972 0.599 0.867 0.882 0.706 CB 1.385 18 residues pruned to eliminate duplicates Z: 62 52.491 2.219 0.886 0.507 0.951 0.738 CB 1.678 62 residues pruned to eliminate duplicates Z: 12 10.987 1.769 0.179 0.901 0.909 0.909 CB 1.247 12 residues pruned to eliminate duplicates Z: 8 15.266 1.998 0.567 0.881 1.000 1.000 CA 1.335 8 residues pruned to eliminate duplicates Z: 18 19.836 1.969 0.344 0.875 0.941 0.706 CB 1.404 18 residues pruned to eliminate duplicates Z: 15 43.593 2.214 1.052 0.883 1.000 0.929 CA 1.854 15 residues pruned to eliminate duplicates Z: 23 42.520 2.389 0.557 0.941 1.000 1.000 CB 1.691 23 residues pruned to eliminate duplicates Z: 12 15.582 1.818 0.578 0.923 1.000 0.818 CB 1.151 12 residues pruned to eliminate duplicates Z: 20 41.964 2.247 0.725 0.916 1.000 0.842 CB 1.754 20 residues pruned to eliminate duplicates Z: 9 13.432 1.773 0.872 0.834 0.875 0.750 CB 1.225 9 residues pruned to eliminate duplicates Z: 19 30.266 2.002 0.702 0.857 1.000 0.778 CB 1.543 19 residues pruned to eliminate duplicates Z: 16 29.193 2.124 0.558 0.831 1.000 0.733 CA 1.712 16 residues pruned to eliminate duplicates Z: 26 36.796 2.244 0.410 0.850 0.920 0.760 CB 1.872 26 residues pruned to eliminate duplicates Z: 9 25.479 2.253 0.904 0.804 0.875 0.625 CB 1.841 9 residues pruned to eliminate duplicates Z: 9 16.596 1.874 1.429 0.626 0.875 0.875 C 1.308 9 residues pruned to eliminate duplicates Z: 24 36.955 2.343 0.435 0.906 1.000 0.826 CB 1.630 24 residues pruned to eliminate duplicates Z: 8 14.070 1.981 0.304 0.837 1.000 0.857 CA 1.540 8 residues pruned to eliminate duplicates Z: 12 15.983 2.048 0.334 0.853 0.909 0.818 CB 1.434 12 residues pruned to eliminate duplicates Z: 7 6.791 1.757 -0.076 0.826 1.000 0.833 CA 1.288 7 residues pruned to eliminate duplicates Z: 23 21.962 1.814 0.996 0.670 1.000 0.636 CB 1.106 23 residues pruned to eliminate duplicates Z: 9 5.142 1.539 0.019 0.680 0.875 0.375 CA 1.123 9 residues pruned to eliminate duplicates Z: 12 17.613 2.215 0.208 0.786 0.909 0.636 CB 1.698 12 residues pruned to eliminate duplicates Z: 22 72.409 2.380 1.537 0.957 0.952 0.810 CB 1.885 22 residues pruned to eliminate duplicates Z: 12 7.691 1.829 0.306 0.542 0.818 0.545 CB 1.139 12 residues pruned to eliminate duplicates Z: 8 12.207 1.795 0.441 0.761 1.000 0.857 C 1.415 8 residues pruned to eliminate duplicates Z: 10 14.313 1.901 0.905 0.623 1.000 0.778 CB 1.172 11 residues pruned to eliminate duplicates Z: 53 53.117 2.227 0.992 0.542 0.942 0.712 CB 1.691 53 residues pruned to eliminate duplicates Z: 15 22.133 1.961 0.712 0.856 0.929 0.857 CB 1.399 15 residues pruned to eliminate duplicates Z: 23 51.371 2.325 0.853 0.915 1.000 0.864 CB 1.796 23 residues pruned to eliminate duplicates Z: 19 30.058 1.974 0.752 0.847 1.000 0.833 CB 1.520 19 residues pruned to eliminate duplicates Z: 18 21.878 2.024 0.454 0.861 0.941 0.647 CB 1.407 18 residues pruned to eliminate duplicates Z: 9 16.720 1.808 0.647 0.896 1.000 1.000 C 1.422 9 residues pruned to eliminate duplicates Z: 9 18.778 1.890 0.664 0.889 1.000 0.750 CA 1.520 9 residues pruned to eliminate duplicates Z: 10 22.273 2.206 0.449 0.910 1.000 0.889 CB 1.648 10 residues pruned to eliminate duplicates 6 1.712 1.636 1.092 0.298 0.600 0.600 CB 0.467 ? Z: 12 14.928 1.961 0.066 0.917 1.000 0.909 CA 1.520 12 residues pruned to eliminate duplicates Z: 11 15.407 2.159 0.642 0.665 0.800 0.400 CB 1.474 11 residues pruned to eliminate duplicates Z: 17 21.790 2.007 0.463 0.879 0.938 0.812 CB 1.434 17 residues pruned to eliminate duplicates Z: 40 73.472 2.335 0.891 0.904 1.000 0.769 CB 1.898 40 residues pruned to eliminate duplicates Z: 14 15.377 1.647 0.558 0.888 1.000 0.846 CB 1.197 13 residues pruned to eliminate duplicates Z: 12 16.448 1.912 0.238 0.927 1.000 0.909 CB 1.468 12 residues pruned to eliminate duplicates Z: 25 43.949 2.227 0.611 0.899 0.958 0.917 CB 1.865 25 residues pruned to eliminate duplicates Z: 93 91.918 2.337 0.891 0.773 0.957 0.685 CB 1.781 93 residues pruned to eliminate duplicates Z: 15 10.396 1.934 0.477 0.397 0.857 0.571 CB 1.265 8 residues pruned to eliminate duplicates Z: 18 34.339 2.435 0.391 0.823 0.941 0.824 CA 1.974 18 residues pruned to eliminate duplicates Z: 10 14.909 2.255 0.608 0.513 0.889 0.556 CB 1.523 7 residues pruned to eliminate duplicates Z: 41 36.336 2.023 0.666 0.706 0.950 0.800 CB 1.489 41 residues pruned to eliminate duplicates Z: 9 6.621 1.800 0.628 0.419 0.750 0.625 CB 1.160 9 residues pruned to eliminate duplicates Z: 6 8.555 2.017 -0.029 0.849 1.000 0.600 CB 1.448 6 residues pruned to eliminate duplicates Z: 178 99.736 2.342 0.684 0.648 0.944 0.740 CB 1.755 178 residues pruned to eliminate duplicates Z: 18 22.428 2.000 0.351 0.868 0.941 0.765 CB 1.564 18 residues pruned to eliminate duplicates Z: 13 29.202 2.093 0.668 0.914 1.000 0.667 CB 1.708 13 residues pruned to eliminate duplicates Z: 15 38.754 2.130 1.152 0.867 0.929 0.786 CB 1.780 15 residues pruned to eliminate duplicates Z: 109 101.417 2.436 0.822 0.754 0.944 0.722 CB 1.856 109 residues pruned to eliminate duplicates Z: 56 50.545 2.298 0.623 0.583 0.927 0.655 CB 1.819 57 residues pruned to eliminate duplicates Z: 32 46.231 2.118 0.740 0.854 0.968 0.774 CB 1.720 32 residues pruned to eliminate duplicates Z: 26 18.787 2.030 0.531 0.438 0.880 0.640 CB 1.464 26 residues pruned to eliminate duplicates Z: 76 93.226 2.368 0.998 0.779 0.947 0.773 CB 1.879 76 residues pruned to eliminate duplicates Z: 35 65.951 2.274 0.979 0.932 1.000 0.559 C 1.754 35 residues pruned to eliminate duplicates Z: 21 43.689 2.318 0.675 0.910 1.000 0.850 CB 1.784 21 residues pruned to eliminate duplicates Z: 26 21.403 2.004 0.742 0.476 0.840 0.600 CB 1.496 26 residues pruned to eliminate duplicates Z: 40 54.192 2.270 0.620 0.865 0.974 0.795 CB 1.774 40 residues pruned to eliminate duplicates Z: 8 14.174 2.020 0.598 0.558 1.000 0.714 CB 1.568 8 residues pruned to eliminate duplicates Z: 20 38.581 2.303 0.755 0.911 0.947 0.842 CB 1.639 20 residues pruned to eliminate duplicates Z: 110 80.587 2.404 0.518 0.724 0.963 0.798 CB 1.794 110 residues pruned to eliminate duplicates Z: 15 16.884 1.887 0.575 0.641 0.929 0.857 CA 1.433 15 residues pruned to eliminate duplicates Z: 16 37.780 2.233 0.686 0.912 1.000 0.800 C 1.836 16 residues pruned to eliminate duplicates Z: 10 9.240 1.440 1.075 0.562 1.000 0.778 CB 0.971 10 residues pruned to eliminate duplicates Z: 22 65.870 2.489 1.200 0.949 1.000 0.857 CB 1.812 22 residues pruned to eliminate duplicates Z: 21 18.766 1.943 0.644 0.503 1.000 0.550 CB 1.309 21 residues pruned to eliminate duplicates Z: 75 52.240 2.044 0.666 0.699 0.959 0.716 CB 1.551 66 residues pruned to eliminate duplicates Z: 9 9.014 1.932 0.102 0.874 0.875 0.625 CB 1.245 9 residues pruned to eliminate duplicates Z: 35 40.242 2.224 0.607 0.701 0.882 0.647 CA 1.821 35 residues pruned to eliminate duplicates Z: 18 25.135 2.002 0.456 0.887 0.941 0.882 CA 1.601 18 residues pruned to eliminate duplicates Z: 18 28.680 2.229 0.340 0.921 1.000 1.000 CA 1.638 18 residues pruned to eliminate duplicates Z: 25 44.993 2.196 0.807 0.847 0.958 0.708 CA 1.792 25 residues pruned to eliminate duplicates Z: 23 48.938 2.307 0.756 0.952 1.000 1.000 CB 1.774 23 residues pruned to eliminate duplicates Z: 14 17.976 2.099 0.058 0.906 1.000 0.769 CB 1.596 14 residues pruned to eliminate duplicates Z: 20 37.307 2.132 0.873 0.904 0.947 0.632 C 1.612 20 residues pruned to eliminate duplicates Z: 18 28.074 2.112 0.542 0.869 1.000 0.706 CB 1.527 18 residues pruned to eliminate duplicates Z: 35 32.991 2.042 0.686 0.735 0.912 0.794 CB 1.460 35 residues pruned to eliminate duplicates Z: 32 24.859 1.980 0.382 0.665 0.935 0.742 CB 1.497 32 residues pruned to eliminate duplicates Z: 41 37.417 2.043 0.746 0.725 0.950 0.725 CB 1.425 41 residues pruned to eliminate duplicates Z: 75 48.069 2.149 0.735 0.511 0.892 0.649 CB 1.663 75 residues pruned to eliminate duplicates Z: 41 72.100 2.287 0.893 0.893 1.000 0.775 CB 1.890 41 residues pruned to eliminate duplicates Z: 9 9.832 1.767 0.736 0.652 0.875 0.875 CB 1.125 9 residues pruned to eliminate duplicates Z: 6 3.777 1.395 0.830 0.521 0.800 0.600 CB 0.810 6 residues pruned to eliminate duplicates Z: 7 6.195 1.806 -0.264 0.855 1.000 0.833 CA 1.405 7 residues pruned to eliminate duplicates Z: 23 72.019 2.326 1.458 0.957 1.000 0.500 C 1.843 26 residues pruned to eliminate duplicates Z: 8 17.312 2.052 0.408 0.794 1.000 0.714 CA 1.751 8 residues pruned to eliminate duplicates Z: 18 34.331 2.022 0.942 0.907 1.000 0.471 CB 1.507 18 residues pruned to eliminate duplicates Z: 16 33.257 2.198 0.586 0.874 1.000 0.800 CB 1.794 16 residues pruned to eliminate duplicates Z: 16 28.141 2.155 0.461 0.853 1.000 0.867 CB 1.705 16 residues pruned to eliminate duplicates Z: 86 65.332 2.352 0.574 0.647 0.929 0.682 CB 1.795 86 residues pruned to eliminate duplicates Z: 16 8.802 1.939 0.760 0.294 0.733 0.400 CB 1.145 16 residues pruned to eliminate duplicates Z: 50 68.679 2.330 0.836 0.775 0.980 0.755 CB 1.836 50 residues pruned to eliminate duplicates Z: 18 27.220 1.970 1.011 0.886 0.941 0.647 CB 1.277 18 residues pruned to eliminate duplicates Z: 16 35.796 2.157 0.749 0.910 1.000 0.800 CA 1.738 16 residues pruned to eliminate duplicates Z: 7 13.171 1.921 0.699 0.789 0.833 0.167 C 1.533 7 residues pruned to eliminate duplicates Z: 28 28.609 2.143 0.661 0.438 0.963 0.630 CB 1.712 28 residues pruned to eliminate duplicates Z: 10 17.206 1.952 0.711 0.668 1.000 0.667 CB 1.471 10 residues pruned to eliminate duplicates Z: 20 34.343 2.193 0.638 0.871 0.947 0.737 CB 1.689 20 residues pruned to eliminate duplicates Z: 44 35.700 1.987 0.630 0.670 0.930 0.767 CB 1.545 43 residues pruned to eliminate duplicates Z: 69 96.655 2.411 1.002 0.813 0.971 0.838 CB 1.905 69 residues pruned to eliminate duplicates Z: 8 9.582 2.159 0.068 0.846 0.714 0.714 CA 1.634 8 residues pruned to eliminate duplicates Z: 47 52.547 2.205 0.795 0.639 0.957 0.696 CB 1.796 47 residues pruned to eliminate duplicates Z: 62 51.871 2.206 0.868 0.499 0.951 0.689 CB 1.697 62 residues pruned to eliminate duplicates Z: 47 39.488 2.074 0.699 0.640 0.957 0.652 CB 1.515 47 residues pruned to eliminate duplicates Z: 6 6.034 2.048 0.014 0.826 0.800 0.800 CB 1.225 6 residues pruned to eliminate duplicates Z: 112 74.835 2.364 0.556 0.647 0.928 0.748 CB 1.814 112 residues pruned to eliminate duplicates Z: 38 42.020 2.146 0.870 0.652 0.946 0.649 CB 1.580 38 residues pruned to eliminate duplicates Z: 8 6.618 1.634 0.587 0.518 0.857 0.286 CA 1.105 8 residues pruned to eliminate duplicates Z: 12 13.605 1.980 0.023 0.859 1.000 0.727 CA 1.490 12 residues pruned to eliminate duplicates Z: 63 47.038 2.163 0.744 0.488 0.968 0.613 CB 1.655 63 residues pruned to eliminate duplicates Z: 18 23.145 2.007 0.510 0.852 0.941 0.706 CB 1.456 18 residues pruned to eliminate duplicates Z: 90 68.264 2.331 0.761 0.661 0.933 0.652 CB 1.628 90 residues pruned to eliminate duplicates Z: 9 21.016 2.028 0.597 0.877 1.000 1.000 CA 1.667 9 residues pruned to eliminate duplicates Z: 18 41.408 2.246 0.979 0.920 0.941 0.765 CB 1.691 18 residues pruned to eliminate duplicates Z: 8 2.405 1.471 0.096 0.214 0.857 0.571 CA 0.922 Z: 45 65.347 2.328 0.828 0.789 0.977 0.750 CA 1.837 45 residues pruned to eliminate duplicates Z: 41 67.470 2.348 0.742 0.873 1.000 0.750 CB 1.900 41 residues pruned to eliminate duplicates Z: 7 11.776 1.855 0.523 0.831 1.000 0.667 CB 1.279 7 residues pruned to eliminate duplicates Z: 109 110.329 2.420 0.929 0.764 0.954 0.731 CB 1.887 109 residues pruned to eliminate duplicates Z: 23 46.039 2.395 0.758 0.942 0.955 0.864 CB 1.694 23 residues pruned to eliminate duplicates Z: 19 22.109 1.964 0.625 0.797 0.889 0.722 CB 1.416 19 residues pruned to eliminate duplicates Z: 8 13.584 2.005 0.154 0.900 1.000 0.857 C 1.585 8 residues pruned to eliminate duplicates Z: 8 10.106 1.876 0.249 0.862 1.000 0.714 CA 1.197 8 residues pruned to eliminate duplicates Z: 10 27.674 2.112 0.870 0.911 1.000 0.778 C 1.655 10 residues pruned to eliminate duplicates Z: 18 21.397 2.011 0.529 0.799 0.941 0.706 CB 1.381 18 residues pruned to eliminate duplicates Z: 10 11.814 2.150 0.512 0.240 1.000 0.778 CA 1.638 10 residues pruned to eliminate duplicates Z: 46 32.871 2.093 0.545 0.617 0.911 0.644 CB 1.489 46 residues pruned to eliminate duplicates Z: 11 11.262 1.701 0.156 0.757 1.000 0.600 CA 1.441 11 residues pruned to eliminate duplicates Z: 9 15.982 2.185 0.547 0.769 0.750 0.625 CA 1.756 9 residues pruned to eliminate duplicates Z: 6 4.241 1.769 -0.164 0.695 0.800 0.600 N 1.342 6 residues pruned to eliminate duplicates Z: 12 9.073 1.590 0.361 0.910 0.909 0.818 CB 0.986 12 residues pruned to eliminate duplicates Z: 43 45.348 2.336 0.649 0.607 0.929 0.643 CB 1.766 43 residues pruned to eliminate duplicates Z: 7 11.195 1.833 0.519 0.831 0.833 0.667 CA 1.480 7 residues pruned to eliminate duplicates Z: 18 25.397 2.111 0.307 0.854 1.000 0.765 CB 1.648 18 residues pruned to eliminate duplicates Z: 32 40.792 2.005 0.803 0.849 0.968 0.710 CB 1.553 32 residues pruned to eliminate duplicates Z: 11 7.393 1.866 0.359 0.268 0.800 0.500 CA 1.501 11 residues pruned to eliminate duplicates Z: 19 49.349 2.326 0.952 0.857 1.000 0.611 CA 1.888 19 residues pruned to eliminate duplicates Z: 7 3.592 1.438 0.307 0.391 1.000 0.500 CB 0.876 7 residues pruned to eliminate duplicates Z: 43 46.257 2.214 0.820 0.550 0.952 0.643 CB 1.770 43 residues pruned to eliminate duplicates Z: 34 35.923 2.116 0.722 0.647 0.939 0.667 CB 1.593 34 residues pruned to eliminate duplicates Z: 20 53.413 2.237 1.230 0.905 1.000 0.526 C 1.749 20 residues pruned to eliminate duplicates Z: 41 43.419 2.149 0.390 0.918 0.975 0.775 CB 1.662 41 residues pruned to eliminate duplicates Z: 42 36.130 1.998 0.708 0.692 0.927 0.756 CB 1.496 42 residues pruned to eliminate duplicates Z: 6 5.239 2.026 -0.084 0.857 0.800 0.800 CB 1.162 6 residues pruned to eliminate duplicates Z: 17 39.716 2.186 0.810 0.871 1.000 0.562 CB 1.830 17 residues pruned to eliminate duplicates Z: 13 18.769 1.760 0.880 0.937 1.000 0.917 CB 1.139 13 residues pruned to eliminate duplicates Z: 75 94.894 2.413 0.982 0.771 0.959 0.757 CB 1.891 75 residues pruned to eliminate duplicates Z: 27 26.999 2.037 0.596 0.742 0.846 0.692 CB 1.550 27 residues pruned to eliminate duplicates Z: 41 35.322 2.042 0.552 0.684 0.950 0.700 CB 1.567 42 residues pruned to eliminate duplicates Z: 83 67.466 2.331 0.486 0.732 0.939 0.768 CB 1.859 83 residues pruned to eliminate duplicates Z: 6 7.757 1.972 0.099 0.869 1.000 0.800 CB 1.169 6 residues pruned to eliminate duplicates Z: 49 26.361 1.980 0.490 0.421 0.917 0.625 CB 1.528 49 residues pruned to eliminate duplicates Z: 31 24.598 1.941 0.372 0.663 0.967 0.767 CB 1.500 31 residues pruned to eliminate duplicates Z: 17 28.722 2.095 0.522 0.856 1.000 0.812 CB 1.661 17 residues pruned to eliminate duplicates Z: 101 93.690 2.298 0.986 0.757 0.940 0.730 CB 1.737 101 residues pruned to eliminate duplicates Z: 12 11.571 1.633 0.363 0.925 1.000 0.909 CB 1.100 12 residues pruned to eliminate duplicates Z: 24 51.314 2.442 0.658 0.850 0.957 0.783 C 2.047 24 residues pruned to eliminate duplicates Z: 9 9.976 1.864 0.686 0.680 1.000 0.875 CB 0.951 9 residues pruned to eliminate duplicates Z: 9 13.717 1.944 0.239 0.793 1.000 0.375 CB 1.557 9 residues pruned to eliminate duplicates Z: 114 100.247 2.394 0.891 0.698 0.938 0.735 CB 1.854 114 residues pruned to eliminate duplicates Z: 54 50.401 2.210 0.774 0.632 0.906 0.698 CB 1.722 54 residues pruned to eliminate duplicates Z: 8 2.268 1.601 0.038 0.434 0.714 0.429 CB 0.774 Z: 14 14.805 2.024 0.266 0.699 0.846 0.462 CA 1.580 14 residues pruned to eliminate duplicates Z: 35 79.102 2.294 1.220 0.934 1.000 0.676 C 1.857 35 residues pruned to eliminate duplicates Z: 16 44.138 2.298 0.993 0.873 1.000 0.733 C 1.812 16 residues pruned to eliminate duplicates Z: 63 51.208 2.175 0.928 0.520 0.968 0.629 CB 1.571 63 residues pruned to eliminate duplicates Z: 14 17.498 1.666 0.877 0.906 0.923 0.692 CB 1.196 14 residues pruned to eliminate duplicates Z: 13 14.456 1.734 0.644 0.905 0.917 0.917 CB 1.136 13 residues pruned to eliminate duplicates Z: 10 12.788 1.676 0.931 0.594 1.000 0.667 CB 1.203 10 residues pruned to eliminate duplicates Z: 10 8.086 1.787 0.292 0.510 0.778 0.444 CB 1.487 10 residues pruned to eliminate duplicates Z: 10 4.728 1.609 0.125 0.267 0.889 0.444 CA 1.277 10 residues pruned to eliminate duplicates Z: 6 7.401 1.865 0.190 0.836 0.800 0.800 CB 1.395 6 residues pruned to eliminate duplicates Z: 112 78.949 2.371 0.557 0.654 0.955 0.793 CB 1.843 112 residues pruned to eliminate duplicates Z: 7 9.189 2.157 0.036 0.764 0.833 0.500 CA 1.593 7 residues pruned to eliminate duplicates Z: 16 16.824 2.076 0.423 0.456 0.933 0.667 CA 1.648 16 residues pruned to eliminate duplicates Z: 17 20.292 1.970 0.498 0.887 0.875 0.875 CB 1.416 17 residues pruned to eliminate duplicates Z: 13 12.424 2.102 0.533 0.448 0.750 0.333 CA 1.565 17 residues pruned to eliminate duplicates Z: 8 13.400 1.857 0.538 0.795 1.000 0.714 C 1.370 8 residues pruned to eliminate duplicates Z: 19 28.388 2.070 0.534 0.870 1.000 0.889 CB 1.538 19 residues pruned to eliminate duplicates Z: 11 28.949 2.029 1.102 0.937 1.000 1.000 C 1.494 11 residues pruned to eliminate duplicates Z: 16 26.097 2.139 0.386 0.880 1.000 0.733 CB 1.646 16 residues pruned to eliminate duplicates Z: 7 14.403 2.362 0.144 0.723 1.000 0.833 CA 1.780 7 residues pruned to eliminate duplicates Z: 22 61.727 2.565 0.996 0.931 1.000 0.952 CB 1.839 22 residues pruned to eliminate duplicates Z: 6 2.709 1.316 0.020 0.564 1.000 0.800 CB 0.849 Z: 13 18.383 1.740 0.774 0.893 1.000 0.833 CB 1.234 13 residues pruned to eliminate duplicates Z: 47 48.384 2.223 0.755 0.633 0.935 0.652 CB 1.726 47 residues pruned to eliminate duplicates Z: 72 96.383 2.427 0.945 0.787 0.972 0.662 C 1.937 72 residues pruned to eliminate duplicates Z: 10 9.213 1.420 0.989 0.705 0.889 0.778 C 1.015 10 residues pruned to eliminate duplicates Z: 23 64.908 2.323 1.319 0.947 1.000 0.909 CB 1.775 23 residues pruned to eliminate duplicates Z: 42 41.767 2.236 0.601 0.628 0.902 0.634 CB 1.789 46 residues pruned to eliminate duplicates Z: 86 93.699 2.402 0.936 0.756 0.953 0.718 CB 1.826 86 residues pruned to eliminate duplicates Z: 27 26.107 1.912 0.899 0.597 0.885 0.692 CB 1.453 27 residues pruned to eliminate duplicates Z: 20 17.941 2.082 0.394 0.419 0.947 0.368 CA 1.628 20 residues pruned to eliminate duplicates Z: 9 3.384 1.138 0.495 0.425 1.000 0.500 O 0.760 Z: 26 20.230 2.053 0.836 0.420 0.920 0.600 CB 1.269 26 residues pruned to eliminate duplicates Z: 19 50.576 2.307 1.049 0.939 0.944 0.667 CA 1.854 19 residues pruned to eliminate duplicates Z: 31 47.457 2.066 0.950 0.879 0.967 0.800 CB 1.612 31 residues pruned to eliminate duplicates Z: 77 95.816 2.383 0.960 0.774 1.000 0.776 CB 1.849 74 residues pruned to eliminate duplicates Z: 31 48.917 2.124 0.860 0.853 0.967 0.600 CB 1.728 31 residues pruned to eliminate duplicates Z: 37 40.700 2.111 0.847 0.677 0.972 0.722 CB 1.520 37 residues pruned to eliminate duplicates Z: 6 3.420 1.378 0.457 0.300 1.000 0.600 CA 0.952 5 residues pruned to eliminate duplicates Z: 40 61.853 2.331 0.827 0.838 0.949 0.744 CB 1.833 40 residues pruned to eliminate duplicates Z: 29 34.433 2.262 0.899 0.479 0.964 0.643 CB 1.606 29 residues pruned to eliminate duplicates Z: 42 27.484 1.873 0.763 0.539 0.951 0.659 CB 1.315 43 residues pruned to eliminate duplicates Z: 11 3.070 1.450 0.627 0.362 0.700 0.600 CB 0.682 11 residues pruned to eliminate duplicates Z: 53 48.123 2.189 0.770 0.631 0.942 0.712 CB 1.616 53 residues pruned to eliminate duplicates Z: 61 47.088 2.180 0.828 0.505 0.933 0.667 CB 1.626 61 residues pruned to eliminate duplicates Z: 36 51.094 2.261 1.067 0.699 0.914 0.686 CB 1.686 36 residues pruned to eliminate duplicates Z: 15 11.162 1.722 0.430 0.637 0.929 0.643 CA 1.148 15 residues pruned to eliminate duplicates Z: 38 48.499 2.362 0.255 0.889 1.000 0.865 CB 1.936 38 residues pruned to eliminate duplicates Z: 11 7.835 1.865 0.349 0.353 0.800 0.600 CB 1.442 11 residues pruned to eliminate duplicates Z: 11 16.840 1.736 0.610 0.840 1.000 0.800 N 1.422 11 residues pruned to eliminate duplicates Z: 94 77.765 2.333 0.625 0.778 0.935 0.806 CB 1.780 94 residues pruned to eliminate duplicates Z: 12 24.175 2.389 0.731 0.629 0.909 0.727 CB 1.717 12 residues pruned to eliminate duplicates Z: 19 29.112 2.063 1.026 0.733 0.944 0.778 CB 1.409 19 residues pruned to eliminate duplicates Z: 38 41.270 2.261 0.628 0.527 0.973 0.703 CB 1.845 47 residues pruned to eliminate duplicates Z: 13 13.738 1.692 0.578 0.907 1.000 1.000 CB 1.056 13 residues pruned to eliminate duplicates Z: 6 15.737 2.181 0.802 0.797 0.800 0.800 CB 1.725 6 residues pruned to eliminate duplicates Z: 14 11.734 1.467 0.467 0.899 1.000 0.769 CB 1.081 14 residues pruned to eliminate duplicates Z: 24 41.928 2.173 0.731 0.873 0.957 0.783 C 1.770 23 residues pruned to eliminate duplicates Z: 12 10.470 1.616 0.387 0.915 0.909 0.636 CB 1.095 12 residues pruned to eliminate duplicates Z: 8 5.625 1.851 0.174 0.279 0.857 0.714 CB 1.465 8 residues pruned to eliminate duplicates Z: 10 13.543 1.569 1.117 0.738 0.889 0.778 C 1.236 10 residues pruned to eliminate duplicates Z: 40 45.574 2.326 0.247 0.898 0.974 0.897 CB 1.847 40 residues pruned to eliminate duplicates Z: 26 49.721 2.325 0.785 0.785 1.000 0.760 CB 1.864 26 residues pruned to eliminate duplicates Z: 17 27.221 2.215 0.801 0.506 0.938 0.688 CA 1.808 17 residues pruned to eliminate duplicates Z: 82 73.358 2.301 0.851 0.625 0.926 0.704 CB 1.838 82 residues pruned to eliminate duplicates Z: 61 49.271 2.243 0.624 0.583 0.933 0.667 CB 1.726 61 residues pruned to eliminate duplicates Z: 6 5.423 1.572 0.182 0.534 1.000 0.800 CA 1.263 6 residues pruned to eliminate duplicates Z: 12 10.809 1.636 0.327 0.892 1.000 0.545 CB 1.079 12 residues pruned to eliminate duplicates Z: 63 51.364 2.172 0.965 0.505 0.935 0.645 CB 1.626 63 residues pruned to eliminate duplicates Z: 7 5.895 1.900 0.233 0.378 0.667 0.500 CA 1.755 7 residues pruned to eliminate duplicates Z: 74 85.850 2.313 0.986 0.771 0.945 0.685 CB 1.821 74 residues pruned to eliminate duplicates Z: 27 27.974 2.159 0.600 0.593 0.962 0.846 CB 1.511 27 residues pruned to eliminate duplicates Z: 20 52.070 2.255 1.115 0.903 0.947 0.789 CA 1.885 20 residues pruned to eliminate duplicates Z: 12 13.030 1.635 0.680 0.880 1.000 0.818 CB 1.037 12 residues pruned to eliminate duplicates Z: 13 13.674 2.034 0.210 0.559 0.917 0.750 CA 1.652 13 residues pruned to eliminate duplicates Z: 25 38.516 2.181 0.698 0.858 0.917 0.833 CA 1.706 25 residues pruned to eliminate duplicates 6 0.821 1.079 0.024 0.545 0.800 0.400 CB 0.398 ? Z: 77 92.015 2.447 0.898 0.764 0.961 0.750 CB 1.872 77 residues pruned to eliminate duplicates Z: 12 11.679 1.519 0.690 0.859 1.000 0.636 CB 1.009 11 residues pruned to eliminate duplicates Z: 29 31.691 2.191 0.722 0.679 0.893 0.679 CB 1.509 29 residues pruned to eliminate duplicates Z: 25 46.454 2.392 0.643 0.865 0.917 0.667 CB 1.928 25 residues pruned to eliminate duplicates Z: 106 93.540 2.311 0.877 0.741 0.943 0.676 CB 1.799 106 residues pruned to eliminate duplicates Z: 23 23.173 1.783 0.788 0.796 0.864 0.545 CB 1.385 23 residues pruned to eliminate duplicates Z: 10 20.343 2.272 1.083 0.525 0.889 0.667 CB 1.573 10 residues pruned to eliminate duplicates Z: 13 7.582 1.564 0.374 0.401 0.917 0.667 CA 1.234 9 residues pruned to eliminate duplicates Z: 15 32.584 2.402 0.748 0.752 0.929 0.929 CB 1.785 15 residues pruned to eliminate duplicates Z: 50 43.449 2.214 0.629 0.618 0.898 0.571 CB 1.714 50 residues pruned to eliminate duplicates Z: 8 3.166 1.687 0.058 0.357 0.571 0.571 N 1.370 8 residues pruned to eliminate duplicates Z: 8 19.384 1.994 0.974 0.723 1.000 0.714 CB 1.522 8 residues pruned to eliminate duplicates Z: 9 17.287 2.160 0.445 0.921 1.000 0.875 CB 1.378 9 residues pruned to eliminate duplicates Z: 15 35.229 2.206 0.938 0.919 1.000 0.571 CB 1.552 15 residues pruned to eliminate duplicates Z: 73 66.538 2.363 0.507 0.751 0.931 0.778 CB 1.891 73 residues pruned to eliminate duplicates Z: 25 29.400 1.875 0.725 0.814 0.958 0.625 CB 1.473 25 residues pruned to eliminate duplicates Z: 12 12.106 1.614 0.501 0.894 1.000 0.636 CB 1.081 12 residues pruned to eliminate duplicates Z: 47 43.424 2.339 0.551 0.647 0.891 0.717 CB 1.725 47 residues pruned to eliminate duplicates Z: 34 34.005 2.016 0.652 0.639 0.970 0.667 C 1.610 34 residues pruned to eliminate duplicates Z: 9 12.319 1.983 0.399 0.588 1.000 0.625 CB 1.443 9 residues pruned to eliminate duplicates Z: 9 7.355 1.890 0.402 0.278 0.875 0.500 CB 1.442 9 residues pruned to eliminate duplicates Z: 39 70.015 2.373 0.824 0.891 1.000 0.711 CB 1.887 39 residues pruned to eliminate duplicates Z: 83 76.313 2.419 0.505 0.760 0.976 0.744 CB 1.883 83 residues pruned to eliminate duplicates Z: 21 32.265 2.222 0.565 0.693 0.950 0.700 CA 1.831 21 residues pruned to eliminate duplicates Z: 10 19.546 1.949 0.994 0.784 0.889 0.667 CB 1.469 10 residues pruned to eliminate duplicates Z: 19 33.159 2.218 0.828 0.645 0.944 0.500 CA 1.781 19 residues pruned to eliminate duplicates Z: 37 39.337 2.023 0.929 0.617 0.944 0.583 CB 1.594 37 residues pruned to eliminate duplicates Z: 10 16.789 1.806 1.024 0.677 1.000 0.778 CB 1.300 10 residues pruned to eliminate duplicates Z: 16 28.343 2.112 0.768 0.900 0.867 0.533 CB 1.616 16 residues pruned to eliminate duplicates Z: 66 72.282 2.296 0.820 0.762 0.985 0.708 CB 1.728 66 residues pruned to eliminate duplicates Z: 16 28.793 2.142 0.708 0.646 1.000 0.600 CA 1.773 16 residues pruned to eliminate duplicates Z: 24 22.314 1.787 1.031 0.671 0.957 0.652 CB 1.144 24 residues pruned to eliminate duplicates Z: 12 16.367 1.867 0.300 0.903 1.000 0.818 CB 1.449 12 residues pruned to eliminate duplicates Z: 6 9.703 1.849 0.176 0.844 1.000 0.800 C 1.485 6 residues pruned to eliminate duplicates Z: 10 16.931 1.893 1.045 0.662 1.000 0.889 CB 1.255 10 residues pruned to eliminate duplicates Z: 24 44.742 2.304 0.752 0.941 1.000 0.913 CB 1.604 24 residues pruned to eliminate duplicates Z: 6 3.153 1.383 0.480 0.321 0.800 0.200 CA 1.049 Z: 20 14.730 2.022 0.607 0.521 0.842 0.684 CB 1.210 20 residues pruned to eliminate duplicates Z: 35 37.606 2.064 0.707 0.633 0.971 0.647 CB 1.664 35 residues pruned to eliminate duplicates Z: 7 6.490 1.934 -0.203 0.849 1.000 0.833 CB 1.274 7 residues pruned to eliminate duplicates Z: 7 7.714 1.841 0.115 0.806 1.000 0.833 CB 1.175 7 residues pruned to eliminate duplicates Z: 8 7.329 1.745 0.228 0.779 0.857 0.571 CA 1.178 8 residues pruned to eliminate duplicates Z: 28 35.218 2.046 0.709 0.736 0.963 0.778 CB 1.629 28 residues pruned to eliminate duplicates Z: 36 41.396 2.161 0.978 0.645 0.829 0.657 CB 1.725 35 residues pruned to eliminate duplicates Z: 31 42.152 2.035 0.779 0.756 1.000 0.667 CB 1.693 32 residues pruned to eliminate duplicates Z: 7 18.220 2.128 0.814 0.809 1.000 0.500 CA 1.472 7 residues pruned to eliminate duplicates Z: 21 43.233 2.216 0.717 0.886 1.000 0.650 CA 1.834 21 residues pruned to eliminate duplicates Z: 21 40.694 2.320 1.089 0.581 0.950 0.600 CB 1.829 21 residues pruned to eliminate duplicates Z: 11 17.054 1.919 0.256 0.918 1.000 0.800 CB 1.578 11 residues pruned to eliminate duplicates Z: 9 10.889 1.643 0.874 0.809 0.875 0.625 C 1.092 9 residues pruned to eliminate duplicates Z: 11 13.435 2.137 0.598 0.485 0.900 0.700 CB 1.404 11 residues pruned to eliminate duplicates Z: 24 22.909 2.053 0.620 0.485 0.913 0.739 CB 1.597 24 residues pruned to eliminate duplicates Z: 21 13.657 2.252 0.162 0.493 0.700 0.400 CB 1.677 21 residues pruned to eliminate duplicates Z: 7 2.930 1.527 0.316 0.269 0.667 0.333 C 1.161 Z: 10 12.277 1.912 0.384 0.530 1.000 0.889 CB 1.501 10 residues pruned to eliminate duplicates Z: 57 53.991 2.206 0.662 0.727 0.946 0.571 CB 1.694 57 residues pruned to eliminate duplicates Z: 48 73.451 2.339 1.055 0.795 0.957 0.830 C 1.798 48 residues pruned to eliminate duplicates Z: 14 25.555 2.150 0.790 0.670 0.923 0.615 CA 1.705 14 residues pruned to eliminate duplicates Z: 55 70.586 2.255 1.068 0.769 0.926 0.519 CB 1.753 55 residues pruned to eliminate duplicates Z: 6 9.136 1.768 0.476 0.719 1.000 1.000 CB 1.284 6 residues pruned to eliminate duplicates Z: 28 35.257 2.357 0.362 0.664 0.926 0.704 CB 1.961 28 residues pruned to eliminate duplicates Z: 123 100.445 2.372 0.871 0.673 0.959 0.738 CB 1.821 123 residues pruned to eliminate duplicates Z: 8 8.106 2.024 0.564 0.390 0.857 0.571 CA 1.269 8 residues pruned to eliminate duplicates Z: 8 10.325 1.797 0.323 0.786 1.000 0.429 CA 1.277 8 residues pruned to eliminate duplicates Z: 8 3.778 1.284 0.208 0.828 1.000 0.857 CB 0.693 2 residues pruned to eliminate duplicates Z: 21 34.164 2.280 0.400 0.903 0.950 0.800 CB 1.796 21 residues pruned to eliminate duplicates Z: 11 6.864 1.740 0.398 0.383 0.800 0.700 CB 1.264 11 residues pruned to eliminate duplicates Z: 16 35.521 2.364 0.616 0.900 1.000 0.867 CB 1.715 16 residues pruned to eliminate duplicates Z: 25 44.381 2.175 0.992 0.696 0.958 0.625 C 1.825 23 residues pruned to eliminate duplicates Z: 13 18.793 2.098 0.533 0.523 1.000 0.583 CA 1.649 13 residues pruned to eliminate duplicates Z: 31 21.687 2.012 0.893 0.482 0.833 0.667 CB 1.271 31 residues pruned to eliminate duplicates 9 1.724 1.197 0.204 0.438 0.875 0.500 CB 0.516 ? Z: 24 29.373 2.214 0.436 0.811 0.826 0.696 CA 1.778 24 residues pruned to eliminate duplicates Z: 69 96.989 2.377 1.033 0.810 0.985 0.765 CB 1.886 70 residues pruned to eliminate duplicates Z: 7 12.638 1.921 0.293 0.869 1.000 0.667 C 1.518 7 residues pruned to eliminate duplicates Z: 10 8.356 2.059 0.289 0.361 0.778 0.444 C 1.567 10 residues pruned to eliminate duplicates Z: 6 8.142 1.858 0.066 0.810 1.000 0.800 CA 1.403 6 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 7 5.034 1.753 0.095 0.366 1.000 0.167 O 1.236 Z: 6 7.364 1.723 0.312 0.681 1.000 0.800 CA 1.234 7 residues pruned to eliminate duplicates Z: 7 10.345 2.075 0.520 0.515 1.000 0.667 CA 1.320 7 residues pruned to eliminate duplicates Z: 40 45.625 2.087 0.671 0.749 0.974 0.590 CB 1.722 40 residues pruned to eliminate duplicates Z: 38 53.027 2.162 0.785 0.773 1.000 0.595 CB 1.774 39 residues pruned to eliminate duplicates Z: 21 45.241 2.133 0.961 0.899 1.000 0.750 C 1.729 21 residues pruned to eliminate duplicates Z: 40 45.445 2.086 0.742 0.724 0.949 0.590 C 1.724 40 residues pruned to eliminate duplicates Z: 37 42.576 2.086 0.789 0.686 0.944 0.528 CB 1.697 37 residues pruned to eliminate duplicates Z: 22 38.595 2.197 0.635 0.875 0.952 0.667 CB 1.790 22 residues pruned to eliminate duplicates Z: 34 50.653 2.192 0.764 0.770 1.000 0.545 C 1.797 34 residues pruned to eliminate duplicates Z: 39 49.081 2.115 0.715 0.775 1.000 0.658 CA 1.722 39 residues pruned to eliminate duplicates Z: 19 47.324 2.280 0.905 0.889 1.000 0.778 C 1.848 19 residues pruned to eliminate duplicates Z: 40 43.631 2.060 0.681 0.754 0.949 0.538 CB 1.695 40 residues pruned to eliminate duplicates Z: 39 48.114 2.099 0.771 0.750 0.974 0.421 C 1.725 39 residues pruned to eliminate duplicates Z: 20 46.059 2.236 1.019 0.898 0.947 0.737 CB 1.768 20 residues pruned to eliminate duplicates Z: 38 49.725 2.126 0.740 0.787 0.973 0.622 CB 1.766 38 residues pruned to eliminate duplicates Z: 38 49.244 2.167 0.747 0.770 0.946 0.649 CB 1.779 38 residues pruned to eliminate duplicates Z: 38 53.233 2.180 0.789 0.775 0.973 0.595 CA 1.809 38 residues pruned to eliminate duplicates Z: 39 47.112 2.121 0.746 0.769 0.947 0.553 CA 1.717 39 residues pruned to eliminate duplicates Z: 38 49.435 2.149 0.742 0.772 0.946 0.622 CA 1.805 38 residues pruned to eliminate duplicates Z: 38 52.771 2.175 0.778 0.776 0.973 0.703 CB 1.807 38 residues pruned to eliminate duplicates Z: 38 52.023 2.172 0.709 0.785 1.000 0.703 CB 1.793 38 residues pruned to eliminate duplicates Z: 39 50.702 2.135 0.734 0.763 1.000 0.632 CA 1.760 39 residues pruned to eliminate duplicates Z: 38 46.657 2.160 0.677 0.768 0.946 0.649 CA 1.765 38 residues pruned to eliminate duplicates Z: 39 47.615 2.116 0.661 0.771 1.000 0.553 CA 1.729 39 residues pruned to eliminate duplicates Z: 38 50.538 2.170 0.687 0.783 1.000 0.676 CB 1.769 38 residues pruned to eliminate duplicates Z: 39 47.438 2.113 0.727 0.749 0.974 0.553 CB 1.734 39 residues pruned to eliminate duplicates Z: 39 48.014 2.124 0.671 0.784 1.000 0.605 CA 1.709 39 residues pruned to eliminate duplicates Z: 39 44.690 2.139 0.645 0.761 0.947 0.632 CB 1.724 39 residues pruned to eliminate duplicates Z: 12 18.511 1.996 0.305 0.903 1.000 0.545 CA 1.527 12 residues pruned to eliminate duplicates Z: 37 47.448 2.175 0.641 0.786 0.972 0.694 CB 1.772 37 residues pruned to eliminate duplicates Z: 39 46.657 2.123 0.665 0.762 0.974 0.737 CB 1.742 39 residues pruned to eliminate duplicates Z: 38 50.568 2.165 0.699 0.763 1.000 0.676 CA 1.790 38 residues pruned to eliminate duplicates Z: 38 48.901 2.156 0.674 0.777 1.000 0.730 CB 1.744 38 residues pruned to eliminate duplicates Z: 12 19.691 2.041 0.285 0.870 1.000 0.818 CA 1.652 12 residues pruned to eliminate duplicates Z: 34 47.129 2.075 0.875 0.825 0.970 0.576 CB 1.640 34 residues pruned to eliminate duplicates Z: 20 54.378 2.391 1.046 0.810 1.000 0.632 CA 1.947 20 residues pruned to eliminate duplicates Z: 35 43.505 2.023 0.936 0.778 0.941 0.618 CB 1.584 35 residues pruned to eliminate duplicates Z: 23 53.430 2.326 1.076 0.788 0.955 0.591 C 1.920 23 residues pruned to eliminate duplicates Z: 19 51.095 2.358 0.892 0.905 1.000 0.833 C 1.921 19 residues pruned to eliminate duplicates Z: 34 40.464 2.008 0.826 0.720 0.970 0.697 CB 1.624 34 residues pruned to eliminate duplicates Z: 35 47.186 2.036 0.908 0.799 1.000 0.647 CB 1.603 35 residues pruned to eliminate duplicates Z: 34 47.259 2.076 0.904 0.823 0.939 0.545 CB 1.675 34 residues pruned to eliminate duplicates Z: 23 51.559 2.239 1.122 0.777 1.000 0.682 CA 1.811 23 residues pruned to eliminate duplicates Z: 34 48.360 2.062 0.910 0.811 1.000 0.576 CB 1.631 34 residues pruned to eliminate duplicates Z: 20 55.890 2.307 1.120 0.880 1.000 0.737 CA 1.900 20 residues pruned to eliminate duplicates Z: 35 45.249 2.029 0.930 0.784 0.971 0.529 CB 1.591 35 residues pruned to eliminate duplicates Z: 33 47.105 2.108 0.881 0.828 0.969 0.594 CB 1.633 33 residues pruned to eliminate duplicates Z: 33 51.101 2.101 0.904 0.840 1.000 0.531 CB 1.686 34 residues pruned to eliminate duplicates Z: 19 53.806 2.321 1.208 0.861 0.944 0.722 CB 1.925 19 residues pruned to eliminate duplicates Z: 35 46.294 2.033 0.881 0.793 1.000 0.588 CB 1.606 35 residues pruned to eliminate duplicates Z: 34 46.767 2.066 0.929 0.796 0.970 0.636 CB 1.626 34 residues pruned to eliminate duplicates Z: 34 46.637 2.073 0.917 0.817 0.939 0.545 CB 1.650 34 residues pruned to eliminate duplicates Z: 31 46.547 2.035 1.018 0.857 0.967 0.533 CB 1.577 31 residues pruned to eliminate duplicates Z: 35 45.987 2.027 0.894 0.778 1.000 0.618 CB 1.608 35 residues pruned to eliminate duplicates Z: 34 46.566 2.065 0.855 0.808 1.000 0.667 CB 1.618 34 residues pruned to eliminate duplicates Z: 33 47.527 2.115 0.932 0.808 0.938 0.531 CB 1.676 33 residues pruned to eliminate duplicates Z: 33 45.047 2.112 0.736 0.837 0.969 0.625 CB 1.677 33 residues pruned to eliminate duplicates Z: 34 44.885 2.062 0.846 0.805 0.970 0.515 CB 1.622 34 residues pruned to eliminate duplicates Z: 34 48.210 2.065 0.904 0.811 1.000 0.545 CB 1.628 34 residues pruned to eliminate duplicates Z: 34 49.834 2.064 0.949 0.809 1.000 0.515 CB 1.648 34 residues pruned to eliminate duplicates Z: 34 48.543 2.071 0.911 0.814 1.000 0.576 CB 1.624 34 residues pruned to eliminate duplicates Z: 33 50.727 2.109 0.900 0.837 1.000 0.625 CB 1.674 33 residues pruned to eliminate duplicates Z: 33 47.276 2.097 0.833 0.829 1.000 0.562 CB 1.636 33 residues pruned to eliminate duplicates Z: 35 42.574 2.024 0.856 0.787 0.971 0.588 CB 1.556 35 residues pruned to eliminate duplicates Z: 33 50.716 2.104 0.908 0.840 1.000 0.500 CB 1.667 33 residues pruned to eliminate duplicates Z: 25 24.724 2.062 0.639 0.493 0.958 0.625 CB 1.569 25 residues pruned to eliminate duplicates Z: 6 4.048 1.493 0.858 0.494 0.800 0.600 N 0.820 6 residues pruned to eliminate duplicates Z: 25 24.752 2.103 0.742 0.440 0.958 0.625 CB 1.531 25 residues pruned to eliminate duplicates Z: 24 28.729 2.141 0.745 0.478 1.000 0.652 CB 1.640 24 residues pruned to eliminate duplicates Z: 6 8.876 2.009 0.495 0.408 1.000 0.800 CA 1.456 6 residues pruned to eliminate duplicates Z: 25 25.194 2.052 0.658 0.500 0.958 0.667 CB 1.578 25 residues pruned to eliminate duplicates Z: 24 25.125 2.116 0.594 0.475 1.000 0.696 CB 1.594 24 residues pruned to eliminate duplicates Z: 9 7.708 1.970 0.115 0.482 0.875 0.250 CB 1.443 9 residues pruned to eliminate duplicates Z: 25 21.855 2.091 0.573 0.439 0.917 0.625 CB 1.575 25 residues pruned to eliminate duplicates Z: 26 20.977 2.018 0.607 0.472 0.920 0.640 CB 1.446 26 residues pruned to eliminate duplicates Z: 19 15.635 1.992 0.465 0.385 0.889 0.500 CB 1.605 19 residues pruned to eliminate duplicates Z: 25 23.552 2.059 0.577 0.461 0.958 0.667 CB 1.608 25 residues pruned to eliminate duplicates Z: 25 24.511 2.073 0.567 0.506 0.958 0.667 CB 1.597 25 residues pruned to eliminate duplicates Z: 25 25.636 2.045 0.588 0.512 1.000 0.708 CB 1.594 25 residues pruned to eliminate duplicates Z: 25 26.263 2.070 0.702 0.511 0.958 0.667 CB 1.570 25 residues pruned to eliminate duplicates Z: 25 24.830 2.063 0.539 0.500 1.000 0.625 CB 1.596 25 residues pruned to eliminate duplicates Z: 25 25.656 2.052 0.624 0.486 1.000 0.667 CB 1.595 25 residues pruned to eliminate duplicates Z: 7 2.934 1.548 0.388 0.454 0.667 0.500 CA 0.877 7 residues pruned to eliminate duplicates Z: 26 20.734 1.980 0.481 0.454 0.960 0.760 CA 1.544 26 residues pruned to eliminate duplicates Z: 10 7.728 1.920 0.375 0.345 0.778 0.667 C 1.485 10 residues pruned to eliminate duplicates Z: 37 34.267 2.118 0.596 0.674 0.861 0.694 C 1.671 37 residues pruned to eliminate duplicates Z: 37 37.500 2.169 0.630 0.665 0.889 0.750 CA 1.707 37 residues pruned to eliminate duplicates Z: 9 7.462 1.873 0.372 0.488 0.750 0.375 CA 1.385 9 residues pruned to eliminate duplicates Z: 8 9.352 2.033 0.574 0.470 0.714 0.714 C 1.594 8 residues pruned to eliminate duplicates Z: 35 41.678 2.200 0.646 0.703 0.941 0.588 C 1.743 35 residues pruned to eliminate duplicates Z: 18 19.217 2.189 0.621 0.419 0.824 0.471 CA 1.737 18 residues pruned to eliminate duplicates Z: 9 10.651 1.948 0.571 0.425 0.875 0.750 C 1.521 9 residues pruned to eliminate duplicates Z: 32 37.218 2.146 0.730 0.746 0.839 0.548 CA 1.722 32 residues pruned to eliminate duplicates Z: 16 17.377 2.141 0.459 0.474 0.867 0.400 C 1.701 16 residues pruned to eliminate duplicates Z: 38 34.505 2.151 0.633 0.668 0.811 0.649 CB 1.705 38 residues pruned to eliminate duplicates Z: 40 34.029 2.030 0.643 0.617 0.897 0.590 CB 1.629 38 residues pruned to eliminate duplicates Z: 24 46.522 2.244 0.787 0.875 0.957 0.609 CA 1.840 24 residues pruned to eliminate duplicates Z: 38 31.074 1.998 0.778 0.580 0.838 0.459 CA 1.590 38 residues pruned to eliminate duplicates Z: 39 32.195 2.038 0.641 0.618 0.868 0.605 C 1.610 39 residues pruned to eliminate duplicates Z: 37 38.009 2.155 0.523 0.677 0.944 0.750 CA 1.737 37 residues pruned to eliminate duplicates Z: 37 40.152 2.147 0.656 0.697 0.917 0.694 CA 1.715 37 residues pruned to eliminate duplicates Z: 20 23.700 2.030 0.500 0.770 0.895 0.789 C 1.571 20 residues pruned to eliminate duplicates Z: 33 33.522 2.118 0.699 0.676 0.844 0.594 CA 1.660 33 residues pruned to eliminate duplicates Z: 34 31.604 2.055 0.670 0.651 0.848 0.545 CA 1.642 34 residues pruned to eliminate duplicates Z: 36 36.151 2.121 0.712 0.672 0.857 0.657 CA 1.676 36 residues pruned to eliminate duplicates Z: 35 40.666 2.215 0.551 0.703 0.941 0.765 CA 1.792 35 residues pruned to eliminate duplicates Z: 38 38.625 2.128 0.596 0.661 0.946 0.757 CA 1.703 38 residues pruned to eliminate duplicates Z: 30 28.510 2.233 0.398 0.610 0.897 0.552 CB 1.705 30 residues pruned to eliminate duplicates Z: 130 76.870 2.268 0.598 0.701 0.922 0.767 CB 1.685 151 residues pruned to eliminate duplicates Z: 25 45.201 2.310 0.823 0.831 0.917 0.917 CB 1.795 25 residues pruned to eliminate duplicates Z: 78 76.637 2.394 0.658 0.753 0.974 0.792 CB 1.802 78 residues pruned to eliminate duplicates Z: 27 52.747 2.251 1.164 0.789 0.923 0.808 CB 1.786 27 residues pruned to eliminate duplicates Z: 78 66.216 2.341 0.545 0.749 0.948 0.805 CB 1.762 78 residues pruned to eliminate duplicates Z: 102 74.120 2.300 0.617 0.740 0.931 0.723 CB 1.718 102 residues pruned to eliminate duplicates Z: 78 75.108 2.366 0.676 0.765 0.948 0.792 CB 1.800 78 residues pruned to eliminate duplicates Z: 75 69.119 2.349 0.507 0.771 0.973 0.811 CB 1.835 75 residues pruned to eliminate duplicates Z: 93 83.502 2.366 0.683 0.777 0.957 0.804 CB 1.790 93 residues pruned to eliminate duplicates Z: 96 78.078 2.318 0.645 0.754 0.947 0.779 CB 1.768 96 residues pruned to eliminate duplicates Z: 94 84.131 2.329 0.713 0.769 0.957 0.774 CB 1.800 94 residues pruned to eliminate duplicates Z: 97 73.584 2.321 0.608 0.755 0.917 0.771 CB 1.749 97 residues pruned to eliminate duplicates Z: 94 84.969 2.346 0.726 0.769 0.957 0.860 CB 1.793 94 residues pruned to eliminate duplicates Z: 103 67.329 2.248 0.582 0.719 0.902 0.755 CB 1.704 103 residues pruned to eliminate duplicates Z: 79 74.976 2.322 0.681 0.742 0.962 0.756 CB 1.821 79 residues pruned to eliminate duplicates Z: 100 83.247 2.340 0.696 0.761 0.970 0.818 CB 1.724 100 residues pruned to eliminate duplicates Z: 100 80.012 2.323 0.681 0.747 0.949 0.747 CB 1.740 100 residues pruned to eliminate duplicates Z: 103 73.579 2.271 0.621 0.749 0.941 0.755 CB 1.684 103 residues pruned to eliminate duplicates Z: 91 84.517 2.354 0.707 0.794 0.956 0.778 CB 1.793 91 residues pruned to eliminate duplicates Z: 76 74.229 2.329 0.675 0.771 0.933 0.747 CB 1.853 76 residues pruned to eliminate duplicates Z: 48 70.901 2.340 0.946 0.780 1.000 0.766 CB 1.775 48 residues pruned to eliminate duplicates Z: 50 75.610 2.394 0.867 0.823 0.980 0.816 CB 1.865 50 residues pruned to eliminate duplicates Z: 94 83.133 2.337 0.653 0.785 0.978 0.828 CB 1.775 94 residues pruned to eliminate duplicates Z: 71 73.074 2.310 0.695 0.777 0.957 0.729 CB 1.825 71 residues pruned to eliminate duplicates Z: 78 79.066 2.396 0.666 0.756 0.974 0.818 CB 1.846 78 residues pruned to eliminate duplicates Z: 93 84.213 2.348 0.719 0.780 0.978 0.783 CB 1.736 93 residues pruned to eliminate duplicates Z: 28 49.920 2.409 0.562 0.849 1.000 0.926 CB 1.892 28 residues pruned to eliminate duplicates Z: 99 75.972 2.268 0.666 0.764 0.949 0.745 CB 1.694 99 residues pruned to eliminate duplicates Z: 68 60.172 2.302 0.513 0.749 0.985 0.836 CB 1.715 68 residues pruned to eliminate duplicates Z: 66 58.838 2.302 0.447 0.742 0.985 0.754 CB 1.792 66 residues pruned to eliminate duplicates Z: 94 89.464 2.352 0.770 0.778 0.978 0.839 CB 1.783 94 residues pruned to eliminate duplicates Z: 66 56.677 2.299 0.474 0.751 0.985 0.846 CB 1.685 66 residues pruned to eliminate duplicates Z: 69 61.531 2.329 0.517 0.758 0.971 0.779 CB 1.730 69 residues pruned to eliminate duplicates Z: 94 80.791 2.338 0.704 0.781 0.935 0.774 CB 1.754 94 residues pruned to eliminate duplicates Z: 72 60.693 2.263 0.591 0.740 0.958 0.775 CB 1.686 72 residues pruned to eliminate duplicates Z: 66 77.139 2.327 0.898 0.774 0.954 0.708 CB 1.783 66 residues pruned to eliminate duplicates Z: 72 61.047 2.259 0.622 0.753 0.930 0.746 CB 1.698 72 residues pruned to eliminate duplicates Z: 95 86.441 2.313 0.807 0.766 0.936 0.702 CB 1.800 95 residues pruned to eliminate duplicates Z: 95 85.953 2.320 0.807 0.731 0.936 0.691 CB 1.835 95 residues pruned to eliminate duplicates Z: 78 64.305 2.283 0.602 0.740 0.961 0.701 CB 1.682 78 residues pruned to eliminate duplicates Z: 69 86.499 2.346 0.893 0.790 0.985 0.750 CB 1.858 69 residues pruned to eliminate duplicates Z: 96 83.514 2.295 0.771 0.761 0.958 0.726 CB 1.745 96 residues pruned to eliminate duplicates Z: 45 59.961 2.286 0.637 0.803 1.000 0.841 CB 1.853 45 residues pruned to eliminate duplicates Z: 76 92.153 2.384 0.888 0.787 0.973 0.747 CB 1.888 76 residues pruned to eliminate duplicates Z: 52 59.602 2.288 0.622 0.748 0.961 0.745 CA 1.876 52 residues pruned to eliminate duplicates Z: 77 65.974 2.286 0.646 0.739 0.947 0.776 CB 1.713 77 residues pruned to eliminate duplicates Z: 57 75.319 2.324 0.962 0.778 0.946 0.732 CB 1.825 57 residues pruned to eliminate duplicates Z: 70 72.273 2.309 0.732 0.757 0.971 0.812 CB 1.784 70 residues pruned to eliminate duplicates Z: 67 87.803 2.358 0.961 0.804 0.955 0.818 CB 1.879 67 residues pruned to eliminate duplicates Z: 68 89.779 2.364 1.025 0.804 0.925 0.687 CB 1.898 68 residues pruned to eliminate duplicates Z: 106 89.357 2.315 0.801 0.710 0.943 0.724 CB 1.834 106 residues pruned to eliminate duplicates Z: 93 91.978 2.322 0.908 0.798 0.924 0.728 CB 1.805 93 residues pruned to eliminate duplicates Z: 94 96.223 2.325 0.941 0.775 0.968 0.763 CB 1.793 94 residues pruned to eliminate duplicates Z: 78 70.522 2.263 0.828 0.733 0.922 0.766 CB 1.709 78 residues pruned to eliminate duplicates Z: 80 88.792 2.356 0.974 0.748 0.949 0.785 CB 1.812 80 residues pruned to eliminate duplicates Z: 51 74.796 2.369 0.892 0.758 0.980 0.740 CA 1.915 51 residues pruned to eliminate duplicates Z: 77 93.569 2.332 1.005 0.767 0.974 0.724 CB 1.860 77 residues pruned to eliminate duplicates Z: 51 68.657 2.371 0.755 0.766 0.980 0.760 CB 1.881 51 residues pruned to eliminate duplicates Z: 75 65.733 2.312 0.652 0.721 0.946 0.730 CB 1.733 75 residues pruned to eliminate duplicates Z: 79 90.103 2.375 1.013 0.740 0.949 0.718 CB 1.814 79 residues pruned to eliminate duplicates Z: 97 88.964 2.286 0.849 0.759 0.969 0.698 CB 1.761 97 residues pruned to eliminate duplicates Z: 51 72.901 2.342 0.822 0.766 1.000 0.740 CB 1.909 51 residues pruned to eliminate duplicates Z: 81 87.992 2.343 0.909 0.739 0.963 0.688 CB 1.844 81 residues pruned to eliminate duplicates Z: 93 94.368 2.350 0.916 0.780 0.967 0.826 CB 1.765 93 residues pruned to eliminate duplicates Z: 53 69.402 2.333 0.866 0.749 0.981 0.731 CB 1.805 53 residues pruned to eliminate duplicates Z: 70 72.298 2.313 0.784 0.754 0.957 0.710 CB 1.759 70 residues pruned to eliminate duplicates Z: 55 64.825 2.332 0.824 0.711 0.944 0.704 CB 1.813 55 residues pruned to eliminate duplicates Z: 119 93.997 2.309 0.830 0.729 0.949 0.644 CB 1.756 119 residues pruned to eliminate duplicates Z: 77 89.667 2.378 0.970 0.755 0.947 0.750 CB 1.846 77 residues pruned to eliminate duplicates Z: 72 71.045 2.303 0.727 0.732 0.972 0.662 CB 1.769 72 residues pruned to eliminate duplicates Z: 94 86.434 2.308 0.835 0.782 0.935 0.710 CB 1.765 94 residues pruned to eliminate duplicates Z: 79 89.564 2.381 0.979 0.736 0.949 0.718 CB 1.836 79 residues pruned to eliminate duplicates Z: 78 89.645 2.380 0.883 0.759 0.987 0.688 CB 1.834 78 residues pruned to eliminate duplicates Z: 68 70.322 2.352 0.652 0.768 0.970 0.746 CB 1.797 68 residues pruned to eliminate duplicates Z: 171 101.525 2.263 0.856 0.641 0.941 0.676 CB 1.727 326 residues pruned to eliminate duplicates Z: 11 10.715 1.779 0.459 0.674 0.900 0.500 C 1.235 11 residues pruned to eliminate duplicates Z: 23 17.640 2.097 0.704 0.427 0.818 0.500 CB 1.387 23 residues pruned to eliminate duplicates Z: 141 85.560 2.304 0.675 0.612 0.950 0.686 CB 1.774 141 residues pruned to eliminate duplicates Z: 64 46.786 2.156 0.868 0.496 0.921 0.587 CB 1.595 64 residues pruned to eliminate duplicates Z: 15 18.820 2.063 0.520 0.563 1.000 0.786 CB 1.509 15 residues pruned to eliminate duplicates Z: 62 51.527 2.219 0.820 0.527 0.934 0.557 CB 1.702 62 residues pruned to eliminate duplicates Z: 69 46.301 2.182 0.727 0.510 0.912 0.618 CB 1.618 69 residues pruned to eliminate duplicates Z: 62 42.318 2.214 0.676 0.469 0.885 0.656 CB 1.702 62 residues pruned to eliminate duplicates Z: 62 52.168 2.206 0.882 0.530 0.951 0.656 CB 1.643 62 residues pruned to eliminate duplicates Z: 176 98.634 2.352 0.650 0.638 0.960 0.731 CB 1.758 176 residues pruned to eliminate duplicates Z: 64 47.040 2.194 0.817 0.500 0.921 0.619 CB 1.616 64 residues pruned to eliminate duplicates Z: 176 98.149 2.335 0.703 0.638 0.937 0.714 CB 1.750 176 residues pruned to eliminate duplicates Z: 61 55.730 2.247 0.965 0.511 0.950 0.700 CB 1.696 61 residues pruned to eliminate duplicates Z: 93 60.077 2.292 0.707 0.554 0.913 0.652 CB 1.664 93 residues pruned to eliminate duplicates Z: 56 53.337 2.243 0.947 0.516 1.000 0.636 CB 1.621 56 residues pruned to eliminate duplicates Z: 60 55.172 2.259 0.891 0.523 0.983 0.695 CB 1.672 60 residues pruned to eliminate duplicates Z: 60 57.169 2.258 0.956 0.518 0.966 0.644 CB 1.714 60 residues pruned to eliminate duplicates Z: 64 52.743 2.198 0.890 0.507 0.968 0.651 CB 1.640 64 residues pruned to eliminate duplicates Z: 70 47.545 2.203 0.820 0.444 0.942 0.594 CB 1.605 70 residues pruned to eliminate duplicates Z: 61 49.112 2.167 0.886 0.506 0.950 0.667 CB 1.623 61 residues pruned to eliminate duplicates Z: 61 52.558 2.254 0.833 0.518 0.967 0.583 CB 1.670 61 residues pruned to eliminate duplicates Z: 65 47.244 2.193 0.720 0.495 0.969 0.547 CB 1.625 65 residues pruned to eliminate duplicates Z: 61 55.972 2.250 0.910 0.517 0.983 0.667 CB 1.682 61 residues pruned to eliminate duplicates Z: 65 46.593 2.185 0.807 0.508 0.906 0.547 CB 1.615 65 residues pruned to eliminate duplicates Z: 58 50.663 2.210 0.930 0.477 0.930 0.596 CB 1.731 58 residues pruned to eliminate duplicates Z: 31 39.768 2.167 1.161 0.570 0.933 0.600 CB 1.553 31 residues pruned to eliminate duplicates Z: 62 54.854 2.243 0.904 0.508 0.967 0.607 CB 1.686 62 residues pruned to eliminate duplicates Z: 72 48.707 2.184 0.862 0.472 0.915 0.592 CB 1.598 72 residues pruned to eliminate duplicates Z: 66 48.131 2.165 0.853 0.464 0.938 0.662 CB 1.646 66 residues pruned to eliminate duplicates Z: 62 48.692 2.215 0.836 0.473 0.934 0.656 CB 1.686 62 residues pruned to eliminate duplicates Z: 62 54.923 2.231 0.947 0.498 0.967 0.590 CB 1.676 62 residues pruned to eliminate duplicates Z: 53 53.443 2.265 0.921 0.521 0.962 0.635 CB 1.734 53 residues pruned to eliminate duplicates Z: 96 58.149 2.258 0.690 0.554 0.895 0.621 CB 1.658 96 residues pruned to eliminate duplicates Z: 63 48.580 2.204 0.815 0.504 0.952 0.629 CB 1.614 63 residues pruned to eliminate duplicates Z: 29 30.738 2.190 0.780 0.426 0.929 0.643 CB 1.732 29 residues pruned to eliminate duplicates Z: 28 29.213 2.197 0.690 0.432 0.926 0.593 CB 1.756 28 residues pruned to eliminate duplicates Z: 29 26.246 2.132 0.690 0.425 0.929 0.571 CB 1.603 29 residues pruned to eliminate duplicates Z: 29 25.264 2.106 0.615 0.413 0.893 0.607 CA 1.722 29 residues pruned to eliminate duplicates Z: 49 45.452 2.211 0.908 0.564 0.958 0.604 CB 1.524 49 residues pruned to eliminate duplicates Z: 29 31.876 2.153 0.790 0.440 0.929 0.714 CB 1.791 29 residues pruned to eliminate duplicates Z: 63 52.285 2.202 0.898 0.502 0.968 0.613 CB 1.639 63 residues pruned to eliminate duplicates Z: 39 27.717 2.125 0.641 0.385 0.895 0.553 CB 1.628 39 residues pruned to eliminate duplicates Z: 54 53.526 2.256 0.949 0.510 0.962 0.660 CB 1.721 54 residues pruned to eliminate duplicates Z: 130 79.930 2.349 0.536 0.662 0.922 0.752 CB 1.819 130 residues pruned to eliminate duplicates Z: 111 80.755 2.348 0.639 0.645 0.936 0.755 CB 1.867 111 residues pruned to eliminate duplicates Z: 63 51.647 2.210 0.918 0.499 0.952 0.661 CB 1.627 63 residues pruned to eliminate duplicates Z: 29 26.980 2.120 0.574 0.425 0.964 0.643 CB 1.712 29 residues pruned to eliminate duplicates Z: 55 55.859 2.215 1.030 0.534 0.963 0.685 CB 1.697 55 residues pruned to eliminate duplicates Z: 177 96.887 2.343 0.617 0.635 0.955 0.705 CB 1.780 177 residues pruned to eliminate duplicates Z: 28 30.622 2.200 0.690 0.414 0.963 0.630 CB 1.802 28 residues pruned to eliminate duplicates Z: 29 29.269 2.145 0.736 0.444 0.893 0.643 CA 1.763 29 residues pruned to eliminate duplicates Z: 37 28.344 2.126 0.707 0.374 0.861 0.639 CB 1.730 37 residues pruned to eliminate duplicates Z: 138 89.064 2.340 0.691 0.624 0.934 0.759 CB 1.831 138 residues pruned to eliminate duplicates Z: 28 28.328 2.143 0.665 0.451 0.926 0.630 CB 1.734 28 residues pruned to eliminate duplicates Z: 28 31.341 2.184 0.774 0.454 0.963 0.630 CB 1.695 28 residues pruned to eliminate duplicates Z: 28 29.392 2.143 0.751 0.435 0.926 0.630 CB 1.741 28 residues pruned to eliminate duplicates Z: 135 86.465 2.373 0.588 0.656 0.940 0.769 CB 1.822 135 residues pruned to eliminate duplicates Z: 37 25.175 2.175 0.575 0.369 0.833 0.667 CB 1.690 37 residues pruned to eliminate duplicates Z: 134 82.200 2.318 0.639 0.644 0.932 0.752 CB 1.758 134 residues pruned to eliminate duplicates Z: 175 90.639 2.321 0.610 0.626 0.925 0.724 CB 1.766 175 residues pruned to eliminate duplicates Z: 69 49.827 2.158 0.908 0.450 0.926 0.632 CB 1.668 69 residues pruned to eliminate duplicates Z: 72 47.856 2.198 0.775 0.463 0.915 0.634 CB 1.650 72 residues pruned to eliminate duplicates Z: 165 92.892 2.316 0.640 0.628 0.951 0.726 CB 1.780 165 residues pruned to eliminate duplicates Z: 171 93.557 2.351 0.628 0.648 0.941 0.729 CB 1.735 171 residues pruned to eliminate duplicates Z: 111 73.253 2.366 0.529 0.641 0.936 0.764 CB 1.807 111 residues pruned to eliminate duplicates Z: 115 86.752 2.425 0.568 0.717 0.939 0.772 CB 1.870 115 residues pruned to eliminate duplicates Z: 167 101.788 2.371 0.712 0.651 0.946 0.759 CB 1.788 167 residues pruned to eliminate duplicates Z: 115 86.478 2.438 0.605 0.720 0.921 0.789 CB 1.842 115 residues pruned to eliminate duplicates Z: 107 84.324 2.445 0.520 0.727 0.962 0.774 CB 1.866 107 residues pruned to eliminate duplicates Z: 77 73.127 2.473 0.465 0.763 0.974 0.855 CB 1.883 77 residues pruned to eliminate duplicates Z: 108 88.331 2.448 0.565 0.749 0.963 0.757 CB 1.853 108 residues pruned to eliminate duplicates Z: 93 88.410 2.478 0.596 0.772 0.967 0.880 CB 1.894 93 residues pruned to eliminate duplicates Z: 144 89.481 2.369 0.595 0.657 0.937 0.748 CB 1.826 144 residues pruned to eliminate duplicates Z: 85 69.522 2.424 0.516 0.691 0.940 0.798 CB 1.843 85 residues pruned to eliminate duplicates Z: 78 76.946 2.473 0.521 0.778 0.974 0.831 CB 1.873 78 residues pruned to eliminate duplicates Z: 142 96.561 2.381 0.665 0.676 0.957 0.759 CB 1.823 142 residues pruned to eliminate duplicates Z: 109 90.360 2.434 0.653 0.746 0.944 0.741 CB 1.836 109 residues pruned to eliminate duplicates Z: 62 63.692 2.382 0.522 0.795 0.951 0.869 CB 1.826 62 residues pruned to eliminate duplicates Z: 98 86.086 2.456 0.542 0.758 0.959 0.866 CB 1.912 98 residues pruned to eliminate duplicates Z: 64 69.947 2.433 0.495 0.837 0.952 0.889 CB 1.902 64 residues pruned to eliminate duplicates Z: 77 81.957 2.475 0.613 0.764 0.974 0.868 CB 1.913 77 residues pruned to eliminate duplicates Z: 109 84.679 2.428 0.605 0.754 0.926 0.769 CB 1.800 109 residues pruned to eliminate duplicates Z: 110 83.255 2.423 0.586 0.723 0.936 0.752 CB 1.812 110 residues pruned to eliminate duplicates Z: 100 89.679 2.464 0.646 0.760 0.949 0.818 CB 1.857 100 residues pruned to eliminate duplicates Z: 109 90.055 2.444 0.673 0.739 0.935 0.778 CB 1.829 109 residues pruned to eliminate duplicates Z: 24 58.891 2.556 0.927 0.838 1.000 0.913 CB 1.863 24 residues pruned to eliminate duplicates Z: 118 85.081 2.374 0.593 0.709 0.966 0.709 CB 1.781 118 residues pruned to eliminate duplicates Z: 77 78.046 2.434 0.634 0.754 0.961 0.855 CB 1.868 77 residues pruned to eliminate duplicates Z: 116 84.279 2.397 0.587 0.708 0.930 0.757 CB 1.838 116 residues pruned to eliminate duplicates Z: 79 81.386 2.441 0.724 0.760 0.936 0.846 CB 1.857 79 residues pruned to eliminate duplicates Z: 114 90.122 2.425 0.619 0.730 0.938 0.770 CB 1.870 114 residues pruned to eliminate duplicates Z: 110 88.878 2.422 0.645 0.740 0.936 0.734 CB 1.841 110 residues pruned to eliminate duplicates Z: 70 69.537 2.428 0.486 0.760 0.957 0.797 CB 1.925 70 residues pruned to eliminate duplicates Z: 132 93.346 2.339 0.744 0.661 0.962 0.733 CB 1.790 132 residues pruned to eliminate duplicates Z: 111 83.936 2.416 0.610 0.710 0.927 0.755 CB 1.834 111 residues pruned to eliminate duplicates Z: 110 92.256 2.448 0.659 0.746 0.936 0.761 CB 1.866 110 residues pruned to eliminate duplicates Z: 63 77.271 2.396 0.783 0.809 0.952 0.790 CB 1.844 63 residues pruned to eliminate duplicates Z: 55 60.792 2.393 0.510 0.735 0.963 0.815 CB 1.925 55 residues pruned to eliminate duplicates Z: 101 89.054 2.462 0.632 0.754 0.950 0.790 CB 1.861 101 residues pruned to eliminate duplicates Z: 103 88.418 2.401 0.652 0.725 0.971 0.824 CB 1.855 103 residues pruned to eliminate duplicates Z: 75 84.628 2.438 0.706 0.791 0.959 0.851 CB 1.910 75 residues pruned to eliminate duplicates Z: 42 61.956 2.383 0.564 0.845 1.000 0.854 C 1.931 42 residues pruned to eliminate duplicates Z: 92 87.390 2.427 0.715 0.789 0.956 0.813 CB 1.787 92 residues pruned to eliminate duplicates Z: 93 98.962 2.456 0.774 0.789 0.957 0.783 CB 1.920 93 residues pruned to eliminate duplicates Z: 78 89.590 2.460 0.785 0.765 0.974 0.805 CB 1.888 78 residues pruned to eliminate duplicates Z: 107 94.650 2.396 0.865 0.716 0.925 0.651 CB 1.830 107 residues pruned to eliminate duplicates Z: 108 103.564 2.449 0.835 0.750 0.953 0.720 CB 1.870 108 residues pruned to eliminate duplicates Z: 145 94.163 2.322 0.744 0.652 0.938 0.722 CB 1.794 145 residues pruned to eliminate duplicates Z: 42 68.693 2.365 0.765 0.834 1.000 0.610 C 1.927 42 residues pruned to eliminate duplicates Z: 78 87.827 2.445 0.835 0.768 0.948 0.805 CB 1.855 78 residues pruned to eliminate duplicates Z: 78 86.803 2.453 0.775 0.760 0.961 0.805 CB 1.876 78 residues pruned to eliminate duplicates Z: 58 67.951 2.365 0.761 0.743 0.930 0.702 CB 1.870 58 residues pruned to eliminate duplicates Z: 55 69.811 2.381 0.795 0.732 0.944 0.630 CB 1.909 55 residues pruned to eliminate duplicates Z: 65 88.228 2.374 1.013 0.813 0.938 0.688 C 1.875 65 residues pruned to eliminate duplicates Z: 64 83.779 2.390 0.908 0.808 0.952 0.714 C 1.857 64 residues pruned to eliminate duplicates Z: 154 102.143 2.367 0.751 0.647 0.948 0.660 CB 1.833 154 residues pruned to eliminate duplicates Z: 215 116.676 2.302 0.854 0.663 0.944 0.673 CB 1.702 215 residues pruned to eliminate duplicates Z: 100 97.672 2.446 0.806 0.756 0.939 0.717 CB 1.884 100 residues pruned to eliminate duplicates Z: 74 93.707 2.461 0.940 0.782 0.959 0.699 CB 1.869 74 residues pruned to eliminate duplicates Z: 79 90.381 2.449 0.856 0.763 0.949 0.744 CB 1.879 79 residues pruned to eliminate duplicates Z: 86 84.298 2.373 0.782 0.735 0.953 0.659 CB 1.837 86 residues pruned to eliminate duplicates Z: 80 89.647 2.427 0.868 0.756 0.949 0.747 CB 1.865 80 residues pruned to eliminate duplicates Z: 77 93.306 2.478 0.876 0.757 0.961 0.737 CB 1.907 77 residues pruned to eliminate duplicates Z: 109 104.814 2.432 0.900 0.745 0.954 0.685 CB 1.838 109 residues pruned to eliminate duplicates Z: 86 89.793 2.403 0.791 0.749 0.953 0.671 CB 1.902 86 residues pruned to eliminate duplicates Z: 113 93.414 2.371 0.856 0.648 0.946 0.688 CB 1.846 113 residues pruned to eliminate duplicates Z: 90 108.803 2.449 0.951 0.802 0.978 0.764 CB 1.896 90 residues pruned to eliminate duplicates Z: 185 110.688 2.334 0.812 0.639 0.935 0.663 CB 1.813 185 residues pruned to eliminate duplicates Z: 109 103.774 2.438 0.838 0.758 0.954 0.704 CB 1.857 109 residues pruned to eliminate duplicates Z: 79 96.908 2.460 0.925 0.764 0.962 0.795 CB 1.907 79 residues pruned to eliminate duplicates Z: 84 94.018 2.428 0.937 0.728 0.964 0.747 CB 1.854 84 residues pruned to eliminate duplicates Z: 99 107.223 2.471 0.877 0.776 0.959 0.745 CB 1.909 99 residues pruned to eliminate duplicates Z: 120 104.482 2.422 0.861 0.707 0.941 0.681 CB 1.870 120 residues pruned to eliminate duplicates Z: 78 92.583 2.443 0.933 0.758 0.961 0.805 CB 1.848 78 residues pruned to eliminate duplicates Z: 146 101.627 2.333 0.886 0.638 0.945 0.690 CB 1.783 146 residues pruned to eliminate duplicates Z: 78 93.620 2.431 0.890 0.776 0.974 0.753 CB 1.868 78 residues pruned to eliminate duplicates Z: 75 81.834 2.372 0.806 0.731 0.932 0.703 CB 1.934 75 residues pruned to eliminate duplicates Z: 99 102.744 2.404 0.929 0.741 0.959 0.684 CB 1.881 99 residues pruned to eliminate duplicates Z: 80 99.651 2.468 0.949 0.771 0.975 0.722 CB 1.881 80 residues pruned to eliminate duplicates Z: 27 44.437 2.477 0.685 0.707 0.923 0.731 CB 1.873 27 residues pruned to eliminate duplicates Z: 108 107.381 2.467 0.839 0.767 0.953 0.748 CB 1.894 108 residues pruned to eliminate duplicates Z: 160 108.072 2.337 0.882 0.652 0.937 0.717 CB 1.805 160 residues pruned to eliminate duplicates Z: 186 117.014 2.356 0.811 0.654 0.946 0.659 CB 1.847 186 residues pruned to eliminate duplicates Z: 117 93.645 2.382 0.831 0.712 0.914 0.664 CB 1.800 117 residues pruned to eliminate duplicates Z: 134 102.069 2.373 0.849 0.672 0.940 0.722 CB 1.831 134 residues pruned to eliminate duplicates Z: 104 101.151 2.451 0.836 0.759 0.932 0.767 CB 1.887 104 residues pruned to eliminate duplicates Z: 118 94.321 2.380 0.856 0.679 0.923 0.701 CB 1.813 118 residues pruned to eliminate duplicates Z: 94 106.274 2.465 0.935 0.773 0.957 0.774 CB 1.896 94 residues pruned to eliminate duplicates Z: 93 110.206 2.466 0.962 0.786 0.978 0.793 CB 1.888 93 residues pruned to eliminate duplicates Z: 84 95.829 2.425 0.825 0.754 0.976 0.699 CB 1.942 84 residues pruned to eliminate duplicates Z: 92 111.872 2.478 0.935 0.794 0.978 0.747 CB 1.932 92 residues pruned to eliminate duplicates Z: 107 109.683 2.453 0.870 0.758 0.972 0.783 CB 1.899 107 residues pruned to eliminate duplicates Z: 110 90.756 2.349 0.834 0.699 0.927 0.688 CB 1.816 110 residues pruned to eliminate duplicates Z: 108 110.127 2.452 0.942 0.761 0.953 0.692 CB 1.860 108 residues pruned to eliminate duplicates Z: 111 104.426 2.414 0.909 0.724 0.955 0.691 CB 1.850 111 residues pruned to eliminate duplicates Z: 85 97.742 2.414 0.893 0.746 0.976 0.679 CB 1.920 85 residues pruned to eliminate duplicates Z: 109 111.966 2.433 0.998 0.747 0.972 0.685 CB 1.829 109 residues pruned to eliminate duplicates Z: 109 104.314 2.433 0.865 0.763 0.944 0.731 CB 1.855 109 residues pruned to eliminate duplicates Z: 150 109.929 2.381 0.827 0.707 0.933 0.698 CB 1.838 150 residues pruned to eliminate duplicates Z: 109 104.581 2.422 0.892 0.756 0.944 0.667 CB 1.851 109 residues pruned to eliminate duplicates Z: 16 20.671 2.222 0.770 0.574 0.867 0.400 CB 1.458 16 residues pruned to eliminate duplicates Z: 16 25.114 2.351 0.733 0.512 0.933 0.333 CB 1.684 16 residues pruned to eliminate duplicates Z: 109 102.790 2.435 0.838 0.748 0.954 0.731 CB 1.857 109 residues pruned to eliminate duplicates Z: 107 103.118 2.391 0.915 0.762 0.953 0.726 CB 1.819 107 residues pruned to eliminate duplicates Z: 171 114.004 2.361 0.865 0.654 0.959 0.682 CB 1.795 171 residues pruned to eliminate duplicates Z: 83 88.927 2.414 0.819 0.758 0.951 0.720 CB 1.870 83 residues pruned to eliminate duplicates Z: 19 23.341 2.190 0.662 0.507 0.944 0.333 CB 1.589 19 residues pruned to eliminate duplicates Z: 153 107.229 2.381 0.768 0.705 0.934 0.717 CB 1.835 153 residues pruned to eliminate duplicates Z: 22 16.037 2.025 0.573 0.360 0.810 0.571 CA 1.579 22 residues pruned to eliminate duplicates Z: 54 50.264 2.272 0.602 0.600 0.962 0.755 CB 1.793 54 residues pruned to eliminate duplicates Z: 54 49.122 2.262 0.603 0.622 0.943 0.792 CB 1.757 54 residues pruned to eliminate duplicates Z: 22 19.070 2.132 0.421 0.485 0.857 0.619 CB 1.627 22 residues pruned to eliminate duplicates Z: 22 15.970 2.102 0.420 0.426 0.762 0.667 CA 1.656 22 residues pruned to eliminate duplicates Z: 26 26.068 2.214 0.372 0.531 0.920 0.760 CA 1.810 26 residues pruned to eliminate duplicates Z: 21 18.102 2.187 0.304 0.454 0.850 0.750 CA 1.752 21 residues pruned to eliminate duplicates Z: 14 10.782 2.195 0.152 0.444 0.769 0.538 C 1.629 14 residues pruned to eliminate duplicates Z: 13 14.422 2.179 0.310 0.474 0.833 0.750 CA 1.797 13 residues pruned to eliminate duplicates Z: 13 13.518 2.127 0.742 0.428 0.750 0.583 CA 1.513 13 residues pruned to eliminate duplicates Z: 46 46.096 2.230 0.667 0.620 0.933 0.733 CB 1.769 46 residues pruned to eliminate duplicates Z: 54 55.315 2.261 0.691 0.621 0.962 0.755 CB 1.842 54 residues pruned to eliminate duplicates Z: 126 103.562 2.340 0.867 0.689 0.960 0.688 CB 1.859 126 residues pruned to eliminate duplicates Z: 54 48.906 2.238 0.650 0.626 0.925 0.717 CB 1.747 54 residues pruned to eliminate duplicates Z: 53 51.804 2.210 0.787 0.642 0.942 0.788 CB 1.691 53 residues pruned to eliminate duplicates Z: 54 53.488 2.192 0.890 0.622 0.943 0.698 CB 1.676 54 residues pruned to eliminate duplicates Z: 46 49.990 2.254 0.729 0.644 0.978 0.756 CB 1.710 46 residues pruned to eliminate duplicates Z: 37 47.310 2.267 0.789 0.660 0.944 0.694 CB 1.775 37 residues pruned to eliminate duplicates Z: 45 41.082 2.164 0.667 0.608 0.932 0.727 CB 1.663 45 residues pruned to eliminate duplicates Z: 37 48.177 2.243 0.843 0.650 0.944 0.778 CB 1.789 37 residues pruned to eliminate duplicates Z: 33 42.547 2.252 0.730 0.660 0.938 0.781 CB 1.775 33 residues pruned to eliminate duplicates Z: 46 53.610 2.277 0.792 0.651 0.956 0.733 CB 1.781 46 residues pruned to eliminate duplicates Z: 35 48.638 2.260 0.788 0.660 0.971 0.794 CB 1.834 35 residues pruned to eliminate duplicates Z: 107 93.065 2.307 0.911 0.712 0.934 0.660 CB 1.812 107 residues pruned to eliminate duplicates Z: 37 46.063 2.235 0.826 0.641 0.944 0.722 CB 1.746 37 residues pruned to eliminate duplicates Z: 38 44.638 2.181 0.818 0.648 0.919 0.703 CA 1.755 38 residues pruned to eliminate duplicates Z: 37 44.731 2.232 0.831 0.635 0.944 0.722 CB 1.702 37 residues pruned to eliminate duplicates Z: 37 48.574 2.234 0.926 0.645 0.944 0.722 CB 1.739 37 residues pruned to eliminate duplicates Z: 36 52.538 2.279 0.904 0.669 0.971 0.800 CB 1.802 36 residues pruned to eliminate duplicates Z: 47 52.996 2.254 0.820 0.631 0.957 0.609 CB 1.761 47 residues pruned to eliminate duplicates Z: 54 50.295 2.207 0.751 0.603 0.925 0.642 CB 1.753 54 residues pruned to eliminate duplicates Z: 37 46.192 2.240 0.822 0.645 0.944 0.722 CB 1.744 37 residues pruned to eliminate duplicates Z: 34 41.209 2.190 0.780 0.637 0.970 0.758 CB 1.669 34 residues pruned to eliminate duplicates Z: 36 48.948 2.268 0.915 0.636 0.943 0.714 CB 1.778 36 residues pruned to eliminate duplicates Z: 58 53.730 2.290 0.714 0.624 0.930 0.702 CB 1.735 58 residues pruned to eliminate duplicates Z: 37 50.285 2.251 0.893 0.671 0.944 0.778 CB 1.779 37 residues pruned to eliminate duplicates Z: 37 51.989 2.219 0.997 0.628 0.972 0.722 CB 1.782 37 residues pruned to eliminate duplicates Z: 39 45.940 2.163 1.003 0.615 0.921 0.737 CB 1.675 39 residues pruned to eliminate duplicates Z: 39 48.303 2.168 0.941 0.630 1.000 0.684 CB 1.648 39 residues pruned to eliminate duplicates Z: 28 41.524 2.142 0.899 0.670 0.963 0.704 CA 1.744 28 residues pruned to eliminate duplicates Z: 37 49.032 2.207 0.911 0.633 0.972 0.694 CB 1.759 37 residues pruned to eliminate duplicates Z: 36 47.817 2.232 0.817 0.655 0.971 0.714 CA 1.775 36 residues pruned to eliminate duplicates Z: 49 50.128 2.213 0.767 0.607 0.958 0.646 CB 1.744 49 residues pruned to eliminate duplicates Z: 37 44.163 2.200 0.936 0.622 0.944 0.611 CB 1.631 37 residues pruned to eliminate duplicates Z: 36 59.116 2.262 1.037 0.670 1.000 0.657 CB 1.853 36 residues pruned to eliminate duplicates Z: 6 5.992 1.575 0.807 0.353 1.000 0.200 CA 1.105 6 residues pruned to eliminate duplicates Z: 52 42.848 2.161 0.654 0.576 0.941 0.627 CB 1.658 52 residues pruned to eliminate duplicates Z: 9 9.278 1.858 0.324 0.512 0.875 0.625 CB 1.506 4 residues pruned to eliminate duplicates Z: 7 6.589 1.672 0.501 0.545 1.000 0.333 CA 1.026 7 residues pruned to eliminate duplicates Z: 9 9.297 1.832 0.651 0.492 0.875 0.500 CB 1.252 9 residues pruned to eliminate duplicates Z: 33 37.640 2.320 0.481 0.723 0.844 0.750 CB 1.877 33 residues pruned to eliminate duplicates Z: 10 11.377 1.920 0.398 0.507 0.889 0.778 CB 1.579 10 residues pruned to eliminate duplicates Z: 14 13.978 2.263 0.161 0.460 0.846 0.538 CB 1.817 14 residues pruned to eliminate duplicates Z: 58 50.218 2.300 0.578 0.573 0.912 0.667 CB 1.872 58 residues pruned to eliminate duplicates Z: 53 47.548 2.328 0.554 0.588 0.904 0.673 CB 1.854 53 residues pruned to eliminate duplicates Z: 54 46.743 2.312 0.607 0.570 0.887 0.717 CB 1.821 54 residues pruned to eliminate duplicates Z: 58 52.198 2.308 0.576 0.576 0.947 0.684 CB 1.864 58 residues pruned to eliminate duplicates Z: 33 34.196 2.269 0.467 0.670 0.875 0.719 CB 1.774 33 residues pruned to eliminate duplicates Z: 35 34.373 2.270 0.452 0.672 0.853 0.559 CB 1.789 35 residues pruned to eliminate duplicates Z: 17 15.830 2.169 0.303 0.448 0.875 0.688 CB 1.687 17 residues pruned to eliminate duplicates Z: 52 42.511 2.290 0.558 0.604 0.843 0.667 CB 1.793 52 residues pruned to eliminate duplicates Z: 34 34.389 2.272 0.397 0.676 0.879 0.758 CB 1.825 34 residues pruned to eliminate duplicates Z: 47 49.659 2.379 0.592 0.586 0.935 0.630 CB 1.906 47 residues pruned to eliminate duplicates Z: 54 48.430 2.310 0.572 0.554 0.925 0.623 CB 1.880 54 residues pruned to eliminate duplicates Z: 57 49.010 2.326 0.519 0.588 0.929 0.732 CB 1.834 57 residues pruned to eliminate duplicates Z: 58 48.412 2.289 0.605 0.557 0.930 0.667 CB 1.775 58 residues pruned to eliminate duplicates Z: 53 40.842 2.297 0.466 0.544 0.885 0.635 CB 1.821 53 residues pruned to eliminate duplicates Z: 34 39.487 2.341 0.518 0.693 0.879 0.727 CB 1.844 34 residues pruned to eliminate duplicates Z: 48 36.913 2.262 0.423 0.580 0.872 0.702 CB 1.775 48 residues pruned to eliminate duplicates Z: 47 43.800 2.344 0.537 0.598 0.870 0.674 CB 1.877 47 residues pruned to eliminate duplicates Z: 39 40.654 2.266 0.498 0.655 0.921 0.789 CB 1.826 39 residues pruned to eliminate duplicates Z: 58 47.719 2.281 0.590 0.572 0.895 0.667 CB 1.818 58 residues pruned to eliminate duplicates Z: 54 49.016 2.322 0.569 0.554 0.943 0.623 CB 1.859 54 residues pruned to eliminate duplicates Z: 48 44.911 2.340 0.521 0.587 0.915 0.745 CB 1.850 48 residues pruned to eliminate duplicates Z: 53 43.743 2.308 0.511 0.572 0.904 0.596 CB 1.795 53 residues pruned to eliminate duplicates Z: 58 47.496 2.301 0.600 0.544 0.895 0.702 CB 1.828 58 residues pruned to eliminate duplicates Z: 58 48.846 2.300 0.587 0.540 0.930 0.684 CB 1.833 58 residues pruned to eliminate duplicates Z: 42 47.699 2.360 0.745 0.587 0.878 0.634 C 1.894 42 residues pruned to eliminate duplicates Z: 58 45.804 2.287 0.562 0.569 0.895 0.561 CB 1.776 58 residues pruned to eliminate duplicates Z: 54 49.484 2.317 0.612 0.566 0.925 0.642 CB 1.847 52 residues pruned to eliminate duplicates Z: 27 49.780 2.401 0.741 0.817 0.923 0.846 CB 1.922 27 residues pruned to eliminate duplicates Z: 59 47.703 2.264 0.609 0.565 0.914 0.552 CB 1.767 59 residues pruned to eliminate duplicates Z: 52 48.131 2.300 0.621 0.576 0.902 0.725 CB 1.863 52 residues pruned to eliminate duplicates Z: 54 49.840 2.332 0.649 0.569 0.887 0.679 CB 1.879 54 residues pruned to eliminate duplicates Z: 48 49.004 2.335 0.699 0.586 0.894 0.596 CB 1.856 48 residues pruned to eliminate duplicates Z: 50 48.604 2.361 0.594 0.569 0.918 0.633 CB 1.880 51 residues pruned to eliminate duplicates Z: 7 11.324 1.899 0.698 0.558 1.000 0.667 C 1.356 7 residues pruned to eliminate duplicates Z: 55 50.438 2.317 0.635 0.571 0.907 0.593 CB 1.864 55 residues pruned to eliminate duplicates Z: 49 52.719 2.342 0.688 0.581 0.938 0.604 CB 1.899 48 residues pruned to eliminate duplicates Z: 9 10.797 1.989 0.732 0.525 0.875 0.375 CB 1.235 9 residues pruned to eliminate duplicates Z: 58 49.065 2.288 0.640 0.563 0.895 0.596 CB 1.822 58 residues pruned to eliminate duplicates Z: 51 47.500 2.313 0.605 0.585 0.920 0.640 CB 1.812 51 residues pruned to eliminate duplicates Z: 54 45.344 2.290 0.588 0.557 0.906 0.679 CB 1.790 54 residues pruned to eliminate duplicates Z: 24 21.871 2.201 0.600 0.341 0.913 0.522 CB 1.686 24 residues pruned to eliminate duplicates Z: 48 49.330 2.344 0.669 0.572 0.915 0.596 CB 1.876 48 residues pruned to eliminate duplicates Z: 54 45.421 2.342 0.540 0.549 0.887 0.604 CB 1.861 54 residues pruned to eliminate duplicates Z: 59 46.878 2.255 0.658 0.565 0.862 0.569 CB 1.792 59 residues pruned to eliminate duplicates Z: 24 23.467 2.262 0.638 0.365 0.870 0.565 CB 1.755 24 residues pruned to eliminate duplicates Z: 22 26.394 2.357 0.693 0.359 0.905 0.667 CB 1.857 22 residues pruned to eliminate duplicates Z: 53 44.016 2.318 0.497 0.579 0.904 0.654 CB 1.804 53 residues pruned to eliminate duplicates Z: 58 41.662 2.253 0.433 0.542 0.912 0.614 CB 1.799 58 residues pruned to eliminate duplicates 515 residues left after pruning, divided into chains as follows: A: 40 B: 7 C: 33 D: 49 E: 327 F: 59 CC for partial structure against native data = 28.80 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 1 used as input for final density modification = 0.300, Contrast = 0.388, Connect. = 0.705 for dens.mod. cycle 1 = 0.300, Contrast = 0.445, Connect. = 0.731 for dens.mod. cycle 2 = 0.300, Contrast = 0.515, Connect. = 0.768 for dens.mod. cycle 3 = 0.300, Contrast = 0.516, Connect. = 0.771 for dens.mod. cycle 4 = 0.300, Contrast = 0.524, Connect. = 0.775 for dens.mod. cycle 5 = 0.300, Contrast = 0.530, Connect. = 0.778 for dens.mod. cycle 6 = 0.300, Contrast = 0.538, Connect. = 0.781 for dens.mod. cycle 7 = 0.300, Contrast = 0.543, Connect. = 0.783 for dens.mod. cycle 8 = 0.300, Contrast = 0.548, Connect. = 0.785 for dens.mod. cycle 9 = 0.300, Contrast = 0.552, Connect. = 0.786 for dens.mod. cycle 10 TimeTaking 414.23