++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 01:31:46 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: ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.ins Phases from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi Native data from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.hkl Listing output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.lst Phases output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phs Poly-Ala trace output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-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 65 Allowed origin shift code: 8 94163 Reflections read from file ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi 94163 Reflections read from file ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.hkl 94163 Unique data, highest resolution = 1.820 Angstroms Anisotropic scaling: intensities multiplied by 0.000042h^2 +0.000042k^2 -0.000313l^2 +0.000000kl +0.000000hl +0.000042hk 32 Reflections with d > 2.020 and 0 in range 2.020 > d > 1.820 added Density sharpening factor set to 1.02 Fourier grid = 512 x 512 x 18 0.000 <= z <= 0.167 92 Point spherical net set up with radius 2.42A 32 Extra Fourier layers will be generated <|E^2-1|> = 0.645 ** -f missing ?? ** = 0.300, Contrast = 0.378, Connect. = 0.752 for dens.mod. cycle 1 = 0.300, Contrast = 0.491, Connect. = 0.778 for dens.mod. cycle 2 = 0.300, Contrast = 0.660, Connect. = 0.813 for dens.mod. cycle 3 = 0.300, Contrast = 0.708, Connect. = 0.822 for dens.mod. cycle 4 = 0.300, Contrast = 0.740, Connect. = 0.826 for dens.mod. cycle 5 = 0.300, Contrast = 0.758, Connect. = 0.829 for dens.mod. cycle 6 = 0.300, Contrast = 0.772, Connect. = 0.832 for dens.mod. cycle 7 = 0.300, Contrast = 0.781, Connect. = 0.833 for dens.mod. cycle 8 = 0.300, Contrast = 0.788, Connect. = 0.834 for dens.mod. cycle 9 = 0.300, Contrast = 0.793, Connect. = 0.835 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4368 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 1026 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 45.024 2.267 1.152 0.935 1.000 0.812 CB 1.608 B: 24 41.729 2.287 0.932 0.947 0.913 0.696 CB 1.490 C: 16 34.702 2.312 0.850 0.903 0.933 0.800 CB 1.599 16 residues pruned to eliminate duplicates D: 24 42.902 2.299 0.841 0.928 0.957 0.870 CB 1.547 24 residues pruned to eliminate duplicates E: 15 37.366 2.399 1.022 0.908 0.929 0.857 CB 1.575 16 residues pruned to eliminate duplicates F: 27 52.793 2.278 0.947 0.918 1.000 0.692 CA 1.646 G: 17 40.585 2.233 0.982 0.931 0.938 0.625 CB 1.709 H: 16 44.871 2.376 1.057 0.919 0.933 0.933 CB 1.789 16 residues pruned to eliminate duplicates I: 31 47.188 2.240 0.845 0.920 0.967 0.767 CB 1.519 31 residues pruned to eliminate duplicates J: 17 31.053 2.123 0.874 0.899 0.938 0.875 CB 1.488 K: 24 48.853 2.295 1.141 0.939 0.957 0.522 CB 1.506 24 residues pruned to eliminate duplicates L: 29 22.490 2.130 0.738 0.346 0.893 0.607 CB 1.520 M: 25 38.660 2.214 0.840 0.897 0.917 0.875 CB 1.514 25 residues pruned to eliminate duplicates N: 29 57.056 2.293 1.059 0.916 0.964 0.679 CB 1.673 27 residues pruned to eliminate duplicates O: 17 50.270 2.279 1.282 0.898 1.000 0.625 CA 1.729 15 residues pruned to eliminate duplicates P: 22 44.882 2.163 0.934 0.925 1.000 0.810 CA 1.642 22 residues pruned to eliminate duplicates Q: 43 37.743 2.236 0.747 0.646 0.929 0.714 CB 1.402 16 residues pruned to eliminate duplicates R: 14 32.133 2.252 0.985 0.856 0.846 0.769 CA 1.738 S: 17 27.348 2.057 0.722 0.893 1.000 0.875 CB 1.386 17 residues pruned to eliminate duplicates T: 16 33.169 2.112 0.975 0.901 0.933 0.867 CB 1.570 17 residues pruned to eliminate duplicates U: 16 40.827 2.295 1.214 0.884 0.933 0.800 CB 1.606 16 residues pruned to eliminate duplicates V: 26 40.803 2.184 1.000 0.880 0.960 0.840 CB 1.410 25 residues pruned to eliminate duplicates W: 23 38.767 2.310 0.789 0.941 0.909 0.818 CB 1.527 23 residues pruned to eliminate duplicates X: 24 50.607 2.296 1.153 0.938 1.000 0.696 CB 1.485 25 residues pruned to eliminate duplicates Y: 16 35.730 2.361 1.088 0.887 0.933 0.867 CB 1.446 16 residues pruned to eliminate duplicates Z: 47 35.941 2.147 0.632 0.547 0.935 0.652 CB 1.545 Z: 49 45.083 2.274 0.835 0.569 0.917 0.729 CB 1.591 55 residues pruned to eliminate duplicates Z: 15 44.871 2.237 1.395 0.912 0.929 0.786 CA 1.707 14 residues pruned to eliminate duplicates Z: 30 44.703 2.139 0.730 0.862 0.966 0.793 CB 1.706 Z: 98 74.277 2.230 0.851 0.689 0.938 0.722 CB 1.637 92 residues pruned to eliminate duplicates Z: 15 40.018 2.336 0.944 0.930 1.000 0.643 CB 1.647 15 residues pruned to eliminate duplicates Z: 15 25.492 2.073 0.764 0.858 1.000 0.714 CB 1.373 Z: 17 29.244 2.105 0.816 0.858 0.938 0.875 CA 1.502 Z: 18 36.797 2.139 1.131 0.888 0.941 0.647 CB 1.499 18 residues pruned to eliminate duplicates Z: 29 53.750 2.208 0.882 0.918 0.964 0.821 CB 1.788 30 residues pruned to eliminate duplicates Z: 15 41.764 2.277 1.211 0.919 0.929 0.857 CB 1.682 15 residues pruned to eliminate duplicates Z: 11 19.745 2.067 0.784 0.600 0.900 0.600 CB 1.710 11 residues pruned to eliminate duplicates Z: 15 41.917 2.132 1.381 0.885 1.000 0.786 CB 1.593 15 residues pruned to eliminate duplicates Z: 16 44.365 2.376 1.159 0.932 0.933 0.933 CB 1.670 16 residues pruned to eliminate duplicates Z: 16 40.461 2.167 1.287 0.926 1.000 0.667 CB 1.478 17 residues pruned to eliminate duplicates Z: 24 37.949 2.216 0.819 0.860 0.957 0.652 CB 1.509 Z: 81 46.692 2.121 0.738 0.531 0.925 0.613 CB 1.484 47 residues pruned to eliminate duplicates Z: 17 28.555 2.111 0.927 0.789 0.875 0.812 CB 1.556 17 residues pruned to eliminate duplicates Z: 15 22.910 2.240 0.684 0.847 0.857 0.643 CA 1.405 Z: 17 17.207 2.107 0.878 0.547 0.875 0.688 CB 1.186 17 residues pruned to eliminate duplicates Z: 15 29.384 2.055 1.126 0.829 1.000 0.571 CB 1.353 15 residues pruned to eliminate duplicates Z: 16 35.775 2.295 0.841 0.923 0.933 0.867 CB 1.646 16 residues pruned to eliminate duplicates Z: 22 50.927 2.303 1.250 0.950 0.952 0.619 CB 1.554 22 residues pruned to eliminate duplicates Z: 17 31.126 2.105 1.002 0.833 1.000 0.812 CB 1.384 17 residues pruned to eliminate duplicates Z: 28 32.594 2.115 0.814 0.790 0.852 0.630 CB 1.488 22 residues pruned to eliminate duplicates Z: 16 41.195 2.235 0.962 0.939 1.000 1.000 CB 1.686 16 residues pruned to eliminate duplicates Z: 13 22.919 2.300 0.467 0.936 0.917 0.833 CB 1.490 Z: 32 56.422 2.213 1.092 0.924 1.000 0.839 CB 1.537 29 residues pruned to eliminate duplicates Z: 17 30.635 2.216 0.801 0.835 0.938 0.750 CB 1.534 19 residues pruned to eliminate duplicates Z: 26 42.930 2.127 1.050 0.824 0.960 0.560 CB 1.549 25 residues pruned to eliminate duplicates Z: 22 25.837 1.997 0.633 0.896 0.905 0.810 CB 1.369 Z: 23 40.204 2.212 1.028 0.769 0.955 0.500 CB 1.577 Z: 29 55.872 2.188 0.996 0.908 0.964 0.821 CA 1.781 29 residues pruned to eliminate duplicates Z: 17 41.536 2.227 0.861 0.942 1.000 0.938 CB 1.737 17 residues pruned to eliminate duplicates Z: 15 42.304 2.287 1.138 0.921 1.000 1.000 CB 1.627 15 residues pruned to eliminate duplicates Z: 10 24.486 2.271 0.836 0.917 1.000 0.778 CB 1.381 Z: 25 39.068 2.384 0.900 0.709 0.958 0.625 CB 1.519 24 residues pruned to eliminate duplicates Z: 14 22.198 2.111 0.798 0.872 0.923 0.846 CB 1.281 13 residues pruned to eliminate duplicates Z: 17 30.422 2.301 0.474 0.918 1.000 0.875 CB 1.581 17 residues pruned to eliminate duplicates Z: 18 41.058 2.164 1.076 0.925 1.000 0.941 CB 1.556 17 residues pruned to eliminate duplicates Z: 15 34.159 2.335 0.625 0.929 1.000 0.929 CB 1.683 15 residues pruned to eliminate duplicates Z: 21 32.509 2.046 0.761 0.883 1.000 0.800 CA 1.458 22 residues pruned to eliminate duplicates Z: 17 33.746 2.259 0.864 0.848 0.938 0.750 CB 1.585 17 residues pruned to eliminate duplicates Z: 28 50.397 2.286 0.776 0.932 1.000 0.815 CA 1.669 28 residues pruned to eliminate duplicates Z: 26 21.709 2.159 0.796 0.390 0.920 0.680 CB 1.368 26 residues pruned to eliminate duplicates Z: 17 44.024 2.329 1.082 0.930 1.000 0.500 CB 1.587 17 residues pruned to eliminate duplicates Z: 15 34.225 2.257 0.790 0.916 1.000 0.857 CA 1.598 15 residues pruned to eliminate duplicates Z: 17 38.440 2.132 1.068 0.940 1.000 0.938 CB 1.513 17 residues pruned to eliminate duplicates Z: 23 43.214 2.336 0.778 0.873 0.955 0.773 CB 1.692 23 residues pruned to eliminate duplicates Z: 28 37.079 2.182 0.986 0.612 0.963 0.667 CA 1.537 47 residues pruned to eliminate duplicates Z: 24 48.299 2.288 1.126 0.945 1.000 0.696 CB 1.433 24 residues pruned to eliminate duplicates Z: 16 36.197 2.119 1.118 0.840 1.000 0.800 CB 1.554 16 residues pruned to eliminate duplicates Z: 29 53.449 2.265 1.031 0.893 0.964 0.857 CB 1.635 29 residues pruned to eliminate duplicates Z: 23 49.244 2.329 0.962 0.931 1.000 0.955 CB 1.605 23 residues pruned to eliminate duplicates Z: 25 22.585 2.223 0.601 0.371 0.917 0.500 CB 1.623 25 residues pruned to eliminate duplicates Z: 29 50.159 2.323 1.005 0.906 0.929 0.571 CB 1.559 29 residues pruned to eliminate duplicates Z: 25 19.702 2.073 0.606 0.419 0.917 0.750 CB 1.434 Z: 27 48.263 2.325 0.737 0.926 0.962 0.846 CB 1.710 27 residues pruned to eliminate duplicates Z: 14 44.698 2.541 1.057 0.921 0.923 0.615 CB 1.808 14 residues pruned to eliminate duplicates Z: 30 46.036 2.140 0.656 0.868 1.000 0.897 CA 1.763 30 residues pruned to eliminate duplicates Z: 29 48.627 2.266 0.968 0.899 0.964 0.536 CB 1.527 29 residues pruned to eliminate duplicates Z: 22 32.895 2.141 0.812 0.901 0.952 0.905 CB 1.386 22 residues pruned to eliminate duplicates Z: 33 33.538 2.218 0.867 0.616 0.906 0.531 CB 1.416 15 residues pruned to eliminate duplicates Z: 11 18.278 2.184 0.702 0.618 1.000 0.700 CB 1.391 11 residues pruned to eliminate duplicates Z: 17 32.179 2.181 0.601 0.921 1.000 0.938 CB 1.621 17 residues pruned to eliminate duplicates Z: 16 33.829 2.201 0.804 0.934 1.000 1.000 CB 1.533 16 residues pruned to eliminate duplicates Z: 15 13.282 1.983 0.530 0.459 1.000 0.286 CB 1.221 Z: 30 43.850 2.132 0.643 0.877 0.966 0.828 CB 1.748 30 residues pruned to eliminate duplicates Z: 52 52.173 2.305 0.786 0.646 0.961 0.765 CB 1.612 52 residues pruned to eliminate duplicates Z: 45 26.558 1.979 0.931 0.475 0.818 0.614 CB 1.313 Z: 57 38.471 2.090 0.997 0.563 0.946 0.643 CB 1.224 47 residues pruned to eliminate duplicates Z: 24 36.990 2.259 0.754 0.854 0.913 0.609 CB 1.575 24 residues pruned to eliminate duplicates Z: 33 28.738 2.041 1.039 0.607 0.844 0.500 CB 1.307 16 residues pruned to eliminate duplicates Z: 37 34.148 2.208 0.870 0.509 0.833 0.500 CB 1.640 28 residues pruned to eliminate duplicates Z: 16 33.086 2.227 0.703 0.926 1.000 0.933 CB 1.580 16 residues pruned to eliminate duplicates Z: 27 32.525 2.222 0.998 0.577 0.846 0.538 CB 1.576 27 residues pruned to eliminate duplicates Z: 23 59.297 2.314 1.393 0.931 1.000 0.818 CB 1.594 24 residues pruned to eliminate duplicates Z: 17 39.059 2.192 1.136 0.906 0.938 0.875 CB 1.583 17 residues pruned to eliminate duplicates Z: 13 19.803 2.059 0.689 0.825 0.917 0.750 CB 1.353 13 residues pruned to eliminate duplicates Z: 53 64.638 2.344 1.128 0.679 0.942 0.673 CB 1.618 53 residues pruned to eliminate duplicates Z: 17 39.205 2.242 1.003 0.921 1.000 0.875 CB 1.536 17 residues pruned to eliminate duplicates Z: 16 32.689 2.282 0.607 0.916 1.000 0.933 CB 1.626 16 residues pruned to eliminate duplicates Z: 14 23.988 2.285 0.517 0.857 0.923 0.846 CA 1.532 14 residues pruned to eliminate duplicates Z: 14 27.429 2.187 0.938 0.908 1.000 0.769 CB 1.275 14 residues pruned to eliminate duplicates Z: 22 26.304 1.937 0.487 0.926 1.000 0.952 CB 1.398 22 residues pruned to eliminate duplicates Z: 24 45.329 2.292 0.867 0.874 0.957 0.783 CB 1.680 25 residues pruned to eliminate duplicates Z: 30 42.425 2.144 0.531 0.890 0.966 0.759 CA 1.788 30 residues pruned to eliminate duplicates Z: 16 31.613 2.268 0.670 0.923 0.933 0.867 CB 1.622 16 residues pruned to eliminate duplicates Z: 59 32.808 1.989 0.744 0.488 0.914 0.534 CB 1.376 62 residues pruned to eliminate duplicates Z: 14 25.207 2.236 0.652 0.850 0.923 0.692 CA 1.519 14 residues pruned to eliminate duplicates Z: 13 25.741 2.389 0.594 0.858 0.917 0.750 CA 1.568 13 residues pruned to eliminate duplicates Z: 24 42.034 2.262 1.015 0.925 0.957 0.565 CB 1.411 24 residues pruned to eliminate duplicates Z: 26 24.933 2.284 0.564 0.398 0.920 0.640 CB 1.691 26 residues pruned to eliminate duplicates Z: 26 34.786 2.301 0.864 0.710 0.920 0.760 CB 1.458 26 residues pruned to eliminate duplicates Z: 29 53.756 2.299 0.989 0.921 0.964 0.929 CB 1.622 29 residues pruned to eliminate duplicates Z: 29 48.773 2.280 0.866 0.893 0.964 0.786 CB 1.613 29 residues pruned to eliminate duplicates Z: 29 51.483 2.156 0.783 0.918 1.000 0.821 CB 1.785 29 residues pruned to eliminate duplicates Z: 29 45.196 2.260 1.028 0.863 0.929 0.357 CB 1.472 29 residues pruned to eliminate duplicates Z: 7 14.607 1.921 0.811 0.836 1.000 1.000 CB 1.283 7 residues pruned to eliminate duplicates Z: 14 37.452 2.187 1.315 0.855 1.000 0.615 CB 1.514 15 residues pruned to eliminate duplicates Z: 10 20.506 2.215 0.705 0.904 1.000 0.778 CB 1.290 Z: 18 18.902 1.891 0.339 0.913 1.000 0.824 CB 1.282 15 residues pruned to eliminate duplicates Z: 16 48.056 2.342 1.339 0.939 1.000 0.867 CB 1.575 16 residues pruned to eliminate duplicates Z: 14 18.019 1.898 0.474 0.921 1.000 1.000 CB 1.257 Z: 33 38.338 2.214 0.895 0.637 0.906 0.531 CB 1.567 33 residues pruned to eliminate duplicates Z: 69 76.319 2.294 0.975 0.779 0.941 0.809 CB 1.697 68 residues pruned to eliminate duplicates Z: 13 32.910 2.260 0.984 0.873 1.000 0.667 CB 1.543 16 residues pruned to eliminate duplicates Z: 16 16.526 2.065 0.103 0.890 1.000 0.867 CB 1.348 16 residues pruned to eliminate duplicates Z: 18 32.859 2.186 0.771 0.931 1.000 0.882 CB 1.438 18 residues pruned to eliminate duplicates Z: 87 80.066 2.373 1.003 0.723 0.919 0.686 CB 1.617 89 residues pruned to eliminate duplicates Z: 25 25.904 1.911 0.597 0.891 0.958 0.875 CB 1.300 22 residues pruned to eliminate duplicates Z: 16 45.745 2.190 1.258 0.941 1.000 1.000 CB 1.657 16 residues pruned to eliminate duplicates Z: 14 19.349 1.909 0.830 0.854 0.923 0.615 CB 1.229 12 residues pruned to eliminate duplicates Z: 12 26.636 2.050 1.012 0.900 1.000 0.636 CB 1.391 12 residues pruned to eliminate duplicates Z: 17 36.156 2.240 0.792 0.924 1.000 0.938 CB 1.582 17 residues pruned to eliminate duplicates Z: 42 37.978 2.152 1.166 0.570 0.902 0.561 CB 1.317 42 residues pruned to eliminate duplicates Z: 13 15.720 2.095 0.940 0.460 0.833 0.417 CB 1.396 13 residues pruned to eliminate duplicates Z: 30 43.426 2.114 0.701 0.923 0.966 0.897 CB 1.632 30 residues pruned to eliminate duplicates Z: 13 36.855 2.240 1.488 0.882 0.917 0.500 CB 1.506 13 residues pruned to eliminate duplicates Z: 8 9.426 1.745 1.012 0.863 0.857 0.571 CB 0.869 8 residues pruned to eliminate duplicates Z: 29 48.398 2.165 0.886 0.878 0.929 0.714 CB 1.751 29 residues pruned to eliminate duplicates Z: 22 40.316 2.168 1.026 0.848 1.000 0.714 CB 1.486 22 residues pruned to eliminate duplicates Z: 14 31.537 2.306 0.930 0.829 0.923 0.692 CA 1.601 14 residues pruned to eliminate duplicates Z: 16 34.882 2.125 0.840 0.945 1.000 1.000 CB 1.593 16 residues pruned to eliminate duplicates Z: 16 21.909 2.123 0.366 0.875 1.000 0.800 CB 1.419 16 residues pruned to eliminate duplicates Z: 30 52.412 2.151 0.961 0.877 0.966 0.724 CB 1.735 30 residues pruned to eliminate duplicates Z: 24 35.252 2.091 0.902 0.839 0.913 0.826 CB 1.512 24 residues pruned to eliminate duplicates Z: 66 51.344 2.167 1.015 0.573 0.908 0.662 CB 1.498 56 residues pruned to eliminate duplicates Z: 21 39.717 2.273 0.782 0.875 1.000 0.800 CB 1.595 21 residues pruned to eliminate duplicates Z: 29 50.515 2.273 0.854 0.913 0.964 0.821 CB 1.662 29 residues pruned to eliminate duplicates Z: 15 32.766 2.210 0.895 0.927 0.929 0.786 CB 1.577 15 residues pruned to eliminate duplicates Z: 30 43.903 2.119 0.609 0.891 1.000 0.793 CB 1.719 30 residues pruned to eliminate duplicates Z: 15 38.844 2.346 1.255 0.927 1.000 0.857 CB 1.375 15 residues pruned to eliminate duplicates Z: 87 75.703 2.268 0.958 0.729 0.895 0.698 CB 1.670 87 residues pruned to eliminate duplicates Z: 16 36.870 2.178 0.918 0.892 1.000 0.800 CB 1.638 16 residues pruned to eliminate duplicates Z: 15 30.958 2.274 0.697 0.917 0.929 0.929 CB 1.630 15 residues pruned to eliminate duplicates Z: 10 20.335 2.062 1.057 0.681 0.889 0.556 CA 1.523 Z: 11 13.145 1.659 0.765 0.770 0.900 0.700 CB 1.242 11 residues pruned to eliminate duplicates Z: 23 38.239 2.212 0.910 0.841 0.909 0.727 CB 1.582 23 residues pruned to eliminate duplicates Z: 16 35.241 2.164 1.288 0.876 0.933 0.267 CB 1.431 16 residues pruned to eliminate duplicates Z: 27 35.596 2.163 0.766 0.805 0.923 0.615 CB 1.517 27 residues pruned to eliminate duplicates Z: 23 36.328 2.190 0.814 0.818 0.955 0.773 CB 1.549 23 residues pruned to eliminate duplicates Z: 25 45.619 2.198 1.195 0.880 1.000 0.708 CB 1.399 25 residues pruned to eliminate duplicates Z: 17 40.767 2.258 0.960 0.923 0.938 0.938 CA 1.726 17 residues pruned to eliminate duplicates Z: 42 27.265 2.107 0.715 0.510 0.878 0.610 CB 1.328 40 residues pruned to eliminate duplicates Z: 28 49.389 2.097 0.928 0.914 0.926 0.815 CA 1.796 28 residues pruned to eliminate duplicates Z: 17 32.581 2.123 1.034 0.907 0.938 0.562 CB 1.430 17 residues pruned to eliminate duplicates Z: 20 27.339 2.100 1.015 0.766 0.789 0.263 CB 1.483 20 residues pruned to eliminate duplicates Z: 11 25.943 2.166 1.028 0.859 1.000 0.900 CB 1.374 10 residues pruned to eliminate duplicates Z: 30 46.108 2.157 0.675 0.885 0.966 0.828 CB 1.771 30 residues pruned to eliminate duplicates Z: 16 33.068 2.125 0.888 0.843 0.933 0.667 CB 1.697 16 residues pruned to eliminate duplicates Z: 8 11.742 1.933 0.556 0.874 0.857 0.571 CB 1.253 7 residues pruned to eliminate duplicates Z: 17 33.926 2.278 1.006 0.868 0.938 0.812 CB 1.447 17 residues pruned to eliminate duplicates Z: 14 22.529 1.968 0.769 0.880 0.923 0.462 CB 1.409 14 residues pruned to eliminate duplicates Z: 11 29.167 2.226 1.120 0.900 1.000 0.600 CB 1.395 11 residues pruned to eliminate duplicates Z: 29 23.559 1.905 0.844 0.632 0.929 0.571 CB 1.205 14 residues pruned to eliminate duplicates Z: 13 22.254 2.213 0.507 0.889 0.917 0.667 CB 1.513 13 residues pruned to eliminate duplicates Z: 22 31.776 2.143 0.814 0.815 0.905 0.571 CB 1.499 22 residues pruned to eliminate duplicates Z: 23 27.258 1.971 0.652 0.882 0.955 0.818 CB 1.353 23 residues pruned to eliminate duplicates Z: 14 24.015 2.304 0.434 0.838 0.923 0.692 CA 1.633 14 residues pruned to eliminate duplicates Z: 30 44.036 2.054 0.825 0.865 0.966 0.655 CB 1.655 30 residues pruned to eliminate duplicates Z: 25 35.063 2.180 0.572 0.888 1.000 0.833 CB 1.505 25 residues pruned to eliminate duplicates Z: 15 27.360 2.258 0.464 0.896 1.000 1.000 CB 1.584 15 residues pruned to eliminate duplicates Z: 36 42.806 2.250 0.840 0.669 0.971 0.629 CB 1.539 35 residues pruned to eliminate duplicates Z: 15 20.201 1.838 0.606 0.911 1.000 0.929 CB 1.296 16 residues pruned to eliminate duplicates Z: 8 18.552 2.220 0.843 0.723 0.857 0.571 CA 1.635 8 residues pruned to eliminate duplicates Z: 10 15.315 2.269 0.494 0.592 1.000 0.556 CB 1.379 10 residues pruned to eliminate duplicates Z: 37 29.159 2.057 0.881 0.598 0.944 0.667 CB 1.211 Z: 15 27.739 2.197 0.756 0.897 0.929 0.857 CB 1.481 15 residues pruned to eliminate duplicates Z: 7 6.153 1.789 0.567 0.720 0.667 0.667 N 1.101 7 residues pruned to eliminate duplicates Z: 15 22.295 2.078 0.969 0.868 0.929 0.857 CB 1.147 15 residues pruned to eliminate duplicates Z: 14 15.778 1.872 0.413 0.917 1.000 0.923 CB 1.167 14 residues pruned to eliminate duplicates Z: 16 49.307 2.305 1.277 0.916 1.000 0.867 CA 1.713 16 residues pruned to eliminate duplicates Z: 18 26.896 2.124 0.768 0.867 0.882 0.765 CB 1.440 18 residues pruned to eliminate duplicates Z: 23 35.430 1.983 1.139 0.908 0.955 0.545 CB 1.325 24 residues pruned to eliminate duplicates Z: 89 73.126 2.323 1.019 0.668 0.920 0.750 CB 1.546 89 residues pruned to eliminate duplicates Z: 8 18.609 2.229 0.694 0.747 0.857 0.571 CA 1.743 8 residues pruned to eliminate duplicates Z: 16 33.386 2.141 1.286 0.888 0.933 0.333 CB 1.359 16 residues pruned to eliminate duplicates Z: 28 33.729 2.240 0.850 0.607 0.889 0.630 CB 1.591 28 residues pruned to eliminate duplicates Z: 13 23.513 2.389 0.504 0.828 0.917 0.667 CA 1.552 13 residues pruned to eliminate duplicates Z: 9 10.700 1.547 0.537 0.847 1.000 0.750 CA 1.182 9 residues pruned to eliminate duplicates Z: 15 33.451 2.172 0.840 0.947 1.000 1.000 CB 1.546 15 residues pruned to eliminate duplicates Z: 24 28.853 2.047 0.878 0.660 0.870 0.739 CB 1.552 24 residues pruned to eliminate duplicates Z: 15 33.481 2.231 0.873 0.946 0.929 0.929 CB 1.595 15 residues pruned to eliminate duplicates Z: 25 30.465 1.900 0.958 0.891 0.958 0.625 CB 1.254 25 residues pruned to eliminate duplicates Z: 22 24.461 1.996 0.455 0.903 0.952 0.952 CB 1.376 22 residues pruned to eliminate duplicates Z: 29 40.664 2.209 0.736 0.901 0.929 0.821 CB 1.541 29 residues pruned to eliminate duplicates Z: 41 33.487 2.015 1.021 0.591 0.925 0.575 CB 1.288 27 residues pruned to eliminate duplicates Z: 17 29.999 2.045 1.023 0.908 0.875 0.688 CB 1.471 17 residues pruned to eliminate duplicates Z: 16 28.902 2.145 0.844 0.901 0.933 0.733 CB 1.443 16 residues pruned to eliminate duplicates Z: 29 62.525 2.299 1.227 0.916 1.000 0.821 CB 1.630 29 residues pruned to eliminate duplicates Z: 32 45.042 2.198 1.151 0.673 1.000 0.677 CB 1.459 32 residues pruned to eliminate duplicates Z: 15 24.502 2.083 1.351 0.876 0.786 0.429 CB 1.237 15 residues pruned to eliminate duplicates Z: 18 38.552 2.334 0.978 0.884 0.941 0.706 CB 1.555 18 residues pruned to eliminate duplicates Z: 20 41.795 2.089 1.109 0.884 0.947 0.316 CB 1.660 20 residues pruned to eliminate duplicates Z: 31 50.111 2.198 1.073 0.890 0.967 0.467 CB 1.494 31 residues pruned to eliminate duplicates Z: 16 25.999 2.075 1.195 0.910 0.933 0.600 CB 1.120 16 residues pruned to eliminate duplicates Z: 16 37.123 2.139 0.966 0.881 1.000 0.933 CB 1.650 16 residues pruned to eliminate duplicates Z: 25 49.702 2.218 1.228 0.903 0.958 0.500 CB 1.527 25 residues pruned to eliminate duplicates Z: 31 49.434 2.089 0.897 0.899 1.000 0.700 CB 1.628 31 residues pruned to eliminate duplicates Z: 13 19.225 2.211 0.311 0.893 0.917 0.917 CB 1.499 13 residues pruned to eliminate duplicates Z: 30 31.158 1.974 0.404 0.878 0.966 0.862 CB 1.569 30 residues pruned to eliminate duplicates Z: 6 13.547 2.058 0.813 0.859 1.000 0.600 CB 1.195 Z: 48 35.352 2.076 0.690 0.636 0.936 0.745 CB 1.381 48 residues pruned to eliminate duplicates Z: 6 11.104 1.902 0.668 0.832 1.000 0.800 CB 1.176 6 residues pruned to eliminate duplicates Z: 37 42.740 2.197 1.152 0.624 0.944 0.667 CB 1.419 37 residues pruned to eliminate duplicates Z: 46 31.279 2.109 0.751 0.538 0.867 0.711 CB 1.403 46 residues pruned to eliminate duplicates Z: 20 13.733 2.077 0.490 0.499 0.947 0.684 CB 1.075 20 residues pruned to eliminate duplicates Z: 53 30.125 2.057 0.652 0.555 0.942 0.654 CB 1.236 55 residues pruned to eliminate duplicates Z: 24 29.092 2.100 0.633 0.798 0.957 0.870 CB 1.425 24 residues pruned to eliminate duplicates Z: 30 39.951 2.258 0.523 0.907 0.966 0.828 CA 1.588 30 residues pruned to eliminate duplicates Z: 24 28.996 2.180 0.935 0.728 0.913 0.696 CB 1.278 24 residues pruned to eliminate duplicates Z: 30 62.837 2.263 1.250 0.921 1.000 0.690 CB 1.612 30 residues pruned to eliminate duplicates Z: 24 36.300 2.255 0.588 0.925 1.000 0.870 CB 1.483 24 residues pruned to eliminate duplicates Z: 12 12.930 2.045 0.539 0.673 0.909 0.818 CB 1.162 12 residues pruned to eliminate duplicates Z: 67 67.774 2.303 0.962 0.664 0.939 0.652 CB 1.688 67 residues pruned to eliminate duplicates Z: 7 7.103 1.840 0.342 0.678 0.833 0.667 CA 1.196 7 residues pruned to eliminate duplicates Z: 117 59.219 2.188 0.800 0.566 0.888 0.664 CB 1.476 117 residues pruned to eliminate duplicates Z: 13 14.675 2.075 0.649 0.540 0.917 0.583 CB 1.298 13 residues pruned to eliminate duplicates Z: 25 45.755 2.214 1.208 0.922 0.917 0.500 CB 1.466 25 residues pruned to eliminate duplicates Z: 25 37.654 2.053 0.680 0.915 0.958 0.750 CB 1.644 25 residues pruned to eliminate duplicates Z: 7 8.915 1.748 0.568 0.791 0.833 0.500 CA 1.234 7 residues pruned to eliminate duplicates Z: 15 17.706 2.080 0.432 0.898 0.929 0.929 CB 1.224 15 residues pruned to eliminate duplicates Z: 31 54.080 2.081 1.071 0.898 1.000 0.633 CB 1.638 31 residues pruned to eliminate duplicates Z: 17 38.756 2.252 1.001 0.895 0.938 0.750 CB 1.645 17 residues pruned to eliminate duplicates Z: 16 37.522 2.248 0.784 0.936 1.000 0.867 CB 1.681 16 residues pruned to eliminate duplicates Z: 17 37.172 2.342 0.700 0.920 1.000 0.875 CB 1.644 17 residues pruned to eliminate duplicates Z: 22 37.604 2.257 0.982 0.774 0.905 0.810 CB 1.591 22 residues pruned to eliminate duplicates Z: 17 24.420 2.041 0.936 0.916 0.938 0.688 CB 1.164 17 residues pruned to eliminate duplicates Z: 16 15.711 1.913 0.611 0.431 0.867 0.733 CB 1.631 16 residues pruned to eliminate duplicates Z: 16 32.363 2.264 1.241 0.870 0.867 0.667 CB 1.387 16 residues pruned to eliminate duplicates Z: 14 16.440 1.767 0.664 0.929 1.000 1.000 CB 1.085 Z: 29 16.326 1.983 0.545 0.449 0.929 0.750 CB 1.143 29 residues pruned to eliminate duplicates Z: 17 30.535 2.111 0.739 0.882 1.000 0.812 CB 1.505 17 residues pruned to eliminate duplicates Z: 23 28.101 2.040 0.697 0.854 0.955 0.727 CB 1.339 23 residues pruned to eliminate duplicates Z: 23 26.868 1.965 0.697 0.904 0.955 0.773 CB 1.282 23 residues pruned to eliminate duplicates Z: 30 47.464 2.230 0.794 0.901 0.966 0.862 CA 1.630 30 residues pruned to eliminate duplicates Z: 7 11.859 2.110 0.317 0.796 0.833 0.500 CA 1.613 7 residues pruned to eliminate duplicates Z: 6 14.851 2.016 0.665 0.823 1.000 0.800 CB 1.496 Z: 15 7.106 1.994 0.592 0.230 0.643 0.357 CB 1.275 Z: 16 37.218 2.256 1.045 0.911 0.933 0.667 CB 1.582 16 residues pruned to eliminate duplicates Z: 24 29.331 2.235 0.798 0.461 0.957 0.696 CB 1.656 24 residues pruned to eliminate duplicates Z: 7 5.311 1.731 0.543 0.833 0.833 0.833 CB 0.731 Z: 16 26.254 2.082 1.113 0.918 0.933 0.733 CB 1.164 16 residues pruned to eliminate duplicates Z: 21 29.479 2.054 1.033 0.879 0.850 0.600 CB 1.347 21 residues pruned to eliminate duplicates Z: 12 24.957 2.114 0.839 0.904 0.909 0.727 CB 1.516 12 residues pruned to eliminate duplicates Z: 49 39.319 2.136 0.981 0.610 0.958 0.688 CB 1.260 49 residues pruned to eliminate duplicates Z: 16 21.528 2.039 0.492 0.924 0.933 0.800 CB 1.375 16 residues pruned to eliminate duplicates Z: 13 22.783 2.185 0.593 0.892 0.917 0.750 CB 1.480 13 residues pruned to eliminate duplicates Z: 32 23.477 1.876 0.860 0.581 0.935 0.419 CB 1.195 35 residues pruned to eliminate duplicates Z: 17 26.691 2.090 0.893 0.868 0.938 0.812 CB 1.315 17 residues pruned to eliminate duplicates Z: 15 33.120 2.175 0.796 0.916 1.000 0.857 CB 1.600 15 residues pruned to eliminate duplicates Z: 13 22.709 1.950 0.876 0.853 0.917 0.750 CB 1.445 13 residues pruned to eliminate duplicates Z: 35 41.795 2.150 1.029 0.687 0.971 0.735 CB 1.426 35 residues pruned to eliminate duplicates Z: 24 44.297 2.290 1.062 0.930 0.957 0.478 CB 1.430 24 residues pruned to eliminate duplicates Z: 17 36.979 2.222 0.672 0.923 1.000 0.938 CB 1.748 17 residues pruned to eliminate duplicates Z: 13 20.338 2.177 0.417 0.865 0.917 0.750 CB 1.521 13 residues pruned to eliminate duplicates Z: 88 76.537 2.285 0.844 0.733 0.943 0.713 CB 1.675 88 residues pruned to eliminate duplicates Z: 24 38.041 2.241 0.793 0.875 0.913 0.652 CB 1.572 24 residues pruned to eliminate duplicates Z: 11 11.672 1.826 0.422 0.773 0.800 0.500 CA 1.396 11 residues pruned to eliminate duplicates Z: 15 39.049 2.293 1.131 0.931 0.929 0.714 CB 1.608 15 residues pruned to eliminate duplicates Z: 15 31.597 2.234 0.855 0.829 0.929 0.714 CB 1.651 15 residues pruned to eliminate duplicates Z: 71 40.432 2.062 0.646 0.609 0.943 0.657 CB 1.362 70 residues pruned to eliminate duplicates Z: 8 16.037 2.154 0.498 0.868 0.857 0.571 CA 1.602 8 residues pruned to eliminate duplicates Z: 24 31.641 1.978 1.031 0.873 0.913 0.739 CB 1.310 24 residues pruned to eliminate duplicates Z: 16 30.500 2.081 1.105 0.895 1.000 0.800 CB 1.289 16 residues pruned to eliminate duplicates Z: 30 57.063 2.142 1.085 0.896 1.000 0.517 CB 1.700 30 residues pruned to eliminate duplicates Z: 29 56.154 2.245 1.185 0.921 0.964 0.571 CB 1.578 29 residues pruned to eliminate duplicates Z: 16 35.351 2.265 0.734 0.931 1.000 0.933 CB 1.624 16 residues pruned to eliminate duplicates Z: 6 12.943 2.149 0.621 0.736 1.000 0.600 CB 1.345 6 residues pruned to eliminate duplicates Z: 31 47.132 2.090 0.776 0.868 1.000 0.800 CB 1.694 31 residues pruned to eliminate duplicates Z: 25 33.636 2.103 0.836 0.864 0.917 0.750 CB 1.423 25 residues pruned to eliminate duplicates Z: 16 24.596 2.129 0.382 0.948 1.000 0.933 CB 1.490 16 residues pruned to eliminate duplicates Z: 8 8.103 1.789 0.366 0.771 0.857 0.571 CB 1.151 Z: 13 16.957 2.283 0.635 0.839 0.750 0.667 CA 1.306 13 residues pruned to eliminate duplicates Z: 34 44.737 2.331 0.974 0.612 0.939 0.576 CB 1.621 34 residues pruned to eliminate duplicates Z: 27 48.342 2.206 0.665 0.924 1.000 0.846 CA 1.812 27 residues pruned to eliminate duplicates Z: 26 28.045 2.018 0.747 0.650 0.960 0.600 CB 1.441 17 residues pruned to eliminate duplicates Z: 14 33.850 2.274 0.943 0.907 0.923 0.769 CA 1.635 14 residues pruned to eliminate duplicates Z: 8 13.679 1.848 0.695 0.794 1.000 1.000 CA 1.276 8 residues pruned to eliminate duplicates Z: 6 3.428 1.733 -0.257 0.577 0.800 0.800 CB 1.383 Z: 15 25.982 2.116 0.942 0.906 1.000 0.857 CB 1.202 15 residues pruned to eliminate duplicates Z: 54 27.312 2.016 0.708 0.507 0.925 0.604 CB 1.170 54 residues pruned to eliminate duplicates Z: 15 27.766 2.119 0.997 0.907 1.000 0.714 CB 1.246 15 residues pruned to eliminate duplicates Z: 21 19.598 1.924 0.866 0.577 0.850 0.400 CB 1.333 16 residues pruned to eliminate duplicates Z: 10 5.483 1.895 0.777 0.161 0.556 0.444 CB 1.477 10 residues pruned to eliminate duplicates Z: 17 17.972 1.980 0.727 0.855 0.938 0.812 CB 1.034 17 residues pruned to eliminate duplicates Z: 19 24.461 2.056 0.408 0.885 1.000 0.722 CB 1.438 19 residues pruned to eliminate duplicates Z: 16 35.637 2.160 1.253 0.868 0.867 0.467 CB 1.594 16 residues pruned to eliminate duplicates Z: 12 20.976 2.152 0.551 0.883 0.909 0.818 CB 1.507 12 residues pruned to eliminate duplicates Z: 107 66.263 2.268 0.854 0.626 0.915 0.613 CB 1.485 107 residues pruned to eliminate duplicates Z: 10 25.775 2.349 0.893 0.735 1.000 1.000 CB 1.565 10 residues pruned to eliminate duplicates Z: 16 37.359 2.197 1.067 0.866 0.933 0.867 CA 1.666 16 residues pruned to eliminate duplicates Z: 13 20.962 2.152 0.466 0.883 0.917 0.667 CB 1.513 13 residues pruned to eliminate duplicates Z: 17 17.676 1.805 0.567 0.732 0.938 0.688 CB 1.353 17 residues pruned to eliminate duplicates Z: 12 5.624 1.726 0.186 0.318 0.818 0.273 CB 1.237 Z: 34 21.374 2.000 0.552 0.572 0.939 0.788 CB 1.191 34 residues pruned to eliminate duplicates Z: 29 50.969 2.261 0.872 0.923 0.964 0.786 CA 1.658 29 residues pruned to eliminate duplicates Z: 23 43.341 2.192 0.970 0.850 1.000 0.682 CB 1.585 23 residues pruned to eliminate duplicates Z: 30 41.771 2.110 0.647 0.888 0.931 0.862 CB 1.728 30 residues pruned to eliminate duplicates Z: 6 11.215 2.175 1.098 0.640 0.800 0.600 CA 1.205 6 residues pruned to eliminate duplicates Z: 7 8.748 1.893 0.430 0.734 0.833 0.833 CB 1.283 7 residues pruned to eliminate duplicates Z: 8 8.098 1.376 0.806 0.787 1.000 0.857 CA 0.957 8 residues pruned to eliminate duplicates Z: 15 26.003 2.128 1.063 0.903 0.929 0.857 CB 1.215 15 residues pruned to eliminate duplicates Z: 31 47.455 2.165 0.775 0.913 1.000 0.900 CB 1.596 31 residues pruned to eliminate duplicates Z: 90 86.044 2.250 1.085 0.732 0.978 0.730 CB 1.614 90 residues pruned to eliminate duplicates Z: 13 8.758 1.883 0.635 0.334 0.917 0.250 CB 1.075 13 residues pruned to eliminate duplicates Z: 10 7.787 1.870 0.564 0.467 0.889 0.333 CB 1.032 10 residues pruned to eliminate duplicates Z: 16 29.231 2.158 0.681 0.929 1.000 0.933 CB 1.456 16 residues pruned to eliminate duplicates Z: 6 5.017 1.747 0.047 0.706 1.000 0.800 CB 1.017 6 residues pruned to eliminate duplicates Z: 55 25.131 1.999 0.556 0.552 0.889 0.630 CB 1.176 55 residues pruned to eliminate duplicates Z: 40 23.997 1.802 0.892 0.620 0.923 0.436 CB 1.090 14 residues pruned to eliminate duplicates Z: 16 34.170 2.157 0.822 0.914 1.000 0.800 CB 1.588 16 residues pruned to eliminate duplicates Z: 6 10.749 1.866 0.556 0.803 1.000 0.600 CA 1.271 6 residues pruned to eliminate duplicates Z: 15 34.674 2.178 1.008 0.902 1.000 0.643 CB 1.511 15 residues pruned to eliminate duplicates Z: 17 47.709 2.128 1.392 0.914 1.000 0.750 CB 1.656 17 residues pruned to eliminate duplicates Z: 16 37.014 2.185 0.991 0.923 1.000 0.800 CB 1.543 16 residues pruned to eliminate duplicates Z: 23 18.500 1.934 0.805 0.554 0.818 0.591 CB 1.310 35 residues pruned to eliminate duplicates Z: 15 22.697 2.101 0.755 0.906 1.000 0.929 CB 1.171 15 residues pruned to eliminate duplicates Z: 6 10.375 1.886 0.529 0.804 1.000 0.400 CB 1.233 5 residues pruned to eliminate duplicates Z: 14 24.890 2.274 0.825 0.827 0.846 0.615 CA 1.482 14 residues pruned to eliminate duplicates Z: 24 52.949 2.305 1.299 0.938 0.957 0.609 CB 1.515 26 residues pruned to eliminate duplicates Z: 28 49.927 2.169 0.979 0.921 0.963 0.481 CB 1.636 28 residues pruned to eliminate duplicates Z: 36 20.578 2.013 0.515 0.544 0.886 0.800 CB 1.234 36 residues pruned to eliminate duplicates Z: 11 15.776 2.166 0.326 0.849 0.900 0.700 CA 1.430 11 residues pruned to eliminate duplicates Z: 6 11.559 1.972 0.795 0.704 1.000 1.000 CA 1.213 6 residues pruned to eliminate duplicates Z: 11 25.562 2.195 1.105 0.890 1.000 0.700 CB 1.259 11 residues pruned to eliminate duplicates Z: 16 30.020 2.250 0.591 0.939 0.933 0.933 CB 1.612 16 residues pruned to eliminate duplicates Z: 37 45.128 2.153 0.773 0.801 1.000 0.778 CB 1.515 37 residues pruned to eliminate duplicates Z: 6 7.704 1.858 0.634 0.524 1.000 0.400 CB 1.108 6 residues pruned to eliminate duplicates Z: 6 10.008 2.037 0.630 0.638 0.800 0.400 CB 1.480 6 residues pruned to eliminate duplicates Z: 14 31.898 2.312 0.847 0.841 0.923 0.615 CA 1.674 14 residues pruned to eliminate duplicates Z: 14 31.463 2.178 1.140 0.904 1.000 0.692 CB 1.333 14 residues pruned to eliminate duplicates Z: 13 22.642 2.136 0.580 0.892 0.917 0.583 CB 1.518 13 residues pruned to eliminate duplicates Z: 11 22.863 2.102 1.087 0.917 0.900 0.600 CB 1.293 11 residues pruned to eliminate duplicates Z: 16 32.221 2.159 0.865 0.848 0.933 0.867 CA 1.642 16 residues pruned to eliminate duplicates Z: 32 21.581 1.875 0.708 0.583 0.935 0.581 CB 1.194 32 residues pruned to eliminate duplicates Z: 44 30.278 2.012 0.779 0.570 0.907 0.721 CB 1.328 44 residues pruned to eliminate duplicates Z: 28 46.192 2.282 0.869 0.812 0.963 0.852 CB 1.650 27 residues pruned to eliminate duplicates Z: 6 9.890 1.926 1.134 0.475 1.000 1.000 CA 1.104 6 residues pruned to eliminate duplicates Z: 34 36.875 2.306 0.711 0.580 0.909 0.697 CB 1.657 34 residues pruned to eliminate duplicates Z: 10 6.675 1.707 0.679 0.509 0.889 0.556 CB 0.866 Z: 14 10.789 2.022 0.600 0.279 0.923 0.538 CA 1.287 15 residues pruned to eliminate duplicates Z: 8 8.343 1.854 0.880 0.495 0.857 0.857 CB 1.061 8 residues pruned to eliminate duplicates Z: 35 29.205 2.020 0.709 0.675 0.941 0.735 CB 1.312 35 residues pruned to eliminate duplicates Z: 17 31.242 2.064 0.965 0.846 0.938 0.688 CB 1.527 17 residues pruned to eliminate duplicates Z: 29 52.150 2.253 0.892 0.942 1.000 0.964 CB 1.603 29 residues pruned to eliminate duplicates Z: 7 17.563 2.155 0.839 0.805 1.000 0.667 CB 1.387 7 residues pruned to eliminate duplicates Z: 15 23.607 2.099 0.808 0.922 0.929 0.857 CB 1.259 15 residues pruned to eliminate duplicates Z: 15 34.079 2.215 1.252 0.919 0.929 0.643 CB 1.386 15 residues pruned to eliminate duplicates Z: 48 33.384 2.127 0.816 0.612 0.957 0.723 CB 1.184 55 residues pruned to eliminate duplicates Z: 17 31.424 2.309 0.501 0.933 1.000 1.000 CB 1.582 17 residues pruned to eliminate duplicates Z: 50 32.957 2.081 0.755 0.532 0.918 0.633 CB 1.360 51 residues pruned to eliminate duplicates Z: 15 30.905 2.198 1.170 0.904 0.929 0.786 CB 1.328 15 residues pruned to eliminate duplicates Z: 14 31.180 2.249 0.727 0.916 1.000 1.000 CB 1.572 14 residues pruned to eliminate duplicates Z: 23 34.238 2.196 0.982 0.812 0.909 0.773 CB 1.405 23 residues pruned to eliminate duplicates Z: 32 37.365 2.314 1.036 0.662 0.903 0.548 CB 1.357 32 residues pruned to eliminate duplicates Z: 24 52.707 2.284 1.252 0.942 0.957 0.783 CB 1.550 24 residues pruned to eliminate duplicates Z: 14 14.564 1.724 0.449 0.923 1.000 1.000 CB 1.136 14 residues pruned to eliminate duplicates Z: 9 6.148 1.642 0.416 0.506 0.875 0.500 CB 1.062 Z: 14 22.238 2.207 0.638 0.835 0.846 0.615 CA 1.510 14 residues pruned to eliminate duplicates Z: 19 31.626 2.052 0.971 0.870 1.000 0.556 CB 1.345 19 residues pruned to eliminate duplicates 7 1.642 1.526 0.047 0.248 0.500 0.500 CB 1.122 ? Z: 90 80.203 2.349 0.967 0.743 0.944 0.730 CB 1.569 90 residues pruned to eliminate duplicates Z: 50 46.601 2.286 0.870 0.541 0.939 0.633 CB 1.594 50 residues pruned to eliminate duplicates Z: 28 48.083 2.184 0.950 0.932 0.963 0.741 CB 1.575 28 residues pruned to eliminate duplicates Z: 17 30.181 2.197 0.524 0.921 1.000 1.000 CB 1.586 17 residues pruned to eliminate duplicates Z: 6 11.382 2.048 0.798 0.706 1.000 1.000 CA 1.146 6 residues pruned to eliminate duplicates Z: 8 11.355 2.019 0.761 0.453 0.857 0.571 CB 1.478 8 residues pruned to eliminate duplicates Z: 37 41.530 2.167 1.189 0.650 0.972 0.639 CB 1.305 37 residues pruned to eliminate duplicates Z: 16 25.409 2.067 0.757 0.915 1.000 1.000 CB 1.277 16 residues pruned to eliminate duplicates Z: 18 26.887 2.200 0.965 0.613 0.882 0.706 CA 1.536 18 residues pruned to eliminate duplicates Z: 15 19.397 2.105 0.447 0.898 1.000 0.929 CB 1.217 15 residues pruned to eliminate duplicates Z: 30 31.928 2.117 0.863 0.693 1.000 0.759 CB 1.260 30 residues pruned to eliminate duplicates Z: 8 11.130 1.721 0.852 0.677 1.000 0.714 N 1.121 Z: 14 22.471 2.221 0.597 0.834 0.846 0.769 CA 1.556 14 residues pruned to eliminate duplicates Z: 10 16.531 2.129 0.813 0.602 1.000 0.778 CA 1.295 10 residues pruned to eliminate duplicates Z: 17 37.258 2.084 1.302 0.872 1.000 0.375 CB 1.415 17 residues pruned to eliminate duplicates Z: 27 18.605 1.920 0.497 0.637 0.962 0.654 CB 1.161 25 residues pruned to eliminate duplicates Z: 14 22.299 2.050 0.688 0.829 0.923 0.692 CB 1.457 14 residues pruned to eliminate duplicates Z: 17 38.475 2.222 0.975 0.904 1.000 0.500 CA 1.562 17 residues pruned to eliminate duplicates Z: 12 15.273 2.100 0.375 0.801 0.909 0.727 CB 1.348 12 residues pruned to eliminate duplicates Z: 61 38.928 2.091 0.869 0.538 0.967 0.667 CB 1.282 61 residues pruned to eliminate duplicates Z: 16 39.489 2.214 1.354 0.918 0.933 0.733 CB 1.478 16 residues pruned to eliminate duplicates Z: 12 14.827 2.108 0.302 0.849 0.818 0.636 CA 1.476 12 residues pruned to eliminate duplicates Z: 31 26.873 1.871 0.869 0.606 0.967 0.400 CB 1.313 31 residues pruned to eliminate duplicates Z: 7 7.063 1.768 0.303 0.849 1.000 1.000 CB 0.928 Z: 14 18.391 1.819 0.609 0.938 1.000 0.615 CB 1.212 14 residues pruned to eliminate duplicates Z: 7 9.342 1.656 0.860 0.785 0.667 0.333 CA 1.445 7 residues pruned to eliminate duplicates Z: 16 12.396 2.071 1.027 0.358 0.667 0.467 CB 1.332 16 residues pruned to eliminate duplicates Z: 13 22.564 2.130 0.662 0.868 0.917 0.833 CB 1.467 13 residues pruned to eliminate duplicates Z: 17 40.657 2.194 1.162 0.923 1.000 0.750 CB 1.506 17 residues pruned to eliminate duplicates Z: 23 33.789 2.000 1.191 0.872 0.909 0.773 CB 1.318 23 residues pruned to eliminate duplicates Z: 7 11.402 1.682 1.111 0.786 1.000 0.833 CB 1.019 7 residues pruned to eliminate duplicates Z: 17 30.522 2.203 0.697 0.896 1.000 0.750 CB 1.462 17 residues pruned to eliminate duplicates Z: 11 7.123 1.874 0.570 0.333 0.800 0.400 CB 1.149 10 residues pruned to eliminate duplicates Z: 17 26.548 2.074 0.729 0.883 1.000 0.875 CB 1.339 17 residues pruned to eliminate duplicates Z: 23 26.317 2.031 0.543 0.864 0.909 0.818 CB 1.444 23 residues pruned to eliminate duplicates Z: 6 8.812 1.978 0.590 0.527 0.800 0.600 CA 1.526 6 residues pruned to eliminate duplicates Z: 27 36.286 2.266 0.927 0.614 0.923 0.577 CA 1.584 27 residues pruned to eliminate duplicates Z: 17 17.814 2.028 0.653 0.620 0.875 0.375 CB 1.356 17 residues pruned to eliminate duplicates Z: 8 21.344 2.431 0.950 0.506 1.000 0.429 CB 1.691 8 residues pruned to eliminate duplicates Z: 13 22.943 2.190 0.559 0.904 0.917 0.833 CB 1.507 13 residues pruned to eliminate duplicates Z: 27 31.547 2.079 0.873 0.753 0.962 0.808 CB 1.318 27 residues pruned to eliminate duplicates Z: 28 29.944 2.018 0.848 0.726 1.000 0.778 CB 1.260 28 residues pruned to eliminate duplicates Z: 35 21.368 1.858 0.703 0.573 0.912 0.647 CB 1.183 13 residues pruned to eliminate duplicates Z: 15 38.313 2.272 1.009 0.924 1.000 0.786 CB 1.576 15 residues pruned to eliminate duplicates Z: 55 31.033 2.052 0.779 0.579 0.963 0.556 CB 1.113 55 residues pruned to eliminate duplicates Z: 49 32.906 2.113 0.829 0.594 0.938 0.667 CB 1.198 49 residues pruned to eliminate duplicates Z: 18 18.635 2.131 0.600 0.456 0.941 0.706 CB 1.473 18 residues pruned to eliminate duplicates Z: 15 8.335 1.684 0.361 0.449 0.786 0.571 CB 1.302 5 residues pruned to eliminate duplicates Z: 13 19.679 1.891 0.628 0.926 1.000 0.750 CB 1.294 13 residues pruned to eliminate duplicates Z: 21 20.056 1.971 0.645 0.570 0.900 0.700 CB 1.437 14 residues pruned to eliminate duplicates Z: 27 18.470 1.872 0.529 0.675 0.923 0.692 CB 1.167 27 residues pruned to eliminate duplicates Z: 29 53.192 2.155 1.001 0.907 1.000 0.607 CB 1.657 40 residues pruned to eliminate duplicates Z: 7 3.983 1.904 0.547 0.342 0.500 0.500 CA 1.311 7 residues pruned to eliminate duplicates Z: 36 36.764 2.121 0.702 0.653 1.000 0.686 CB 1.493 36 residues pruned to eliminate duplicates Z: 24 35.013 2.129 0.850 0.841 0.957 0.696 CA 1.445 24 residues pruned to eliminate duplicates Z: 102 77.189 2.198 1.014 0.677 0.931 0.624 CB 1.585 89 residues pruned to eliminate duplicates Z: 14 8.730 1.696 0.424 0.758 0.846 0.692 CB 0.942 8 residues pruned to eliminate duplicates Z: 30 52.606 2.298 0.826 0.931 1.000 0.931 CB 1.627 30 residues pruned to eliminate duplicates Z: 20 13.934 1.836 0.658 0.485 0.842 0.474 CB 1.266 8 residues pruned to eliminate duplicates Z: 13 13.963 1.743 0.427 0.919 1.000 0.917 CA 1.142 13 residues pruned to eliminate duplicates Z: 13 14.656 1.912 0.522 0.608 1.000 0.500 CB 1.312 13 residues pruned to eliminate duplicates Z: 17 29.949 2.051 1.040 0.885 1.000 0.750 CB 1.292 17 residues pruned to eliminate duplicates Z: 70 69.666 2.271 0.865 0.771 0.913 0.797 CB 1.706 70 residues pruned to eliminate duplicates Z: 14 11.696 1.869 0.620 0.394 1.000 0.385 CB 1.199 14 residues pruned to eliminate duplicates Z: 9 13.502 1.909 0.570 0.775 0.875 0.500 CA 1.428 9 residues pruned to eliminate duplicates Z: 6 6.589 1.935 0.367 0.535 1.000 0.200 CB 1.076 6 residues pruned to eliminate duplicates Z: 32 30.887 2.006 0.900 0.591 0.935 0.548 CB 1.426 32 residues pruned to eliminate duplicates Z: 7 12.693 1.652 0.747 0.862 1.000 0.833 CB 1.319 7 residues pruned to eliminate duplicates Z: 16 37.002 2.106 1.317 0.901 1.000 0.467 CB 1.397 16 residues pruned to eliminate duplicates Z: 14 20.036 1.905 0.734 0.893 1.000 0.769 CB 1.207 14 residues pruned to eliminate duplicates Z: 14 22.381 1.888 0.869 0.914 1.000 0.769 CB 1.244 14 residues pruned to eliminate duplicates Z: 67 38.789 2.195 0.695 0.547 0.848 0.652 CB 1.444 67 residues pruned to eliminate duplicates Z: 18 26.352 1.939 1.045 0.804 0.882 0.765 CB 1.401 18 residues pruned to eliminate duplicates Z: 17 31.754 2.091 1.068 0.848 0.938 0.625 CB 1.453 17 residues pruned to eliminate duplicates Z: 13 23.096 2.152 0.620 0.908 0.917 0.667 CB 1.482 13 residues pruned to eliminate duplicates Z: 6 5.575 1.710 0.055 0.709 1.000 0.600 CB 1.143 6 residues pruned to eliminate duplicates Z: 7 5.532 1.895 -0.026 0.654 1.000 0.667 CA 1.060 7 residues pruned to eliminate duplicates Z: 87 65.733 2.314 0.881 0.694 0.895 0.721 CB 1.524 101 residues pruned to eliminate duplicates Z: 17 30.418 2.183 0.648 0.919 0.938 0.875 CB 1.589 17 residues pruned to eliminate duplicates Z: 30 44.839 2.109 0.669 0.875 1.000 0.897 CA 1.721 30 residues pruned to eliminate duplicates Z: 56 37.111 2.117 0.843 0.553 0.891 0.618 CB 1.367 56 residues pruned to eliminate duplicates Z: 7 11.043 1.895 0.336 0.815 1.000 0.833 CB 1.354 7 residues pruned to eliminate duplicates Z: 87 78.319 2.321 1.132 0.723 0.930 0.721 CB 1.500 87 residues pruned to eliminate duplicates Z: 14 20.781 1.910 0.677 0.933 1.000 0.846 CB 1.255 14 residues pruned to eliminate duplicates Z: 25 37.133 2.167 0.510 0.914 1.000 0.917 CB 1.638 25 residues pruned to eliminate duplicates Z: 25 44.128 2.187 1.080 0.914 1.000 0.625 CB 1.400 25 residues pruned to eliminate duplicates Z: 7 4.235 1.473 0.253 0.726 0.833 0.667 CB 0.917 7 residues pruned to eliminate duplicates Z: 10 19.870 2.136 0.759 0.698 1.000 0.556 CB 1.471 10 residues pruned to eliminate duplicates Z: 11 23.833 2.088 0.853 0.900 1.000 1.000 CB 1.391 11 residues pruned to eliminate duplicates Z: 16 22.134 2.144 0.933 0.668 0.933 0.733 CB 1.264 15 residues pruned to eliminate duplicates Z: 37 43.739 2.178 1.143 0.615 1.000 0.667 CB 1.401 37 residues pruned to eliminate duplicates Z: 18 17.288 1.871 0.974 0.869 0.941 0.588 CB 0.881 18 residues pruned to eliminate duplicates Z: 40 22.893 2.008 0.717 0.493 0.821 0.538 CB 1.305 40 residues pruned to eliminate duplicates Z: 9 7.287 1.507 0.660 0.827 0.875 0.875 CB 0.887 9 residues pruned to eliminate duplicates Z: 22 30.378 2.028 0.768 0.905 0.952 0.857 CB 1.381 22 residues pruned to eliminate duplicates Z: 24 29.133 2.056 0.932 0.648 0.957 0.652 CB 1.393 24 residues pruned to eliminate duplicates Z: 16 25.931 2.096 0.689 0.872 1.000 0.733 CB 1.378 16 residues pruned to eliminate duplicates Z: 13 8.861 1.812 0.480 0.541 0.917 0.667 CB 0.999 13 residues pruned to eliminate duplicates Z: 15 34.873 2.332 0.956 0.913 0.929 0.786 CB 1.557 15 residues pruned to eliminate duplicates Z: 18 23.557 2.081 0.839 0.612 0.941 0.824 CB 1.427 22 residues pruned to eliminate duplicates Z: 17 25.184 2.002 0.840 0.897 0.875 0.500 CB 1.398 17 residues pruned to eliminate duplicates Z: 6 5.272 1.669 0.291 0.651 0.800 0.800 CA 1.189 6 residues pruned to eliminate duplicates Z: 13 6.205 1.765 0.667 0.389 0.833 0.583 CB 0.821 13 residues pruned to eliminate duplicates Z: 14 18.721 1.869 0.730 0.923 1.000 0.923 CB 1.129 14 residues pruned to eliminate duplicates Z: 16 19.471 1.985 0.856 0.854 0.933 0.667 CB 1.080 16 residues pruned to eliminate duplicates Z: 42 35.557 2.073 0.931 0.645 0.878 0.585 CB 1.380 40 residues pruned to eliminate duplicates Z: 14 10.480 2.066 0.292 0.437 0.923 0.615 CB 1.260 14 residues pruned to eliminate duplicates Z: 25 18.655 1.815 0.805 0.666 0.875 0.542 CB 1.139 25 residues pruned to eliminate duplicates Z: 12 15.468 1.948 0.776 0.622 0.909 0.636 CB 1.322 12 residues pruned to eliminate duplicates Z: 11 16.883 2.079 0.964 0.587 1.000 0.700 CB 1.203 11 residues pruned to eliminate duplicates Z: 10 6.560 1.992 0.390 0.424 0.667 0.444 CB 1.283 10 residues pruned to eliminate duplicates Z: 84 81.566 2.333 1.137 0.731 0.952 0.711 CB 1.533 84 residues pruned to eliminate duplicates Z: 61 71.509 2.356 1.101 0.732 0.917 0.700 CB 1.651 61 residues pruned to eliminate duplicates Z: 6 8.997 1.987 0.430 0.839 1.000 0.600 CB 1.058 6 residues pruned to eliminate duplicates Z: 15 33.459 2.005 1.500 0.909 0.929 0.571 CB 1.363 15 residues pruned to eliminate duplicates Z: 10 11.588 1.868 0.897 0.564 0.889 0.667 CB 1.153 10 residues pruned to eliminate duplicates Z: 25 26.592 2.178 0.958 0.579 0.833 0.667 CB 1.416 25 residues pruned to eliminate duplicates Z: 19 23.256 2.072 0.756 0.581 0.944 0.722 CB 1.476 21 residues pruned to eliminate duplicates Z: 20 24.391 2.041 0.875 0.656 1.000 0.789 CB 1.265 20 residues pruned to eliminate duplicates Z: 13 18.824 2.123 0.362 0.886 0.917 0.833 CB 1.480 13 residues pruned to eliminate duplicates Z: 37 31.683 2.183 0.863 0.537 0.889 0.556 CB 1.408 36 residues pruned to eliminate duplicates Z: 6 4.656 1.742 0.145 0.491 1.000 0.800 CA 1.053 6 residues pruned to eliminate duplicates Z: 12 15.082 1.818 0.667 0.622 1.000 0.636 CB 1.337 12 residues pruned to eliminate duplicates Z: 14 15.254 1.808 0.295 0.937 1.000 1.000 CB 1.257 14 residues pruned to eliminate duplicates Z: 30 48.728 2.232 0.732 0.909 1.000 0.862 CA 1.662 30 residues pruned to eliminate duplicates Z: 14 19.164 1.893 0.763 0.918 1.000 0.692 CB 1.123 14 residues pruned to eliminate duplicates Z: 35 37.093 2.239 0.950 0.608 0.882 0.588 CB 1.491 35 residues pruned to eliminate duplicates Z: 24 21.723 2.248 0.588 0.408 0.870 0.739 CB 1.607 24 residues pruned to eliminate duplicates Z: 15 9.599 2.054 0.615 0.354 0.786 0.429 CB 1.152 15 residues pruned to eliminate duplicates Z: 13 15.520 1.982 0.835 0.435 0.917 0.750 CB 1.438 13 residues pruned to eliminate duplicates 6 1.383 1.264 0.274 0.295 0.600 0.600 CA 0.805 ? Z: 8 9.730 2.023 0.577 0.518 1.000 0.714 CB 1.132 6 residues pruned to eliminate duplicates Z: 9 4.127 1.390 0.519 0.476 0.875 0.375 O 0.809 9 residues pruned to eliminate duplicates Z: 59 61.024 2.280 0.967 0.723 0.914 0.759 CB 1.598 59 residues pruned to eliminate duplicates Z: 35 20.228 1.898 0.677 0.545 0.853 0.529 CB 1.223 35 residues pruned to eliminate duplicates Z: 13 7.946 1.959 0.454 0.333 0.750 0.500 CB 1.289 13 residues pruned to eliminate duplicates Z: 17 10.565 1.621 0.206 0.698 1.000 0.750 CB 1.128 15 residues pruned to eliminate duplicates Z: 51 41.320 2.215 0.822 0.546 0.900 0.620 CB 1.538 51 residues pruned to eliminate duplicates Z: 6 17.750 2.050 0.981 0.809 1.000 0.400 CB 1.493 6 residues pruned to eliminate duplicates Z: 11 8.717 1.743 0.780 0.360 0.800 0.500 CA 1.292 11 residues pruned to eliminate duplicates Z: 8 3.840 1.790 0.285 0.318 0.714 0.571 CB 1.080 Z: 17 13.147 2.019 0.490 0.598 0.938 0.625 CB 1.061 17 residues pruned to eliminate duplicates Z: 13 11.254 2.009 0.513 0.650 0.833 0.667 CB 1.115 13 residues pruned to eliminate duplicates Z: 17 13.080 2.033 0.335 0.486 0.938 0.688 CB 1.303 17 residues pruned to eliminate duplicates Z: 23 26.496 1.916 0.930 0.877 0.909 0.545 CB 1.220 23 residues pruned to eliminate duplicates Z: 30 31.901 2.167 0.754 0.805 0.828 0.724 CB 1.444 30 residues pruned to eliminate duplicates Z: 7 5.127 1.598 0.457 0.727 0.833 0.667 CB 0.880 7 residues pruned to eliminate duplicates Z: 30 60.420 2.264 1.272 0.890 0.966 0.655 CB 1.625 30 residues pruned to eliminate duplicates Z: 8 3.828 1.718 0.339 0.155 0.714 0.429 CB 1.343 8 residues pruned to eliminate duplicates Z: 41 31.652 2.097 0.809 0.542 0.950 0.725 CB 1.332 41 residues pruned to eliminate duplicates Z: 12 14.623 1.852 0.534 0.668 1.000 0.818 CB 1.328 12 residues pruned to eliminate duplicates Z: 13 19.381 2.047 1.091 0.570 0.917 0.667 CB 1.332 13 residues pruned to eliminate duplicates Z: 8 2.548 1.549 -0.058 0.348 0.714 0.571 CB 1.090 Z: 35 40.578 2.278 1.255 0.589 0.912 0.588 CB 1.364 35 residues pruned to eliminate duplicates Z: 25 40.490 2.186 0.811 0.900 0.958 0.833 CB 1.556 25 residues pruned to eliminate duplicates Z: 6 4.005 1.616 0.407 0.489 0.800 0.400 CB 0.995 Z: 21 23.719 1.992 0.505 0.848 0.950 0.750 CA 1.382 21 residues pruned to eliminate duplicates Z: 9 5.555 1.824 0.156 0.579 1.000 0.750 CB 0.863 9 residues pruned to eliminate duplicates Z: 24 38.401 2.229 0.776 0.830 0.957 0.739 CB 1.590 24 residues pruned to eliminate duplicates 6 1.139 1.283 -0.139 0.526 0.800 0.400 CB 0.562 ? Z: 6 5.749 1.877 0.653 0.866 1.000 1.000 CB 0.607 6 residues pruned to eliminate duplicates Z: 12 10.730 1.821 0.393 0.728 0.909 0.636 CB 1.142 12 residues pruned to eliminate duplicates Z: 9 6.680 1.698 0.178 0.400 1.000 0.375 CB 1.311 9 residues pruned to eliminate duplicates Z: 8 4.039 1.399 0.253 0.859 0.714 0.571 CB 0.897 8 residues pruned to eliminate duplicates Z: 30 46.674 2.198 0.777 0.831 0.931 0.690 CB 1.790 30 residues pruned to eliminate duplicates Z: 8 7.641 1.992 0.443 0.451 1.000 0.571 CB 1.057 8 residues pruned to eliminate duplicates Z: 25 38.711 2.145 0.828 0.879 0.958 0.917 CB 1.525 25 residues pruned to eliminate duplicates Z: 15 24.267 2.064 0.780 0.881 0.929 0.786 CB 1.377 15 residues pruned to eliminate duplicates Z: 33 20.460 1.733 0.824 0.578 0.938 0.438 CB 1.133 33 residues pruned to eliminate duplicates Z: 9 10.762 1.864 0.437 0.563 1.000 0.625 CA 1.336 9 residues pruned to eliminate duplicates Z: 48 40.302 2.136 0.999 0.636 0.957 0.723 CB 1.266 48 residues pruned to eliminate duplicates Z: 16 11.606 1.871 0.678 0.409 0.800 0.533 CB 1.313 16 residues pruned to eliminate duplicates Z: 14 23.665 2.100 0.893 0.835 0.846 0.462 CB 1.461 14 residues pruned to eliminate duplicates Z: 12 14.505 1.908 0.616 0.516 0.909 0.636 CB 1.537 12 residues pruned to eliminate duplicates Z: 19 26.342 2.015 1.044 0.869 1.000 0.611 CB 1.102 19 residues pruned to eliminate duplicates Z: 6 3.119 1.948 -0.260 0.483 0.800 0.400 CB 1.230 6 residues pruned to eliminate duplicates Z: 9 6.850 1.420 0.735 0.391 1.000 0.625 N 1.103 Z: 15 12.605 1.944 0.467 0.458 0.857 0.571 CB 1.439 15 residues pruned to eliminate duplicates Z: 24 19.568 2.073 0.568 0.413 1.000 0.696 CB 1.375 24 residues pruned to eliminate duplicates Z: 11 5.618 1.931 0.265 0.373 0.800 0.400 CB 1.042 10 residues pruned to eliminate duplicates Z: 7 10.442 1.836 0.621 0.762 1.000 0.833 CA 1.135 7 residues pruned to eliminate duplicates Z: 6 14.818 1.781 1.261 0.683 1.000 1.000 CB 1.391 Z: 6 7.461 1.801 0.411 0.794 0.800 0.400 CB 1.269 6 residues pruned to eliminate duplicates Z: 6 6.536 1.628 0.438 0.795 0.800 0.600 CB 1.205 6 residues pruned to eliminate duplicates Z: 73 83.705 2.378 1.092 0.775 0.944 0.792 CB 1.647 73 residues pruned to eliminate duplicates Z: 17 17.167 1.963 0.828 0.844 0.875 0.750 CB 1.017 17 residues pruned to eliminate duplicates Z: 16 45.573 2.269 1.233 0.938 1.000 0.933 CB 1.615 16 residues pruned to eliminate duplicates Z: 46 61.742 2.360 1.190 0.698 0.956 0.711 CB 1.555 46 residues pruned to eliminate duplicates Z: 9 11.377 2.208 0.498 0.764 0.750 0.750 CB 1.283 9 residues pruned to eliminate duplicates Z: 16 13.565 1.761 0.682 0.461 0.933 0.733 CB 1.319 16 residues pruned to eliminate duplicates Z: 15 19.391 1.719 0.787 0.920 1.000 0.857 CB 1.188 15 residues pruned to eliminate duplicates Z: 30 12.847 1.631 0.616 0.560 0.897 0.414 CB 0.952 30 residues pruned to eliminate duplicates Z: 16 37.955 2.192 1.235 0.920 0.933 0.733 CB 1.510 16 residues pruned to eliminate duplicates Z: 27 24.327 2.016 0.572 0.747 1.000 0.846 CB 1.207 27 residues pruned to eliminate duplicates Z: 8 13.073 2.092 1.249 0.601 0.857 0.857 CB 1.113 8 residues pruned to eliminate duplicates Z: 12 14.803 1.813 0.654 0.668 1.000 0.727 CB 1.274 12 residues pruned to eliminate duplicates Z: 17 21.340 2.026 0.771 0.550 0.938 0.625 CB 1.511 17 residues pruned to eliminate duplicates Z: 14 20.585 1.885 0.865 0.911 1.000 0.692 CB 1.151 14 residues pruned to eliminate duplicates Z: 6 5.618 1.926 0.830 0.294 0.800 0.600 CA 1.122 6 residues pruned to eliminate duplicates Z: 25 27.297 2.060 0.820 0.659 0.958 0.458 CB 1.338 25 residues pruned to eliminate duplicates Z: 26 37.359 2.160 1.069 0.706 1.000 0.760 CB 1.386 26 residues pruned to eliminate duplicates Z: 26 32.081 2.144 1.001 0.575 0.920 0.600 CB 1.512 26 residues pruned to eliminate duplicates Z: 9 6.006 1.865 0.395 0.518 0.750 0.625 CB 1.069 11 residues pruned to eliminate duplicates Z: 31 44.988 2.191 1.006 0.807 0.933 0.467 CB 1.531 31 residues pruned to eliminate duplicates Z: 7 7.800 1.833 0.290 0.810 1.000 0.667 CB 1.028 7 residues pruned to eliminate duplicates Z: 8 13.164 2.075 0.890 0.697 0.714 0.571 CA 1.484 8 residues pruned to eliminate duplicates Z: 26 18.174 1.801 0.598 0.727 0.920 0.680 CB 1.119 26 residues pruned to eliminate duplicates Z: 28 42.026 2.308 0.773 0.804 0.926 0.815 CB 1.637 28 residues pruned to eliminate duplicates Z: 31 25.773 2.103 0.810 0.419 0.867 0.667 CB 1.552 31 residues pruned to eliminate duplicates Z: 14 18.572 1.759 0.907 0.929 1.000 0.846 CB 1.074 14 residues pruned to eliminate duplicates Z: 13 14.657 1.807 0.424 0.921 1.000 1.000 CB 1.157 13 residues pruned to eliminate duplicates Z: 15 18.551 1.713 0.777 0.895 1.000 0.571 CB 1.167 15 residues pruned to eliminate duplicates Z: 29 46.083 2.215 0.772 0.916 0.964 0.857 CB 1.626 29 residues pruned to eliminate duplicates Z: 14 12.721 1.776 0.150 0.919 1.000 0.923 CB 1.218 14 residues pruned to eliminate duplicates Z: 12 16.788 2.003 0.959 0.700 0.909 0.545 CB 1.182 12 residues pruned to eliminate duplicates Z: 6 6.324 1.829 0.392 0.552 0.800 0.600 CA 1.320 6 residues pruned to eliminate duplicates Z: 24 27.302 1.958 0.733 0.887 0.957 0.826 CB 1.264 24 residues pruned to eliminate duplicates Z: 13 7.983 1.683 0.699 0.717 0.833 0.667 CB 0.794 13 residues pruned to eliminate duplicates Z: 66 74.825 2.338 0.960 0.788 0.923 0.785 CB 1.704 66 residues pruned to eliminate duplicates Z: 15 7.658 1.467 0.527 0.643 0.786 0.429 CB 1.018 15 residues pruned to eliminate duplicates Z: 7 2.822 1.281 0.018 0.447 0.833 0.333 CA 1.120 Z: 8 4.526 1.747 0.006 0.674 1.000 0.714 CB 0.829 Z: 35 17.182 1.794 0.582 0.544 0.853 0.559 CB 1.167 35 residues pruned to eliminate duplicates Z: 10 6.719 1.769 0.566 0.331 0.889 0.333 CB 1.095 10 residues pruned to eliminate duplicates Z: 14 14.539 1.947 0.597 0.673 0.769 0.615 CA 1.438 14 residues pruned to eliminate duplicates Z: 60 57.640 2.224 1.099 0.674 0.898 0.661 CB 1.525 60 residues pruned to eliminate duplicates Z: 14 18.570 1.880 0.776 0.738 0.923 0.385 CB 1.350 14 residues pruned to eliminate duplicates Z: 7 13.468 1.967 0.986 0.668 1.000 0.667 CB 1.205 6 residues pruned to eliminate duplicates Z: 12 12.776 1.748 0.437 0.916 1.000 0.636 CB 1.083 12 residues pruned to eliminate duplicates Z: 8 12.064 1.979 0.603 0.478 0.857 0.857 CB 1.715 8 residues pruned to eliminate duplicates Z: 25 12.784 1.961 0.484 0.417 0.875 0.417 CB 1.118 25 residues pruned to eliminate duplicates Z: 8 6.574 1.837 0.350 0.743 0.714 0.571 CA 1.129 8 residues pruned to eliminate duplicates Z: 8 3.957 1.325 0.128 0.843 0.857 0.714 CB 0.869 8 residues pruned to eliminate duplicates Z: 18 17.475 2.037 0.779 0.484 0.824 0.529 CB 1.444 18 residues pruned to eliminate duplicates 6 1.074 1.579 -0.299 0.310 0.600 0.400 N 0.893 ? Z: 14 17.520 1.839 0.628 0.905 1.000 0.923 CB 1.155 14 residues pruned to eliminate duplicates Z: 13 21.018 1.817 1.081 0.928 1.000 0.833 CB 1.124 13 residues pruned to eliminate duplicates Z: 58 74.452 2.352 1.017 0.791 0.947 0.825 CB 1.699 58 residues pruned to eliminate duplicates Z: 9 19.474 2.197 0.681 0.771 1.000 0.500 CB 1.467 9 residues pruned to eliminate duplicates Z: 14 22.104 2.031 0.639 0.906 1.000 0.923 CB 1.310 14 residues pruned to eliminate duplicates Z: 14 19.213 1.787 0.873 0.945 1.000 0.615 CB 1.102 14 residues pruned to eliminate duplicates Z: 47 74.942 2.370 1.110 0.851 0.957 0.804 CB 1.710 47 residues pruned to eliminate duplicates Z: 35 40.692 2.227 0.858 0.644 0.971 0.559 CB 1.519 35 residues pruned to eliminate duplicates Z: 16 19.438 2.103 0.881 0.730 0.933 0.800 CB 1.105 16 residues pruned to eliminate duplicates Z: 44 23.052 2.036 0.597 0.437 0.884 0.535 CB 1.305 44 residues pruned to eliminate duplicates Z: 10 7.700 1.543 0.462 0.590 1.000 0.556 CB 1.044 8 residues pruned to eliminate duplicates Z: 32 47.280 2.258 0.962 0.644 1.000 0.645 CB 1.675 32 residues pruned to eliminate duplicates Z: 6 12.272 2.042 0.857 0.378 1.000 0.600 CA 1.648 6 residues pruned to eliminate duplicates Z: 17 15.910 1.991 0.633 0.851 0.875 0.750 CB 1.035 17 residues pruned to eliminate duplicates Z: 24 12.434 1.900 0.345 0.576 0.870 0.652 CB 1.085 24 residues pruned to eliminate duplicates Z: 7 12.019 1.996 0.618 0.791 0.833 0.833 CA 1.412 7 residues pruned to eliminate duplicates Z: 16 26.226 2.200 0.793 0.610 1.000 0.800 CA 1.546 16 residues pruned to eliminate duplicates Z: 17 21.786 1.954 1.132 0.614 0.938 0.688 CB 1.251 17 residues pruned to eliminate duplicates Z: 12 4.490 2.003 0.365 0.415 0.545 0.364 CB 0.992 12 residues pruned to eliminate duplicates Z: 9 4.549 1.744 0.139 0.174 0.875 0.500 CA 1.371 9 residues pruned to eliminate duplicates Z: 10 9.220 1.994 0.080 0.778 0.778 0.444 CB 1.436 10 residues pruned to eliminate duplicates Z: 12 15.719 1.993 0.689 0.695 1.000 0.636 CB 1.178 12 residues pruned to eliminate duplicates Z: 12 18.609 1.823 1.032 0.848 0.909 0.545 CB 1.236 12 residues pruned to eliminate duplicates Z: 8 13.415 1.955 1.039 0.832 0.714 0.000 CA 1.336 8 residues pruned to eliminate duplicates Z: 49 63.707 2.381 1.194 0.675 0.979 0.646 CB 1.530 49 residues pruned to eliminate duplicates Z: 6 4.297 1.558 0.298 0.605 1.000 0.800 CB 0.860 Z: 10 5.805 1.419 0.263 0.824 0.889 0.444 CB 0.917 10 residues pruned to eliminate duplicates Z: 32 43.525 2.163 1.185 0.629 1.000 0.774 CB 1.465 32 residues pruned to eliminate duplicates Z: 12 19.419 1.977 0.759 0.722 1.000 0.818 CB 1.378 12 residues pruned to eliminate duplicates Z: 40 42.331 2.299 0.888 0.506 0.949 0.692 CB 1.637 40 residues pruned to eliminate duplicates Z: 15 12.343 1.853 0.497 0.556 1.000 0.571 CB 1.126 15 residues pruned to eliminate duplicates Z: 24 25.550 1.928 0.848 0.846 0.870 0.783 CB 1.278 23 residues pruned to eliminate duplicates Z: 10 12.266 1.937 0.782 0.548 1.000 0.556 CB 1.131 10 residues pruned to eliminate duplicates Z: 17 9.696 1.821 0.885 0.309 0.688 0.562 CB 1.270 17 residues pruned to eliminate duplicates Z: 8 3.691 1.593 0.243 0.326 0.714 0.571 CB 1.194 8 residues pruned to eliminate duplicates 8 1.783 1.317 0.463 0.304 0.714 0.429 CA 0.609 ? Z: 44 39.232 2.142 1.017 0.540 0.953 0.651 CB 1.396 44 residues pruned to eliminate duplicates Z: 20 13.159 1.558 0.684 0.694 0.947 0.526 CB 1.017 20 residues pruned to eliminate duplicates Z: 6 5.968 1.534 0.678 0.783 1.000 0.600 CB 0.808 5 residues pruned to eliminate duplicates Z: 40 24.604 2.035 0.653 0.490 0.897 0.590 CB 1.318 40 residues pruned to eliminate duplicates 6 1.866 1.483 0.506 0.312 0.600 0.600 CB 0.767 ? Z: 7 5.378 1.833 0.453 0.467 0.667 0.667 CB 1.279 7 residues pruned to eliminate duplicates Z: 20 24.623 2.117 0.718 0.610 0.947 0.579 CB 1.477 20 residues pruned to eliminate duplicates Z: 16 36.712 2.237 0.951 0.940 0.933 0.867 CB 1.615 16 residues pruned to eliminate duplicates Z: 10 6.181 1.762 0.378 0.569 0.778 0.556 CB 1.020 10 residues pruned to eliminate duplicates Z: 8 6.941 1.585 0.740 0.488 0.857 0.571 CB 1.123 5 residues pruned to eliminate duplicates Z: 37 30.777 2.131 0.861 0.496 0.917 0.611 CB 1.417 37 residues pruned to eliminate duplicates Z: 8 4.134 1.773 0.427 0.744 0.571 0.429 CB 0.869 Z: 35 30.630 2.102 0.845 0.639 1.000 0.706 CB 1.189 35 residues pruned to eliminate duplicates Z: 15 29.171 2.166 0.901 0.835 0.929 0.571 CB 1.528 15 residues pruned to eliminate duplicates Z: 10 15.213 1.806 1.072 0.832 0.889 0.667 CB 1.145 10 residues pruned to eliminate duplicates Z: 17 19.697 1.858 0.886 0.825 0.812 0.562 CB 1.305 17 residues pruned to eliminate duplicates Z: 27 36.542 2.338 0.887 0.657 0.962 0.654 CB 1.460 27 residues pruned to eliminate duplicates Z: 29 27.216 2.124 0.802 0.617 0.857 0.643 CB 1.405 29 residues pruned to eliminate duplicates Z: 76 76.744 2.317 1.040 0.751 0.933 0.760 CB 1.605 76 residues pruned to eliminate duplicates Z: 8 3.262 1.439 0.535 0.213 0.714 0.429 N 1.095 Z: 90 80.473 2.240 0.963 0.718 0.944 0.719 CB 1.688 90 residues pruned to eliminate duplicates Z: 31 40.734 2.252 1.178 0.678 0.933 0.700 CB 1.380 31 residues pruned to eliminate duplicates Z: 13 17.820 2.091 0.432 0.844 0.917 0.667 CA 1.394 13 residues pruned to eliminate duplicates Z: 55 60.104 2.308 0.991 0.673 0.944 0.648 CB 1.606 55 residues pruned to eliminate duplicates Z: 11 7.281 1.584 0.897 0.289 0.800 0.600 CB 1.215 11 residues pruned to eliminate duplicates Z: 7 5.907 1.674 0.114 0.512 1.000 0.667 C 1.279 Z: 33 17.490 1.790 0.769 0.552 0.875 0.438 CB 1.060 33 residues pruned to eliminate duplicates Z: 45 31.164 2.043 0.886 0.550 0.886 0.614 CB 1.310 44 residues pruned to eliminate duplicates Z: 13 21.800 1.946 1.082 0.849 0.917 0.667 CB 1.256 13 residues pruned to eliminate duplicates Z: 16 26.344 2.230 0.801 0.651 1.000 0.733 CA 1.471 16 residues pruned to eliminate duplicates Z: 12 13.663 1.709 0.501 0.922 1.000 0.818 CB 1.130 12 residues pruned to eliminate duplicates Z: 12 15.484 2.106 0.693 0.516 1.000 0.727 CB 1.288 12 residues pruned to eliminate duplicates Z: 12 26.010 2.181 0.806 0.914 0.909 0.636 CB 1.549 12 residues pruned to eliminate duplicates Z: 26 23.398 2.045 0.911 0.571 0.840 0.600 CB 1.331 26 residues pruned to eliminate duplicates Z: 36 38.463 2.126 0.821 0.657 0.943 0.657 CB 1.540 36 residues pruned to eliminate duplicates Z: 10 24.952 2.280 1.217 0.764 0.889 0.778 CB 1.464 10 residues pruned to eliminate duplicates Z: 9 6.073 1.483 0.612 0.396 0.875 0.500 CB 1.145 Z: 54 50.723 2.270 0.853 0.584 0.943 0.698 CB 1.619 54 residues pruned to eliminate duplicates Z: 18 25.900 2.088 0.933 0.543 1.000 0.529 CB 1.492 18 residues pruned to eliminate duplicates Z: 44 42.707 2.257 0.998 0.618 0.930 0.628 CB 1.389 44 residues pruned to eliminate duplicates Z: 7 6.470 1.769 0.195 0.886 1.000 1.000 CB 0.901 7 residues pruned to eliminate duplicates Z: 13 28.358 2.276 0.647 0.914 1.000 0.833 CA 1.545 13 residues pruned to eliminate duplicates Z: 19 25.922 2.267 0.637 0.557 1.000 0.611 CB 1.557 19 residues pruned to eliminate duplicates Z: 21 28.990 2.116 0.690 0.773 0.950 0.950 CB 1.499 21 residues pruned to eliminate duplicates Z: 15 22.360 2.043 0.670 0.789 0.929 0.571 CB 1.463 15 residues pruned to eliminate duplicates Z: 16 27.883 2.221 0.795 0.664 0.933 0.733 CB 1.662 16 residues pruned to eliminate duplicates Z: 14 12.077 1.850 0.955 0.413 0.769 0.385 CA 1.319 14 residues pruned to eliminate duplicates Z: 16 24.709 1.990 0.973 0.892 1.000 0.667 CB 1.168 16 residues pruned to eliminate duplicates Z: 7 5.741 1.707 0.791 0.699 1.000 1.000 CB 0.640 Z: 11 16.065 2.338 0.374 0.343 1.000 0.800 CA 1.877 11 residues pruned to eliminate duplicates Z: 6 2.239 2.027 0.130 0.299 0.600 0.400 CB 0.912 6 residues pruned to eliminate duplicates Z: 6 11.622 1.771 0.644 0.840 1.000 0.800 CA 1.332 6 residues pruned to eliminate duplicates Z: 10 15.122 1.987 1.012 0.745 0.778 0.444 CB 1.303 10 residues pruned to eliminate duplicates Z: 7 3.628 1.404 0.769 0.533 0.667 0.500 CA 0.866 Z: 53 55.343 2.111 0.756 0.774 0.962 0.712 CB 1.690 61 residues pruned to eliminate duplicates Z: 6 5.876 2.102 0.319 0.475 0.800 0.600 CB 1.214 6 residues pruned to eliminate duplicates Z: 86 80.578 2.337 1.038 0.737 0.965 0.765 CB 1.538 86 residues pruned to eliminate duplicates Z: 9 5.633 1.865 0.615 0.301 0.625 0.500 CB 1.320 9 residues pruned to eliminate duplicates Z: 37 28.035 2.040 0.746 0.531 0.972 0.694 CB 1.309 37 residues pruned to eliminate duplicates Z: 6 6.596 1.494 0.784 0.739 1.000 0.600 C 0.893 Z: 8 4.994 1.543 0.579 0.535 0.857 0.571 CB 0.873 Z: 11 21.913 2.096 0.975 0.867 1.000 0.600 CB 1.225 11 residues pruned to eliminate duplicates Z: 20 27.553 2.228 0.901 0.539 0.947 0.526 CB 1.516 20 residues pruned to eliminate duplicates Z: 6 6.851 1.832 0.620 0.804 0.800 0.600 CB 0.990 6 residues pruned to eliminate duplicates Z: 7 7.653 1.706 0.630 0.583 1.000 0.667 CB 1.037 16 residues pruned to eliminate duplicates Z: 22 34.951 2.290 0.950 0.642 1.000 0.619 CB 1.495 22 residues pruned to eliminate duplicates Z: 6 3.490 1.506 0.485 0.495 0.600 0.600 O 1.169 Z: 70 79.175 2.327 1.230 0.738 0.957 0.623 CB 1.552 70 residues pruned to eliminate duplicates 801 residues left after pruning, divided into chains as follows: A: 31 B: 55 C: 95 D: 19 E: 86 F: 14 G: 186 H: 148 I: 35 J: 30 K: 102 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 43.15 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.554, Connect. = 0.793 for dens.mod. cycle 1 = 0.300, Contrast = 0.634, Connect. = 0.814 for dens.mod. cycle 2 = 0.300, Contrast = 0.774, Connect. = 0.834 for dens.mod. cycle 3 = 0.300, Contrast = 0.789, Connect. = 0.835 for dens.mod. cycle 4 = 0.300, Contrast = 0.806, Connect. = 0.836 for dens.mod. cycle 5 = 0.300, Contrast = 0.811, Connect. = 0.837 for dens.mod. cycle 6 = 0.300, Contrast = 0.817, Connect. = 0.838 for dens.mod. cycle 7 = 0.300, Contrast = 0.820, Connect. = 0.838 for dens.mod. cycle 8 = 0.300, Contrast = 0.822, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.822, Connect. = 0.839 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4050 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 985 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 16 44.125 2.451 0.973 0.911 0.933 0.800 CB 1.789 B: 15 22.028 2.112 0.488 0.867 0.929 0.929 CB 1.476 C: 24 51.457 2.415 0.995 0.941 0.957 0.783 CB 1.616 D: 26 50.417 2.278 1.034 0.902 0.960 0.920 CB 1.617 25 residues pruned to eliminate duplicates E: 37 28.343 2.045 0.679 0.599 0.944 0.583 CB 1.325 F: 16 49.595 2.472 1.245 0.932 0.933 0.933 CB 1.727 16 residues pruned to eliminate duplicates G: 13 23.800 2.274 0.425 0.867 1.000 0.750 CB 1.551 12 residues pruned to eliminate duplicates H: 55 52.950 2.405 0.773 0.579 0.926 0.741 CB 1.691 27 residues pruned to eliminate duplicates I: 25 52.361 2.343 0.997 0.931 1.000 0.583 CB 1.596 25 residues pruned to eliminate duplicates J: 15 46.810 2.491 1.125 0.924 0.929 0.929 CB 1.787 K: 14 48.670 2.673 0.836 0.927 1.000 0.846 CB 1.928 14 residues pruned to eliminate duplicates L: 26 46.071 2.295 0.773 0.880 0.960 0.880 CB 1.709 26 residues pruned to eliminate duplicates M: 24 55.237 2.418 1.138 0.946 0.957 0.565 CB 1.611 24 residues pruned to eliminate duplicates N: 16 31.960 2.331 0.646 0.872 0.867 0.733 CB 1.809 O: 106 59.239 2.281 0.717 0.593 0.914 0.486 CB 1.476 37 residues pruned to eliminate duplicates P: 32 56.593 2.368 0.828 0.912 0.935 0.774 CB 1.778 Q: 30 49.756 2.340 0.702 0.891 0.966 0.690 CB 1.727 30 residues pruned to eliminate duplicates R: 50 53.349 2.454 0.732 0.599 0.959 0.776 CB 1.701 50 residues pruned to eliminate duplicates S: 14 30.302 2.331 0.471 0.911 1.000 0.923 CB 1.737 T: 24 53.067 2.315 1.031 0.860 1.000 0.478 CB 1.730 U: 19 41.568 2.268 1.158 0.876 0.944 0.722 CB 1.541 19 residues pruned to eliminate duplicates V: 24 53.407 2.411 1.094 0.943 0.957 0.739 CB 1.598 24 residues pruned to eliminate duplicates W: 16 48.321 2.383 1.051 0.930 1.000 0.933 CB 1.785 16 residues pruned to eliminate duplicates X: 30 61.101 2.310 0.976 0.918 0.966 0.828 CB 1.816 Y: 23 47.843 2.394 0.800 0.848 1.000 0.682 CA 1.756 23 residues pruned to eliminate duplicates Z: 25 50.554 2.324 1.004 0.937 0.958 0.750 CB 1.609 25 residues pruned to eliminate duplicates Z: 22 39.351 2.304 0.845 0.866 0.857 0.810 CA 1.725 22 residues pruned to eliminate duplicates Z: 31 60.333 2.407 0.943 0.914 0.933 0.833 CB 1.784 32 residues pruned to eliminate duplicates Z: 17 44.314 2.461 0.878 0.896 0.938 0.625 CB 1.831 17 residues pruned to eliminate duplicates Z: 14 30.322 2.212 0.776 0.609 1.000 0.846 CB 1.930 Z: 15 28.667 2.256 0.593 0.845 0.929 0.714 CA 1.707 Z: 19 47.253 2.288 1.071 0.887 1.000 0.722 CB 1.695 Z: 75 70.653 2.409 0.837 0.618 0.973 0.770 CB 1.705 69 residues pruned to eliminate duplicates Z: 48 52.358 2.402 0.911 0.568 0.915 0.766 CB 1.704 47 residues pruned to eliminate duplicates Z: 24 46.269 2.369 0.954 0.832 0.913 0.522 CB 1.714 24 residues pruned to eliminate duplicates Z: 16 40.257 2.466 0.611 0.924 1.000 0.933 CB 1.837 16 residues pruned to eliminate duplicates Z: 14 32.511 2.284 0.938 0.921 1.000 0.846 CB 1.434 16 residues pruned to eliminate duplicates Z: 14 27.342 2.284 0.602 0.898 1.000 0.846 CB 1.481 14 residues pruned to eliminate duplicates Z: 31 53.823 2.256 0.763 0.879 1.000 0.833 CB 1.792 31 residues pruned to eliminate duplicates Z: 7 12.603 2.173 0.602 0.550 1.000 0.500 CB 1.408 Z: 24 33.388 2.273 0.814 0.833 0.826 0.609 CB 1.534 24 residues pruned to eliminate duplicates Z: 17 48.634 2.426 0.917 0.927 1.000 0.938 CB 1.832 17 residues pruned to eliminate duplicates Z: 30 59.416 2.399 1.055 0.932 0.897 0.759 CB 1.743 30 residues pruned to eliminate duplicates Z: 18 51.773 2.336 1.076 0.929 1.000 0.765 CB 1.812 19 residues pruned to eliminate duplicates Z: 106 84.557 2.362 0.841 0.674 0.924 0.733 CB 1.749 76 residues pruned to eliminate duplicates Z: 17 47.114 2.317 1.137 0.910 1.000 0.750 CB 1.688 17 residues pruned to eliminate duplicates Z: 16 48.362 2.458 1.200 0.921 1.000 0.800 CB 1.625 16 residues pruned to eliminate duplicates Z: 18 39.200 2.277 0.726 0.899 1.000 0.941 CA 1.729 18 residues pruned to eliminate duplicates Z: 26 46.049 2.265 0.883 0.901 0.920 0.680 CB 1.675 26 residues pruned to eliminate duplicates Z: 15 30.032 2.066 1.053 0.869 0.929 0.571 CB 1.489 Z: 24 37.325 2.288 0.677 0.836 0.913 0.696 CB 1.664 24 residues pruned to eliminate duplicates Z: 15 42.613 2.485 0.753 0.929 1.000 0.857 CB 1.830 15 residues pruned to eliminate duplicates Z: 16 48.573 2.394 1.077 0.938 1.000 0.933 CA 1.755 16 residues pruned to eliminate duplicates Z: 16 35.493 2.322 0.694 0.880 0.933 0.667 CB 1.810 16 residues pruned to eliminate duplicates Z: 133 92.734 2.354 0.898 0.666 0.947 0.667 CB 1.636 104 residues pruned to eliminate duplicates Z: 23 40.865 2.401 0.699 0.835 0.909 0.636 CB 1.760 23 residues pruned to eliminate duplicates Z: 103 87.729 2.452 0.881 0.689 0.931 0.725 CB 1.700 65 residues pruned to eliminate duplicates Z: 17 40.833 2.417 0.806 0.936 0.938 0.812 CB 1.738 17 residues pruned to eliminate duplicates Z: 17 32.183 2.183 0.767 0.902 0.938 0.750 CB 1.587 14 residues pruned to eliminate duplicates Z: 28 39.364 2.364 0.947 0.616 0.852 0.593 CB 1.731 28 residues pruned to eliminate duplicates Z: 18 50.985 2.296 1.060 0.919 1.000 0.765 CB 1.842 18 residues pruned to eliminate duplicates Z: 29 63.675 2.441 1.121 0.937 0.964 0.607 CB 1.678 41 residues pruned to eliminate duplicates Z: 16 51.601 2.492 0.954 0.932 1.000 0.667 CB 1.911 16 residues pruned to eliminate duplicates Z: 25 49.369 2.355 0.767 0.924 1.000 0.917 CB 1.701 25 residues pruned to eliminate duplicates Z: 12 30.931 2.310 0.684 0.878 1.000 0.909 CA 1.740 12 residues pruned to eliminate duplicates Z: 21 34.041 2.314 0.504 0.827 0.950 0.850 CB 1.735 21 residues pruned to eliminate duplicates Z: 15 34.441 2.148 1.326 0.889 0.929 0.643 CB 1.428 15 residues pruned to eliminate duplicates Z: 31 50.579 2.395 0.586 0.925 0.933 0.833 CB 1.828 30 residues pruned to eliminate duplicates Z: 16 31.096 2.353 0.377 0.898 1.000 0.933 CA 1.772 16 residues pruned to eliminate duplicates Z: 16 26.635 2.394 0.207 0.905 1.000 0.933 CB 1.693 16 residues pruned to eliminate duplicates Z: 16 37.583 2.304 0.793 0.919 0.933 0.867 CA 1.774 16 residues pruned to eliminate duplicates Z: 17 30.348 2.179 0.630 0.877 1.000 0.812 CB 1.551 Z: 23 41.624 2.474 0.498 0.943 0.955 0.955 CB 1.740 23 residues pruned to eliminate duplicates Z: 34 54.609 2.261 0.956 0.849 0.970 0.727 CB 1.643 34 residues pruned to eliminate duplicates Z: 6 9.151 1.916 0.635 0.699 1.000 0.400 CB 1.090 6 residues pruned to eliminate duplicates Z: 31 53.968 2.367 0.705 0.924 0.967 0.867 CB 1.775 31 residues pruned to eliminate duplicates Z: 14 34.015 2.395 0.729 0.884 0.923 0.692 CA 1.784 14 residues pruned to eliminate duplicates Z: 15 31.725 2.268 0.626 0.919 1.000 0.714 CB 1.620 15 residues pruned to eliminate duplicates Z: 19 37.873 2.263 0.937 0.871 0.944 0.556 CB 1.573 19 residues pruned to eliminate duplicates Z: 12 23.804 2.177 1.043 0.832 0.909 0.545 CB 1.333 Z: 15 40.964 2.422 0.666 0.917 1.000 0.857 CB 1.915 15 residues pruned to eliminate duplicates Z: 51 34.671 2.166 0.453 0.579 0.920 0.680 CB 1.569 Z: 38 35.454 2.237 0.652 0.608 0.973 0.757 CB 1.463 37 residues pruned to eliminate duplicates Z: 34 49.245 2.470 0.863 0.579 0.939 0.576 CB 1.838 34 residues pruned to eliminate duplicates Z: 26 44.180 2.225 0.721 0.890 1.000 0.920 CB 1.660 26 residues pruned to eliminate duplicates Z: 63 47.048 2.256 0.708 0.625 0.935 0.694 CB 1.474 51 residues pruned to eliminate duplicates Z: 15 34.888 2.336 0.684 0.942 1.000 1.000 CB 1.644 15 residues pruned to eliminate duplicates Z: 21 34.582 2.194 0.865 0.917 0.950 0.850 CB 1.404 21 residues pruned to eliminate duplicates Z: 17 44.264 2.332 1.005 0.927 0.938 0.688 CB 1.769 17 residues pruned to eliminate duplicates Z: 13 31.938 2.279 1.012 0.929 1.000 0.833 CB 1.407 13 residues pruned to eliminate duplicates Z: 16 43.828 2.458 0.818 0.923 1.000 0.733 CB 1.779 16 residues pruned to eliminate duplicates Z: 31 36.900 2.231 0.855 0.639 0.900 0.533 CB 1.587 17 residues pruned to eliminate duplicates Z: 15 41.020 2.468 0.638 0.923 1.000 0.929 CB 1.906 15 residues pruned to eliminate duplicates Z: 17 39.805 2.286 1.188 0.888 0.938 0.812 CB 1.528 17 residues pruned to eliminate duplicates Z: 17 29.294 2.149 0.427 0.880 1.000 0.875 CB 1.731 17 residues pruned to eliminate duplicates Z: 13 33.141 2.457 0.580 0.873 1.000 0.667 CA 1.795 13 residues pruned to eliminate duplicates Z: 13 29.609 2.284 0.595 0.882 1.000 0.833 CB 1.697 13 residues pruned to eliminate duplicates Z: 31 57.068 2.256 0.848 0.880 1.000 0.800 CB 1.811 31 residues pruned to eliminate duplicates Z: 14 35.927 2.350 1.083 0.931 1.000 0.846 CB 1.422 14 residues pruned to eliminate duplicates Z: 22 29.119 2.070 0.602 0.911 0.952 0.857 CB 1.426 22 residues pruned to eliminate duplicates Z: 34 57.001 2.511 0.812 0.679 0.970 0.606 CB 1.907 24 residues pruned to eliminate duplicates Z: 16 35.321 2.348 0.781 0.853 0.933 0.733 CB 1.727 16 residues pruned to eliminate duplicates Z: 17 31.524 2.145 0.795 0.852 1.000 0.688 CB 1.514 17 residues pruned to eliminate duplicates Z: 25 41.050 2.339 0.471 0.914 1.000 0.958 CB 1.722 25 residues pruned to eliminate duplicates Z: 30 52.209 2.268 0.680 0.913 1.000 0.793 CB 1.801 30 residues pruned to eliminate duplicates Z: 13 29.337 2.459 0.534 0.867 0.917 0.833 CA 1.791 13 residues pruned to eliminate duplicates Z: 14 38.837 2.412 0.896 0.905 0.923 0.846 CB 1.817 14 residues pruned to eliminate duplicates Z: 42 48.380 2.397 0.908 0.618 0.951 0.732 CB 1.553 42 residues pruned to eliminate duplicates Z: 30 64.943 2.388 0.958 0.939 1.000 0.828 CB 1.792 30 residues pruned to eliminate duplicates Z: 15 30.700 2.259 0.614 0.931 1.000 1.000 CB 1.573 15 residues pruned to eliminate duplicates Z: 23 49.718 2.405 0.887 0.850 0.955 0.773 CA 1.812 23 residues pruned to eliminate duplicates Z: 16 45.683 2.391 1.028 0.903 0.933 0.867 CA 1.859 16 residues pruned to eliminate duplicates Z: 92 87.183 2.394 0.850 0.712 0.945 0.758 CB 1.801 92 residues pruned to eliminate duplicates Z: 16 42.562 2.365 0.761 0.951 1.000 1.000 CA 1.819 16 residues pruned to eliminate duplicates Z: 32 66.431 2.366 1.193 0.887 0.968 0.677 CB 1.713 32 residues pruned to eliminate duplicates Z: 13 37.285 2.494 0.587 0.925 1.000 1.000 CB 1.908 13 residues pruned to eliminate duplicates Z: 16 48.746 2.263 1.092 0.921 1.000 0.867 CB 1.870 16 residues pruned to eliminate duplicates Z: 11 27.538 2.224 0.783 0.910 1.000 0.600 CB 1.558 10 residues pruned to eliminate duplicates Z: 14 26.782 2.160 0.845 0.943 0.923 0.846 CB 1.399 14 residues pruned to eliminate duplicates Z: 17 38.256 2.320 0.734 0.909 0.938 0.875 CA 1.799 17 residues pruned to eliminate duplicates Z: 13 27.338 2.349 0.869 0.875 0.833 0.667 CA 1.568 13 residues pruned to eliminate duplicates Z: 15 41.538 2.400 0.940 0.894 0.929 0.786 CB 1.842 15 residues pruned to eliminate duplicates Z: 40 44.388 2.385 0.773 0.587 0.897 0.590 CB 1.724 40 residues pruned to eliminate duplicates Z: 13 22.487 2.207 0.476 0.872 0.917 0.583 CB 1.585 13 residues pruned to eliminate duplicates Z: 12 31.507 2.431 0.852 0.841 0.909 0.727 CA 1.731 12 residues pruned to eliminate duplicates Z: 14 19.792 2.400 0.225 0.854 0.846 0.615 CA 1.630 14 residues pruned to eliminate duplicates Z: 6 12.761 1.917 0.355 0.834 1.000 0.800 O 1.647 Z: 90 88.055 2.447 0.910 0.740 0.933 0.787 CB 1.727 90 residues pruned to eliminate duplicates Z: 14 17.162 2.136 0.341 0.815 0.923 0.846 CB 1.369 14 residues pruned to eliminate duplicates Z: 18 27.052 2.103 0.536 0.884 1.000 0.941 CB 1.467 18 residues pruned to eliminate duplicates Z: 30 47.738 2.296 0.565 0.890 0.966 0.897 CB 1.837 30 residues pruned to eliminate duplicates Z: 32 54.715 2.331 0.717 0.925 0.968 0.871 CB 1.781 32 residues pruned to eliminate duplicates Z: 31 50.180 2.247 0.735 0.858 0.967 0.733 CB 1.789 31 residues pruned to eliminate duplicates Z: 17 30.372 2.225 0.897 0.874 0.938 0.688 CB 1.396 17 residues pruned to eliminate duplicates Z: 29 53.273 2.339 0.647 0.931 0.964 0.893 CB 1.894 29 residues pruned to eliminate duplicates Z: 149 95.343 2.400 0.938 0.648 0.912 0.703 CB 1.610 121 residues pruned to eliminate duplicates Z: 7 15.053 2.089 0.731 0.857 0.833 0.667 CB 1.503 7 residues pruned to eliminate duplicates Z: 14 47.699 2.517 0.992 0.940 1.000 0.923 CB 1.832 14 residues pruned to eliminate duplicates Z: 15 44.389 2.504 0.817 0.920 1.000 0.857 CB 1.837 15 residues pruned to eliminate duplicates Z: 105 68.762 2.308 0.740 0.622 0.962 0.615 CB 1.556 106 residues pruned to eliminate duplicates Z: 93 88.534 2.392 0.886 0.708 0.935 0.685 CB 1.811 93 residues pruned to eliminate duplicates Z: 25 59.883 2.348 1.282 0.929 1.000 0.542 CB 1.597 26 residues pruned to eliminate duplicates Z: 31 54.610 2.261 0.787 0.898 1.000 0.633 CB 1.764 31 residues pruned to eliminate duplicates Z: 17 34.402 2.250 0.714 0.879 0.938 0.875 CB 1.725 17 residues pruned to eliminate duplicates Z: 105 68.307 2.294 0.825 0.603 0.952 0.615 CB 1.524 105 residues pruned to eliminate duplicates Z: 23 37.695 2.307 0.927 0.863 0.864 0.773 CB 1.536 23 residues pruned to eliminate duplicates Z: 18 27.998 2.128 0.767 0.829 0.941 0.647 CB 1.444 18 residues pruned to eliminate duplicates Z: 178 112.063 2.444 0.963 0.631 0.921 0.616 CB 1.685 166 residues pruned to eliminate duplicates Z: 18 39.074 2.270 0.880 0.896 0.941 0.706 CB 1.690 18 residues pruned to eliminate duplicates Z: 32 57.770 2.339 0.813 0.916 0.968 0.806 CB 1.786 32 residues pruned to eliminate duplicates Z: 14 27.929 2.386 0.525 0.841 0.923 0.846 CB 1.720 14 residues pruned to eliminate duplicates Z: 15 34.068 2.393 0.520 0.898 1.000 0.929 CA 1.790 15 residues pruned to eliminate duplicates Z: 65 49.323 2.270 0.802 0.567 0.969 0.703 CB 1.458 65 residues pruned to eliminate duplicates Z: 16 25.862 2.232 0.407 0.920 1.000 0.933 CB 1.497 16 residues pruned to eliminate duplicates Z: 16 21.906 2.147 0.456 0.929 1.000 0.867 CB 1.266 16 residues pruned to eliminate duplicates Z: 29 61.212 2.341 0.908 0.938 1.000 0.857 CB 1.801 29 residues pruned to eliminate duplicates Z: 13 42.335 2.474 1.127 0.905 1.000 0.750 CB 1.653 14 residues pruned to eliminate duplicates Z: 27 65.298 2.354 1.021 0.946 1.000 0.808 CB 1.862 27 residues pruned to eliminate duplicates Z: 39 45.463 2.266 1.037 0.600 0.947 0.553 CB 1.533 39 residues pruned to eliminate duplicates Z: 51 45.597 2.278 0.922 0.597 0.960 0.640 CB 1.398 51 residues pruned to eliminate duplicates Z: 17 48.594 2.373 1.195 0.940 1.000 0.938 CB 1.620 17 residues pruned to eliminate duplicates Z: 6 11.092 2.109 0.364 0.620 1.000 0.800 CB 1.540 6 residues pruned to eliminate duplicates Z: 17 27.940 2.297 0.400 0.910 0.938 0.812 CA 1.642 17 residues pruned to eliminate duplicates Z: 28 52.280 2.268 0.756 0.932 1.000 0.852 CB 1.765 28 residues pruned to eliminate duplicates Z: 23 29.465 2.035 0.523 0.912 1.000 0.955 CB 1.435 23 residues pruned to eliminate duplicates Z: 38 30.201 2.234 0.738 0.504 0.838 0.595 CB 1.520 38 residues pruned to eliminate duplicates Z: 30 60.517 2.303 1.021 0.918 0.966 0.517 CB 1.764 30 residues pruned to eliminate duplicates Z: 16 38.070 2.355 0.727 0.892 1.000 0.933 CA 1.737 16 residues pruned to eliminate duplicates Z: 24 34.950 2.271 0.732 0.823 0.870 0.565 CB 1.610 24 residues pruned to eliminate duplicates Z: 43 56.453 2.436 0.910 0.646 0.929 0.738 CB 1.759 43 residues pruned to eliminate duplicates Z: 26 42.776 2.227 0.567 0.917 1.000 0.960 CB 1.730 26 residues pruned to eliminate duplicates Z: 32 64.386 2.348 1.002 0.898 1.000 0.645 CB 1.759 32 residues pruned to eliminate duplicates Z: 18 49.278 2.239 1.387 0.908 1.000 0.353 CB 1.588 18 residues pruned to eliminate duplicates Z: 17 30.641 2.286 0.464 0.902 1.000 0.875 CA 1.633 17 residues pruned to eliminate duplicates Z: 21 45.132 2.294 0.862 0.862 0.950 0.800 CB 1.826 21 residues pruned to eliminate duplicates Z: 22 23.898 2.079 0.727 0.860 0.857 0.571 CB 1.246 22 residues pruned to eliminate duplicates Z: 14 43.567 2.356 1.383 0.891 1.000 0.615 CB 1.547 14 residues pruned to eliminate duplicates Z: 17 40.295 2.319 0.785 0.926 1.000 0.875 CB 1.707 17 residues pruned to eliminate duplicates Z: 18 39.662 2.239 0.988 0.850 1.000 0.529 CA 1.601 18 residues pruned to eliminate duplicates Z: 41 31.618 2.230 0.539 0.554 0.875 0.650 CB 1.580 41 residues pruned to eliminate duplicates Z: 16 26.107 2.225 0.737 0.897 0.933 0.800 CB 1.338 16 residues pruned to eliminate duplicates Z: 15 36.142 2.303 1.088 0.897 1.000 0.714 CB 1.437 13 residues pruned to eliminate duplicates Z: 68 64.277 2.411 0.761 0.621 0.955 0.746 CB 1.728 68 residues pruned to eliminate duplicates Z: 17 31.897 2.172 0.730 0.931 0.938 0.812 CB 1.581 17 residues pruned to eliminate duplicates Z: 70 46.019 2.200 0.710 0.604 0.913 0.681 CB 1.462 61 residues pruned to eliminate duplicates Z: 12 29.302 2.154 0.924 0.881 1.000 0.545 CB 1.544 Z: 31 46.384 2.224 0.564 0.903 0.967 0.800 CB 1.795 31 residues pruned to eliminate duplicates Z: 20 45.889 2.400 0.834 0.843 1.000 0.842 CA 1.782 20 residues pruned to eliminate duplicates Z: 12 23.308 2.395 0.954 0.533 0.818 0.455 CB 1.776 11 residues pruned to eliminate duplicates Z: 28 59.962 2.329 0.958 0.908 0.963 0.852 CB 1.867 28 residues pruned to eliminate duplicates Z: 39 36.888 2.255 0.734 0.590 0.974 0.658 CB 1.442 39 residues pruned to eliminate duplicates Z: 13 19.982 2.017 0.720 0.799 1.000 0.500 CB 1.280 14 residues pruned to eliminate duplicates Z: 30 66.096 2.440 0.975 0.930 1.000 0.828 CB 1.782 30 residues pruned to eliminate duplicates Z: 21 32.503 2.180 0.630 0.892 0.950 0.900 CB 1.547 21 residues pruned to eliminate duplicates Z: 6 9.353 2.165 0.406 0.625 0.800 0.600 CB 1.527 Z: 33 24.311 2.190 0.670 0.330 0.875 0.656 CB 1.618 33 residues pruned to eliminate duplicates Z: 63 31.807 1.995 0.620 0.527 0.935 0.500 CB 1.302 18 residues pruned to eliminate duplicates Z: 16 30.437 2.305 0.681 0.904 0.933 0.867 CB 1.548 16 residues pruned to eliminate duplicates Z: 8 7.196 1.722 0.265 0.728 0.857 0.571 CB 1.186 8 residues pruned to eliminate duplicates Z: 30 60.265 2.283 0.951 0.916 1.000 0.483 CB 1.775 30 residues pruned to eliminate duplicates Z: 18 43.503 2.263 1.103 0.913 0.941 0.706 CB 1.668 18 residues pruned to eliminate duplicates Z: 7 11.053 1.798 0.320 0.841 1.000 0.667 CB 1.419 7 residues pruned to eliminate duplicates Z: 17 51.139 2.324 1.205 0.923 1.000 0.938 CB 1.754 17 residues pruned to eliminate duplicates Z: 17 40.770 2.333 0.966 0.899 0.938 0.562 CA 1.694 17 residues pruned to eliminate duplicates Z: 58 41.596 2.253 0.862 0.540 0.947 0.667 CB 1.333 58 residues pruned to eliminate duplicates Z: 36 44.438 2.363 0.964 0.587 0.886 0.400 CB 1.680 36 residues pruned to eliminate duplicates Z: 6 10.189 1.869 0.615 0.767 1.000 0.800 CB 1.191 6 residues pruned to eliminate duplicates Z: 15 35.272 2.232 0.834 0.913 1.000 0.786 CB 1.629 15 residues pruned to eliminate duplicates Z: 6 7.677 1.768 0.405 0.745 1.000 0.600 CB 1.110 6 residues pruned to eliminate duplicates Z: 22 28.631 2.156 0.500 0.907 0.952 0.857 CB 1.442 22 residues pruned to eliminate duplicates Z: 29 41.414 2.232 1.122 0.705 0.964 0.893 CB 1.421 30 residues pruned to eliminate duplicates Z: 30 53.734 2.314 0.725 0.885 0.966 0.793 CB 1.869 30 residues pruned to eliminate duplicates Z: 15 24.791 2.216 0.754 0.905 0.929 0.929 CB 1.307 15 residues pruned to eliminate duplicates Z: 6 11.311 2.053 0.947 0.760 1.000 1.000 CB 1.004 6 residues pruned to eliminate duplicates Z: 37 40.002 2.348 0.811 0.555 0.889 0.639 CB 1.671 37 residues pruned to eliminate duplicates Z: 34 62.017 2.501 1.046 0.649 1.000 0.485 CB 1.837 33 residues pruned to eliminate duplicates Z: 32 41.919 2.276 0.993 0.670 1.000 0.516 CB 1.419 32 residues pruned to eliminate duplicates Z: 10 12.693 1.913 0.162 0.757 1.000 0.556 CB 1.513 10 residues pruned to eliminate duplicates Z: 50 42.048 2.289 0.632 0.609 0.939 0.714 CB 1.545 50 residues pruned to eliminate duplicates Z: 23 37.610 2.162 1.079 0.919 0.955 0.727 CB 1.317 21 residues pruned to eliminate duplicates Z: 24 48.868 2.417 0.778 0.943 1.000 0.870 CB 1.643 24 residues pruned to eliminate duplicates Z: 75 70.854 2.427 0.767 0.650 0.973 0.716 CB 1.717 75 residues pruned to eliminate duplicates Z: 31 50.669 2.227 0.646 0.879 1.000 0.800 CB 1.830 31 residues pruned to eliminate duplicates Z: 30 60.052 2.296 0.991 0.909 0.966 0.621 CB 1.793 30 residues pruned to eliminate duplicates Z: 6 10.015 2.199 0.264 0.848 1.000 0.600 CB 1.196 6 residues pruned to eliminate duplicates Z: 16 36.638 2.274 0.786 0.847 1.000 0.800 CB 1.730 16 residues pruned to eliminate duplicates Z: 13 24.979 2.263 0.742 0.837 1.000 0.667 CB 1.368 13 residues pruned to eliminate duplicates Z: 32 57.862 2.375 0.872 0.894 0.935 0.742 CB 1.792 32 residues pruned to eliminate duplicates Z: 14 36.942 2.324 1.211 0.917 1.000 0.692 CB 1.407 14 residues pruned to eliminate duplicates Z: 23 36.165 2.117 1.162 0.908 0.909 0.455 CB 1.316 23 residues pruned to eliminate duplicates Z: 14 17.011 1.944 0.335 0.911 1.000 0.923 CB 1.288 Z: 11 32.175 2.249 0.874 0.939 1.000 0.800 CB 1.677 12 residues pruned to eliminate duplicates Z: 11 28.937 2.253 0.860 0.876 1.000 0.800 CB 1.588 10 residues pruned to eliminate duplicates Z: 72 42.068 2.152 0.713 0.548 0.915 0.676 CB 1.412 72 residues pruned to eliminate duplicates Z: 15 36.766 2.460 0.673 0.914 0.929 0.929 CB 1.818 15 residues pruned to eliminate duplicates Z: 16 37.044 2.308 0.690 0.887 1.000 0.667 CB 1.767 16 residues pruned to eliminate duplicates Z: 50 33.686 2.227 0.611 0.536 0.918 0.612 CB 1.410 50 residues pruned to eliminate duplicates Z: 83 51.923 2.236 0.807 0.536 0.915 0.598 CB 1.498 83 residues pruned to eliminate duplicates Z: 41 36.981 2.205 0.925 0.534 0.875 0.425 CB 1.522 39 residues pruned to eliminate duplicates Z: 18 44.573 2.310 0.911 0.904 1.000 0.882 CB 1.744 18 residues pruned to eliminate duplicates Z: 9 13.391 1.953 0.180 0.856 1.000 0.625 CB 1.515 9 residues pruned to eliminate duplicates Z: 20 36.196 2.241 0.856 0.920 0.947 0.789 CB 1.484 20 residues pruned to eliminate duplicates Z: 24 56.276 2.392 1.263 0.957 0.957 0.565 CB 1.555 24 residues pruned to eliminate duplicates Z: 17 44.992 2.299 1.018 0.922 1.000 0.500 CA 1.705 17 residues pruned to eliminate duplicates Z: 15 22.169 2.293 0.631 0.596 1.000 0.786 CB 1.446 15 residues pruned to eliminate duplicates Z: 31 52.436 2.250 0.780 0.889 0.967 0.833 CB 1.780 31 residues pruned to eliminate duplicates Z: 16 35.453 2.448 0.461 0.944 1.000 1.000 CB 1.773 16 residues pruned to eliminate duplicates Z: 17 39.745 2.220 1.157 0.871 0.938 0.625 CB 1.614 17 residues pruned to eliminate duplicates Z: 14 19.913 1.926 0.493 0.932 1.000 0.923 CB 1.341 14 residues pruned to eliminate duplicates Z: 15 18.668 1.839 0.382 0.950 1.000 0.929 CB 1.354 15 residues pruned to eliminate duplicates Z: 31 54.136 2.240 0.818 0.904 1.000 0.667 CB 1.729 31 residues pruned to eliminate duplicates Z: 21 38.056 2.306 0.708 0.856 0.900 0.800 CB 1.770 21 residues pruned to eliminate duplicates Z: 21 35.557 2.190 0.868 0.923 0.950 0.850 CB 1.438 21 residues pruned to eliminate duplicates Z: 23 49.363 2.480 0.865 0.809 0.955 0.682 CA 1.821 23 residues pruned to eliminate duplicates Z: 35 55.389 2.548 0.819 0.660 0.912 0.588 CB 1.937 35 residues pruned to eliminate duplicates Z: 18 23.348 2.044 0.422 0.847 1.000 0.882 CB 1.446 18 residues pruned to eliminate duplicates Z: 69 67.282 2.480 0.804 0.654 0.926 0.721 CB 1.706 69 residues pruned to eliminate duplicates Z: 131 92.090 2.431 0.957 0.629 0.892 0.569 CB 1.685 131 residues pruned to eliminate duplicates Z: 14 17.413 1.901 0.293 0.943 1.000 1.000 CB 1.362 14 residues pruned to eliminate duplicates Z: 30 63.490 2.396 0.923 0.924 1.000 0.759 CB 1.797 30 residues pruned to eliminate duplicates Z: 16 21.409 2.195 0.455 0.906 0.933 0.933 CB 1.318 16 residues pruned to eliminate duplicates Z: 99 90.838 2.490 0.854 0.731 0.939 0.765 CB 1.719 99 residues pruned to eliminate duplicates Z: 7 8.294 1.913 0.259 0.791 0.833 0.667 CB 1.307 Z: 6 8.571 1.902 0.267 0.837 1.000 0.800 CB 1.190 6 residues pruned to eliminate duplicates Z: 14 22.538 1.910 0.695 0.923 1.000 0.923 CB 1.356 14 residues pruned to eliminate duplicates Z: 15 28.927 2.241 0.708 0.917 1.000 0.929 CB 1.426 15 residues pruned to eliminate duplicates Z: 9 12.476 2.045 0.272 0.798 0.875 0.500 CB 1.493 9 residues pruned to eliminate duplicates Z: 6 9.959 1.969 0.280 0.709 1.000 0.800 CB 1.462 6 residues pruned to eliminate duplicates Z: 6 10.517 1.979 0.545 0.803 1.000 1.000 CB 1.180 6 residues pruned to eliminate duplicates Z: 13 28.075 2.437 0.528 0.837 0.917 0.500 CB 1.776 13 residues pruned to eliminate duplicates Z: 13 20.828 1.918 0.795 0.691 1.000 0.667 CA 1.467 13 residues pruned to eliminate duplicates Z: 14 25.619 2.087 0.667 0.869 1.000 0.769 CB 1.492 14 residues pruned to eliminate duplicates Z: 13 28.585 2.419 0.416 0.854 1.000 0.917 CB 1.780 13 residues pruned to eliminate duplicates Z: 23 48.162 2.401 0.760 0.844 1.000 0.636 CB 1.808 23 residues pruned to eliminate duplicates Z: 9 16.033 2.077 0.883 0.646 0.875 0.750 CB 1.445 9 residues pruned to eliminate duplicates Z: 31 45.840 2.327 0.579 0.893 0.933 0.867 CB 1.751 31 residues pruned to eliminate duplicates Z: 51 44.238 2.288 0.886 0.590 0.940 0.660 CB 1.415 51 residues pruned to eliminate duplicates Z: 6 5.206 1.544 1.196 0.756 1.000 0.600 CB 0.547 6 residues pruned to eliminate duplicates Z: 16 43.133 2.375 0.843 0.925 1.000 0.800 CB 1.785 16 residues pruned to eliminate duplicates Z: 17 33.732 2.211 1.022 0.923 0.938 0.875 CB 1.414 17 residues pruned to eliminate duplicates Z: 14 17.434 2.100 0.357 0.817 0.923 0.692 CB 1.395 14 residues pruned to eliminate duplicates Z: 33 42.524 2.326 0.888 0.696 0.938 0.812 CB 1.527 33 residues pruned to eliminate duplicates Z: 14 18.232 2.191 0.274 0.830 0.923 0.615 CB 1.476 14 residues pruned to eliminate duplicates Z: 39 28.542 2.031 0.704 0.596 0.868 0.684 CB 1.406 39 residues pruned to eliminate duplicates Z: 15 27.624 2.221 0.839 0.922 0.929 0.857 CB 1.369 15 residues pruned to eliminate duplicates Z: 55 34.767 2.199 0.604 0.525 0.907 0.685 CB 1.442 55 residues pruned to eliminate duplicates Z: 16 25.363 2.189 0.617 0.924 0.933 0.867 CB 1.392 16 residues pruned to eliminate duplicates Z: 11 16.758 2.182 0.630 0.626 0.900 0.800 CB 1.471 11 residues pruned to eliminate duplicates Z: 36 54.526 2.467 0.891 0.642 0.943 0.571 CB 1.835 36 residues pruned to eliminate duplicates Z: 31 66.919 2.409 1.067 0.913 1.000 0.533 CB 1.736 31 residues pruned to eliminate duplicates Z: 62 41.147 2.166 0.732 0.491 0.967 0.557 CB 1.465 62 residues pruned to eliminate duplicates Z: 91 84.795 2.384 0.832 0.718 0.956 0.767 CB 1.759 89 residues pruned to eliminate duplicates Z: 19 15.048 1.928 0.489 0.555 0.889 0.722 CB 1.316 15 residues pruned to eliminate duplicates Z: 77 64.079 2.396 0.792 0.607 0.921 0.671 CB 1.679 77 residues pruned to eliminate duplicates Z: 37 51.541 2.468 0.754 0.633 0.972 0.667 CB 1.802 37 residues pruned to eliminate duplicates Z: 75 69.827 2.432 0.843 0.628 0.919 0.676 CB 1.747 75 residues pruned to eliminate duplicates Z: 31 60.486 2.261 1.061 0.900 0.967 0.667 CB 1.752 32 residues pruned to eliminate duplicates Z: 16 35.307 2.224 0.986 0.926 1.000 0.667 CB 1.448 16 residues pruned to eliminate duplicates Z: 25 39.637 2.331 0.507 0.920 1.000 0.875 CB 1.623 25 residues pruned to eliminate duplicates Z: 6 4.026 1.774 -0.142 0.431 1.000 0.800 CB 1.270 Z: 15 45.572 2.522 0.954 0.919 0.929 0.786 CB 1.876 15 residues pruned to eliminate duplicates Z: 16 40.074 2.355 0.866 0.886 0.933 0.733 CB 1.819 16 residues pruned to eliminate duplicates Z: 50 32.901 2.105 0.686 0.534 0.939 0.571 CB 1.364 50 residues pruned to eliminate duplicates Z: 57 48.120 2.229 0.867 0.608 0.911 0.607 CB 1.532 61 residues pruned to eliminate duplicates Z: 15 45.575 2.325 1.042 0.912 1.000 0.786 CB 1.816 15 residues pruned to eliminate duplicates Z: 25 35.347 2.200 0.974 0.648 0.917 0.542 CB 1.578 15 residues pruned to eliminate duplicates Z: 8 4.532 2.005 0.009 0.776 1.000 0.571 CB 0.664 8 residues pruned to eliminate duplicates Z: 14 21.933 1.918 0.553 0.943 1.000 0.923 CB 1.415 14 residues pruned to eliminate duplicates Z: 12 21.632 2.305 0.338 0.908 0.909 0.818 CB 1.653 12 residues pruned to eliminate duplicates Z: 17 39.065 2.247 0.927 0.886 0.938 0.562 CA 1.736 17 residues pruned to eliminate duplicates Z: 16 34.876 2.252 0.888 0.885 0.933 0.600 CB 1.639 16 residues pruned to eliminate duplicates Z: 35 56.933 2.515 1.018 0.637 0.912 0.471 CB 1.856 35 residues pruned to eliminate duplicates Z: 16 39.680 2.313 0.921 0.888 0.933 0.800 CA 1.781 16 residues pruned to eliminate duplicates Z: 11 17.143 2.091 0.377 0.690 1.000 0.800 CB 1.582 11 residues pruned to eliminate duplicates Z: 14 16.509 2.165 0.197 0.821 0.923 0.692 CB 1.449 14 residues pruned to eliminate duplicates Z: 22 25.296 2.220 0.371 0.755 0.952 0.857 CB 1.517 22 residues pruned to eliminate duplicates Z: 16 39.396 2.303 0.934 0.941 1.000 0.867 CB 1.585 16 residues pruned to eliminate duplicates Z: 31 57.560 2.384 0.691 0.934 1.000 0.900 CA 1.818 31 residues pruned to eliminate duplicates Z: 10 8.405 2.106 0.306 0.421 0.778 0.444 CB 1.423 10 residues pruned to eliminate duplicates Z: 6 15.213 2.121 0.532 0.838 1.000 0.800 CB 1.565 6 residues pruned to eliminate duplicates Z: 30 51.749 2.301 0.608 0.885 1.000 0.862 CB 1.875 30 residues pruned to eliminate duplicates Z: 15 33.709 2.239 1.293 0.910 0.929 0.643 CB 1.341 15 residues pruned to eliminate duplicates Z: 49 26.080 2.088 0.658 0.438 0.854 0.604 CB 1.356 49 residues pruned to eliminate duplicates Z: 29 21.735 2.120 0.542 0.509 0.929 0.536 CB 1.342 27 residues pruned to eliminate duplicates Z: 93 82.797 2.363 0.897 0.698 0.946 0.707 CB 1.699 93 residues pruned to eliminate duplicates Z: 17 28.519 2.155 0.688 0.866 1.000 0.812 CB 1.434 17 residues pruned to eliminate duplicates Z: 8 6.785 1.629 0.340 0.758 1.000 0.714 CB 0.934 8 residues pruned to eliminate duplicates Z: 99 85.862 2.358 0.837 0.717 0.949 0.684 CB 1.733 99 residues pruned to eliminate duplicates Z: 12 26.083 2.128 1.012 0.855 1.000 0.818 CB 1.356 12 residues pruned to eliminate duplicates Z: 52 37.946 2.203 0.859 0.578 0.961 0.490 CB 1.253 55 residues pruned to eliminate duplicates Z: 21 37.978 2.193 1.031 0.911 0.950 0.500 CB 1.423 21 residues pruned to eliminate duplicates Z: 39 52.680 2.428 0.753 0.660 0.947 0.789 CB 1.827 39 residues pruned to eliminate duplicates Z: 17 38.558 2.194 0.817 0.906 1.000 0.875 CB 1.720 17 residues pruned to eliminate duplicates Z: 60 35.991 2.184 0.646 0.550 0.864 0.593 CB 1.436 43 residues pruned to eliminate duplicates Z: 91 90.468 2.398 0.970 0.727 0.922 0.700 CB 1.784 91 residues pruned to eliminate duplicates Z: 6 7.931 1.590 0.333 0.807 1.000 0.800 CA 1.280 6 residues pruned to eliminate duplicates Z: 16 47.499 2.525 1.044 0.936 1.000 0.867 CB 1.655 16 residues pruned to eliminate duplicates Z: 70 53.544 2.240 0.840 0.641 0.928 0.739 CB 1.479 71 residues pruned to eliminate duplicates Z: 23 49.062 2.382 0.803 0.843 1.000 0.727 CA 1.812 23 residues pruned to eliminate duplicates Z: 12 23.620 2.215 0.769 0.860 0.909 0.545 CB 1.470 12 residues pruned to eliminate duplicates Z: 50 49.561 2.438 0.768 0.515 0.939 0.612 CB 1.723 50 residues pruned to eliminate duplicates Z: 12 18.306 2.154 0.853 0.816 0.818 0.545 CB 1.284 12 residues pruned to eliminate duplicates Z: 6 5.774 1.578 0.304 0.825 1.000 0.600 C 0.947 6 residues pruned to eliminate duplicates Z: 16 33.531 2.251 0.977 0.883 0.933 0.800 CB 1.507 16 residues pruned to eliminate duplicates Z: 6 10.064 2.001 0.710 0.654 0.800 0.600 CB 1.425 6 residues pruned to eliminate duplicates Z: 29 60.287 2.423 0.940 0.893 0.964 0.857 CB 1.805 29 residues pruned to eliminate duplicates Z: 30 52.743 2.348 0.789 0.895 0.966 0.862 CB 1.731 30 residues pruned to eliminate duplicates Z: 35 40.516 2.318 0.910 0.602 0.912 0.647 CB 1.563 35 residues pruned to eliminate duplicates Z: 16 44.539 2.375 0.851 0.933 1.000 0.933 CB 1.826 16 residues pruned to eliminate duplicates Z: 33 32.664 2.218 0.789 0.595 0.875 0.594 CB 1.519 33 residues pruned to eliminate duplicates Z: 17 29.164 2.228 0.758 0.872 0.938 0.812 CB 1.447 17 residues pruned to eliminate duplicates Z: 7 17.622 2.110 0.734 0.801 1.000 0.833 CA 1.511 7 residues pruned to eliminate duplicates Z: 14 29.261 2.356 0.530 0.884 0.923 0.615 CA 1.762 14 residues pruned to eliminate duplicates Z: 26 34.042 2.340 0.815 0.579 0.840 0.640 CB 1.770 26 residues pruned to eliminate duplicates Z: 17 51.782 2.418 1.192 0.937 0.938 0.562 CB 1.812 17 residues pruned to eliminate duplicates Z: 18 30.025 2.113 1.017 0.708 0.882 0.294 CB 1.604 18 residues pruned to eliminate duplicates Z: 75 54.456 2.257 0.781 0.594 0.973 0.595 CB 1.479 75 residues pruned to eliminate duplicates Z: 17 38.454 2.282 0.815 0.922 1.000 0.750 CB 1.633 17 residues pruned to eliminate duplicates Z: 121 88.809 2.332 0.952 0.679 0.917 0.600 CB 1.647 109 residues pruned to eliminate duplicates Z: 6 19.077 2.337 0.715 0.777 1.000 1.000 CB 1.667 6 residues pruned to eliminate duplicates Z: 14 18.448 2.197 0.275 0.861 0.923 0.769 CB 1.453 14 residues pruned to eliminate duplicates Z: 48 38.133 2.139 0.757 0.610 0.957 0.787 CB 1.393 48 residues pruned to eliminate duplicates Z: 43 46.372 2.428 1.064 0.594 0.833 0.548 CB 1.566 43 residues pruned to eliminate duplicates Z: 6 8.836 2.235 0.236 0.578 1.000 0.600 CB 1.327 6 residues pruned to eliminate duplicates Z: 12 10.380 1.916 0.172 0.654 0.909 0.818 CB 1.329 12 residues pruned to eliminate duplicates Z: 13 20.717 1.890 0.647 0.942 1.000 1.000 CB 1.333 13 residues pruned to eliminate duplicates Z: 36 20.955 1.866 0.525 0.566 0.943 0.657 CB 1.238 18 residues pruned to eliminate duplicates Z: 13 13.626 2.212 0.345 0.633 0.833 0.750 CB 1.400 13 residues pruned to eliminate duplicates Z: 31 55.907 2.360 0.719 0.911 1.000 0.900 CB 1.783 31 residues pruned to eliminate duplicates Z: 21 15.609 1.850 0.689 0.573 0.850 0.550 CB 1.225 21 residues pruned to eliminate duplicates Z: 89 89.656 2.459 0.902 0.725 0.989 0.773 CB 1.687 89 residues pruned to eliminate duplicates Z: 9 18.770 2.086 0.861 0.838 0.875 0.500 CB 1.460 9 residues pruned to eliminate duplicates Z: 11 20.976 2.196 0.474 0.898 1.000 1.000 CB 1.465 11 residues pruned to eliminate duplicates Z: 6 15.131 2.148 0.349 0.873 1.000 0.600 CB 1.701 6 residues pruned to eliminate duplicates Z: 9 10.285 2.093 0.223 0.654 0.875 0.875 CB 1.407 9 residues pruned to eliminate duplicates Z: 47 36.880 2.243 0.682 0.624 0.935 0.717 CB 1.371 47 residues pruned to eliminate duplicates Z: 8 5.502 1.770 0.090 0.559 0.857 0.429 CB 1.188 Z: 8 6.170 1.660 0.258 0.456 0.857 0.429 O 1.363 8 residues pruned to eliminate duplicates Z: 6 7.867 2.224 -0.009 0.867 1.000 0.800 CB 1.168 6 residues pruned to eliminate duplicates Z: 71 42.252 2.112 0.816 0.572 0.900 0.529 CB 1.365 72 residues pruned to eliminate duplicates Z: 12 20.446 2.159 0.489 0.842 0.909 0.636 CA 1.572 12 residues pruned to eliminate duplicates Z: 12 21.385 2.311 0.332 0.890 0.909 0.727 CB 1.658 12 residues pruned to eliminate duplicates Z: 7 10.563 1.915 0.965 0.694 0.667 0.667 CA 1.440 7 residues pruned to eliminate duplicates Z: 12 15.535 2.062 0.781 0.525 0.909 0.364 CB 1.370 Z: 13 16.967 2.110 0.715 0.424 1.000 0.500 CB 1.465 13 residues pruned to eliminate duplicates Z: 11 8.423 2.093 0.338 0.392 0.900 0.500 CB 1.185 11 residues pruned to eliminate duplicates Z: 8 9.320 2.084 0.409 0.527 0.857 0.571 CB 1.363 8 residues pruned to eliminate duplicates Z: 17 31.175 2.210 0.877 0.878 0.938 0.750 CB 1.455 17 residues pruned to eliminate duplicates Z: 6 2.330 1.383 0.420 0.394 0.800 0.600 N 0.742 Z: 7 6.123 1.501 0.228 0.695 1.000 0.667 CB 1.135 7 residues pruned to eliminate duplicates Z: 20 11.187 1.957 0.251 0.434 0.947 0.579 CB 1.184 20 residues pruned to eliminate duplicates Z: 51 38.880 2.302 0.690 0.502 0.900 0.520 CB 1.566 51 residues pruned to eliminate duplicates Z: 152 100.216 2.387 0.957 0.629 0.954 0.642 CB 1.622 152 residues pruned to eliminate duplicates Z: 10 8.726 2.189 0.258 0.445 0.889 0.444 CB 1.257 10 residues pruned to eliminate duplicates Z: 8 5.713 1.829 0.096 0.846 0.857 0.857 CB 0.934 8 residues pruned to eliminate duplicates Z: 15 35.396 2.151 0.774 0.912 1.000 0.786 CB 1.756 15 residues pruned to eliminate duplicates Z: 7 8.147 1.854 0.217 0.854 1.000 0.667 CB 1.089 7 residues pruned to eliminate duplicates Z: 41 22.804 1.939 0.622 0.566 0.900 0.600 CB 1.195 28 residues pruned to eliminate duplicates Z: 14 28.977 2.262 0.601 0.931 1.000 0.923 CB 1.550 14 residues pruned to eliminate duplicates Z: 41 35.341 2.188 0.703 0.652 0.925 0.675 CB 1.408 46 residues pruned to eliminate duplicates Z: 8 5.431 1.718 0.455 0.481 0.857 0.429 CB 0.977 8 residues pruned to eliminate duplicates Z: 11 6.568 2.070 0.345 0.280 0.800 0.500 CB 1.195 11 residues pruned to eliminate duplicates Z: 6 3.604 1.692 0.171 0.600 0.600 0.400 O 1.232 6 residues pruned to eliminate duplicates Z: 16 36.245 2.217 1.039 0.917 1.000 0.667 CB 1.461 16 residues pruned to eliminate duplicates Z: 21 35.683 2.189 0.839 0.911 0.950 0.700 CB 1.479 21 residues pruned to eliminate duplicates Z: 11 27.285 2.251 0.679 0.922 1.000 0.800 CB 1.606 11 residues pruned to eliminate duplicates Z: 43 36.649 2.246 0.648 0.591 0.929 0.762 CB 1.509 43 residues pruned to eliminate duplicates Z: 29 56.984 2.389 0.860 0.912 0.964 0.857 CB 1.780 29 residues pruned to eliminate duplicates Z: 31 44.716 2.290 1.050 0.665 0.933 0.700 CB 1.599 31 residues pruned to eliminate duplicates Z: 16 21.887 1.958 0.475 0.844 1.000 0.800 CB 1.455 16 residues pruned to eliminate duplicates Z: 61 40.474 2.190 0.715 0.563 0.917 0.617 CB 1.428 67 residues pruned to eliminate duplicates Z: 14 13.532 2.000 0.245 0.856 0.923 0.769 CB 1.204 14 residues pruned to eliminate duplicates Z: 6 6.577 1.831 0.117 0.693 0.800 0.800 CB 1.507 6 residues pruned to eliminate duplicates Z: 110 88.333 2.413 0.864 0.693 0.936 0.688 CB 1.685 110 residues pruned to eliminate duplicates Z: 49 32.643 2.212 0.514 0.618 0.958 0.750 CB 1.313 49 residues pruned to eliminate duplicates Z: 7 12.483 2.026 0.632 0.838 0.833 0.833 CB 1.382 7 residues pruned to eliminate duplicates Z: 17 48.824 2.327 1.142 0.931 1.000 0.750 CB 1.710 17 residues pruned to eliminate duplicates Z: 11 26.977 2.236 0.754 0.896 1.000 1.000 CB 1.559 11 residues pruned to eliminate duplicates Z: 7 9.314 2.015 0.304 0.852 0.833 0.667 CB 1.284 7 residues pruned to eliminate duplicates Z: 11 20.070 2.150 0.567 0.883 1.000 0.700 CB 1.362 11 residues pruned to eliminate duplicates Z: 14 23.540 2.349 0.492 0.859 0.769 0.462 CA 1.782 14 residues pruned to eliminate duplicates Z: 39 55.699 2.450 0.832 0.681 0.947 0.763 CB 1.800 39 residues pruned to eliminate duplicates Z: 38 25.024 1.955 0.806 0.616 0.946 0.432 CB 1.104 38 residues pruned to eliminate duplicates Z: 18 33.279 2.289 0.679 0.848 0.941 0.647 CB 1.655 18 residues pruned to eliminate duplicates Z: 13 22.111 2.286 0.557 0.881 0.917 0.833 CB 1.417 13 residues pruned to eliminate duplicates Z: 13 11.581 1.871 0.386 0.641 0.917 0.583 CB 1.232 13 residues pruned to eliminate duplicates Z: 9 7.803 1.759 0.346 0.474 0.875 0.500 CB 1.369 8 residues pruned to eliminate duplicates Z: 36 37.207 2.295 0.807 0.678 0.886 0.657 CB 1.454 36 residues pruned to eliminate duplicates Z: 28 62.426 2.401 0.969 0.936 1.000 0.926 CB 1.769 28 residues pruned to eliminate duplicates Z: 14 26.182 1.936 0.851 0.912 1.000 0.846 CB 1.436 14 residues pruned to eliminate duplicates Z: 68 52.569 2.289 0.719 0.589 0.896 0.627 CB 1.674 68 residues pruned to eliminate duplicates Z: 32 45.493 2.435 0.626 0.696 0.935 0.548 CB 1.844 32 residues pruned to eliminate duplicates Z: 19 23.592 2.134 0.691 0.677 0.944 0.667 CB 1.386 19 residues pruned to eliminate duplicates Z: 34 53.674 2.274 0.866 0.867 0.939 0.576 CB 1.716 34 residues pruned to eliminate duplicates Z: 14 23.396 1.929 0.688 0.943 1.000 1.000 CB 1.381 14 residues pruned to eliminate duplicates Z: 15 19.417 1.852 0.400 0.930 1.000 0.929 CB 1.400 15 residues pruned to eliminate duplicates Z: 35 32.584 2.349 0.723 0.569 0.882 0.706 CB 1.463 35 residues pruned to eliminate duplicates Z: 48 40.168 2.193 0.847 0.583 0.915 0.702 CB 1.460 48 residues pruned to eliminate duplicates Z: 89 93.061 2.407 0.955 0.727 0.966 0.761 CB 1.779 89 residues pruned to eliminate duplicates Z: 13 33.659 2.309 1.096 0.889 1.000 0.667 CB 1.445 13 residues pruned to eliminate duplicates Z: 32 29.078 1.940 0.841 0.613 0.935 0.516 CB 1.405 32 residues pruned to eliminate duplicates Z: 24 41.982 2.319 0.537 0.898 1.000 0.957 CB 1.758 24 residues pruned to eliminate duplicates Z: 17 29.350 2.282 0.529 0.832 0.938 0.812 CB 1.685 17 residues pruned to eliminate duplicates Z: 13 20.651 1.892 0.616 0.937 1.000 1.000 CB 1.357 13 residues pruned to eliminate duplicates Z: 17 32.195 2.189 0.929 0.930 0.938 0.562 CB 1.422 17 residues pruned to eliminate duplicates Z: 19 20.318 2.122 0.547 0.616 0.889 0.500 CB 1.471 17 residues pruned to eliminate duplicates Z: 22 38.702 2.193 1.035 0.943 0.952 0.667 CB 1.377 23 residues pruned to eliminate duplicates Z: 13 11.284 1.991 0.367 0.600 0.833 0.667 CB 1.306 13 residues pruned to eliminate duplicates Z: 31 47.823 2.232 0.682 0.895 0.967 0.667 CB 1.725 31 residues pruned to eliminate duplicates Z: 25 48.945 2.362 0.707 0.895 1.000 0.917 CB 1.777 25 residues pruned to eliminate duplicates Z: 18 49.453 2.252 1.184 0.925 1.000 0.765 CB 1.712 18 residues pruned to eliminate duplicates Z: 112 81.568 2.412 0.829 0.653 0.919 0.649 CB 1.657 112 residues pruned to eliminate duplicates Z: 8 4.028 1.908 -0.194 0.374 0.857 0.429 CB 1.320 Z: 62 39.163 2.138 0.757 0.485 0.902 0.541 CB 1.504 62 residues pruned to eliminate duplicates Z: 28 46.086 2.226 0.634 0.906 0.963 0.778 CB 1.801 28 residues pruned to eliminate duplicates Z: 13 12.201 1.899 0.900 0.495 0.750 0.500 CB 1.308 13 residues pruned to eliminate duplicates Z: 30 18.544 2.105 0.404 0.480 0.862 0.586 CB 1.379 30 residues pruned to eliminate duplicates Z: 10 11.311 2.074 0.362 0.589 1.000 0.556 CB 1.226 10 residues pruned to eliminate duplicates Z: 15 11.818 1.986 0.391 0.597 0.857 0.643 CB 1.216 15 residues pruned to eliminate duplicates Z: 12 13.647 1.888 0.473 0.670 1.000 0.636 CB 1.265 12 residues pruned to eliminate duplicates Z: 11 9.106 1.875 0.576 0.281 0.800 0.400 CB 1.559 11 residues pruned to eliminate duplicates Z: 66 45.962 2.188 0.811 0.595 0.938 0.615 CB 1.399 67 residues pruned to eliminate duplicates Z: 6 8.538 1.805 0.470 0.790 1.000 0.400 CA 1.115 6 residues pruned to eliminate duplicates Z: 15 21.310 1.857 0.612 0.930 1.000 0.929 CB 1.330 15 residues pruned to eliminate duplicates Z: 26 22.907 1.932 0.602 0.725 0.960 0.680 CB 1.258 26 residues pruned to eliminate duplicates Z: 27 21.012 2.145 0.584 0.528 0.846 0.577 CB 1.394 24 residues pruned to eliminate duplicates Z: 14 22.130 1.908 0.680 0.942 1.000 0.846 CB 1.328 14 residues pruned to eliminate duplicates Z: 9 11.267 2.017 0.353 0.589 1.000 0.500 CB 1.340 9 residues pruned to eliminate duplicates Z: 22 34.134 2.247 0.635 0.876 0.952 0.810 CB 1.547 22 residues pruned to eliminate duplicates Z: 20 8.910 1.988 0.487 0.224 0.684 0.316 CB 1.395 20 residues pruned to eliminate duplicates Z: 15 21.184 1.893 0.692 0.932 1.000 0.714 CB 1.234 15 residues pruned to eliminate duplicates Z: 37 42.308 2.283 1.020 0.632 0.944 0.667 CB 1.430 37 residues pruned to eliminate duplicates Z: 19 24.270 2.128 0.760 0.664 0.833 0.833 CB 1.575 19 residues pruned to eliminate duplicates Z: 15 24.817 1.880 0.902 0.934 1.000 0.643 CB 1.293 15 residues pruned to eliminate duplicates Z: 6 9.664 2.037 0.020 0.730 1.000 0.800 CA 1.692 6 residues pruned to eliminate duplicates Z: 53 32.392 2.181 0.740 0.546 0.904 0.615 CB 1.251 53 residues pruned to eliminate duplicates Z: 32 30.622 2.146 0.873 0.588 0.871 0.677 CB 1.445 32 residues pruned to eliminate duplicates Z: 30 57.331 2.360 0.854 0.918 1.000 0.759 CB 1.717 30 residues pruned to eliminate duplicates Z: 29 20.551 2.131 0.649 0.404 0.857 0.643 CB 1.427 29 residues pruned to eliminate duplicates Z: 42 41.903 2.400 0.677 0.507 0.927 0.707 CB 1.741 42 residues pruned to eliminate duplicates Z: 25 33.020 2.199 0.875 0.668 0.917 0.583 CB 1.527 25 residues pruned to eliminate duplicates Z: 39 21.776 1.979 0.577 0.578 0.868 0.605 CB 1.210 39 residues pruned to eliminate duplicates Z: 130 86.834 2.376 0.806 0.650 0.915 0.705 CB 1.693 130 residues pruned to eliminate duplicates Z: 15 20.497 1.870 0.576 0.927 1.000 0.857 CB 1.303 15 residues pruned to eliminate duplicates Z: 51 45.765 2.358 0.743 0.520 0.940 0.720 CB 1.642 51 residues pruned to eliminate duplicates Z: 89 91.386 2.491 0.976 0.721 0.932 0.727 CB 1.740 89 residues pruned to eliminate duplicates Z: 10 20.956 2.199 0.959 0.844 0.889 0.667 CB 1.357 10 residues pruned to eliminate duplicates Z: 17 24.032 2.145 0.968 0.841 0.875 0.562 CB 1.213 17 residues pruned to eliminate duplicates Z: 14 10.150 1.807 0.592 0.436 0.846 0.308 CB 1.236 14 residues pruned to eliminate duplicates Z: 24 43.550 2.247 1.074 0.830 0.913 0.609 CB 1.605 24 residues pruned to eliminate duplicates Z: 22 37.222 2.212 0.872 0.810 0.905 0.429 CB 1.655 22 residues pruned to eliminate duplicates Z: 9 8.614 1.875 0.158 0.571 0.875 0.500 CB 1.497 9 residues pruned to eliminate duplicates Z: 74 81.099 2.495 0.801 0.761 0.959 0.767 CB 1.748 74 residues pruned to eliminate duplicates Z: 56 29.471 2.127 0.570 0.523 0.909 0.618 CB 1.278 56 residues pruned to eliminate duplicates Z: 83 45.609 2.116 0.741 0.616 0.902 0.646 CB 1.357 110 residues pruned to eliminate duplicates Z: 14 19.034 1.958 0.582 0.878 0.923 0.769 CA 1.340 Z: 7 7.070 1.692 0.139 0.896 1.000 0.833 CB 1.073 7 residues pruned to eliminate duplicates Z: 33 43.823 2.414 0.834 0.610 0.906 0.594 CB 1.739 33 residues pruned to eliminate duplicates Z: 8 11.492 2.039 0.643 0.479 0.857 0.714 CB 1.545 8 residues pruned to eliminate duplicates Z: 12 14.222 1.903 0.579 0.711 0.909 0.636 CB 1.296 12 residues pruned to eliminate duplicates Z: 15 27.895 2.210 0.833 0.886 0.786 0.357 CB 1.691 15 residues pruned to eliminate duplicates Z: 13 23.462 2.348 1.000 0.614 0.917 0.750 CB 1.412 13 residues pruned to eliminate duplicates Z: 32 39.246 2.346 0.747 0.614 0.903 0.677 CB 1.710 32 residues pruned to eliminate duplicates Z: 39 25.881 1.963 0.715 0.593 0.974 0.605 CB 1.172 39 residues pruned to eliminate duplicates Z: 14 24.630 2.127 0.506 0.909 1.000 0.538 CB 1.513 14 residues pruned to eliminate duplicates Z: 24 38.168 2.025 1.187 0.915 0.957 0.522 CB 1.328 23 residues pruned to eliminate duplicates Z: 16 43.543 2.467 0.861 0.919 1.000 0.800 CB 1.725 16 residues pruned to eliminate duplicates Z: 15 37.779 2.380 0.674 0.914 1.000 0.857 CB 1.792 15 residues pruned to eliminate duplicates Z: 28 18.362 2.169 0.466 0.362 0.926 0.741 CB 1.392 28 residues pruned to eliminate duplicates Z: 14 22.491 1.916 0.668 0.939 1.000 1.000 CB 1.356 14 residues pruned to eliminate duplicates Z: 23 37.853 2.219 0.964 0.904 0.909 0.364 CB 1.450 23 residues pruned to eliminate duplicates Z: 8 6.273 2.031 0.170 0.440 0.714 0.571 CB 1.486 8 residues pruned to eliminate duplicates Z: 30 57.511 2.352 0.756 0.922 1.000 0.862 CA 1.819 30 residues pruned to eliminate duplicates Z: 51 48.904 2.347 0.855 0.507 0.960 0.620 CB 1.643 51 residues pruned to eliminate duplicates Z: 6 13.252 1.957 0.415 0.843 1.000 1.000 CA 1.593 Z: 32 58.298 2.300 0.879 0.852 1.000 0.774 CB 1.792 32 residues pruned to eliminate duplicates Z: 14 9.602 2.008 0.432 0.542 0.846 0.615 CB 1.050 14 residues pruned to eliminate duplicates Z: 74 54.112 2.322 0.757 0.582 0.877 0.671 CB 1.637 74 residues pruned to eliminate duplicates Z: 6 6.879 1.851 0.394 0.824 0.800 0.600 CB 1.126 6 residues pruned to eliminate duplicates Z: 19 17.617 2.124 0.383 0.575 0.889 0.667 CB 1.480 18 residues pruned to eliminate duplicates Z: 15 22.232 1.893 0.683 0.935 0.929 0.714 CB 1.400 15 residues pruned to eliminate duplicates Z: 6 9.701 2.032 0.458 0.521 1.000 0.400 CB 1.433 6 residues pruned to eliminate duplicates Z: 7 12.564 2.074 0.389 0.659 1.000 0.500 CB 1.536 7 residues pruned to eliminate duplicates Z: 9 16.830 1.942 0.948 0.710 0.875 0.625 CA 1.486 9 residues pruned to eliminate duplicates Z: 8 3.994 1.655 0.060 0.537 1.000 0.571 CB 0.830 8 residues pruned to eliminate duplicates Z: 98 84.562 2.365 0.847 0.717 0.938 0.742 CB 1.721 104 residues pruned to eliminate duplicates Z: 14 24.621 1.953 0.788 0.943 1.000 0.923 CB 1.356 14 residues pruned to eliminate duplicates Z: 20 15.461 2.161 0.255 0.537 0.842 0.684 CB 1.499 20 residues pruned to eliminate duplicates Z: 24 45.078 2.380 0.788 0.908 0.957 0.913 CB 1.639 24 residues pruned to eliminate duplicates Z: 20 19.299 2.163 0.448 0.561 0.895 0.737 CB 1.489 35 residues pruned to eliminate duplicates Z: 7 11.316 1.820 0.464 0.759 1.000 0.667 CA 1.378 7 residues pruned to eliminate duplicates Z: 14 44.429 2.365 1.324 0.913 1.000 0.615 CB 1.587 14 residues pruned to eliminate duplicates Z: 26 21.477 2.172 0.664 0.298 0.920 0.560 CB 1.619 26 residues pruned to eliminate duplicates Z: 15 20.110 1.889 0.411 0.931 1.000 1.000 CB 1.409 15 residues pruned to eliminate duplicates Z: 78 62.515 2.381 0.849 0.592 0.883 0.675 CB 1.678 78 residues pruned to eliminate duplicates Z: 30 25.805 1.973 0.755 0.641 0.897 0.586 CB 1.353 30 residues pruned to eliminate duplicates Z: 11 22.261 2.154 0.689 0.887 0.900 0.700 CB 1.550 11 residues pruned to eliminate duplicates Z: 15 18.881 1.867 0.349 0.928 1.000 0.929 CB 1.403 15 residues pruned to eliminate duplicates Z: 199 93.369 2.292 0.841 0.595 0.924 0.652 CB 1.554 199 residues pruned to eliminate duplicates Z: 106 81.621 2.378 0.828 0.648 0.924 0.695 CB 1.728 106 residues pruned to eliminate duplicates Z: 6 5.166 1.614 0.221 0.557 0.800 0.400 O 1.386 6 residues pruned to eliminate duplicates Z: 8 4.165 1.842 -0.014 0.724 0.714 0.429 CB 0.992 8 residues pruned to eliminate duplicates Z: 6 4.880 1.904 -0.142 0.628 1.000 0.800 CB 1.185 7 residues pruned to eliminate duplicates Z: 105 83.426 2.342 0.903 0.666 0.952 0.654 CB 1.654 105 residues pruned to eliminate duplicates Z: 21 38.599 2.189 0.939 0.915 0.950 0.600 CB 1.513 21 residues pruned to eliminate duplicates Z: 6 7.674 2.031 0.433 0.773 0.600 0.400 CA 1.545 6 residues pruned to eliminate duplicates Z: 14 7.649 1.700 0.457 0.300 0.846 0.462 CB 1.265 14 residues pruned to eliminate duplicates Z: 32 40.467 2.415 0.883 0.597 0.968 0.613 CB 1.506 32 residues pruned to eliminate duplicates Z: 9 7.032 1.934 0.389 0.559 0.750 0.625 CB 1.165 9 residues pruned to eliminate duplicates Z: 62 60.049 2.334 0.850 0.588 0.934 0.557 CB 1.752 62 residues pruned to eliminate duplicates Z: 10 5.798 1.822 0.101 0.514 0.778 0.444 CB 1.221 10 residues pruned to eliminate duplicates Z: 15 24.292 2.202 0.542 0.831 0.857 0.500 CB 1.676 15 residues pruned to eliminate duplicates Z: 25 43.043 2.312 0.706 0.920 0.958 0.833 CB 1.637 25 residues pruned to eliminate duplicates Z: 8 6.662 1.742 0.138 0.903 0.857 0.714 CB 1.057 8 residues pruned to eliminate duplicates Z: 6 6.038 1.916 0.440 0.723 0.800 0.800 CB 1.000 6 residues pruned to eliminate duplicates Z: 33 34.526 2.243 0.851 0.566 0.844 0.594 CB 1.635 33 residues pruned to eliminate duplicates Z: 41 28.295 1.984 0.734 0.590 0.975 0.600 CB 1.224 41 residues pruned to eliminate duplicates Z: 16 35.646 2.213 1.165 0.910 0.867 0.467 CB 1.572 16 residues pruned to eliminate duplicates Z: 29 59.946 2.366 0.961 0.908 0.964 0.750 CB 1.798 29 residues pruned to eliminate duplicates Z: 51 37.224 2.210 0.795 0.501 0.920 0.620 CB 1.441 51 residues pruned to eliminate duplicates Z: 33 42.310 2.262 0.947 0.641 0.969 0.625 CB 1.536 33 residues pruned to eliminate duplicates Z: 9 12.760 2.024 0.991 0.381 0.750 0.500 O 1.695 9 residues pruned to eliminate duplicates Z: 16 38.989 2.258 1.197 0.895 0.933 0.467 CB 1.558 16 residues pruned to eliminate duplicates Z: 7 8.118 1.816 0.554 0.772 1.000 0.833 CB 0.924 Z: 13 14.018 2.049 0.688 0.427 0.917 0.750 CB 1.377 13 residues pruned to eliminate duplicates Z: 16 39.209 2.335 0.911 0.915 0.933 0.933 CB 1.718 16 residues pruned to eliminate duplicates Z: 6 3.794 1.482 0.716 0.263 0.800 0.400 CA 1.093 5 residues pruned to eliminate duplicates Z: 13 24.170 2.065 0.939 0.638 1.000 0.667 CB 1.531 13 residues pruned to eliminate duplicates Z: 71 77.335 2.484 0.832 0.748 0.929 0.814 CB 1.753 71 residues pruned to eliminate duplicates Z: 71 84.671 2.442 0.945 0.770 0.971 0.771 CB 1.727 71 residues pruned to eliminate duplicates Z: 17 33.705 2.135 0.675 0.885 1.000 0.812 CB 1.700 17 residues pruned to eliminate duplicates Z: 31 51.732 2.377 0.725 0.910 0.967 0.667 CB 1.689 31 residues pruned to eliminate duplicates Z: 38 38.639 2.304 0.639 0.629 0.919 0.730 CB 1.621 38 residues pruned to eliminate duplicates Z: 87 62.473 2.391 0.713 0.558 0.919 0.674 CB 1.693 87 residues pruned to eliminate duplicates Z: 16 24.287 1.834 0.666 0.936 1.000 0.733 CB 1.429 16 residues pruned to eliminate duplicates Z: 17 24.818 2.059 0.570 0.908 0.938 0.875 CA 1.454 17 residues pruned to eliminate duplicates Z: 9 10.792 1.757 0.324 0.925 1.000 0.500 CB 1.150 9 residues pruned to eliminate duplicates Z: 65 53.872 2.277 0.874 0.564 0.938 0.562 CB 1.582 65 residues pruned to eliminate duplicates Z: 24 64.918 2.317 1.362 0.937 1.000 0.565 CB 1.722 24 residues pruned to eliminate duplicates Z: 29 67.123 2.325 1.133 0.948 0.964 0.500 CB 1.831 29 residues pruned to eliminate duplicates Z: 11 7.597 1.913 0.295 0.651 0.800 0.400 CB 1.053 11 residues pruned to eliminate duplicates Z: 48 33.725 2.235 0.647 0.518 0.894 0.660 CB 1.469 48 residues pruned to eliminate duplicates Z: 29 37.861 2.224 0.847 0.697 0.964 0.821 CB 1.509 32 residues pruned to eliminate duplicates Z: 29 69.258 2.390 1.217 0.930 0.964 0.500 CB 1.792 29 residues pruned to eliminate duplicates Z: 7 18.816 2.247 1.198 0.720 1.000 0.833 CB 1.274 7 residues pruned to eliminate duplicates Z: 6 3.387 1.768 0.100 0.258 0.800 0.800 CB 1.284 6 residues pruned to eliminate duplicates Z: 8 6.382 1.882 0.012 0.529 1.000 0.714 CB 1.230 Z: 10 17.817 2.172 0.709 0.605 1.000 0.667 CB 1.447 10 residues pruned to eliminate duplicates Z: 9 2.465 1.418 0.416 0.193 0.625 0.500 CB 1.002 Z: 15 14.501 1.874 0.490 0.494 1.000 0.571 CB 1.396 15 residues pruned to eliminate duplicates Z: 29 21.189 1.863 0.635 0.651 1.000 0.643 CB 1.142 29 residues pruned to eliminate duplicates Z: 38 35.157 2.176 0.846 0.615 0.919 0.703 CB 1.404 38 residues pruned to eliminate duplicates Z: 85 77.577 2.455 0.912 0.655 0.917 0.679 CB 1.703 85 residues pruned to eliminate duplicates Z: 18 22.941 2.100 0.940 0.685 0.765 0.353 CB 1.508 18 residues pruned to eliminate duplicates Z: 16 37.889 2.373 0.684 0.912 1.000 0.867 CA 1.734 16 residues pruned to eliminate duplicates Z: 11 22.368 2.185 0.472 0.885 1.000 0.700 CB 1.588 Z: 14 31.204 2.287 0.918 0.849 0.923 0.538 CB 1.585 14 residues pruned to eliminate duplicates Z: 25 29.330 2.089 0.853 0.637 0.958 0.667 CB 1.420 25 residues pruned to eliminate duplicates Z: 14 40.046 2.182 1.446 0.928 0.923 0.769 CB 1.579 14 residues pruned to eliminate duplicates Z: 73 81.028 2.343 0.936 0.749 0.917 0.750 CB 1.838 73 residues pruned to eliminate duplicates Z: 15 10.129 2.144 0.446 0.261 0.786 0.429 CB 1.460 15 residues pruned to eliminate duplicates Z: 26 39.011 2.469 0.730 0.646 0.920 0.720 CB 1.732 26 residues pruned to eliminate duplicates Z: 6 12.193 2.076 0.471 0.754 1.000 0.800 CA 1.424 6 residues pruned to eliminate duplicates Z: 11 10.095 2.038 0.257 0.721 0.900 0.700 CB 1.135 11 residues pruned to eliminate duplicates Z: 35 66.060 2.332 0.975 0.843 0.971 0.794 CB 1.886 35 residues pruned to eliminate duplicates Z: 6 3.084 1.359 -0.114 0.629 1.000 0.600 CB 1.015 Z: 29 43.713 2.287 0.444 0.938 0.964 0.893 CB 1.804 29 residues pruned to eliminate duplicates Z: 21 32.123 2.091 0.784 0.743 0.950 0.750 CB 1.631 21 residues pruned to eliminate duplicates Z: 46 42.994 2.248 0.990 0.647 0.800 0.556 CB 1.562 46 residues pruned to eliminate duplicates Z: 14 25.339 1.943 0.848 0.946 1.000 0.462 CB 1.353 14 residues pruned to eliminate duplicates Z: 34 45.007 2.282 0.912 0.691 0.939 0.818 CB 1.606 34 residues pruned to eliminate duplicates Z: 93 80.959 2.448 0.876 0.673 0.924 0.750 CB 1.696 93 residues pruned to eliminate duplicates Z: 9 7.440 1.760 0.340 0.517 0.875 0.250 CB 1.253 5 residues pruned to eliminate duplicates Z: 16 23.327 2.117 0.342 0.858 1.000 0.800 CA 1.562 16 residues pruned to eliminate duplicates Z: 6 2.648 1.842 -0.330 0.806 1.000 0.600 CB 0.735 Z: 15 27.001 1.902 1.034 0.949 1.000 0.571 CB 1.287 15 residues pruned to eliminate duplicates Z: 56 37.742 2.207 0.624 0.563 0.964 0.636 CB 1.386 56 residues pruned to eliminate duplicates Z: 7 4.846 1.646 0.149 0.882 1.000 0.833 CB 0.757 7 residues pruned to eliminate duplicates Z: 16 15.611 1.842 0.382 0.868 0.933 0.667 CB 1.240 16 residues pruned to eliminate duplicates Z: 6 15.871 1.968 0.658 0.841 1.000 1.000 CB 1.622 Z: 14 16.882 1.913 0.253 0.940 1.000 1.000 CB 1.358 14 residues pruned to eliminate duplicates Z: 22 47.941 2.438 0.914 0.764 1.000 0.381 CB 1.774 22 residues pruned to eliminate duplicates Z: 10 4.989 1.526 0.240 0.748 0.778 0.556 CB 0.905 10 residues pruned to eliminate duplicates Z: 13 21.674 2.278 0.534 0.883 0.917 0.750 CB 1.412 13 residues pruned to eliminate duplicates Z: 36 55.490 2.403 1.055 0.634 0.971 0.629 CB 1.723 36 residues pruned to eliminate duplicates Z: 29 56.442 2.371 0.957 0.920 0.964 0.714 CB 1.679 29 residues pruned to eliminate duplicates Z: 44 39.969 2.176 0.822 0.548 0.953 0.535 CB 1.538 44 residues pruned to eliminate duplicates Z: 87 57.789 2.257 0.753 0.582 0.942 0.686 CB 1.546 87 residues pruned to eliminate duplicates Z: 13 20.699 2.197 0.258 0.851 1.000 0.833 CB 1.601 13 residues pruned to eliminate duplicates Z: 18 20.338 2.197 0.656 0.597 0.882 0.647 CB 1.401 18 residues pruned to eliminate duplicates Z: 66 62.307 2.330 0.828 0.618 0.969 0.585 CB 1.675 66 residues pruned to eliminate duplicates Z: 15 29.600 2.137 1.097 0.797 0.929 0.714 CB 1.466 15 residues pruned to eliminate duplicates Z: 58 80.530 2.527 1.093 0.705 0.947 0.737 CB 1.768 58 residues pruned to eliminate duplicates Z: 7 12.738 2.099 0.195 0.889 1.000 0.500 CB 1.493 7 residues pruned to eliminate duplicates Z: 87 57.971 2.259 0.717 0.588 0.953 0.698 CB 1.553 87 residues pruned to eliminate duplicates Z: 12 23.555 2.214 0.565 0.823 0.909 0.364 CB 1.704 12 residues pruned to eliminate duplicates Z: 32 32.754 2.229 0.798 0.585 0.871 0.516 CB 1.554 32 residues pruned to eliminate duplicates Z: 6 2.738 1.191 0.516 0.756 0.600 0.600 O 0.900 6 residues pruned to eliminate duplicates Z: 6 6.374 2.022 0.239 0.545 0.800 0.800 CB 1.360 6 residues pruned to eliminate duplicates Z: 82 55.993 2.277 0.786 0.609 0.889 0.605 CB 1.552 84 residues pruned to eliminate duplicates Z: 13 34.411 2.228 0.859 0.895 1.000 0.833 CA 1.718 13 residues pruned to eliminate duplicates Z: 9 3.904 1.718 0.337 0.204 0.625 0.375 C 1.366 Z: 18 19.418 2.265 0.628 0.517 0.824 0.647 CB 1.525 18 residues pruned to eliminate duplicates Z: 7 3.333 1.496 0.385 0.482 0.667 0.333 CB 1.003 7 residues pruned to eliminate duplicates Z: 7 11.708 2.094 0.616 0.558 1.000 0.333 CB 1.335 7 residues pruned to eliminate duplicates Z: 8 4.685 1.858 0.211 0.395 0.857 0.714 CB 1.025 8 residues pruned to eliminate duplicates Z: 16 24.187 2.340 0.660 0.626 0.867 0.733 CA 1.648 16 residues pruned to eliminate duplicates Z: 15 23.118 1.874 0.869 0.927 1.000 0.429 CB 1.236 15 residues pruned to eliminate duplicates Z: 82 50.521 2.214 0.875 0.553 0.852 0.617 CB 1.508 82 residues pruned to eliminate duplicates Z: 31 31.427 2.131 0.741 0.642 0.967 0.633 CB 1.401 31 residues pruned to eliminate duplicates 6 1.241 1.330 -0.174 0.318 0.600 0.600 CB 1.029 ? Z: 14 22.480 1.916 0.855 0.941 1.000 0.462 CB 1.217 14 residues pruned to eliminate duplicates Z: 16 39.819 2.189 1.167 0.940 1.000 0.733 CB 1.505 16 residues pruned to eliminate duplicates Z: 7 8.227 1.905 0.167 0.709 1.000 0.500 CB 1.250 7 residues pruned to eliminate duplicates Z: 25 23.062 2.181 0.629 0.481 0.917 0.708 CB 1.473 25 residues pruned to eliminate duplicates Z: 99 76.802 2.419 0.867 0.645 0.888 0.663 CB 1.689 99 residues pruned to eliminate duplicates Z: 18 22.704 2.231 0.406 0.651 1.000 0.765 CB 1.525 18 residues pruned to eliminate duplicates Z: 37 32.466 2.307 0.509 0.455 0.972 0.611 CB 1.674 37 residues pruned to eliminate duplicates Z: 30 37.840 2.272 0.916 0.611 0.862 0.621 CB 1.686 30 residues pruned to eliminate duplicates Z: 8 5.473 1.744 0.338 0.412 0.857 0.714 CA 1.134 8 residues pruned to eliminate duplicates Z: 13 16.166 2.081 0.471 0.642 1.000 0.417 CB 1.335 13 residues pruned to eliminate duplicates Z: 20 14.349 1.893 0.421 0.548 0.947 0.579 CB 1.232 20 residues pruned to eliminate duplicates Z: 51 72.817 2.409 1.026 0.761 0.960 0.680 CB 1.743 51 residues pruned to eliminate duplicates Z: 6 4.707 1.406 0.604 0.461 1.000 0.600 C 0.971 Z: 20 28.263 2.200 0.570 0.694 0.947 0.789 CB 1.659 20 residues pruned to eliminate duplicates Z: 17 38.987 2.226 1.228 0.895 1.000 0.562 CB 1.408 17 residues pruned to eliminate duplicates Z: 8 4.850 1.495 0.232 0.891 1.000 0.571 CB 0.716 8 residues pruned to eliminate duplicates Z: 137 98.920 2.421 0.871 0.658 0.941 0.721 CB 1.718 137 residues pruned to eliminate duplicates 6 1.132 1.414 0.495 0.296 0.800 0.600 CB 0.376 ? Z: 38 35.502 2.281 0.765 0.543 0.865 0.595 CB 1.609 38 residues pruned to eliminate duplicates Z: 12 16.710 2.339 0.649 0.486 1.000 0.636 CB 1.325 12 residues pruned to eliminate duplicates Z: 16 29.130 2.168 0.716 0.923 1.000 0.800 CB 1.420 16 residues pruned to eliminate duplicates Z: 10 10.682 2.082 -0.134 0.928 1.000 1.000 CB 1.384 10 residues pruned to eliminate duplicates Z: 10 9.323 1.604 0.442 0.861 1.000 0.889 CB 0.987 10 residues pruned to eliminate duplicates Z: 9 18.092 2.426 0.621 0.507 1.000 0.750 CB 1.615 9 residues pruned to eliminate duplicates Z: 8 24.198 2.078 1.142 0.767 1.000 0.857 CB 1.622 8 residues pruned to eliminate duplicates Z: 13 11.440 1.886 0.184 0.653 1.000 0.583 CB 1.283 13 residues pruned to eliminate duplicates Z: 6 4.676 1.866 0.944 0.821 1.000 1.000 CB 0.436 Z: 71 73.790 2.358 0.909 0.777 0.929 0.743 CB 1.652 71 residues pruned to eliminate duplicates Z: 26 34.547 2.261 0.868 0.651 0.880 0.640 CB 1.615 26 residues pruned to eliminate duplicates Z: 21 32.834 2.142 1.017 0.906 0.950 0.400 CB 1.273 21 residues pruned to eliminate duplicates Z: 26 22.628 2.181 0.656 0.433 0.840 0.640 CB 1.598 26 residues pruned to eliminate duplicates Z: 38 27.580 2.176 0.595 0.489 0.892 0.595 CB 1.481 46 residues pruned to eliminate duplicates Z: 7 10.254 1.763 0.908 0.692 0.833 0.833 CB 1.253 Z: 34 37.724 2.312 1.017 0.594 0.848 0.606 CB 1.517 34 residues pruned to eliminate duplicates Z: 10 7.419 1.630 0.090 0.672 1.000 0.444 CB 1.188 Z: 15 14.164 2.001 0.462 0.480 1.000 0.571 CB 1.320 15 residues pruned to eliminate duplicates Z: 6 6.072 1.754 0.261 0.700 0.800 0.600 CB 1.278 6 residues pruned to eliminate duplicates Z: 28 51.898 2.258 1.114 0.877 0.926 0.481 CB 1.641 28 residues pruned to eliminate duplicates Z: 11 20.514 2.218 0.657 0.678 1.000 0.800 CB 1.499 11 residues pruned to eliminate duplicates Z: 94 92.268 2.443 0.945 0.717 0.968 0.645 CB 1.710 94 residues pruned to eliminate duplicates Z: 7 8.872 1.896 0.304 0.689 1.000 0.833 CB 1.232 7 residues pruned to eliminate duplicates Z: 44 36.660 2.235 0.978 0.527 0.860 0.535 CB 1.430 44 residues pruned to eliminate duplicates Z: 11 5.667 2.011 0.476 0.410 0.700 0.400 CB 0.948 11 residues pruned to eliminate duplicates Z: 6 7.139 1.750 0.896 0.473 0.800 0.600 CB 1.235 12 residues pruned to eliminate duplicates Z: 47 32.229 2.109 0.866 0.497 0.913 0.522 CB 1.327 47 residues pruned to eliminate duplicates Z: 8 8.467 1.682 0.279 0.846 1.000 0.714 CB 1.105 8 residues pruned to eliminate duplicates Z: 49 75.727 2.352 0.891 0.826 1.000 0.750 CB 1.854 49 residues pruned to eliminate duplicates Z: 38 40.520 2.215 0.962 0.619 1.000 0.703 CB 1.371 38 residues pruned to eliminate duplicates Z: 23 33.777 2.231 0.637 0.852 0.909 0.727 CB 1.604 23 residues pruned to eliminate duplicates Z: 32 22.337 1.956 0.669 0.594 0.903 0.419 CB 1.244 32 residues pruned to eliminate duplicates Z: 6 4.099 1.480 0.428 0.669 0.800 0.400 CB 0.928 Z: 19 28.719 2.096 0.609 0.763 0.944 0.833 CB 1.682 19 residues pruned to eliminate duplicates Z: 8 4.316 1.925 0.651 0.416 0.571 0.571 CB 0.980 8 residues pruned to eliminate duplicates Z: 47 42.699 2.265 0.856 0.580 0.957 0.652 CB 1.449 47 residues pruned to eliminate duplicates Z: 34 37.406 2.221 0.871 0.620 0.939 0.667 CB 1.489 34 residues pruned to eliminate duplicates Z: 6 7.880 1.721 0.630 0.855 0.800 0.400 CB 1.159 6 residues pruned to eliminate duplicates Z: 11 7.827 1.552 0.493 0.834 0.900 0.700 CB 0.890 10 residues pruned to eliminate duplicates Z: 12 22.795 2.035 0.981 0.731 0.909 0.727 CB 1.524 12 residues pruned to eliminate duplicates Z: 63 46.601 2.275 0.773 0.560 0.887 0.629 CB 1.560 63 residues pruned to eliminate duplicates Z: 25 26.880 2.135 0.695 0.590 1.000 0.542 CB 1.391 25 residues pruned to eliminate duplicates Z: 39 57.196 2.472 0.866 0.667 0.947 0.868 CB 1.819 39 residues pruned to eliminate duplicates Z: 94 81.234 2.346 0.817 0.715 0.925 0.731 CB 1.759 94 residues pruned to eliminate duplicates Z: 39 16.040 1.807 0.392 0.538 0.921 0.605 CB 1.082 39 residues pruned to eliminate duplicates Z: 14 25.284 2.267 0.579 0.749 0.923 0.615 CB 1.699 14 residues pruned to eliminate duplicates Z: 15 25.402 1.902 0.910 0.926 1.000 0.429 CB 1.310 15 residues pruned to eliminate duplicates Z: 14 27.571 2.123 0.802 0.809 0.923 0.615 CB 1.654 14 residues pruned to eliminate duplicates Z: 7 5.740 1.655 -0.005 0.891 1.000 1.000 CB 1.024 7 residues pruned to eliminate duplicates Z: 52 62.415 2.299 0.891 0.743 0.941 0.667 CB 1.717 52 residues pruned to eliminate duplicates Z: 9 11.568 1.694 0.665 0.839 0.875 0.375 CB 1.238 9 residues pruned to eliminate duplicates Z: 41 37.532 2.227 0.700 0.577 0.975 0.750 CB 1.493 41 residues pruned to eliminate duplicates Z: 10 3.153 1.646 0.249 0.233 0.667 0.444 CB 1.047 10 residues pruned to eliminate duplicates Z: 56 38.798 2.166 0.723 0.552 0.891 0.655 CB 1.496 56 residues pruned to eliminate duplicates Z: 18 16.717 1.838 0.951 0.530 0.824 0.588 CB 1.333 18 residues pruned to eliminate duplicates Z: 19 24.861 2.133 0.790 0.592 1.000 0.778 CB 1.406 19 residues pruned to eliminate duplicates Z: 20 34.634 2.381 0.633 0.778 0.895 0.684 CB 1.787 20 residues pruned to eliminate duplicates Z: 14 17.986 1.795 0.545 0.906 1.000 0.846 CB 1.279 14 residues pruned to eliminate duplicates Z: 17 22.998 1.769 0.833 0.897 1.000 0.688 CB 1.269 17 residues pruned to eliminate duplicates Z: 33 33.277 2.306 0.810 0.612 0.875 0.562 CB 1.448 33 residues pruned to eliminate duplicates Z: 6 5.240 1.509 0.443 0.602 1.000 0.600 CB 0.977 6 residues pruned to eliminate duplicates Z: 23 15.482 1.760 0.531 0.703 1.000 0.545 CB 1.018 23 residues pruned to eliminate duplicates Z: 9 11.576 2.001 0.840 0.467 0.875 0.625 CB 1.313 9 residues pruned to eliminate duplicates Z: 38 41.667 2.307 0.874 0.586 0.946 0.622 CB 1.543 38 residues pruned to eliminate duplicates Z: 76 84.880 2.498 1.010 0.675 0.960 0.733 CB 1.730 76 residues pruned to eliminate duplicates Z: 6 3.821 1.667 0.074 0.437 0.800 0.400 O 1.273 Z: 6 2.438 1.452 0.287 0.506 0.800 0.600 CB 0.725 6 residues pruned to eliminate duplicates Z: 14 16.425 2.203 0.203 0.843 0.923 0.692 CB 1.386 14 residues pruned to eliminate duplicates Z: 6 11.101 1.987 0.447 0.774 1.000 0.400 CB 1.355 6 residues pruned to eliminate duplicates Z: 6 13.388 2.163 0.654 0.749 1.000 0.600 CA 1.340 6 residues pruned to eliminate duplicates Z: 10 9.446 2.258 -0.164 0.708 0.889 0.778 CB 1.554 10 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 26 32.573 2.173 0.865 0.641 1.000 0.640 CB 1.409 26 residues pruned to eliminate duplicates Z: 28 28.174 2.151 0.893 0.565 0.926 0.630 CB 1.351 28 residues pruned to eliminate duplicates Z: 14 38.172 2.307 1.131 0.854 1.000 0.846 CB 1.591 14 residues pruned to eliminate duplicates Z: 24 33.469 2.255 1.000 0.663 0.913 0.609 CB 1.457 24 residues pruned to eliminate duplicates Z: 13 34.104 2.418 1.228 0.845 0.917 0.750 CB 1.482 13 residues pruned to eliminate duplicates Z: 28 31.231 2.101 0.978 0.565 0.963 0.667 CB 1.410 28 residues pruned to eliminate duplicates Z: 25 35.552 2.186 0.867 0.667 1.000 0.667 CB 1.524 25 residues pruned to eliminate duplicates Z: 36 35.254 2.134 0.870 0.557 0.914 0.571 CB 1.544 36 residues pruned to eliminate duplicates Z: 25 32.892 2.219 0.754 0.702 0.958 0.625 CB 1.497 25 residues pruned to eliminate duplicates Z: 26 30.766 2.132 0.694 0.671 0.960 0.640 CB 1.515 26 residues pruned to eliminate duplicates Z: 64 52.769 2.263 0.874 0.591 0.905 0.524 CB 1.588 64 residues pruned to eliminate duplicates Z: 26 33.882 2.161 1.025 0.655 0.920 0.600 CB 1.457 26 residues pruned to eliminate duplicates Z: 24 36.614 2.226 0.909 0.695 0.957 0.565 CB 1.571 24 residues pruned to eliminate duplicates Z: 25 34.509 2.143 0.813 0.666 1.000 0.625 CB 1.555 25 residues pruned to eliminate duplicates Z: 25 36.000 2.169 0.915 0.660 1.000 0.500 CB 1.526 25 residues pruned to eliminate duplicates Z: 33 29.925 2.057 0.736 0.588 0.938 0.531 CB 1.453 33 residues pruned to eliminate duplicates Z: 25 31.530 2.192 0.782 0.657 0.917 0.708 CB 1.553 25 residues pruned to eliminate duplicates Z: 24 37.420 2.211 1.018 0.656 0.957 0.565 CB 1.582 24 residues pruned to eliminate duplicates Z: 24 32.494 2.173 0.780 0.679 0.957 0.609 CB 1.554 24 residues pruned to eliminate duplicates Z: 25 34.023 2.138 0.790 0.670 1.000 0.625 CB 1.551 25 residues pruned to eliminate duplicates Z: 29 27.070 2.074 0.778 0.591 0.893 0.464 CB 1.425 29 residues pruned to eliminate duplicates Z: 41 38.290 2.204 0.781 0.668 0.875 0.675 CB 1.509 41 residues pruned to eliminate duplicates Z: 42 39.985 2.200 0.833 0.654 0.902 0.634 CB 1.487 42 residues pruned to eliminate duplicates Z: 19 22.530 2.210 0.699 0.666 0.833 0.722 CB 1.456 19 residues pruned to eliminate duplicates Z: 19 24.608 2.173 0.765 0.632 0.889 0.778 CB 1.503 19 residues pruned to eliminate duplicates Z: 19 21.420 2.173 0.605 0.596 0.944 0.667 CB 1.399 19 residues pruned to eliminate duplicates Z: 19 25.050 2.218 0.621 0.660 0.944 0.833 CB 1.499 19 residues pruned to eliminate duplicates Z: 18 25.877 2.234 0.737 0.681 0.941 0.529 CB 1.456 18 residues pruned to eliminate duplicates Z: 21 19.915 2.063 0.600 0.515 0.900 0.600 CB 1.476 11 residues pruned to eliminate duplicates Z: 13 21.642 2.045 0.881 0.832 0.917 0.667 CB 1.330 13 residues pruned to eliminate duplicates Z: 21 19.952 2.118 0.645 0.531 0.850 0.600 CB 1.461 23 residues pruned to eliminate duplicates Z: 11 30.303 2.256 0.887 0.889 1.000 0.700 CB 1.621 16 residues pruned to eliminate duplicates Z: 12 30.738 2.171 0.953 0.869 1.000 0.727 CA 1.596 12 residues pruned to eliminate duplicates Z: 20 21.132 2.180 0.598 0.549 0.895 0.579 CB 1.483 14 residues pruned to eliminate duplicates Z: 14 21.679 1.990 0.838 0.811 0.923 0.769 CB 1.358 14 residues pruned to eliminate duplicates Z: 19 23.688 2.163 0.603 0.595 0.944 0.778 CB 1.558 20 residues pruned to eliminate duplicates Z: 13 23.533 2.147 0.638 0.828 1.000 0.583 CB 1.456 13 residues pruned to eliminate duplicates Z: 19 23.668 2.184 0.530 0.600 1.000 0.722 CB 1.517 19 residues pruned to eliminate duplicates Z: 17 26.342 2.241 0.640 0.660 1.000 0.750 CB 1.545 18 residues pruned to eliminate duplicates Z: 14 26.801 2.195 0.877 0.737 0.923 0.692 CB 1.580 14 residues pruned to eliminate duplicates Z: 19 20.091 2.181 0.379 0.587 0.944 0.611 CB 1.534 19 residues pruned to eliminate duplicates Z: 20 20.978 2.138 0.615 0.591 0.842 0.684 CB 1.517 20 residues pruned to eliminate duplicates Z: 20 19.558 2.123 0.494 0.596 0.895 0.632 CB 1.443 20 residues pruned to eliminate duplicates Z: 9 11.460 2.045 0.483 0.562 1.000 0.500 CB 1.258 9 residues pruned to eliminate duplicates Z: 43 31.681 2.021 0.623 0.687 0.929 0.690 CB 1.352 43 residues pruned to eliminate duplicates Z: 32 22.405 1.926 0.694 0.629 0.935 0.742 CB 1.168 32 residues pruned to eliminate duplicates Z: 9 12.518 2.090 0.431 0.618 1.000 0.625 CB 1.324 9 residues pruned to eliminate duplicates Z: 27 24.428 2.139 0.543 0.600 0.923 0.692 CB 1.429 27 residues pruned to eliminate duplicates Z: 39 21.992 1.942 0.598 0.575 0.921 0.605 CB 1.161 39 residues pruned to eliminate duplicates Z: 8 12.012 2.059 0.438 0.612 1.000 0.571 CB 1.379 8 residues pruned to eliminate duplicates Z: 39 24.996 1.966 0.707 0.588 0.947 0.684 CB 1.171 39 residues pruned to eliminate duplicates Z: 39 25.635 1.984 0.634 0.600 0.921 0.605 CB 1.267 39 residues pruned to eliminate duplicates Z: 25 16.376 1.868 0.611 0.644 0.875 0.708 CB 1.109 25 residues pruned to eliminate duplicates Z: 42 23.498 1.943 0.763 0.535 0.854 0.610 CB 1.212 42 residues pruned to eliminate duplicates Z: 19 21.270 1.914 0.788 0.755 0.889 0.667 CB 1.313 19 residues pruned to eliminate duplicates Z: 51 29.829 2.002 0.740 0.589 0.900 0.660 CB 1.236 51 residues pruned to eliminate duplicates Z: 39 25.430 1.975 0.663 0.602 0.947 0.526 CB 1.203 39 residues pruned to eliminate duplicates Z: 15 21.343 1.851 0.700 0.898 1.000 0.571 CB 1.297 15 residues pruned to eliminate duplicates Z: 30 23.681 1.910 0.898 0.630 0.862 0.448 CB 1.246 30 residues pruned to eliminate duplicates Z: 41 24.433 1.960 0.746 0.571 0.875 0.525 CB 1.204 41 residues pruned to eliminate duplicates Z: 27 19.737 1.902 0.677 0.668 0.923 0.462 CB 1.125 27 residues pruned to eliminate duplicates Z: 42 24.674 1.990 0.703 0.549 0.927 0.415 CB 1.170 42 residues pruned to eliminate duplicates Z: 25 17.103 1.810 0.820 0.671 0.833 0.417 CB 1.087 25 residues pruned to eliminate duplicates Z: 27 21.382 1.902 0.788 0.710 0.885 0.462 CB 1.152 27 residues pruned to eliminate duplicates Z: 30 25.435 1.943 0.873 0.636 0.931 0.414 CB 1.227 30 residues pruned to eliminate duplicates Z: 14 16.761 1.864 0.949 0.932 0.846 0.231 CB 1.056 14 residues pruned to eliminate duplicates Z: 26 17.381 1.807 0.915 0.634 0.880 0.120 CB 1.008 26 residues pruned to eliminate duplicates Z: 20 14.821 1.837 0.870 0.533 0.895 0.368 CB 1.071 20 residues pruned to eliminate duplicates Z: 39 24.203 1.968 0.668 0.598 0.895 0.474 CB 1.217 39 residues pruned to eliminate duplicates Z: 9 3.894 1.667 0.682 0.345 0.750 0.500 CB 0.775 9 residues pruned to eliminate duplicates Z: 14 11.974 1.983 0.759 0.394 0.846 0.462 CB 1.258 14 residues pruned to eliminate duplicates Z: 15 9.796 1.870 0.806 0.366 0.786 0.357 CB 1.140 15 residues pruned to eliminate duplicates Z: 12 8.572 1.989 0.817 0.303 0.818 0.364 CB 1.088 12 residues pruned to eliminate duplicates Z: 52 29.927 2.118 0.584 0.498 0.902 0.549 CB 1.387 52 residues pruned to eliminate duplicates Z: 6 4.711 1.565 0.831 0.394 1.000 0.800 CA 0.823 6 residues pruned to eliminate duplicates Z: 18 10.675 1.812 0.674 0.368 0.882 0.529 CB 1.114 18 residues pruned to eliminate duplicates Z: 14 15.360 1.996 0.754 0.478 1.000 0.538 CB 1.244 14 residues pruned to eliminate duplicates Z: 43 23.660 1.889 0.709 0.600 0.905 0.452 CB 1.137 43 residues pruned to eliminate duplicates Z: 35 51.533 2.453 0.966 0.625 0.941 0.353 CB 1.731 35 residues pruned to eliminate duplicates Z: 24 53.442 2.502 0.993 0.715 1.000 0.565 CB 1.840 24 residues pruned to eliminate duplicates Z: 36 61.389 2.468 1.080 0.665 0.943 0.543 CB 1.840 36 residues pruned to eliminate duplicates Z: 38 59.354 2.457 0.963 0.628 0.946 0.676 CB 1.896 38 residues pruned to eliminate duplicates Z: 94 58.502 2.270 0.766 0.565 0.914 0.688 CB 1.554 94 residues pruned to eliminate duplicates Z: 51 70.315 2.457 0.890 0.717 0.980 0.740 CB 1.796 51 residues pruned to eliminate duplicates Z: 51 65.324 2.438 0.974 0.691 0.920 0.660 CB 1.751 51 residues pruned to eliminate duplicates Z: 35 63.938 2.487 1.061 0.682 0.971 0.735 CB 1.865 35 residues pruned to eliminate duplicates Z: 66 64.265 2.396 0.874 0.625 0.908 0.646 CB 1.739 66 residues pruned to eliminate duplicates Z: 25 48.672 2.488 0.853 0.717 1.000 0.792 CB 1.770 25 residues pruned to eliminate duplicates Z: 74 59.986 2.347 0.814 0.600 0.904 0.671 CB 1.658 74 residues pruned to eliminate duplicates Z: 52 65.554 2.423 0.800 0.701 0.980 0.765 CB 1.787 52 residues pruned to eliminate duplicates Z: 38 50.888 2.439 0.918 0.630 0.946 0.622 CB 1.673 38 residues pruned to eliminate duplicates Z: 56 43.102 2.266 0.765 0.522 0.927 0.527 CB 1.533 56 residues pruned to eliminate duplicates Z: 36 56.663 2.464 0.921 0.635 0.943 0.686 CA 1.891 36 residues pruned to eliminate duplicates Z: 39 58.694 2.387 0.975 0.626 0.974 0.684 CB 1.843 39 residues pruned to eliminate duplicates Z: 36 53.644 2.449 0.858 0.634 0.943 0.686 CB 1.863 36 residues pruned to eliminate duplicates Z: 30 51.979 2.433 0.863 0.673 1.000 0.759 CB 1.816 30 residues pruned to eliminate duplicates Z: 36 60.009 2.491 0.906 0.653 1.000 0.600 CB 1.854 36 residues pruned to eliminate duplicates Z: 44 47.337 2.369 0.813 0.579 0.953 0.558 CB 1.634 44 residues pruned to eliminate duplicates Z: 43 53.819 2.415 0.838 0.612 0.976 0.619 CB 1.723 43 residues pruned to eliminate duplicates Z: 36 64.494 2.469 1.073 0.659 0.971 0.657 CB 1.892 36 residues pruned to eliminate duplicates Z: 64 60.489 2.333 0.903 0.593 0.921 0.667 CB 1.705 64 residues pruned to eliminate duplicates Z: 35 62.149 2.523 0.844 0.681 1.000 0.706 CB 1.941 35 residues pruned to eliminate duplicates Z: 42 57.582 2.448 0.907 0.612 1.000 0.683 CB 1.733 42 residues pruned to eliminate duplicates Z: 54 43.413 2.246 0.771 0.556 0.925 0.585 CB 1.535 54 residues pruned to eliminate duplicates Z: 42 48.273 2.401 0.777 0.568 0.976 0.585 CB 1.695 42 residues pruned to eliminate duplicates Z: 61 38.916 2.208 0.650 0.531 0.867 0.533 CB 1.543 61 residues pruned to eliminate duplicates Z: 13 23.943 2.308 0.628 0.558 0.917 0.583 CA 1.897 13 residues pruned to eliminate duplicates Z: 43 46.959 2.368 0.690 0.586 0.976 0.643 CB 1.709 43 residues pruned to eliminate duplicates Z: 59 46.390 2.239 0.648 0.578 0.966 0.690 CB 1.587 59 residues pruned to eliminate duplicates Z: 35 56.166 2.492 0.764 0.662 1.000 0.735 CB 1.886 35 residues pruned to eliminate duplicates Z: 92 64.719 2.329 0.725 0.596 0.934 0.670 CB 1.650 92 residues pruned to eliminate duplicates Z: 66 62.188 2.387 0.760 0.624 0.923 0.662 CB 1.769 66 residues pruned to eliminate duplicates Z: 68 56.115 2.360 0.747 0.579 0.910 0.642 CB 1.693 68 residues pruned to eliminate duplicates Z: 32 28.619 2.230 0.570 0.550 0.903 0.645 CB 1.548 32 residues pruned to eliminate duplicates Z: 31 36.373 2.265 0.752 0.629 0.933 0.767 CB 1.588 31 residues pruned to eliminate duplicates Z: 19 21.048 2.115 0.424 0.738 0.944 0.778 CB 1.408 19 residues pruned to eliminate duplicates Z: 90 47.600 2.225 0.665 0.540 0.888 0.674 CB 1.475 90 residues pruned to eliminate duplicates Z: 61 44.664 2.204 0.621 0.622 0.917 0.633 CB 1.570 61 residues pruned to eliminate duplicates Z: 18 28.740 2.208 0.662 0.791 0.941 0.824 CB 1.563 18 residues pruned to eliminate duplicates Z: 95 69.678 2.328 0.789 0.585 0.947 0.628 CB 1.679 95 residues pruned to eliminate duplicates Z: 33 33.002 2.175 0.731 0.585 0.906 0.594 CB 1.576 33 residues pruned to eliminate duplicates Z: 45 48.192 2.339 0.832 0.638 0.932 0.636 CB 1.600 45 residues pruned to eliminate duplicates Z: 18 31.016 2.183 0.800 0.805 0.941 0.706 CB 1.558 18 residues pruned to eliminate duplicates Z: 32 37.576 2.245 0.899 0.603 0.903 0.613 CB 1.588 32 residues pruned to eliminate duplicates Z: 62 45.957 2.241 0.720 0.577 0.951 0.607 CB 1.491 62 residues pruned to eliminate duplicates Z: 90 65.650 2.305 0.764 0.614 0.978 0.652 CB 1.572 90 residues pruned to eliminate duplicates Z: 44 45.260 2.317 0.840 0.566 0.930 0.605 CB 1.633 44 residues pruned to eliminate duplicates Z: 57 52.160 2.279 0.926 0.598 0.911 0.554 CB 1.587 57 residues pruned to eliminate duplicates Z: 31 36.200 2.243 0.779 0.646 0.933 0.633 CB 1.548 31 residues pruned to eliminate duplicates Z: 66 60.518 2.321 0.760 0.606 0.969 0.615 CB 1.713 66 residues pruned to eliminate duplicates Z: 44 36.999 2.215 0.810 0.515 0.953 0.465 CB 1.453 44 residues pruned to eliminate duplicates Z: 40 39.996 2.273 0.975 0.538 0.872 0.564 CB 1.577 40 residues pruned to eliminate duplicates Z: 32 29.707 2.177 0.717 0.605 0.839 0.613 CB 1.540 32 residues pruned to eliminate duplicates Z: 16 16.655 2.159 0.843 0.382 0.867 0.533 CB 1.413 16 residues pruned to eliminate duplicates Z: 12 22.171 2.276 1.010 0.489 0.909 0.455 CB 1.625 12 residues pruned to eliminate duplicates Z: 16 14.089 2.129 0.785 0.366 0.800 0.600 CB 1.381 16 residues pruned to eliminate duplicates Z: 59 45.507 2.210 0.949 0.590 0.897 0.534 CB 1.420 59 residues pruned to eliminate duplicates Z: 67 61.432 2.350 0.771 0.640 0.939 0.682 CB 1.697 67 residues pruned to eliminate duplicates Z: 32 39.065 2.233 0.978 0.609 0.935 0.677 CB 1.532 32 residues pruned to eliminate duplicates Z: 30 32.222 2.165 0.993 0.556 0.862 0.414 CB 1.524 30 residues pruned to eliminate duplicates Z: 16 20.706 2.177 1.002 0.404 0.800 0.400 CB 1.696 16 residues pruned to eliminate duplicates Z: 86 52.700 2.272 0.770 0.552 0.906 0.624 CB 1.492 362 residues pruned to eliminate duplicates Z: 16 26.526 2.088 0.972 0.715 0.867 0.667 CB 1.579 16 residues pruned to eliminate duplicates Z: 119 64.748 2.268 0.846 0.547 0.890 0.551 CB 1.528 119 residues pruned to eliminate duplicates Z: 61 44.251 2.216 0.760 0.588 0.917 0.667 CB 1.468 61 residues pruned to eliminate duplicates Z: 13 36.097 2.451 1.101 0.823 0.917 0.750 CB 1.668 13 residues pruned to eliminate duplicates Z: 46 35.201 2.184 0.892 0.492 0.889 0.511 CB 1.440 46 residues pruned to eliminate duplicates Z: 73 54.060 2.271 0.909 0.567 0.917 0.542 CB 1.502 73 residues pruned to eliminate duplicates Z: 27 27.329 2.207 0.758 0.597 0.885 0.538 CB 1.423 27 residues pruned to eliminate duplicates Z: 41 38.943 2.260 0.825 0.521 0.925 0.600 CB 1.581 41 residues pruned to eliminate duplicates Z: 94 66.138 2.315 0.804 0.602 0.946 0.516 CB 1.575 94 residues pruned to eliminate duplicates Z: 57 40.964 2.180 0.878 0.514 0.911 0.536 CB 1.448 57 residues pruned to eliminate duplicates Z: 45 37.254 2.204 0.893 0.525 0.932 0.591 CB 1.410 45 residues pruned to eliminate duplicates Z: 95 54.823 2.237 0.706 0.606 0.904 0.660 CB 1.482 95 residues pruned to eliminate duplicates Z: 71 49.288 2.246 0.794 0.575 0.900 0.543 CB 1.511 71 residues pruned to eliminate duplicates Z: 44 35.346 2.200 0.815 0.516 0.930 0.605 CB 1.428 44 residues pruned to eliminate duplicates Z: 16 14.605 2.048 0.677 0.416 0.933 0.467 CB 1.285 16 residues pruned to eliminate duplicates Z: 43 35.434 2.213 0.767 0.563 0.905 0.619 CB 1.454 43 residues pruned to eliminate duplicates Z: 50 39.677 2.269 0.818 0.510 0.878 0.510 CB 1.551 50 residues pruned to eliminate duplicates Z: 116 65.971 2.266 0.723 0.592 0.922 0.643 CB 1.566 116 residues pruned to eliminate duplicates Z: 98 65.835 2.312 0.811 0.607 0.928 0.588 CB 1.555 98 residues pruned to eliminate duplicates Z: 32 28.792 2.112 0.688 0.605 0.935 0.484 CB 1.403 32 residues pruned to eliminate duplicates Z: 61 44.083 2.215 0.745 0.596 0.933 0.617 CB 1.439 61 residues pruned to eliminate duplicates Z: 21 12.521 1.898 0.695 0.395 0.950 0.350 CB 1.024 21 residues pruned to eliminate duplicates Z: 55 38.822 2.206 0.853 0.506 0.870 0.481 CB 1.476 55 residues pruned to eliminate duplicates Z: 45 35.488 2.192 0.692 0.537 0.909 0.614 CB 1.530 45 residues pruned to eliminate duplicates Z: 42 35.341 2.194 0.791 0.523 0.951 0.585 CB 1.443 42 residues pruned to eliminate duplicates Z: 62 45.028 2.208 0.880 0.577 0.902 0.574 CB 1.430 62 residues pruned to eliminate duplicates Z: 61 47.945 2.223 0.797 0.608 0.917 0.683 CB 1.526 61 residues pruned to eliminate duplicates Z: 60 51.541 2.244 0.886 0.630 0.932 0.627 CB 1.505 60 residues pruned to eliminate duplicates Z: 19 17.409 2.053 0.502 0.530 0.944 0.444 CB 1.368 19 residues pruned to eliminate duplicates Z: 19 15.418 2.037 0.447 0.494 0.944 0.556 CB 1.313 19 residues pruned to eliminate duplicates Z: 11 10.075 1.920 0.498 0.581 0.800 0.600 CB 1.281 11 residues pruned to eliminate duplicates Z: 13 11.709 1.888 0.392 0.546 0.917 0.333 CB 1.341 13 residues pruned to eliminate duplicates Z: 19 17.366 2.016 0.614 0.559 0.889 0.500 CB 1.337 19 residues pruned to eliminate duplicates Z: 13 14.338 1.928 0.643 0.611 0.917 0.667 CB 1.283 13 residues pruned to eliminate duplicates Z: 15 12.254 1.839 0.428 0.529 0.929 0.643 CB 1.305 15 residues pruned to eliminate duplicates Z: 13 12.045 1.885 0.251 0.614 1.000 0.417 CB 1.324 13 residues pruned to eliminate duplicates Z: 13 10.022 1.823 0.208 0.592 1.000 0.667 CB 1.203 13 residues pruned to eliminate duplicates Z: 18 17.201 2.076 0.456 0.514 0.941 0.471 CB 1.446 18 residues pruned to eliminate duplicates Z: 17 12.170 1.984 0.466 0.418 0.812 0.375 CB 1.403 17 residues pruned to eliminate duplicates Z: 18 15.103 2.062 0.422 0.502 0.882 0.588 CB 1.413 18 residues pruned to eliminate duplicates Z: 19 15.856 2.031 0.539 0.523 0.889 0.556 CB 1.314 19 residues pruned to eliminate duplicates Z: 19 13.037 1.982 0.468 0.521 0.833 0.556 CB 1.242 19 residues pruned to eliminate duplicates Z: 18 12.221 2.031 0.247 0.496 0.882 0.471 CB 1.331 18 residues pruned to eliminate duplicates Z: 18 15.994 2.015 0.552 0.522 0.941 0.471 CB 1.290 18 residues pruned to eliminate duplicates Z: 7 9.106 1.736 0.938 0.542 0.833 0.833 CB 1.272 7 residues pruned to eliminate duplicates Z: 63 42.870 2.328 0.674 0.430 0.919 0.597 CB 1.634 63 residues pruned to eliminate duplicates Z: 15 9.596 2.128 0.717 0.233 0.786 0.357 CB 1.220 15 residues pruned to eliminate duplicates Z: 114 90.322 2.445 0.967 0.674 0.912 0.593 CB 1.651 114 residues pruned to eliminate duplicates Z: 87 69.008 2.405 0.905 0.561 0.919 0.640 CB 1.666 86 residues pruned to eliminate duplicates Z: 6 9.356 1.922 0.746 0.319 1.000 0.400 CA 1.523 6 residues pruned to eliminate duplicates Z: 38 39.167 2.304 0.908 0.487 0.919 0.459 CB 1.615 38 residues pruned to eliminate duplicates Z: 84 65.239 2.384 0.821 0.537 0.952 0.687 CB 1.672 84 residues pruned to eliminate duplicates Z: 7 4.281 1.641 0.214 0.300 0.833 0.500 CB 1.317 7 residues pruned to eliminate duplicates Z: 18 10.859 2.137 0.577 0.242 0.824 0.471 CB 1.278 18 residues pruned to eliminate duplicates Z: 76 69.453 2.433 0.786 0.608 0.960 0.707 CB 1.735 76 residues pruned to eliminate duplicates Z: 76 67.005 2.429 0.825 0.602 0.933 0.653 CB 1.697 75 residues pruned to eliminate duplicates Z: 6 7.483 1.825 1.152 0.392 0.800 0.800 CA 1.194 6 residues pruned to eliminate duplicates Z: 49 47.814 2.431 0.725 0.515 0.958 0.646 CB 1.692 49 residues pruned to eliminate duplicates Z: 76 64.940 2.418 0.813 0.600 0.947 0.720 CB 1.643 77 residues pruned to eliminate duplicates Z: 16 23.729 2.255 0.499 0.685 0.933 0.667 CA 1.639 16 residues pruned to eliminate duplicates Z: 77 68.264 2.412 0.832 0.605 0.947 0.724 CB 1.693 77 residues pruned to eliminate duplicates Z: 27 38.281 2.342 0.911 0.584 0.885 0.500 CB 1.750 27 residues pruned to eliminate duplicates Z: 28 38.050 2.363 0.819 0.593 0.926 0.667 CB 1.684 28 residues pruned to eliminate duplicates Z: 50 50.857 2.436 0.804 0.511 0.939 0.673 CB 1.742 50 residues pruned to eliminate duplicates Z: 30 35.210 2.237 0.935 0.513 0.931 0.655 CB 1.601 30 residues pruned to eliminate duplicates Z: 30 34.101 2.335 0.791 0.577 0.862 0.586 CB 1.632 30 residues pruned to eliminate duplicates Z: 63 40.734 2.281 0.701 0.468 0.871 0.565 CB 1.581 63 residues pruned to eliminate duplicates Z: 54 45.392 2.373 0.777 0.465 0.943 0.604 CB 1.624 54 residues pruned to eliminate duplicates Z: 51 49.961 2.422 0.805 0.507 0.920 0.620 CB 1.744 51 residues pruned to eliminate duplicates Z: 67 63.080 2.437 0.769 0.605 0.955 0.712 CB 1.708 67 residues pruned to eliminate duplicates Z: 51 50.569 2.410 0.856 0.507 0.940 0.640 CB 1.690 51 residues pruned to eliminate duplicates Z: 50 48.108 2.407 0.809 0.529 0.918 0.571 CB 1.670 50 residues pruned to eliminate duplicates Z: 61 47.437 2.385 0.790 0.471 0.900 0.617 CB 1.642 61 residues pruned to eliminate duplicates Z: 75 71.391 2.416 0.898 0.618 0.959 0.703 CB 1.687 75 residues pruned to eliminate duplicates Z: 53 52.827 2.420 0.714 0.567 0.942 0.692 CB 1.756 53 residues pruned to eliminate duplicates Z: 53 52.052 2.371 0.893 0.546 0.962 0.692 CB 1.600 53 residues pruned to eliminate duplicates Z: 55 53.751 2.406 0.807 0.567 0.926 0.685 CB 1.704 55 residues pruned to eliminate duplicates Z: 51 51.590 2.402 0.838 0.518 0.940 0.660 CB 1.726 51 residues pruned to eliminate duplicates Z: 24 33.227 2.445 0.789 0.402 1.000 0.565 CB 1.756 24 residues pruned to eliminate duplicates Z: 50 54.667 2.429 0.890 0.544 0.939 0.653 CB 1.736 50 residues pruned to eliminate duplicates Z: 27 32.001 2.365 0.739 0.413 0.962 0.731 CB 1.738 27 residues pruned to eliminate duplicates Z: 51 55.270 2.419 0.881 0.532 0.940 0.660 CB 1.771 51 residues pruned to eliminate duplicates Z: 54 53.490 2.419 0.729 0.586 0.943 0.736 CB 1.714 54 residues pruned to eliminate duplicates Z: 86 51.783 2.220 0.690 0.581 0.918 0.706 CB 1.509 86 residues pruned to eliminate duplicates Z: 30 26.260 2.291 0.575 0.378 0.897 0.655 CA 1.717 30 residues pruned to eliminate duplicates Z: 30 28.506 2.322 0.644 0.382 0.931 0.586 CB 1.689 30 residues pruned to eliminate duplicates Z: 53 56.790 2.424 0.769 0.592 0.942 0.750 CB 1.785 53 residues pruned to eliminate duplicates Z: 6 7.747 1.875 1.035 0.315 1.000 0.400 CA 1.114 6 residues pruned to eliminate duplicates Z: 27 29.837 2.396 0.762 0.400 0.885 0.769 CB 1.742 27 residues pruned to eliminate duplicates Z: 27 31.468 2.356 0.626 0.444 0.962 0.692 CB 1.774 27 residues pruned to eliminate duplicates Z: 56 47.480 2.358 0.743 0.572 0.873 0.673 CB 1.665 56 residues pruned to eliminate duplicates Z: 52 48.570 2.397 0.772 0.542 0.922 0.804 CB 1.668 52 residues pruned to eliminate duplicates Z: 53 58.209 2.434 0.772 0.592 0.962 0.750 CB 1.783 53 residues pruned to eliminate duplicates Z: 40 50.165 2.440 0.768 0.634 0.923 0.795 CB 1.779 40 residues pruned to eliminate duplicates Z: 50 56.828 2.462 0.790 0.595 0.959 0.735 CB 1.753 50 residues pruned to eliminate duplicates Z: 76 65.820 2.425 0.860 0.602 0.907 0.680 CB 1.686 76 residues pruned to eliminate duplicates Z: 85 52.531 2.244 0.723 0.563 0.929 0.679 CB 1.501 85 residues pruned to eliminate duplicates Z: 30 45.939 2.373 0.797 0.727 0.931 0.793 CB 1.751 30 residues pruned to eliminate duplicates Z: 31 42.619 2.394 0.764 0.739 0.933 0.833 CB 1.594 31 residues pruned to eliminate duplicates Z: 9 12.333 2.227 0.148 0.779 0.875 0.875 CB 1.524 9 residues pruned to eliminate duplicates Z: 31 42.809 2.398 0.673 0.754 0.967 0.800 CB 1.607 31 residues pruned to eliminate duplicates Z: 29 45.198 2.427 0.731 0.768 0.964 0.679 CB 1.663 29 residues pruned to eliminate duplicates Z: 30 40.139 2.317 0.675 0.741 0.931 0.724 CB 1.662 29 residues pruned to eliminate duplicates Z: 25 45.864 2.331 0.674 0.908 1.000 0.917 CB 1.703 25 residues pruned to eliminate duplicates Z: 53 56.598 2.434 0.704 0.630 0.981 0.731 CB 1.707 54 residues pruned to eliminate duplicates Z: 24 39.291 2.346 0.541 0.936 0.957 0.957 CB 1.650 24 residues pruned to eliminate duplicates Z: 31 44.147 2.406 0.803 0.757 0.967 0.633 CB 1.529 31 residues pruned to eliminate duplicates Z: 77 68.608 2.403 0.846 0.620 0.934 0.618 CB 1.697 77 residues pruned to eliminate duplicates Z: 31 49.829 2.396 0.954 0.772 1.000 0.567 CB 1.528 31 residues pruned to eliminate duplicates Z: 24 55.673 2.416 1.152 0.932 0.957 0.565 CB 1.631 24 residues pruned to eliminate duplicates Z: 28 58.656 2.463 1.038 0.808 1.000 0.519 CB 1.720 28 residues pruned to eliminate duplicates Z: 25 51.801 2.316 1.145 0.925 0.958 0.583 CB 1.559 25 residues pruned to eliminate duplicates Z: 27 59.799 2.422 1.175 0.828 1.000 0.577 CB 1.676 26 residues pruned to eliminate duplicates Z: 24 53.997 2.429 1.047 0.954 0.957 0.739 CB 1.629 24 residues pruned to eliminate duplicates Z: 75 76.426 2.450 0.900 0.655 0.959 0.649 CB 1.722 75 residues pruned to eliminate duplicates Z: 28 57.700 2.475 1.014 0.803 1.000 0.741 CB 1.710 28 residues pruned to eliminate duplicates Z: 53 46.998 2.363 0.797 0.555 0.904 0.558 CB 1.610 54 residues pruned to eliminate duplicates Z: 24 55.691 2.406 1.184 0.946 0.957 0.565 CB 1.597 24 residues pruned to eliminate duplicates Z: 86 61.059 2.308 0.852 0.573 0.906 0.576 CB 1.593 86 residues pruned to eliminate duplicates Z: 27 56.773 2.353 1.115 0.827 1.000 0.577 CB 1.687 26 residues pruned to eliminate duplicates Z: 27 55.058 2.350 1.084 0.846 0.962 0.615 CB 1.703 27 residues pruned to eliminate duplicates Z: 17 10.651 1.713 0.470 0.659 0.938 0.750 CB 0.973 17 residues pruned to eliminate duplicates Z: 16 9.056 1.741 0.267 0.711 0.867 0.733 CB 1.010 16 residues pruned to eliminate duplicates Z: 14 12.124 1.827 0.431 0.753 0.923 0.692 CB 1.112 14 residues pruned to eliminate duplicates Z: 44 20.089 1.883 0.466 0.519 0.907 0.558 CB 1.201 44 residues pruned to eliminate duplicates Z: 15 9.368 1.710 0.426 0.634 0.857 0.786 CB 1.056 15 residues pruned to eliminate duplicates Z: 14 12.539 1.826 0.581 0.696 0.923 0.692 CB 1.091 14 residues pruned to eliminate duplicates Z: 16 11.254 1.703 0.379 0.729 0.933 0.800 CB 1.078 16 residues pruned to eliminate duplicates Z: 14 10.648 1.813 0.394 0.744 0.846 0.692 CB 1.110 14 residues pruned to eliminate duplicates Z: 15 12.037 1.805 0.284 0.768 1.000 0.714 CB 1.095 15 residues pruned to eliminate duplicates Z: 16 10.575 1.705 0.343 0.699 0.933 0.600 CB 1.066 16 residues pruned to eliminate duplicates Z: 14 15.703 1.840 0.715 0.707 1.000 0.769 CB 1.143 14 residues pruned to eliminate duplicates Z: 16 16.274 1.722 0.693 0.688 1.000 0.600 CB 1.214 16 residues pruned to eliminate duplicates Z: 8 6.625 1.702 0.725 0.441 0.857 0.429 CB 1.058 8 residues pruned to eliminate duplicates Z: 19 22.022 2.153 0.581 0.614 0.944 0.556 CB 1.450 19 residues pruned to eliminate duplicates Z: 21 18.031 2.057 0.390 0.600 0.950 0.600 CB 1.349 21 residues pruned to eliminate duplicates Z: 52 26.045 2.016 0.406 0.575 0.922 0.627 CB 1.298 52 residues pruned to eliminate duplicates Z: 26 25.498 2.236 0.392 0.550 1.000 0.640 CB 1.562 26 residues pruned to eliminate duplicates Z: 24 19.229 2.132 0.494 0.504 0.913 0.435 CB 1.373 24 residues pruned to eliminate duplicates Z: 39 35.943 2.190 0.605 0.641 0.947 0.632 CB 1.534 39 residues pruned to eliminate duplicates Z: 43 24.341 1.960 0.414 0.530 0.952 0.667 CB 1.382 43 residues pruned to eliminate duplicates Z: 26 19.412 1.951 0.422 0.670 0.880 0.760 CB 1.359 26 residues pruned to eliminate duplicates Z: 35 21.158 1.939 0.378 0.588 0.912 0.588 CB 1.369 35 residues pruned to eliminate duplicates Z: 45 25.671 1.975 0.611 0.515 0.864 0.523 CB 1.388 45 residues pruned to eliminate duplicates Z: 11 9.597 1.903 0.359 0.491 0.900 0.600 CB 1.316 11 residues pruned to eliminate duplicates Z: 41 24.459 2.015 0.511 0.546 0.925 0.600 CB 1.313 41 residues pruned to eliminate duplicates Z: 27 21.441 1.979 0.476 0.668 0.923 0.692 CB 1.335 27 residues pruned to eliminate duplicates Z: 39 27.226 2.028 0.586 0.580 0.921 0.605 CB 1.380 39 residues pruned to eliminate duplicates Z: 34 23.371 1.927 0.516 0.563 0.939 0.515 CB 1.394 34 residues pruned to eliminate duplicates Z: 18 18.530 1.835 0.496 0.832 0.941 0.765 CB 1.306 18 residues pruned to eliminate duplicates Z: 30 22.922 1.982 0.570 0.604 0.862 0.586 CB 1.438 30 residues pruned to eliminate duplicates Z: 31 25.653 1.950 0.783 0.610 0.900 0.500 CB 1.348 31 residues pruned to eliminate duplicates Z: 34 21.989 1.970 0.761 0.542 0.848 0.485 CB 1.248 34 residues pruned to eliminate duplicates Z: 18 18.820 1.831 0.824 0.811 0.882 0.471 CB 1.181 18 residues pruned to eliminate duplicates Z: 18 22.191 1.853 0.842 0.814 0.941 0.529 CB 1.275 18 residues pruned to eliminate duplicates Z: 31 25.275 1.974 0.766 0.601 0.900 0.567 CB 1.336 31 residues pruned to eliminate duplicates Z: 32 23.553 1.942 0.735 0.579 0.871 0.516 CB 1.335 32 residues pruned to eliminate duplicates Z: 30 26.155 2.010 0.794 0.607 0.862 0.552 CB 1.412 30 residues pruned to eliminate duplicates Z: 30 26.729 1.980 0.814 0.627 0.897 0.517 CB 1.368 30 residues pruned to eliminate duplicates Z: 31 15.307 1.870 0.393 0.532 0.867 0.533 CB 1.199 31 residues pruned to eliminate duplicates Z: 29 27.345 1.987 0.897 0.609 0.893 0.536 CB 1.385 29 residues pruned to eliminate duplicates Z: 71 44.305 2.162 0.727 0.580 0.871 0.643 CB 1.508 71 residues pruned to eliminate duplicates Z: 32 26.160 1.946 0.758 0.590 0.903 0.581 CB 1.395 32 residues pruned to eliminate duplicates Z: 34 24.954 1.887 0.841 0.537 0.939 0.455 CB 1.284 34 residues pruned to eliminate duplicates Z: 31 26.606 1.981 0.775 0.596 0.933 0.533 CB 1.350 31 residues pruned to eliminate duplicates Z: 40 27.044 1.986 0.723 0.575 0.897 0.615 CB 1.312 40 residues pruned to eliminate duplicates Z: 14 13.451 2.082 0.557 0.346 0.846 0.538 CB 1.608 14 residues pruned to eliminate duplicates Z: 31 22.920 1.948 0.716 0.571 0.833 0.600 CB 1.403 31 residues pruned to eliminate duplicates Z: 15 13.931 2.019 0.743 0.336 0.786 0.571 CB 1.612 15 residues pruned to eliminate duplicates Z: 32 25.818 1.976 0.888 0.611 0.871 0.613 CB 1.284 32 residues pruned to eliminate duplicates Z: 15 14.339 2.007 0.777 0.334 0.929 0.357 CB 1.387 15 residues pruned to eliminate duplicates Z: 32 27.637 1.938 0.947 0.596 0.903 0.452 CB 1.329 32 residues pruned to eliminate duplicates Z: 30 27.977 1.994 0.898 0.628 0.897 0.517 CB 1.357 30 residues pruned to eliminate duplicates Z: 44 26.906 2.032 0.751 0.535 0.884 0.581 CB 1.261 44 residues pruned to eliminate duplicates Z: 31 28.344 1.972 0.818 0.609 0.967 0.633 CB 1.346 31 residues pruned to eliminate duplicates Z: 35 26.921 1.984 0.725 0.566 0.912 0.471 CB 1.389 35 residues pruned to eliminate duplicates Z: 33 41.774 2.266 1.067 0.605 0.938 0.625 CB 1.522 33 residues pruned to eliminate duplicates Z: 89 49.354 2.166 0.757 0.568 0.886 0.648 CB 1.460 89 residues pruned to eliminate duplicates Z: 34 25.938 2.002 0.768 0.562 0.848 0.606 CB 1.416 34 residues pruned to eliminate duplicates Z: 35 24.232 1.944 0.660 0.544 0.882 0.559 CB 1.398 35 residues pruned to eliminate duplicates Z: 64 45.444 2.137 0.811 0.582 0.937 0.556 CB 1.460 64 residues pruned to eliminate duplicates Z: 56 40.072 2.249 0.731 0.489 0.909 0.582 CB 1.543 56 residues pruned to eliminate duplicates Z: 38 38.033 2.304 0.639 0.613 0.946 0.730 CB 1.572 38 residues pruned to eliminate duplicates Z: 37 38.568 2.201 0.867 0.605 0.944 0.722 CB 1.498 37 residues pruned to eliminate duplicates Z: 38 44.339 2.308 0.901 0.614 0.973 0.676 CB 1.533 38 residues pruned to eliminate duplicates Z: 57 43.262 2.277 0.772 0.571 0.946 0.661 CB 1.414 57 residues pruned to eliminate duplicates Z: 51 38.094 2.220 0.701 0.546 0.900 0.660 CB 1.516 51 residues pruned to eliminate duplicates Z: 35 43.696 2.290 0.922 0.640 1.000 0.676 CB 1.494 35 residues pruned to eliminate duplicates Z: 38 38.130 2.250 0.985 0.588 0.892 0.676 CB 1.446 38 residues pruned to eliminate duplicates Z: 90 62.583 2.371 0.717 0.592 0.955 0.730 CB 1.563 90 residues pruned to eliminate duplicates Z: 62 47.276 2.303 0.808 0.562 0.918 0.623 CB 1.491 62 residues pruned to eliminate duplicates Z: 51 43.191 2.279 0.857 0.604 0.900 0.580 CB 1.453 51 residues pruned to eliminate duplicates Z: 36 40.307 2.289 0.932 0.604 0.914 0.629 CB 1.527 36 residues pruned to eliminate duplicates Z: 39 45.019 2.326 0.974 0.594 0.947 0.579 CB 1.534 39 residues pruned to eliminate duplicates Z: 138 98.196 2.401 0.916 0.669 0.956 0.715 CB 1.631 138 residues pruned to eliminate duplicates Z: 38 42.176 2.200 1.047 0.610 0.946 0.595 CB 1.466 38 residues pruned to eliminate duplicates Z: 59 39.796 2.251 0.782 0.550 0.879 0.483 CB 1.412 59 residues pruned to eliminate duplicates Z: 138 95.034 2.423 0.857 0.671 0.949 0.708 CB 1.625 138 residues pruned to eliminate duplicates Z: 56 43.190 2.287 0.863 0.584 0.855 0.600 CB 1.475 56 residues pruned to eliminate duplicates Z: 137 93.949 2.421 0.838 0.667 0.949 0.721 CB 1.635 137 residues pruned to eliminate duplicates Z: 49 42.883 2.258 0.859 0.601 0.896 0.625 CB 1.495 49 residues pruned to eliminate duplicates Z: 40 41.097 2.269 0.905 0.589 0.949 0.538 CB 1.473 40 residues pruned to eliminate duplicates Z: 55 39.725 2.219 0.842 0.509 0.889 0.685 CB 1.474 55 residues pruned to eliminate duplicates Z: 34 47.440 2.310 1.096 0.659 0.970 0.667 CB 1.518 34 residues pruned to eliminate duplicates Z: 50 42.778 2.317 0.704 0.595 0.918 0.653 CB 1.539 50 residues pruned to eliminate duplicates Z: 50 45.170 2.309 0.850 0.589 0.918 0.653 CB 1.510 50 residues pruned to eliminate duplicates Z: 37 45.616 2.315 1.031 0.615 0.944 0.639 CB 1.536 37 residues pruned to eliminate duplicates Z: 34 44.101 2.344 0.866 0.654 0.970 0.788 CB 1.569 34 residues pruned to eliminate duplicates Z: 36 39.475 2.273 0.847 0.621 0.914 0.829 CB 1.550 36 residues pruned to eliminate duplicates Z: 56 42.478 2.269 0.770 0.577 0.927 0.673 CB 1.428 56 residues pruned to eliminate duplicates Z: 37 44.089 2.354 0.845 0.580 1.000 0.639 CB 1.566 37 residues pruned to eliminate duplicates Z: 61 48.881 2.350 0.764 0.580 0.950 0.650 CB 1.483 61 residues pruned to eliminate duplicates Z: 38 45.499 2.328 0.972 0.615 0.973 0.568 CB 1.502 38 residues pruned to eliminate duplicates Z: 57 42.556 2.219 0.801 0.549 0.946 0.625 CB 1.432 57 residues pruned to eliminate duplicates Z: 48 52.508 2.327 0.948 0.640 0.979 0.787 CB 1.514 48 residues pruned to eliminate duplicates Z: 63 48.391 2.320 0.750 0.574 0.952 0.661 CB 1.482 63 residues pruned to eliminate duplicates Z: 70 53.589 2.352 0.795 0.569 0.942 0.681 CB 1.517 70 residues pruned to eliminate duplicates Z: 49 46.587 2.326 0.820 0.608 0.958 0.708 CB 1.496 49 residues pruned to eliminate duplicates Z: 18 18.009 2.214 0.587 0.515 0.941 0.647 CB 1.301 18 residues pruned to eliminate duplicates Z: 58 47.650 2.281 0.815 0.578 0.947 0.596 CB 1.494 58 residues pruned to eliminate duplicates Z: 20 15.960 2.146 0.394 0.522 0.895 0.632 CB 1.338 20 residues pruned to eliminate duplicates Z: 137 95.448 2.437 0.790 0.670 0.971 0.735 CB 1.652 137 residues pruned to eliminate duplicates Z: 12 16.923 2.234 0.364 0.668 0.909 0.727 CB 1.578 12 residues pruned to eliminate duplicates Z: 138 95.649 2.423 0.899 0.653 0.949 0.679 CB 1.623 138 residues pruned to eliminate duplicates Z: 13 12.917 2.119 0.516 0.606 0.833 0.667 CB 1.259 13 residues pruned to eliminate duplicates Z: 55 44.082 2.308 0.796 0.580 0.926 0.611 CB 1.447 55 residues pruned to eliminate duplicates Z: 61 47.395 2.316 0.762 0.552 0.967 0.567 CB 1.474 61 residues pruned to eliminate duplicates Z: 96 48.742 2.205 0.716 0.555 0.895 0.589 CB 1.400 96 residues pruned to eliminate duplicates Z: 61 49.886 2.342 0.747 0.606 0.950 0.767 CB 1.499 61 residues pruned to eliminate duplicates Z: 34 19.472 2.136 0.673 0.429 0.848 0.636 CB 1.203 34 residues pruned to eliminate duplicates Z: 17 18.833 2.253 0.611 0.535 0.938 0.562 CB 1.336 17 residues pruned to eliminate duplicates Z: 91 86.759 2.476 0.843 0.730 0.944 0.756 CB 1.726 91 residues pruned to eliminate duplicates Z: 15 23.136 2.299 0.755 0.576 0.929 0.714 CB 1.534 15 residues pruned to eliminate duplicates Z: 103 89.558 2.449 0.894 0.677 0.951 0.696 CB 1.709 103 residues pruned to eliminate duplicates Z: 88 91.557 2.493 0.953 0.750 0.931 0.770 CB 1.733 88 residues pruned to eliminate duplicates Z: 14 14.715 2.121 0.506 0.531 0.846 0.538 CB 1.464 14 residues pruned to eliminate duplicates Z: 15 19.483 2.192 0.610 0.490 1.000 0.643 CB 1.490 15 residues pruned to eliminate duplicates Z: 44 47.490 2.434 0.754 0.639 0.930 0.674 CB 1.602 44 residues pruned to eliminate duplicates Z: 42 46.517 2.446 0.738 0.662 0.951 0.732 CB 1.547 42 residues pruned to eliminate duplicates Z: 159 91.692 2.399 0.854 0.590 0.911 0.690 CB 1.651 159 residues pruned to eliminate duplicates Z: 98 90.157 2.484 0.901 0.709 0.938 0.660 CB 1.709 98 residues pruned to eliminate duplicates Z: 103 81.767 2.453 0.836 0.666 0.922 0.706 CB 1.672 103 residues pruned to eliminate duplicates Z: 44 41.741 2.402 0.640 0.620 0.907 0.721 CB 1.591 44 residues pruned to eliminate duplicates Z: 93 82.494 2.481 0.788 0.707 0.935 0.717 CB 1.719 93 residues pruned to eliminate duplicates Z: 43 48.613 2.449 0.746 0.638 0.952 0.690 CB 1.619 43 residues pruned to eliminate duplicates Z: 107 82.980 2.431 0.885 0.639 0.934 0.660 CB 1.654 107 residues pruned to eliminate duplicates Z: 41 46.552 2.493 0.636 0.643 0.950 0.675 CB 1.661 41 residues pruned to eliminate duplicates Z: 30 36.829 2.449 0.694 0.645 0.931 0.724 CB 1.546 30 residues pruned to eliminate duplicates Z: 42 48.522 2.478 0.801 0.653 0.927 0.732 CB 1.588 42 residues pruned to eliminate duplicates Z: 130 90.080 2.438 0.861 0.637 0.915 0.620 CB 1.680 130 residues pruned to eliminate duplicates Z: 77 89.353 2.505 0.959 0.758 0.961 0.750 CB 1.728 77 residues pruned to eliminate duplicates Z: 87 94.428 2.523 0.932 0.733 0.965 0.744 CB 1.756 87 residues pruned to eliminate duplicates Z: 101 84.464 2.472 0.863 0.667 0.930 0.690 CB 1.689 101 residues pruned to eliminate duplicates Z: 87 87.004 2.471 0.969 0.710 0.930 0.721 CB 1.713 87 residues pruned to eliminate duplicates Z: 26 46.346 2.538 0.923 0.735 0.920 0.880 CB 1.672 26 residues pruned to eliminate duplicates Z: 43 49.072 2.436 0.805 0.638 0.929 0.714 CB 1.629 43 residues pruned to eliminate duplicates Z: 89 87.603 2.488 0.954 0.710 0.932 0.773 CB 1.703 89 residues pruned to eliminate duplicates Z: 86 96.305 2.508 1.018 0.744 0.941 0.765 CB 1.763 86 residues pruned to eliminate duplicates Z: 156 92.335 2.431 0.758 0.610 0.935 0.690 CB 1.670 156 residues pruned to eliminate duplicates Z: 45 49.433 2.412 0.952 0.592 0.886 0.682 CB 1.635 45 residues pruned to eliminate duplicates Z: 141 90.643 2.371 0.921 0.642 0.936 0.664 CB 1.574 141 residues pruned to eliminate duplicates Z: 89 92.966 2.489 1.003 0.738 0.943 0.716 CB 1.703 89 residues pruned to eliminate duplicates Z: 101 90.345 2.479 0.970 0.691 0.930 0.760 CB 1.670 101 residues pruned to eliminate duplicates Z: 43 53.330 2.417 1.008 0.621 0.976 0.571 CB 1.550 43 residues pruned to eliminate duplicates Z: 77 88.786 2.510 0.955 0.766 0.934 0.711 CB 1.755 77 residues pruned to eliminate duplicates Z: 26 55.246 2.550 1.137 0.758 1.000 0.840 CB 1.612 26 residues pruned to eliminate duplicates Z: 90 95.933 2.502 1.025 0.722 0.944 0.697 CB 1.741 90 residues pruned to eliminate duplicates Z: 97 86.199 2.460 0.966 0.682 0.927 0.688 CB 1.661 97 residues pruned to eliminate duplicates Z: 91 90.283 2.477 0.959 0.715 0.933 0.700 CB 1.729 91 residues pruned to eliminate duplicates Z: 91 84.537 2.460 0.987 0.687 0.911 0.667 CB 1.686 91 residues pruned to eliminate duplicates Z: 84 87.260 2.480 0.950 0.736 0.940 0.687 CB 1.706 84 residues pruned to eliminate duplicates Z: 86 91.739 2.477 1.033 0.718 0.953 0.753 CB 1.703 86 residues pruned to eliminate duplicates Z: 89 97.429 2.509 1.013 0.743 0.966 0.705 CB 1.713 89 residues pruned to eliminate duplicates Z: 90 90.870 2.467 1.035 0.691 0.944 0.697 CB 1.708 90 residues pruned to eliminate duplicates Z: 93 92.287 2.475 1.018 0.719 0.935 0.728 CB 1.691 93 residues pruned to eliminate duplicates Z: 137 100.032 2.469 0.918 0.623 0.941 0.603 CB 1.713 137 residues pruned to eliminate duplicates Z: 71 65.520 2.432 1.028 0.608 0.871 0.614 CB 1.644 71 residues pruned to eliminate duplicates Z: 92 94.711 2.463 1.089 0.710 0.945 0.758 CB 1.689 92 residues pruned to eliminate duplicates Z: 125 90.084 2.402 1.026 0.651 0.903 0.645 CB 1.599 125 residues pruned to eliminate duplicates Z: 73 95.350 2.555 1.122 0.768 0.917 0.778 CB 1.782 73 residues pruned to eliminate duplicates Z: 92 93.024 2.489 1.013 0.723 0.945 0.670 CB 1.683 92 residues pruned to eliminate duplicates Z: 92 90.989 2.489 0.945 0.720 0.945 0.725 CB 1.709 92 residues pruned to eliminate duplicates Z: 94 93.637 2.455 1.043 0.712 0.946 0.753 CB 1.688 94 residues pruned to eliminate duplicates Z: 179 104.244 2.442 0.897 0.629 0.899 0.685 CB 1.662 179 residues pruned to eliminate duplicates Z: 74 98.405 2.528 1.126 0.760 0.959 0.753 CB 1.774 74 residues pruned to eliminate duplicates Z: 106 84.341 2.448 0.899 0.670 0.933 0.733 CB 1.622 106 residues pruned to eliminate duplicates Z: 90 82.813 2.465 0.941 0.658 0.933 0.719 CB 1.698 90 residues pruned to eliminate duplicates Z: 90 99.241 2.512 1.056 0.731 0.944 0.742 CB 1.752 90 residues pruned to eliminate duplicates Z: 101 90.794 2.473 1.000 0.692 0.920 0.660 CB 1.674 101 residues pruned to eliminate duplicates Z: 77 92.710 2.513 1.069 0.746 0.947 0.724 CB 1.733 77 residues pruned to eliminate duplicates Z: 77 93.833 2.522 1.041 0.765 0.961 0.724 CB 1.721 77 residues pruned to eliminate duplicates Z: 103 85.333 2.443 0.973 0.645 0.912 0.735 CB 1.679 103 residues pruned to eliminate duplicates Z: 137 99.218 2.465 0.976 0.614 0.926 0.676 CB 1.693 137 residues pruned to eliminate duplicates Z: 106 87.991 2.447 1.007 0.657 0.895 0.686 CB 1.689 106 residues pruned to eliminate duplicates Z: 89 93.960 2.507 1.025 0.723 0.943 0.682 CB 1.711 89 residues pruned to eliminate duplicates Z: 90 94.669 2.486 1.065 0.717 0.944 0.708 CB 1.702 90 residues pruned to eliminate duplicates Z: 91 91.218 2.466 0.975 0.719 0.933 0.722 CB 1.735 91 residues pruned to eliminate duplicates Z: 77 90.734 2.495 1.007 0.743 0.947 0.763 CB 1.765 77 residues pruned to eliminate duplicates Z: 178 115.175 2.457 0.908 0.644 0.949 0.701 CB 1.700 178 residues pruned to eliminate duplicates Z: 46 84.832 2.552 1.026 0.838 0.978 0.844 CB 1.869 46 residues pruned to eliminate duplicates Z: 130 95.856 2.449 0.930 0.649 0.922 0.651 CB 1.685 130 residues pruned to eliminate duplicates Z: 79 91.791 2.480 1.092 0.751 0.949 0.705 CB 1.688 79 residues pruned to eliminate duplicates Z: 103 87.625 2.448 0.995 0.654 0.931 0.657 CB 1.654 103 residues pruned to eliminate duplicates Z: 107 88.276 2.418 0.983 0.662 0.925 0.726 CB 1.665 107 residues pruned to eliminate duplicates Z: 102 91.681 2.463 1.025 0.680 0.941 0.624 CB 1.648 102 residues pruned to eliminate duplicates Z: 135 95.960 2.409 1.012 0.644 0.940 0.590 CB 1.590 135 residues pruned to eliminate duplicates Z: 78 91.797 2.482 1.137 0.730 0.935 0.662 CB 1.715 78 residues pruned to eliminate duplicates Z: 90 93.297 2.472 1.089 0.709 0.933 0.629 CB 1.698 90 residues pruned to eliminate duplicates Z: 47 86.931 2.538 1.184 0.800 0.978 0.652 CB 1.817 47 residues pruned to eliminate duplicates Z: 73 96.389 2.528 1.181 0.762 0.958 0.681 CB 1.703 73 residues pruned to eliminate duplicates Z: 103 91.858 2.449 1.032 0.673 0.951 0.618 CB 1.638 103 residues pruned to eliminate duplicates Z: 139 103.151 2.430 1.015 0.663 0.949 0.630 CB 1.624 139 residues pruned to eliminate duplicates Z: 90 95.427 2.475 1.130 0.699 0.955 0.629 CB 1.675 90 residues pruned to eliminate duplicates Z: 23 58.159 2.401 1.347 0.918 0.955 0.864 CB 1.625 23 residues pruned to eliminate duplicates Z: 91 86.653 2.451 1.106 0.673 0.933 0.644 CB 1.615 91 residues pruned to eliminate duplicates Z: 139 93.246 2.453 0.928 0.602 0.920 0.645 CB 1.655 139 residues pruned to eliminate duplicates Z: 154 98.088 2.434 0.928 0.598 0.915 0.627 CB 1.681 154 residues pruned to eliminate duplicates Z: 34 34.151 2.272 0.620 0.667 1.000 0.758 CB 1.383 Z: 6 5.808 1.902 0.560 0.230 1.000 0.200 CB 1.199 6 residues pruned to eliminate duplicates Z: 18 30.035 2.139 0.672 0.812 1.000 0.824 CB 1.553 18 residues pruned to eliminate duplicates Z: 40 35.111 2.244 0.688 0.560 0.974 0.718 CB 1.437 36 residues pruned to eliminate duplicates Z: 17 18.353 2.135 0.347 0.874 0.875 0.750 CB 1.326 17 residues pruned to eliminate duplicates Z: 48 36.679 2.249 0.708 0.582 0.957 0.745 CB 1.344 44 residues pruned to eliminate duplicates Z: 16 21.758 2.168 0.547 0.880 0.867 0.800 CB 1.401 16 residues pruned to eliminate duplicates Z: 41 40.336 2.244 0.936 0.594 0.950 0.700 CB 1.412 39 residues pruned to eliminate duplicates Z: 16 24.211 2.198 0.642 0.869 0.867 0.733 CB 1.460 16 residues pruned to eliminate duplicates Z: 34 40.575 2.293 0.860 0.672 1.000 0.636 CB 1.412 34 residues pruned to eliminate duplicates Z: 50 34.663 2.168 0.742 0.573 0.898 0.653 CB 1.360 50 residues pruned to eliminate duplicates Z: 39 39.817 2.258 0.831 0.594 1.000 0.632 CB 1.428 39 residues pruned to eliminate duplicates Z: 67 37.314 2.140 0.780 0.490 0.924 0.591 CB 1.318 50 residues pruned to eliminate duplicates Z: 15 31.185 2.230 1.065 0.909 0.929 0.643 CB 1.383 15 residues pruned to eliminate duplicates Z: 58 33.146 2.158 0.694 0.544 0.930 0.702 CB 1.238 58 residues pruned to eliminate duplicates Z: 49 35.577 2.238 0.784 0.570 0.917 0.625 CB 1.311 49 residues pruned to eliminate duplicates Z: 46 38.512 2.226 0.806 0.567 0.956 0.600 CB 1.401 46 residues pruned to eliminate duplicates Z: 38 40.255 2.278 0.890 0.587 0.973 0.649 CB 1.454 38 residues pruned to eliminate duplicates Z: 39 39.862 2.242 0.863 0.573 1.000 0.632 CB 1.443 39 residues pruned to eliminate duplicates Z: 37 35.170 2.232 0.851 0.608 0.917 0.667 CB 1.397 37 residues pruned to eliminate duplicates Z: 57 33.372 2.164 0.593 0.563 0.946 0.625 CB 1.286 57 residues pruned to eliminate duplicates Z: 55 36.608 2.206 0.754 0.518 0.926 0.593 CB 1.366 55 residues pruned to eliminate duplicates Z: 39 38.751 2.229 0.913 0.586 0.947 0.711 CB 1.434 39 residues pruned to eliminate duplicates Z: 37 43.197 2.294 0.920 0.609 1.000 0.639 CB 1.473 37 residues pruned to eliminate duplicates Z: 35 44.290 2.273 0.994 0.653 0.971 0.676 CB 1.497 35 residues pruned to eliminate duplicates Z: 40 35.140 2.183 0.897 0.586 0.923 0.744 CB 1.355 40 residues pruned to eliminate duplicates Z: 38 35.372 2.228 0.846 0.561 0.946 0.568 CB 1.410 38 residues pruned to eliminate duplicates Z: 53 32.042 2.184 0.626 0.546 0.923 0.596 CB 1.296 53 residues pruned to eliminate duplicates Z: 140 85.625 2.347 0.805 0.653 0.921 0.683 CB 1.615 52 residues pruned to eliminate duplicates Z: 8 3.019 1.789 0.298 0.451 1.000 0.143 CB 0.516 8 residues pruned to eliminate duplicates Z: 49 38.772 2.219 0.787 0.591 0.958 0.688 CB 1.350 49 residues pruned to eliminate duplicates Z: 48 40.478 2.254 0.851 0.608 0.957 0.702 CB 1.334 48 residues pruned to eliminate duplicates Z: 9 12.101 2.239 0.530 0.392 1.000 0.375 CB 1.399 9 residues pruned to eliminate duplicates Z: 56 34.154 2.205 0.757 0.536 0.909 0.545 CB 1.262 56 residues pruned to eliminate duplicates Z: 24 12.542 2.109 0.531 0.429 0.870 0.391 CB 1.002 24 residues pruned to eliminate duplicates Z: 11 11.070 2.042 0.474 0.612 0.900 0.700 CB 1.162 11 residues pruned to eliminate duplicates Z: 51 34.291 2.219 0.706 0.578 0.960 0.700 CB 1.238 51 residues pruned to eliminate duplicates Z: 49 36.566 2.232 0.749 0.585 0.958 0.667 CB 1.301 49 residues pruned to eliminate duplicates Z: 51 35.006 2.211 0.775 0.577 0.920 0.720 CB 1.273 51 residues pruned to eliminate duplicates Z: 101 86.447 2.354 0.920 0.693 0.940 0.780 CB 1.705 99 residues pruned to eliminate duplicates Z: 6 14.856 1.940 0.494 0.866 1.000 0.600 CB 1.678 6 residues pruned to eliminate duplicates Z: 137 87.768 2.329 0.796 0.660 0.956 0.750 CB 1.622 137 residues pruned to eliminate duplicates Z: 137 92.291 2.342 0.862 0.667 0.949 0.721 CB 1.639 157 residues pruned to eliminate duplicates Z: 7 4.431 1.577 0.441 0.503 0.667 0.333 O 1.190 7 residues pruned to eliminate duplicates Z: 90 58.527 2.282 0.843 0.576 0.910 0.652 CB 1.506 90 residues pruned to eliminate duplicates Z: 102 80.960 2.382 0.757 0.664 0.950 0.673 CB 1.740 102 residues pruned to eliminate duplicates Z: 99 79.168 2.326 0.794 0.689 0.949 0.765 CB 1.699 98 residues pruned to eliminate duplicates Z: 8 17.122 2.108 0.841 0.518 1.000 0.714 CA 1.639 8 residues pruned to eliminate duplicates Z: 138 90.472 2.315 0.902 0.647 0.949 0.672 CB 1.612 139 residues pruned to eliminate duplicates Z: 6 10.802 1.852 0.602 0.723 1.000 0.200 CA 1.331 6 residues pruned to eliminate duplicates Z: 55 51.169 2.338 0.904 0.579 0.889 0.685 CB 1.631 55 residues pruned to eliminate duplicates Z: 93 87.904 2.388 0.904 0.712 0.946 0.739 CB 1.759 93 residues pruned to eliminate duplicates Z: 90 89.168 2.401 0.924 0.712 0.944 0.685 CB 1.788 90 residues pruned to eliminate duplicates Z: 90 89.098 2.429 0.872 0.730 0.933 0.730 CB 1.811 90 residues pruned to eliminate duplicates Z: 105 76.334 2.349 0.820 0.649 0.904 0.712 CB 1.685 105 residues pruned to eliminate duplicates Z: 91 85.995 2.390 0.818 0.722 0.944 0.733 CB 1.809 91 residues pruned to eliminate duplicates Z: 91 95.196 2.395 0.930 0.737 0.978 0.733 CB 1.795 91 residues pruned to eliminate duplicates Z: 136 90.606 2.344 0.885 0.657 0.926 0.615 CB 1.648 138 residues pruned to eliminate duplicates Z: 7 13.820 2.335 0.952 0.396 1.000 0.667 CB 1.381 7 residues pruned to eliminate duplicates Z: 74 88.519 2.448 0.905 0.765 0.959 0.767 CB 1.831 74 residues pruned to eliminate duplicates Z: 104 80.243 2.352 0.801 0.662 0.932 0.699 CB 1.723 104 residues pruned to eliminate duplicates Z: 104 81.550 2.355 0.866 0.652 0.922 0.631 CB 1.721 104 residues pruned to eliminate duplicates Z: 88 96.408 2.439 0.968 0.728 0.966 0.713 CB 1.815 88 residues pruned to eliminate duplicates Z: 17 33.413 2.401 0.804 0.776 0.875 0.688 CB 1.727 17 residues pruned to eliminate duplicates Z: 42 57.830 2.429 0.945 0.679 0.927 0.707 CB 1.750 42 residues pruned to eliminate duplicates Z: 75 89.452 2.442 0.977 0.770 0.946 0.743 CB 1.793 73 residues pruned to eliminate duplicates Z: 15 44.337 2.517 0.808 0.907 1.000 0.786 CB 1.851 15 residues pruned to eliminate duplicates Z: 89 92.671 2.425 0.927 0.735 0.955 0.750 CB 1.793 89 residues pruned to eliminate duplicates Z: 43 56.147 2.380 0.869 0.648 0.976 0.714 CB 1.738 43 residues pruned to eliminate duplicates Z: 102 79.560 2.364 0.790 0.667 0.921 0.713 CB 1.742 102 residues pruned to eliminate duplicates Z: 92 92.698 2.384 0.922 0.707 0.978 0.725 CB 1.797 92 residues pruned to eliminate duplicates Z: 18 39.936 2.262 0.922 0.915 0.941 0.824 CB 1.673 18 residues pruned to eliminate duplicates Z: 89 95.208 2.429 0.980 0.740 0.943 0.739 CB 1.804 91 residues pruned to eliminate duplicates Z: 17 46.675 2.332 0.981 0.905 1.000 0.875 CA 1.798 17 residues pruned to eliminate duplicates Z: 93 61.807 2.282 0.900 0.559 0.924 0.641 CB 1.519 93 residues pruned to eliminate duplicates Z: 151 85.492 2.307 0.826 0.628 0.933 0.700 CB 1.574 151 residues pruned to eliminate duplicates Z: 92 89.752 2.377 0.907 0.718 0.967 0.714 CB 1.763 92 residues pruned to eliminate duplicates Z: 92 88.659 2.387 0.959 0.704 0.934 0.681 CB 1.767 91 residues pruned to eliminate duplicates Z: 18 46.789 2.267 0.979 0.906 1.000 0.765 CB 1.799 18 residues pruned to eliminate duplicates Z: 92 88.611 2.387 0.939 0.718 0.923 0.670 CB 1.785 92 residues pruned to eliminate duplicates Z: 135 91.751 2.351 0.919 0.656 0.955 0.709 CB 1.592 135 residues pruned to eliminate duplicates Z: 137 75.961 2.331 0.737 0.604 0.897 0.706 CB 1.624 74 residues pruned to eliminate duplicates Z: 15 41.092 2.590 0.668 0.804 1.000 0.929 CB 1.950 15 residues pruned to eliminate duplicates Z: 74 93.961 2.461 1.021 0.775 0.959 0.753 CB 1.808 74 residues pruned to eliminate duplicates Z: 103 75.965 2.352 0.848 0.657 0.892 0.686 CB 1.676 103 residues pruned to eliminate duplicates Z: 91 93.094 2.399 1.003 0.722 0.944 0.733 CB 1.770 91 residues pruned to eliminate duplicates Z: 88 94.753 2.443 0.974 0.729 0.966 0.747 CB 1.775 88 residues pruned to eliminate duplicates Z: 90 93.290 2.400 0.973 0.732 0.966 0.787 CB 1.754 90 residues pruned to eliminate duplicates Z: 75 93.411 2.439 1.083 0.776 0.946 0.743 CB 1.771 75 residues pruned to eliminate duplicates Z: 93 86.247 2.383 0.959 0.697 0.924 0.707 CB 1.742 93 residues pruned to eliminate duplicates Z: 99 89.454 2.355 0.932 0.707 0.949 0.653 CB 1.733 99 residues pruned to eliminate duplicates Z: 90 87.416 2.404 0.910 0.720 0.944 0.697 CB 1.752 90 residues pruned to eliminate duplicates Z: 90 96.547 2.420 0.979 0.731 0.966 0.697 CB 1.797 90 residues pruned to eliminate duplicates Z: 91 90.012 2.393 0.950 0.717 0.944 0.700 CB 1.769 91 residues pruned to eliminate duplicates Z: 92 89.073 2.391 0.973 0.715 0.934 0.736 CB 1.744 92 residues pruned to eliminate duplicates Z: 62 60.628 2.314 0.835 0.671 0.934 0.689 CB 1.671 62 residues pruned to eliminate duplicates Z: 90 91.104 2.398 0.950 0.722 0.944 0.618 CB 1.791 90 residues pruned to eliminate duplicates Z: 92 90.375 2.392 0.934 0.706 0.967 0.637 CB 1.757 92 residues pruned to eliminate duplicates Z: 103 80.482 2.366 0.837 0.661 0.922 0.676 CB 1.713 103 residues pruned to eliminate duplicates Z: 90 94.501 2.423 0.960 0.723 0.955 0.708 CB 1.806 90 residues pruned to eliminate duplicates Z: 91 89.122 2.411 0.927 0.702 0.944 0.722 CB 1.781 91 residues pruned to eliminate duplicates Z: 49 69.554 2.386 0.822 0.803 0.979 0.833 CB 1.811 49 residues pruned to eliminate duplicates Z: 135 88.520 2.330 0.878 0.633 0.940 0.687 CB 1.640 135 residues pruned to eliminate duplicates Z: 76 96.655 2.430 1.055 0.753 0.987 0.720 CB 1.807 76 residues pruned to eliminate duplicates Z: 90 90.475 2.421 0.910 0.732 0.944 0.730 CB 1.783 90 residues pruned to eliminate duplicates Z: 91 92.889 2.393 0.963 0.710 0.967 0.711 CB 1.782 91 residues pruned to eliminate duplicates Z: 92 83.277 2.379 0.863 0.702 0.945 0.714 CB 1.734 92 residues pruned to eliminate duplicates Z: 74 93.155 2.470 0.921 0.778 0.973 0.808 CB 1.849 74 residues pruned to eliminate duplicates Z: 89 90.958 2.405 0.962 0.732 0.955 0.659 CB 1.747 89 residues pruned to eliminate duplicates Z: 49 66.825 2.375 0.871 0.775 0.938 0.708 CB 1.816 49 residues pruned to eliminate duplicates Z: 71 54.312 2.251 0.725 0.602 0.914 0.643 CB 1.659 71 residues pruned to eliminate duplicates Z: 91 93.087 2.389 0.930 0.725 0.978 0.711 CB 1.777 91 residues pruned to eliminate duplicates Z: 90 91.933 2.405 0.967 0.725 0.966 0.708 CB 1.741 90 residues pruned to eliminate duplicates Z: 75 89.975 2.444 1.027 0.745 0.946 0.649 CB 1.792 75 residues pruned to eliminate duplicates Z: 103 82.293 2.368 0.867 0.656 0.931 0.598 CB 1.712 103 residues pruned to eliminate duplicates Z: 75 90.850 2.441 1.066 0.757 0.946 0.703 CB 1.761 75 residues pruned to eliminate duplicates Z: 91 95.784 2.393 0.962 0.729 0.978 0.678 CB 1.789 91 residues pruned to eliminate duplicates Z: 91 87.480 2.391 0.986 0.712 0.922 0.622 CB 1.736 91 residues pruned to eliminate duplicates Z: 87 79.808 2.369 0.947 0.695 0.930 0.709 CB 1.679 87 residues pruned to eliminate duplicates Z: 74 95.505 2.467 1.038 0.776 0.973 0.699 CB 1.791 74 residues pruned to eliminate duplicates Z: 105 77.631 2.345 0.878 0.645 0.904 0.606 CB 1.670 105 residues pruned to eliminate duplicates Z: 91 93.257 2.379 1.011 0.689 0.978 0.678 CB 1.766 91 residues pruned to eliminate duplicates Z: 92 87.429 2.366 1.011 0.711 0.934 0.571 CB 1.702 92 residues pruned to eliminate duplicates Z: 87 79.336 2.389 0.926 0.692 0.919 0.733 CB 1.698 87 residues pruned to eliminate duplicates Z: 74 95.680 2.455 1.060 0.777 0.973 0.753 CB 1.783 74 residues pruned to eliminate duplicates Z: 88 82.871 2.389 0.991 0.685 0.931 0.690 CB 1.693 88 residues pruned to eliminate duplicates Z: 104 77.251 2.351 0.823 0.659 0.913 0.699 CB 1.680 104 residues pruned to eliminate duplicates Z: 103 83.990 2.357 0.961 0.663 0.922 0.598 CB 1.678 103 residues pruned to eliminate duplicates Z: 102 86.679 2.377 0.962 0.669 0.931 0.624 CB 1.701 102 residues pruned to eliminate duplicates Z: 151 86.707 2.313 0.825 0.617 0.940 0.680 CB 1.596 151 residues pruned to eliminate duplicates Z: 95 80.825 2.355 0.969 0.684 0.915 0.681 CB 1.660 95 residues pruned to eliminate duplicates Z: 88 82.218 2.379 0.938 0.686 0.943 0.667 CB 1.710 88 residues pruned to eliminate duplicates Z: 86 85.678 2.380 0.969 0.723 0.953 0.647 CB 1.701 86 residues pruned to eliminate duplicates Z: 60 63.720 2.333 0.822 0.728 0.949 0.576 CB 1.673 60 residues pruned to eliminate duplicates Z: 162 91.818 2.289 0.810 0.647 0.957 0.658 CB 1.592 137 residues pruned to eliminate duplicates Z: 17 20.263 2.093 0.587 0.723 1.000 0.875 CB 1.247 17 residues pruned to eliminate duplicates Z: 50 37.950 2.243 0.708 0.519 0.959 0.653 CB 1.448 50 residues pruned to eliminate duplicates Z: 70 42.435 2.160 0.822 0.550 0.870 0.623 CB 1.422 70 residues pruned to eliminate duplicates Z: 27 29.601 2.173 0.772 0.620 0.923 0.654 CB 1.458 27 residues pruned to eliminate duplicates Z: 48 39.956 2.240 0.742 0.525 0.957 0.745 CB 1.522 48 residues pruned to eliminate duplicates Z: 48 35.013 2.204 0.608 0.506 0.979 0.702 CB 1.464 48 residues pruned to eliminate duplicates Z: 62 44.258 2.261 0.647 0.599 0.902 0.656 CB 1.536 62 residues pruned to eliminate duplicates Z: 28 32.944 2.203 0.813 0.637 0.963 0.667 CB 1.450 28 residues pruned to eliminate duplicates Z: 73 45.069 2.212 0.695 0.612 0.889 0.722 CB 1.433 73 residues pruned to eliminate duplicates Z: 19 22.962 2.266 0.676 0.639 0.833 0.667 CB 1.502 19 residues pruned to eliminate duplicates Z: 41 31.999 2.252 0.643 0.503 0.925 0.700 CB 1.473 41 residues pruned to eliminate duplicates Z: 51 37.141 2.238 0.671 0.530 0.940 0.620 CB 1.451 51 residues pruned to eliminate duplicates Z: 73 45.271 2.223 0.644 0.618 0.903 0.736 CB 1.446 73 residues pruned to eliminate duplicates Z: 41 35.585 2.284 0.608 0.512 0.975 0.700 CB 1.554 41 residues pruned to eliminate duplicates Z: 50 36.303 2.210 0.706 0.507 0.939 0.694 CB 1.455 50 residues pruned to eliminate duplicates Z: 70 46.319 2.211 0.731 0.629 0.884 0.696 CB 1.460 70 residues pruned to eliminate duplicates Z: 29 28.031 2.282 0.529 0.558 0.929 0.643 CB 1.545 29 residues pruned to eliminate duplicates Z: 48 31.168 2.159 0.678 0.434 0.894 0.553 CB 1.504 48 residues pruned to eliminate duplicates Z: 39 31.763 2.223 0.690 0.570 0.868 0.632 CB 1.476 39 residues pruned to eliminate duplicates Z: 50 37.013 2.252 0.652 0.538 0.918 0.714 CB 1.491 50 residues pruned to eliminate duplicates Z: 51 36.287 2.212 0.693 0.516 0.900 0.560 CB 1.498 51 residues pruned to eliminate duplicates Z: 62 46.826 2.243 0.689 0.609 0.934 0.738 CB 1.527 62 residues pruned to eliminate duplicates Z: 32 23.067 2.143 0.553 0.533 0.903 0.581 CB 1.334 32 residues pruned to eliminate duplicates Z: 30 17.949 2.146 0.578 0.363 0.828 0.690 CB 1.378 30 residues pruned to eliminate duplicates Z: 28 22.064 2.237 0.648 0.401 0.852 0.667 CB 1.502 28 residues pruned to eliminate duplicates Z: 47 40.510 2.254 0.689 0.585 0.935 0.696 CB 1.546 53 residues pruned to eliminate duplicates Z: 7 3.967 1.812 -0.031 0.355 0.833 0.333 CB 1.295 7 residues pruned to eliminate duplicates Z: 29 22.127 2.194 0.580 0.375 0.929 0.714 CB 1.484 29 residues pruned to eliminate duplicates Z: 28 26.022 2.185 0.780 0.404 0.926 0.741 CB 1.538 28 residues pruned to eliminate duplicates Z: 159 90.513 2.297 0.898 0.654 0.899 0.652 CB 1.592 159 residues pruned to eliminate duplicates Z: 53 33.847 2.071 0.734 0.538 0.923 0.654 CB 1.364 47 residues pruned to eliminate duplicates Z: 6 3.200 1.822 0.290 0.237 0.600 0.200 CA 1.378 6 residues pruned to eliminate duplicates Z: 72 48.060 2.181 0.730 0.613 0.944 0.718 CB 1.439 72 residues pruned to eliminate duplicates Z: 71 52.496 2.231 0.750 0.644 0.957 0.757 CB 1.467 75 residues pruned to eliminate duplicates Z: 20 36.059 2.218 0.697 0.934 1.000 0.842 CB 1.532 20 residues pruned to eliminate duplicates Z: 75 46.596 2.159 0.700 0.617 0.946 0.676 CB 1.397 75 residues pruned to eliminate duplicates Z: 30 28.908 2.089 0.606 0.761 0.966 0.793 CB 1.314 31 residues pruned to eliminate duplicates Z: 24 35.744 2.107 0.862 0.897 0.957 0.696 CB 1.422 21 residues pruned to eliminate duplicates Z: 22 38.071 2.062 0.969 0.899 1.000 0.905 CB 1.463 22 residues pruned to eliminate duplicates Z: 71 48.736 2.224 0.759 0.644 0.957 0.743 CB 1.360 71 residues pruned to eliminate duplicates Z: 62 51.127 2.234 0.781 0.639 0.984 0.689 CB 1.468 65 residues pruned to eliminate duplicates Z: 23 40.438 2.090 1.028 0.905 1.000 0.591 CB 1.448 21 residues pruned to eliminate duplicates Z: 24 37.710 2.113 0.958 0.890 0.957 0.609 CB 1.429 24 residues pruned to eliminate duplicates Z: 74 45.547 2.138 0.836 0.634 0.904 0.630 CB 1.325 74 residues pruned to eliminate duplicates Z: 26 32.597 2.162 0.871 0.772 0.920 0.640 CB 1.377 26 residues pruned to eliminate duplicates Z: 24 30.976 2.174 0.733 0.785 0.913 0.652 CB 1.462 24 residues pruned to eliminate duplicates Z: 53 36.820 2.118 0.819 0.596 0.923 0.538 CB 1.310 53 residues pruned to eliminate duplicates Z: 24 34.596 2.204 0.872 0.798 0.913 0.522 CB 1.476 24 residues pruned to eliminate duplicates Z: 25 34.814 2.159 0.833 0.833 0.917 0.625 CB 1.469 25 residues pruned to eliminate duplicates Z: 25 36.316 2.154 0.858 0.867 0.958 0.708 CB 1.414 25 residues pruned to eliminate duplicates Z: 21 31.588 2.170 0.664 0.879 0.950 0.500 CB 1.493 21 residues pruned to eliminate duplicates Z: 23 39.065 2.207 0.909 0.895 1.000 0.773 CB 1.417 23 residues pruned to eliminate duplicates Z: 63 48.522 2.245 0.732 0.653 0.935 0.694 CB 1.470 63 residues pruned to eliminate duplicates Z: 26 36.198 2.144 0.896 0.814 1.000 0.680 CB 1.355 26 residues pruned to eliminate duplicates Z: 26 36.315 2.089 1.137 0.825 0.960 0.440 CB 1.279 26 residues pruned to eliminate duplicates Z: 23 17.229 1.792 0.615 0.595 1.000 0.636 CB 1.159 23 residues pruned to eliminate duplicates Z: 25 14.334 1.748 0.579 0.554 0.875 0.542 CB 1.149 25 residues pruned to eliminate duplicates Z: 33 24.922 1.981 0.611 0.621 0.969 0.562 CB 1.271 33 residues pruned to eliminate duplicates Z: 38 27.321 2.055 0.583 0.593 0.892 0.541 CB 1.416 38 residues pruned to eliminate duplicates Z: 39 29.507 2.027 0.622 0.589 0.974 0.526 CB 1.374 39 residues pruned to eliminate duplicates Z: 39 28.267 1.989 0.714 0.563 0.947 0.447 CB 1.335 39 residues pruned to eliminate duplicates Z: 38 29.676 2.020 0.725 0.586 0.946 0.676 CB 1.363 38 residues pruned to eliminate duplicates Z: 37 29.691 2.049 0.716 0.592 0.944 0.417 CB 1.364 37 residues pruned to eliminate duplicates Z: 49 25.567 1.973 0.682 0.467 0.854 0.479 CB 1.346 49 residues pruned to eliminate duplicates Z: 38 31.543 2.040 0.671 0.591 0.973 0.568 CB 1.433 38 residues pruned to eliminate duplicates Z: 88 58.860 2.247 0.745 0.578 0.954 0.655 CB 1.566 88 residues pruned to eliminate duplicates Z: 106 68.648 2.321 0.766 0.603 0.943 0.590 CB 1.571 106 residues pruned to eliminate duplicates Z: 37 31.485 2.039 0.696 0.603 0.972 0.639 CB 1.414 37 residues pruned to eliminate duplicates Z: 106 68.783 2.305 0.850 0.573 0.943 0.581 CB 1.556 106 residues pruned to eliminate duplicates Z: 37 29.579 2.027 0.664 0.594 0.972 0.556 CB 1.374 37 residues pruned to eliminate duplicates Z: 34 19.923 1.913 0.585 0.521 0.909 0.576 CB 1.231 34 residues pruned to eliminate duplicates Z: 95 64.773 2.291 0.794 0.611 0.957 0.606 CB 1.528 95 residues pruned to eliminate duplicates Z: 41 26.146 1.975 0.766 0.516 0.875 0.550 CB 1.332 41 residues pruned to eliminate duplicates Z: 38 28.494 2.053 0.742 0.565 0.892 0.541 CB 1.379 38 residues pruned to eliminate duplicates Z: 45 27.532 1.984 0.712 0.523 0.909 0.523 CB 1.315 45 residues pruned to eliminate duplicates Z: 38 27.266 1.981 0.761 0.586 0.919 0.595 CB 1.287 38 residues pruned to eliminate duplicates Z: 37 29.103 2.031 0.685 0.599 0.972 0.639 CB 1.327 37 residues pruned to eliminate duplicates Z: 62 38.330 2.142 0.708 0.475 0.967 0.557 CB 1.422 62 residues pruned to eliminate duplicates Z: 38 22.703 1.965 0.671 0.560 0.865 0.459 CB 1.239 38 residues pruned to eliminate duplicates Z: 38 28.461 2.045 0.744 0.595 0.892 0.622 CB 1.344 38 residues pruned to eliminate duplicates Z: 57 34.594 2.091 0.610 0.560 0.946 0.554 CB 1.369 57 residues pruned to eliminate duplicates Z: 89 57.409 2.221 0.779 0.577 0.943 0.705 CB 1.524 89 residues pruned to eliminate duplicates Z: 36 29.012 2.052 0.681 0.616 0.971 0.714 CB 1.310 36 residues pruned to eliminate duplicates Z: 40 27.212 2.013 0.555 0.556 0.974 0.615 CB 1.353 40 residues pruned to eliminate duplicates Z: 62 41.119 2.167 0.724 0.500 0.967 0.574 CB 1.456 62 residues pruned to eliminate duplicates Z: 38 25.852 2.008 0.633 0.592 0.946 0.486 CB 1.255 38 residues pruned to eliminate duplicates Z: 75 50.507 2.268 0.732 0.592 0.932 0.581 CB 1.467 75 residues pruned to eliminate duplicates Z: 38 27.010 2.052 0.643 0.591 0.973 0.649 CB 1.240 38 residues pruned to eliminate duplicates Z: 74 55.828 2.282 0.780 0.616 0.959 0.630 CB 1.503 74 residues pruned to eliminate duplicates Z: 76 57.482 2.273 0.919 0.567 0.947 0.640 CB 1.507 76 residues pruned to eliminate duplicates Z: 63 46.469 2.219 0.768 0.614 0.984 0.548 CB 1.372 63 residues pruned to eliminate duplicates Z: 39 25.650 2.029 0.571 0.593 0.974 0.553 CB 1.227 39 residues pruned to eliminate duplicates Z: 26 35.966 2.426 0.851 0.668 0.800 0.520 CB 1.715 26 residues pruned to eliminate duplicates Z: 67 67.252 2.440 0.809 0.622 0.955 0.667 CB 1.750 67 residues pruned to eliminate duplicates Z: 36 53.071 2.519 0.923 0.575 0.943 0.429 CB 1.827 36 residues pruned to eliminate duplicates Z: 62 46.867 2.241 0.755 0.611 0.951 0.590 CB 1.444 62 residues pruned to eliminate duplicates Z: 36 46.712 2.471 0.802 0.666 0.886 0.514 CB 1.717 36 residues pruned to eliminate duplicates Z: 105 61.323 2.298 0.816 0.566 0.885 0.587 CB 1.527 105 residues pruned to eliminate duplicates Z: 71 45.810 2.175 0.761 0.584 0.943 0.629 CB 1.398 71 residues pruned to eliminate duplicates Z: 32 48.777 2.460 1.035 0.603 0.903 0.645 CB 1.757 32 residues pruned to eliminate duplicates Z: 103 60.746 2.239 0.841 0.568 0.912 0.559 CB 1.499 103 residues pruned to eliminate duplicates Z: 27 48.622 2.465 1.082 0.633 0.962 0.538 CB 1.706 27 residues pruned to eliminate duplicates Z: 72 52.773 2.262 0.788 0.593 0.972 0.549 CB 1.457 72 residues pruned to eliminate duplicates Z: 51 65.986 2.464 0.820 0.700 0.960 0.720 CB 1.806 51 residues pruned to eliminate duplicates Z: 76 51.719 2.236 0.733 0.599 0.933 0.640 CB 1.502 76 residues pruned to eliminate duplicates Z: 107 65.312 2.287 0.760 0.598 0.943 0.604 CB 1.522 107 residues pruned to eliminate duplicates Z: 24 51.137 2.597 0.919 0.697 0.957 0.652 CB 1.869 24 residues pruned to eliminate duplicates Z: 24 54.145 2.531 1.043 0.702 1.000 0.783 CB 1.817 24 residues pruned to eliminate duplicates Z: 32 47.068 2.490 0.895 0.627 0.968 0.645 CB 1.643 32 residues pruned to eliminate duplicates Z: 25 41.003 2.378 0.974 0.651 0.875 0.542 CB 1.770 25 residues pruned to eliminate duplicates Z: 37 60.431 2.555 0.997 0.637 0.944 0.528 CB 1.839 37 residues pruned to eliminate duplicates Z: 76 52.309 2.256 0.745 0.594 0.947 0.600 CB 1.481 76 residues pruned to eliminate duplicates Z: 74 52.319 2.262 0.801 0.597 0.959 0.630 CB 1.429 74 residues pruned to eliminate duplicates Z: 75 52.177 2.234 0.797 0.592 0.959 0.622 CB 1.443 75 residues pruned to eliminate duplicates Z: 106 64.027 2.283 0.845 0.554 0.924 0.619 CB 1.524 106 residues pruned to eliminate duplicates Z: 64 66.262 2.447 0.967 0.587 0.905 0.651 CB 1.764 64 residues pruned to eliminate duplicates Z: 73 49.432 2.270 0.746 0.569 0.944 0.583 CB 1.456 73 residues pruned to eliminate duplicates Z: 73 49.286 2.261 0.696 0.577 0.944 0.611 CB 1.489 73 residues pruned to eliminate duplicates Z: 74 47.554 2.239 0.663 0.561 0.973 0.575 CB 1.450 74 residues pruned to eliminate duplicates Z: 10 23.396 2.444 0.791 0.501 1.000 0.444 CA 1.780 10 residues pruned to eliminate duplicates Z: 10 15.439 2.442 0.692 0.374 0.778 0.222 CA 1.834 10 residues pruned to eliminate duplicates Z: 104 58.071 2.262 0.665 0.569 0.951 0.612 CB 1.493 104 residues pruned to eliminate duplicates Z: 11 13.426 2.168 0.748 0.290 0.800 0.200 CA 1.772 11 residues pruned to eliminate duplicates Z: 75 55.238 2.280 0.791 0.594 0.959 0.635 CB 1.498 75 residues pruned to eliminate duplicates Z: 40 42.575 2.313 0.870 0.548 0.897 0.513 CB 1.676 40 residues pruned to eliminate duplicates Z: 33 35.434 2.330 0.755 0.587 0.875 0.719 CB 1.611 33 residues pruned to eliminate duplicates Z: 41 42.887 2.373 0.821 0.562 0.900 0.500 CB 1.642 41 residues pruned to eliminate duplicates Z: 40 47.025 2.368 0.980 0.557 0.897 0.590 CB 1.693 40 residues pruned to eliminate duplicates Z: 90 62.648 2.245 0.773 0.632 0.966 0.629 CB 1.525 90 residues pruned to eliminate duplicates Z: 32 37.437 2.317 0.953 0.602 0.903 0.548 CB 1.492 32 residues pruned to eliminate duplicates Z: 36 35.199 2.282 0.824 0.555 0.857 0.543 CB 1.580 36 residues pruned to eliminate duplicates Z: 27 36.589 2.223 1.003 0.634 0.846 0.577 CA 1.679 27 residues pruned to eliminate duplicates Z: 35 38.771 2.210 0.947 0.563 0.882 0.529 CB 1.647 35 residues pruned to eliminate duplicates Z: 34 37.497 2.310 0.931 0.572 0.939 0.545 CB 1.452 34 residues pruned to eliminate duplicates Z: 40 45.459 2.378 0.927 0.589 0.897 0.538 CB 1.624 40 residues pruned to eliminate duplicates Z: 102 61.951 2.268 0.800 0.598 0.941 0.604 CB 1.461 102 residues pruned to eliminate duplicates Z: 72 50.404 2.316 0.805 0.502 0.915 0.479 CB 1.560 72 residues pruned to eliminate duplicates Z: 65 64.734 2.425 0.774 0.602 0.953 0.641 CB 1.791 65 residues pruned to eliminate duplicates Z: 27 34.252 2.249 0.647 0.667 0.923 0.577 CB 1.683 27 residues pruned to eliminate duplicates Z: 39 35.097 2.273 0.815 0.548 0.868 0.632 CB 1.515 39 residues pruned to eliminate duplicates Z: 41 35.933 2.312 0.793 0.567 0.825 0.475 CB 1.557 41 residues pruned to eliminate duplicates Z: 32 34.258 2.328 0.725 0.595 0.903 0.548 CB 1.548 32 residues pruned to eliminate duplicates Z: 33 33.822 2.307 0.755 0.577 0.875 0.469 CB 1.567 33 residues pruned to eliminate duplicates Z: 36 35.439 2.225 0.854 0.590 0.800 0.571 CB 1.666 36 residues pruned to eliminate duplicates Z: 41 47.350 2.370 0.928 0.580 0.900 0.625 CB 1.685 41 residues pruned to eliminate duplicates Z: 16 15.546 2.335 0.576 0.305 0.867 0.467 CB 1.563 16 residues pruned to eliminate duplicates Z: 33 40.872 2.300 0.891 0.591 0.938 0.625 CB 1.624 33 residues pruned to eliminate duplicates Z: 35 37.930 2.279 1.010 0.576 0.824 0.559 CB 1.603 35 residues pruned to eliminate duplicates Z: 40 45.979 2.377 0.897 0.560 0.897 0.538 CB 1.717 40 residues pruned to eliminate duplicates Z: 34 37.658 2.261 0.829 0.627 0.939 0.667 CB 1.497 34 residues pruned to eliminate duplicates Z: 105 70.528 2.309 0.836 0.608 0.942 0.606 CB 1.562 105 residues pruned to eliminate duplicates Z: 32 40.730 2.340 0.821 0.630 0.935 0.548 CB 1.624 32 residues pruned to eliminate duplicates Z: 34 39.566 2.232 0.920 0.581 0.970 0.606 CB 1.533 34 residues pruned to eliminate duplicates Z: 33 41.330 2.305 1.030 0.614 0.844 0.594 CB 1.662 33 residues pruned to eliminate duplicates Z: 33 39.670 2.340 0.792 0.654 0.875 0.656 CB 1.656 33 residues pruned to eliminate duplicates 764 residues left after pruning, divided into chains as follows: A: 6 B: 18 C: 519 D: 221 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 42.90 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.569, Connect. = 0.793 for dens.mod. cycle 1 = 0.300, Contrast = 0.645, Connect. = 0.813 for dens.mod. cycle 2 = 0.300, Contrast = 0.783, Connect. = 0.834 for dens.mod. cycle 3 = 0.300, Contrast = 0.795, Connect. = 0.835 for dens.mod. cycle 4 = 0.300, Contrast = 0.809, Connect. = 0.836 for dens.mod. cycle 5 = 0.300, Contrast = 0.814, Connect. = 0.837 for dens.mod. cycle 6 = 0.300, Contrast = 0.819, Connect. = 0.838 for dens.mod. cycle 7 = 0.300, Contrast = 0.820, Connect. = 0.839 for dens.mod. cycle 8 = 0.300, Contrast = 0.821, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.821, Connect. = 0.840 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4129 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 993 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 12 20.830 2.428 0.219 0.886 1.000 0.818 CB 1.531 B: 15 47.679 2.507 0.954 0.924 1.000 0.857 CB 1.827 C: 25 47.385 2.302 0.835 0.915 0.958 0.792 CB 1.689 D: 62 47.427 2.228 0.784 0.607 0.967 0.607 CB 1.427 E: 24 47.848 2.389 0.884 0.929 0.957 0.739 CB 1.621 24 residues pruned to eliminate duplicates F: 23 56.212 2.471 1.095 0.949 0.955 0.545 CB 1.674 23 residues pruned to eliminate duplicates G: 15 43.665 2.473 0.842 0.921 0.929 0.857 CB 1.941 15 residues pruned to eliminate duplicates H: 32 62.588 2.350 0.903 0.927 1.000 0.710 CB 1.761 I: 30 57.305 2.396 0.887 0.930 0.966 0.931 CB 1.705 30 residues pruned to eliminate duplicates J: 31 56.980 2.392 0.786 0.905 0.967 0.800 CB 1.793 31 residues pruned to eliminate duplicates K: 25 52.113 2.337 0.942 0.937 0.958 0.667 CB 1.702 25 residues pruned to eliminate duplicates L: 16 52.077 2.418 1.144 0.920 0.933 0.867 CA 1.957 16 residues pruned to eliminate duplicates M: 15 49.141 2.538 1.104 0.902 0.929 0.857 CB 1.889 15 residues pruned to eliminate duplicates N: 14 24.779 2.422 0.371 0.829 0.846 0.769 CB 1.841 O: 29 49.832 2.270 0.983 0.810 0.929 0.714 CA 1.719 P: 14 21.564 2.101 0.357 0.889 1.000 0.923 CB 1.511 12 residues pruned to eliminate duplicates Q: 22 50.398 2.409 0.919 0.830 0.952 0.667 CA 1.877 22 residues pruned to eliminate duplicates R: 91 85.933 2.416 0.823 0.722 0.933 0.756 CB 1.803 S: 60 35.421 2.118 0.675 0.463 0.949 0.644 CB 1.423 60 residues pruned to eliminate duplicates T: 15 41.882 2.454 1.079 0.927 0.929 0.786 CB 1.656 15 residues pruned to eliminate duplicates U: 14 34.200 2.405 0.702 0.888 0.923 0.923 CB 1.807 14 residues pruned to eliminate duplicates V: 31 66.297 2.417 1.032 0.928 0.967 0.733 CB 1.785 32 residues pruned to eliminate duplicates W: 23 52.916 2.321 1.020 0.856 1.000 0.727 CB 1.775 23 residues pruned to eliminate duplicates X: 31 56.026 2.389 0.878 0.915 0.967 0.700 CB 1.667 31 residues pruned to eliminate duplicates Y: 73 50.463 2.193 0.701 0.608 0.986 0.611 CB 1.459 29 residues pruned to eliminate duplicates Z: 18 42.811 2.354 0.693 0.924 1.000 0.941 CB 1.829 Z: 32 54.990 2.284 0.709 0.907 1.000 0.806 CB 1.799 32 residues pruned to eliminate duplicates Z: 15 23.738 2.225 0.349 0.918 0.929 0.929 CB 1.606 Z: 24 54.091 2.414 1.104 0.937 0.957 0.609 CB 1.615 25 residues pruned to eliminate duplicates Z: 18 28.411 2.172 0.604 0.869 0.882 0.765 CA 1.638 Z: 17 50.548 2.355 1.061 0.930 1.000 0.750 CB 1.822 18 residues pruned to eliminate duplicates Z: 17 44.634 2.343 1.019 0.921 0.938 0.875 CB 1.771 17 residues pruned to eliminate duplicates Z: 24 38.170 2.342 0.671 0.849 0.913 0.565 CB 1.652 17 residues pruned to eliminate duplicates Z: 31 48.603 2.298 0.633 0.890 0.967 0.767 CB 1.760 31 residues pruned to eliminate duplicates Z: 23 44.227 2.230 0.861 0.864 1.000 0.727 CB 1.665 24 residues pruned to eliminate duplicates Z: 23 41.722 2.428 0.580 0.930 0.955 0.864 CB 1.699 23 residues pruned to eliminate duplicates Z: 28 53.494 2.314 0.767 0.916 0.963 0.741 CB 1.847 28 residues pruned to eliminate duplicates Z: 15 26.260 2.297 0.495 0.847 0.857 0.571 CA 1.771 14 residues pruned to eliminate duplicates Z: 14 36.607 2.403 1.014 0.910 1.000 0.846 CB 1.488 Z: 6 9.128 1.898 0.562 0.862 0.800 0.800 CA 1.264 Z: 17 35.769 2.217 0.714 0.884 1.000 0.812 CB 1.700 17 residues pruned to eliminate duplicates Z: 16 45.124 2.388 1.128 0.926 0.933 0.733 CB 1.723 16 residues pruned to eliminate duplicates Z: 30 56.785 2.401 0.810 0.929 0.966 0.862 CB 1.759 30 residues pruned to eliminate duplicates Z: 23 40.044 2.353 0.650 0.813 1.000 0.682 CB 1.674 28 residues pruned to eliminate duplicates Z: 23 54.049 2.397 1.101 0.853 0.909 0.773 CA 1.860 23 residues pruned to eliminate duplicates Z: 15 31.776 2.268 0.623 0.935 1.000 0.929 CB 1.608 15 residues pruned to eliminate duplicates Z: 25 56.155 2.361 1.129 0.940 0.958 0.750 CB 1.653 24 residues pruned to eliminate duplicates Z: 12 32.106 2.311 0.996 0.912 0.909 0.727 CB 1.635 12 residues pruned to eliminate duplicates Z: 14 28.706 2.467 0.224 0.941 1.000 0.846 CB 1.831 14 residues pruned to eliminate duplicates Z: 14 30.188 2.270 0.829 0.902 1.000 0.846 CB 1.438 14 residues pruned to eliminate duplicates Z: 17 48.916 2.425 0.972 0.937 1.000 0.875 CB 1.780 17 residues pruned to eliminate duplicates Z: 49 51.175 2.415 0.801 0.532 0.958 0.667 CB 1.717 15 residues pruned to eliminate duplicates Z: 101 79.052 2.388 0.787 0.668 0.920 0.700 CB 1.725 91 residues pruned to eliminate duplicates Z: 18 45.253 2.227 1.008 0.896 1.000 0.706 CA 1.758 18 residues pruned to eliminate duplicates Z: 61 46.333 2.222 0.666 0.616 0.950 0.717 CB 1.524 Z: 16 34.564 2.304 0.818 0.901 1.000 0.800 CB 1.521 16 residues pruned to eliminate duplicates Z: 15 44.347 2.486 0.862 0.940 1.000 0.857 CB 1.778 15 residues pruned to eliminate duplicates Z: 15 27.924 2.328 0.431 0.875 0.929 0.571 CB 1.756 15 residues pruned to eliminate duplicates Z: 23 55.581 2.526 0.892 0.849 0.955 0.682 CA 1.926 24 residues pruned to eliminate duplicates Z: 15 23.324 2.274 0.378 0.839 0.857 0.643 CB 1.734 15 residues pruned to eliminate duplicates Z: 23 43.992 2.344 0.922 0.837 0.864 0.591 CB 1.804 23 residues pruned to eliminate duplicates Z: 14 26.923 2.291 0.473 0.890 1.000 0.846 CB 1.592 14 residues pruned to eliminate duplicates Z: 66 67.968 2.479 0.795 0.634 0.923 0.615 CB 1.810 48 residues pruned to eliminate duplicates Z: 17 37.235 2.229 0.657 0.913 1.000 0.875 CA 1.783 17 residues pruned to eliminate duplicates Z: 20 45.735 2.188 1.022 0.897 1.000 0.789 CB 1.697 20 residues pruned to eliminate duplicates Z: 30 61.785 2.416 0.818 0.928 1.000 0.897 CB 1.830 30 residues pruned to eliminate duplicates Z: 13 27.221 2.310 0.453 0.889 1.000 0.917 CB 1.685 13 residues pruned to eliminate duplicates Z: 71 52.990 2.241 0.781 0.628 0.943 0.686 CB 1.492 61 residues pruned to eliminate duplicates Z: 17 54.224 2.219 1.325 0.917 1.000 0.688 CA 1.854 17 residues pruned to eliminate duplicates Z: 15 45.479 2.494 0.875 0.932 1.000 0.786 CB 1.815 15 residues pruned to eliminate duplicates Z: 28 30.392 2.199 0.630 0.688 0.926 0.741 CB 1.483 Z: 16 41.066 2.364 0.717 0.930 1.000 0.933 CB 1.827 16 residues pruned to eliminate duplicates Z: 16 47.995 2.426 1.000 0.924 1.000 0.867 CA 1.794 16 residues pruned to eliminate duplicates Z: 17 41.846 2.277 1.296 0.897 0.938 0.562 CB 1.527 17 residues pruned to eliminate duplicates Z: 16 40.537 2.303 1.189 0.912 1.000 0.733 CB 1.471 Z: 21 31.605 2.146 0.656 0.897 0.950 0.800 CB 1.498 21 residues pruned to eliminate duplicates Z: 30 50.942 2.369 0.560 0.905 1.000 0.793 CB 1.822 30 residues pruned to eliminate duplicates Z: 16 45.835 2.372 1.015 0.932 1.000 0.867 CB 1.729 16 residues pruned to eliminate duplicates Z: 15 44.489 2.463 1.012 0.908 0.929 0.857 CA 1.835 15 residues pruned to eliminate duplicates Z: 176 113.338 2.467 0.878 0.644 0.926 0.703 CB 1.745 137 residues pruned to eliminate duplicates Z: 17 42.462 2.371 0.993 0.916 1.000 0.875 CB 1.587 17 residues pruned to eliminate duplicates Z: 16 56.817 2.438 1.260 0.911 1.000 0.600 CA 1.888 16 residues pruned to eliminate duplicates Z: 140 87.531 2.404 0.785 0.621 0.899 0.604 CB 1.716 140 residues pruned to eliminate duplicates Z: 14 25.820 2.408 0.294 0.881 0.923 0.846 CA 1.803 14 residues pruned to eliminate duplicates Z: 22 29.283 2.124 0.551 0.852 0.952 0.857 CB 1.506 22 residues pruned to eliminate duplicates Z: 51 48.698 2.389 0.823 0.512 0.960 0.620 CB 1.628 51 residues pruned to eliminate duplicates Z: 26 42.952 2.225 0.752 0.894 0.960 0.840 CB 1.647 26 residues pruned to eliminate duplicates Z: 31 45.618 2.292 0.428 0.905 1.000 0.833 CB 1.811 31 residues pruned to eliminate duplicates Z: 100 77.511 2.384 0.760 0.678 0.909 0.758 CB 1.734 102 residues pruned to eliminate duplicates Z: 12 26.008 2.270 0.469 0.911 1.000 0.909 CA 1.667 12 residues pruned to eliminate duplicates Z: 15 52.118 2.465 1.075 0.933 1.000 0.643 CB 1.901 15 residues pruned to eliminate duplicates Z: 16 40.130 2.374 0.764 0.903 1.000 0.800 CA 1.763 16 residues pruned to eliminate duplicates Z: 147 81.321 2.297 0.821 0.617 0.918 0.637 CB 1.570 130 residues pruned to eliminate duplicates Z: 15 44.056 2.503 0.713 0.943 1.000 1.000 CB 1.903 15 residues pruned to eliminate duplicates Z: 19 34.505 2.097 0.843 0.871 0.944 0.778 CB 1.625 19 residues pruned to eliminate duplicates Z: 32 54.629 2.273 0.730 0.905 1.000 0.774 CB 1.776 32 residues pruned to eliminate duplicates Z: 17 37.911 2.424 0.583 0.927 1.000 0.812 CB 1.731 17 residues pruned to eliminate duplicates Z: 24 41.690 2.332 0.647 0.934 0.957 0.957 CB 1.650 26 residues pruned to eliminate duplicates Z: 24 52.260 2.415 1.021 0.924 0.957 0.739 CB 1.640 24 residues pruned to eliminate duplicates Z: 23 45.488 2.258 0.893 0.830 0.955 0.727 CB 1.787 23 residues pruned to eliminate duplicates Z: 90 57.561 2.369 0.637 0.583 0.933 0.652 CB 1.558 56 residues pruned to eliminate duplicates Z: 30 39.640 2.264 0.940 0.666 0.897 0.621 CB 1.603 15 residues pruned to eliminate duplicates Z: 43 55.702 2.395 0.868 0.638 0.952 0.714 CB 1.773 43 residues pruned to eliminate duplicates Z: 39 49.581 2.482 0.761 0.669 0.921 0.763 CB 1.709 39 residues pruned to eliminate duplicates Z: 39 44.398 2.297 0.989 0.608 1.000 0.658 CB 1.422 37 residues pruned to eliminate duplicates Z: 16 29.837 2.287 0.531 0.911 1.000 0.867 CB 1.559 16 residues pruned to eliminate duplicates Z: 21 33.764 2.339 0.524 0.841 0.900 0.700 CB 1.756 21 residues pruned to eliminate duplicates Z: 49 42.378 2.270 0.767 0.563 0.958 0.646 CB 1.497 50 residues pruned to eliminate duplicates Z: 25 49.392 2.341 0.917 0.901 0.958 0.833 CB 1.674 25 residues pruned to eliminate duplicates Z: 18 37.407 2.184 1.000 0.866 0.941 0.882 CB 1.616 18 residues pruned to eliminate duplicates Z: 17 41.494 2.230 0.980 0.914 1.000 0.750 CA 1.661 17 residues pruned to eliminate duplicates Z: 32 45.970 2.249 0.595 0.867 0.968 0.710 CB 1.740 32 residues pruned to eliminate duplicates Z: 16 15.056 2.087 0.796 0.379 0.800 0.400 CB 1.475 16 residues pruned to eliminate duplicates Z: 15 21.032 2.059 0.619 0.563 0.929 0.643 CB 1.709 15 residues pruned to eliminate duplicates Z: 17 45.150 2.292 0.923 0.906 1.000 0.875 CA 1.821 17 residues pruned to eliminate duplicates Z: 27 25.375 2.191 0.511 0.554 0.923 0.692 CB 1.546 27 residues pruned to eliminate duplicates Z: 16 36.455 2.330 0.880 0.873 0.933 0.733 CB 1.677 16 residues pruned to eliminate duplicates Z: 103 82.724 2.440 0.812 0.680 0.931 0.706 CB 1.686 103 residues pruned to eliminate duplicates Z: 67 57.735 2.359 0.749 0.615 0.924 0.576 CB 1.671 66 residues pruned to eliminate duplicates Z: 15 32.517 2.360 0.542 0.908 0.929 0.786 CB 1.827 15 residues pruned to eliminate duplicates Z: 16 41.186 2.421 0.824 0.935 1.000 0.933 CB 1.679 16 residues pruned to eliminate duplicates Z: 16 47.615 2.444 0.918 0.926 1.000 0.933 CB 1.839 16 residues pruned to eliminate duplicates Z: 14 41.809 2.519 0.705 0.915 1.000 1.000 CB 1.907 14 residues pruned to eliminate duplicates Z: 24 34.294 2.067 0.794 0.908 0.957 0.652 CB 1.432 24 residues pruned to eliminate duplicates Z: 7 10.104 1.839 0.709 0.663 0.833 0.500 CA 1.354 7 residues pruned to eliminate duplicates Z: 21 21.695 2.278 0.826 0.449 0.800 0.500 CB 1.535 21 residues pruned to eliminate duplicates Z: 16 24.662 2.195 0.464 0.899 0.867 0.733 CA 1.634 16 residues pruned to eliminate duplicates Z: 76 68.775 2.431 0.857 0.610 0.920 0.693 CB 1.722 75 residues pruned to eliminate duplicates Z: 30 62.475 2.387 0.992 0.931 0.966 0.621 CB 1.766 30 residues pruned to eliminate duplicates Z: 16 36.139 2.286 1.088 0.910 0.933 0.800 CB 1.486 16 residues pruned to eliminate duplicates Z: 9 10.126 1.672 0.552 0.814 1.000 0.625 CA 1.051 9 residues pruned to eliminate duplicates Z: 15 16.620 2.072 0.362 0.859 0.929 0.714 CB 1.247 15 residues pruned to eliminate duplicates Z: 17 46.662 2.492 0.880 0.939 1.000 0.688 CB 1.730 17 residues pruned to eliminate duplicates Z: 32 36.075 2.284 0.793 0.578 0.871 0.613 CB 1.685 32 residues pruned to eliminate duplicates Z: 15 20.230 2.225 0.443 0.930 0.929 0.786 CB 1.268 15 residues pruned to eliminate duplicates Z: 16 33.601 2.289 0.619 0.888 1.000 0.733 CB 1.687 16 residues pruned to eliminate duplicates Z: 15 31.790 2.442 0.337 0.921 1.000 0.857 CB 1.832 15 residues pruned to eliminate duplicates Z: 30 48.177 2.299 0.515 0.903 1.000 0.897 CB 1.831 30 residues pruned to eliminate duplicates Z: 52 51.373 2.368 0.847 0.532 0.961 0.667 CB 1.660 52 residues pruned to eliminate duplicates Z: 24 52.961 2.408 1.126 0.930 0.957 0.652 CB 1.577 25 residues pruned to eliminate duplicates Z: 49 38.377 2.258 0.791 0.582 0.938 0.667 CB 1.350 49 residues pruned to eliminate duplicates Z: 72 42.704 2.140 0.713 0.594 0.887 0.648 CB 1.424 40 residues pruned to eliminate duplicates Z: 12 33.549 2.575 0.470 0.879 1.000 0.727 CB 1.937 12 residues pruned to eliminate duplicates Z: 12 31.632 2.377 1.067 0.915 1.000 0.909 CB 1.372 12 residues pruned to eliminate duplicates Z: 23 41.135 2.375 0.722 0.820 0.909 0.773 CB 1.787 23 residues pruned to eliminate duplicates Z: 18 41.961 2.437 0.851 0.885 0.941 0.765 CA 1.731 18 residues pruned to eliminate duplicates Z: 16 36.824 2.339 0.794 0.910 0.933 0.800 CA 1.721 16 residues pruned to eliminate duplicates Z: 50 35.976 2.271 0.620 0.501 0.918 0.714 CB 1.519 50 residues pruned to eliminate duplicates Z: 17 29.374 2.103 0.556 0.927 0.938 0.812 CB 1.678 17 residues pruned to eliminate duplicates Z: 17 29.608 2.192 0.729 0.864 0.938 0.812 CB 1.527 17 residues pruned to eliminate duplicates Z: 30 48.911 2.318 0.544 0.895 1.000 0.759 CB 1.820 30 residues pruned to eliminate duplicates Z: 32 52.332 2.228 0.759 0.903 1.000 0.871 CB 1.710 32 residues pruned to eliminate duplicates Z: 24 55.439 2.389 1.241 0.938 0.957 0.435 CB 1.569 24 residues pruned to eliminate duplicates Z: 91 89.899 2.473 0.895 0.723 0.944 0.733 CB 1.751 91 residues pruned to eliminate duplicates Z: 31 59.665 2.387 0.840 0.904 0.967 0.767 CB 1.828 31 residues pruned to eliminate duplicates Z: 29 40.158 2.290 0.641 0.787 0.893 0.679 CA 1.757 29 residues pruned to eliminate duplicates Z: 17 33.799 2.293 0.581 0.892 1.000 0.875 CB 1.675 17 residues pruned to eliminate duplicates Z: 74 43.905 2.146 0.584 0.603 0.959 0.644 CB 1.429 74 residues pruned to eliminate duplicates Z: 76 103.969 2.531 1.101 0.781 0.987 0.787 CB 1.786 76 residues pruned to eliminate duplicates Z: 6 7.514 2.054 0.559 0.687 0.600 0.400 N 1.474 Z: 20 62.927 2.384 1.322 0.944 1.000 0.842 CB 1.805 20 residues pruned to eliminate duplicates Z: 30 47.139 2.411 0.854 0.772 0.931 0.828 CB 1.654 30 residues pruned to eliminate duplicates Z: 28 54.614 2.276 0.809 0.931 1.000 0.889 CB 1.783 28 residues pruned to eliminate duplicates Z: 28 55.786 2.256 0.856 0.942 0.963 0.815 CB 1.846 41 residues pruned to eliminate duplicates Z: 30 47.510 2.325 0.629 0.885 0.931 0.724 CB 1.806 30 residues pruned to eliminate duplicates Z: 14 31.124 2.236 0.674 0.922 1.000 0.769 CB 1.621 14 residues pruned to eliminate duplicates Z: 7 10.853 2.273 0.661 0.622 0.833 0.333 CB 1.256 7 residues pruned to eliminate duplicates Z: 23 51.638 2.407 0.927 0.867 0.955 0.727 CA 1.818 23 residues pruned to eliminate duplicates Z: 56 48.983 2.353 0.704 0.563 0.945 0.709 CB 1.639 56 residues pruned to eliminate duplicates Z: 15 39.880 2.422 0.762 0.941 1.000 0.786 CA 1.733 15 residues pruned to eliminate duplicates Z: 10 14.715 2.238 0.919 0.627 0.667 0.444 CB 1.521 10 residues pruned to eliminate duplicates Z: 23 34.886 2.143 0.878 0.888 0.909 0.727 CB 1.465 20 residues pruned to eliminate duplicates Z: 13 21.785 2.257 0.941 0.538 0.917 0.417 CB 1.509 13 residues pruned to eliminate duplicates Z: 14 26.663 1.975 1.121 0.898 0.923 0.462 CB 1.368 Z: 15 41.034 2.493 0.734 0.927 1.000 0.929 CB 1.778 15 residues pruned to eliminate duplicates Z: 30 51.241 2.317 0.629 0.886 1.000 0.828 CB 1.819 30 residues pruned to eliminate duplicates Z: 15 43.551 2.348 1.114 0.896 1.000 0.500 CB 1.680 15 residues pruned to eliminate duplicates Z: 65 40.795 2.221 0.752 0.537 0.891 0.719 CB 1.419 66 residues pruned to eliminate duplicates Z: 74 64.390 2.399 0.822 0.585 0.945 0.671 CB 1.680 74 residues pruned to eliminate duplicates Z: 13 44.789 2.475 1.319 0.879 1.000 0.833 CB 1.633 14 residues pruned to eliminate duplicates Z: 16 26.578 2.203 0.348 0.909 1.000 1.000 CB 1.641 16 residues pruned to eliminate duplicates Z: 17 36.958 2.273 0.764 0.908 1.000 0.438 CA 1.636 17 residues pruned to eliminate duplicates Z: 67 65.269 2.464 0.713 0.633 0.955 0.561 CB 1.759 67 residues pruned to eliminate duplicates Z: 6 11.974 2.089 0.547 0.785 1.000 0.600 CB 1.289 6 residues pruned to eliminate duplicates Z: 29 54.446 2.216 0.869 0.909 1.000 0.821 CB 1.763 29 residues pruned to eliminate duplicates Z: 22 33.100 2.075 0.638 0.916 1.000 0.810 CB 1.501 22 residues pruned to eliminate duplicates Z: 24 42.106 2.393 0.746 0.797 0.913 0.565 CB 1.774 24 residues pruned to eliminate duplicates Z: 13 27.298 2.422 1.105 0.465 0.917 0.583 CA 1.746 13 residues pruned to eliminate duplicates Z: 14 18.162 2.094 0.683 0.585 0.923 0.692 CB 1.427 14 residues pruned to eliminate duplicates Z: 6 10.549 2.025 0.153 0.860 1.000 1.000 CA 1.486 6 residues pruned to eliminate duplicates Z: 31 54.184 2.304 0.681 0.897 1.000 0.900 CB 1.829 28 residues pruned to eliminate duplicates Z: 15 31.093 2.178 0.951 0.858 0.929 0.643 CB 1.551 15 residues pruned to eliminate duplicates Z: 13 29.400 2.335 0.689 0.910 1.000 0.750 CB 1.526 13 residues pruned to eliminate duplicates Z: 15 28.360 2.105 1.026 0.920 1.000 0.929 CB 1.252 15 residues pruned to eliminate duplicates Z: 32 49.873 2.392 1.013 0.652 0.935 0.581 CB 1.726 32 residues pruned to eliminate duplicates Z: 8 8.007 1.918 0.322 0.444 0.857 0.429 CA 1.475 Z: 83 91.986 2.508 0.904 0.761 0.939 0.817 CB 1.796 83 residues pruned to eliminate duplicates Z: 17 50.799 2.379 0.992 0.925 1.000 0.938 CA 1.880 17 residues pruned to eliminate duplicates Z: 18 28.980 2.178 0.624 0.898 0.941 0.882 CB 1.511 18 residues pruned to eliminate duplicates Z: 29 53.340 2.301 0.861 0.885 0.929 0.821 CB 1.830 29 residues pruned to eliminate duplicates Z: 17 23.978 2.125 0.630 0.863 0.938 0.812 CB 1.354 17 residues pruned to eliminate duplicates Z: 31 55.668 2.331 0.770 0.904 1.000 0.833 CB 1.755 31 residues pruned to eliminate duplicates Z: 17 48.024 2.305 1.120 0.904 1.000 0.688 CB 1.750 17 residues pruned to eliminate duplicates Z: 29 50.268 2.330 0.759 0.893 0.893 0.786 CB 1.863 29 residues pruned to eliminate duplicates Z: 16 21.366 2.168 0.362 0.872 0.867 0.733 CA 1.571 16 residues pruned to eliminate duplicates Z: 32 55.460 2.340 0.756 0.910 0.968 0.806 CB 1.776 32 residues pruned to eliminate duplicates Z: 28 39.053 2.205 0.554 0.871 0.926 0.741 CB 1.728 28 residues pruned to eliminate duplicates Z: 16 23.525 2.240 0.490 0.894 0.933 0.867 CB 1.399 16 residues pruned to eliminate duplicates Z: 36 23.866 2.013 0.527 0.551 0.943 0.686 CB 1.324 36 residues pruned to eliminate duplicates Z: 28 49.079 2.269 0.587 0.937 1.000 0.926 CB 1.825 28 residues pruned to eliminate duplicates Z: 43 35.613 2.248 0.625 0.565 0.952 0.643 CB 1.483 43 residues pruned to eliminate duplicates Z: 30 21.178 2.175 0.525 0.414 0.897 0.586 CB 1.447 30 residues pruned to eliminate duplicates Z: 35 37.885 2.266 0.841 0.651 0.941 0.676 CB 1.437 35 residues pruned to eliminate duplicates Z: 30 33.291 2.109 0.668 0.812 0.897 0.621 CB 1.494 30 residues pruned to eliminate duplicates Z: 14 33.961 2.335 1.168 0.913 1.000 0.769 CB 1.317 14 residues pruned to eliminate duplicates Z: 37 21.452 2.097 0.587 0.378 0.833 0.611 CB 1.468 37 residues pruned to eliminate duplicates Z: 30 53.909 2.379 0.688 0.931 0.966 0.828 CB 1.805 30 residues pruned to eliminate duplicates Z: 39 40.439 2.286 0.773 0.617 0.974 0.711 CB 1.488 39 residues pruned to eliminate duplicates Z: 92 65.845 2.366 0.843 0.613 0.923 0.736 CB 1.540 92 residues pruned to eliminate duplicates Z: 24 37.965 2.098 1.087 0.907 0.957 0.435 CB 1.344 24 residues pruned to eliminate duplicates Z: 31 48.921 2.345 0.714 0.875 0.900 0.800 CB 1.795 31 residues pruned to eliminate duplicates Z: 19 39.523 2.219 1.019 0.921 0.944 0.667 CB 1.550 19 residues pruned to eliminate duplicates Z: 23 40.232 2.248 0.758 0.812 0.909 0.636 CA 1.820 23 residues pruned to eliminate duplicates Z: 22 38.120 2.314 0.674 0.876 0.905 0.810 CB 1.725 22 residues pruned to eliminate duplicates Z: 13 16.847 2.059 0.693 0.563 0.917 0.417 CB 1.431 13 residues pruned to eliminate duplicates Z: 14 15.984 2.154 0.342 0.820 0.846 0.692 CB 1.373 14 residues pruned to eliminate duplicates Z: 8 16.629 2.042 0.692 0.831 1.000 1.000 CA 1.367 8 residues pruned to eliminate duplicates Z: 25 39.126 2.307 0.600 0.898 0.958 0.958 CB 1.615 25 residues pruned to eliminate duplicates Z: 139 95.118 2.373 0.903 0.663 0.935 0.659 CB 1.649 139 residues pruned to eliminate duplicates Z: 24 60.420 2.424 1.311 0.951 0.957 0.565 CB 1.620 24 residues pruned to eliminate duplicates Z: 30 61.464 2.344 0.914 0.903 1.000 0.655 CB 1.813 30 residues pruned to eliminate duplicates Z: 15 29.590 2.267 0.639 0.871 1.000 0.643 CB 1.553 15 residues pruned to eliminate duplicates Z: 14 37.228 2.363 0.971 0.893 1.000 0.692 CB 1.591 14 residues pruned to eliminate duplicates Z: 12 23.165 2.257 0.676 0.640 1.000 0.455 CB 1.619 12 residues pruned to eliminate duplicates Z: 66 68.924 2.480 0.803 0.611 0.938 0.600 CB 1.833 66 residues pruned to eliminate duplicates Z: 16 39.627 2.289 1.145 0.922 1.000 0.667 CB 1.466 16 residues pruned to eliminate duplicates Z: 13 20.252 2.106 0.672 0.677 0.917 0.500 CB 1.539 13 residues pruned to eliminate duplicates Z: 26 32.703 2.176 0.617 0.817 0.960 0.880 CB 1.471 26 residues pruned to eliminate duplicates Z: 74 65.218 2.407 0.805 0.605 0.918 0.630 CB 1.732 74 residues pruned to eliminate duplicates Z: 17 51.059 2.291 1.072 0.943 1.000 0.875 CB 1.863 17 residues pruned to eliminate duplicates Z: 43 38.739 2.254 0.843 0.552 0.952 0.643 CB 1.436 43 residues pruned to eliminate duplicates Z: 13 25.539 2.032 1.031 0.904 0.917 0.917 CB 1.388 Z: 16 27.472 2.233 0.983 0.892 0.933 0.667 CB 1.233 16 residues pruned to eliminate duplicates Z: 16 17.982 2.215 0.268 0.900 0.933 0.933 CB 1.266 16 residues pruned to eliminate duplicates Z: 30 68.815 2.400 1.108 0.936 0.966 0.621 CB 1.822 30 residues pruned to eliminate duplicates Z: 17 32.315 2.289 0.569 0.908 1.000 0.875 CA 1.598 17 residues pruned to eliminate duplicates Z: 23 32.953 2.150 0.857 0.918 0.909 0.682 CB 1.365 23 residues pruned to eliminate duplicates Z: 29 46.267 2.271 0.770 0.814 0.929 0.643 CA 1.782 29 residues pruned to eliminate duplicates Z: 12 31.324 2.466 0.634 0.866 1.000 1.000 CB 1.715 12 residues pruned to eliminate duplicates Z: 30 54.315 2.379 0.817 0.926 0.931 0.828 CB 1.758 30 residues pruned to eliminate duplicates Z: 14 23.999 2.186 0.577 0.886 0.923 0.769 CB 1.509 14 residues pruned to eliminate duplicates Z: 9 16.147 2.104 0.432 0.761 0.875 0.500 CB 1.716 9 residues pruned to eliminate duplicates Z: 32 64.921 2.358 0.932 0.907 1.000 0.742 CB 1.819 32 residues pruned to eliminate duplicates Z: 32 56.272 2.336 0.874 0.894 0.968 0.774 CB 1.712 32 residues pruned to eliminate duplicates Z: 15 20.830 1.897 0.454 0.942 0.929 0.929 CB 1.508 15 residues pruned to eliminate duplicates Z: 12 25.425 2.190 0.681 0.897 0.909 0.818 CB 1.640 12 residues pruned to eliminate duplicates Z: 16 37.085 2.224 1.023 0.900 1.000 0.600 CB 1.520 16 residues pruned to eliminate duplicates Z: 89 92.774 2.497 1.043 0.688 0.932 0.614 CB 1.751 89 residues pruned to eliminate duplicates Z: 8 6.967 1.669 0.800 0.490 0.714 0.429 CB 1.239 8 residues pruned to eliminate duplicates Z: 25 53.530 2.317 1.272 0.902 0.917 0.500 CB 1.614 24 residues pruned to eliminate duplicates Z: 13 7.356 2.026 0.060 0.517 0.750 0.667 CB 1.297 Z: 20 47.749 2.395 0.922 0.863 0.947 0.842 CB 1.843 20 residues pruned to eliminate duplicates Z: 8 2.986 1.547 -0.014 0.330 0.714 0.571 CB 1.248 Z: 86 93.745 2.495 1.048 0.719 0.941 0.659 CB 1.734 86 residues pruned to eliminate duplicates Z: 29 54.989 2.376 0.895 0.922 0.929 0.786 CB 1.748 29 residues pruned to eliminate duplicates Z: 25 14.043 2.054 0.632 0.384 0.792 0.458 CB 1.222 25 residues pruned to eliminate duplicates Z: 27 33.417 2.242 0.796 0.635 0.923 0.654 CB 1.554 27 residues pruned to eliminate duplicates Z: 14 21.370 1.949 0.446 0.934 1.000 1.000 CB 1.467 14 residues pruned to eliminate duplicates Z: 6 11.900 1.986 0.622 0.724 1.000 1.000 CB 1.349 6 residues pruned to eliminate duplicates Z: 8 8.828 1.833 0.397 0.721 0.857 0.714 CB 1.245 8 residues pruned to eliminate duplicates Z: 13 20.117 1.994 0.660 0.867 0.833 0.500 CB 1.540 13 residues pruned to eliminate duplicates Z: 17 17.650 2.127 0.305 0.444 1.000 0.500 CB 1.684 17 residues pruned to eliminate duplicates Z: 22 42.238 2.438 0.953 0.841 0.857 0.619 CB 1.684 22 residues pruned to eliminate duplicates Z: 75 72.624 2.431 0.822 0.641 0.959 0.716 CB 1.741 75 residues pruned to eliminate duplicates Z: 11 25.113 2.248 0.787 0.845 0.900 0.900 CB 1.633 11 residues pruned to eliminate duplicates Z: 8 5.581 1.826 0.587 0.331 0.857 0.429 CB 1.022 8 residues pruned to eliminate duplicates Z: 8 15.664 1.989 0.544 0.870 1.000 0.857 CA 1.407 8 residues pruned to eliminate duplicates Z: 47 48.927 2.293 0.835 0.659 0.957 0.804 CB 1.546 47 residues pruned to eliminate duplicates Z: 7 10.527 1.929 0.591 0.685 0.833 0.667 CA 1.418 7 residues pruned to eliminate duplicates Z: 30 56.454 2.371 0.861 0.911 0.966 0.931 CB 1.745 30 residues pruned to eliminate duplicates Z: 33 53.107 2.224 0.801 0.905 0.969 0.594 CB 1.722 33 residues pruned to eliminate duplicates Z: 24 45.494 2.299 0.820 0.854 0.957 0.783 CA 1.750 24 residues pruned to eliminate duplicates Z: 50 58.261 2.449 0.863 0.604 0.980 0.735 CB 1.686 50 residues pruned to eliminate duplicates Z: 151 86.700 2.341 0.772 0.613 0.920 0.700 CB 1.667 137 residues pruned to eliminate duplicates Z: 67 69.035 2.468 0.789 0.640 0.939 0.621 CB 1.797 66 residues pruned to eliminate duplicates Z: 130 89.237 2.449 0.757 0.646 0.922 0.651 CB 1.728 130 residues pruned to eliminate duplicates Z: 13 22.878 2.321 0.414 0.867 0.917 0.667 CB 1.606 13 residues pruned to eliminate duplicates Z: 16 30.201 2.191 1.192 0.920 0.933 0.600 CB 1.225 16 residues pruned to eliminate duplicates Z: 73 53.103 2.224 0.772 0.607 0.944 0.583 CB 1.519 73 residues pruned to eliminate duplicates Z: 30 61.151 2.386 1.103 0.935 0.931 0.517 CB 1.694 30 residues pruned to eliminate duplicates Z: 13 13.639 1.961 0.439 0.690 0.833 0.500 CB 1.407 13 residues pruned to eliminate duplicates Z: 73 64.406 2.381 0.774 0.623 0.944 0.694 CB 1.696 73 residues pruned to eliminate duplicates Z: 11 29.567 2.233 0.882 0.882 1.000 0.900 CB 1.609 11 residues pruned to eliminate duplicates Z: 18 36.847 2.150 1.185 0.842 0.882 0.588 CB 1.607 18 residues pruned to eliminate duplicates Z: 16 31.235 2.234 1.002 0.918 1.000 0.800 CB 1.272 16 residues pruned to eliminate duplicates Z: 24 44.954 2.423 0.865 0.728 1.000 0.739 CB 1.690 24 residues pruned to eliminate duplicates Z: 26 32.365 2.143 0.699 0.826 0.920 0.720 CB 1.457 26 residues pruned to eliminate duplicates Z: 18 34.441 2.259 0.434 0.928 1.000 0.882 CA 1.805 18 residues pruned to eliminate duplicates Z: 30 43.639 2.268 0.435 0.920 1.000 0.828 CB 1.753 30 residues pruned to eliminate duplicates Z: 20 50.286 2.440 0.952 0.879 1.000 0.684 CB 1.756 20 residues pruned to eliminate duplicates Z: 6 14.155 1.820 0.824 0.753 1.000 0.400 CB 1.521 6 residues pruned to eliminate duplicates Z: 77 70.608 2.419 0.891 0.602 0.921 0.724 CB 1.745 77 residues pruned to eliminate duplicates Z: 49 39.525 2.261 0.679 0.542 0.917 0.667 CB 1.575 49 residues pruned to eliminate duplicates Z: 30 58.587 2.295 1.012 0.896 0.966 0.448 CB 1.748 30 residues pruned to eliminate duplicates Z: 9 6.717 1.491 0.591 0.807 0.875 0.375 CB 0.875 9 residues pruned to eliminate duplicates Z: 15 31.335 2.230 0.983 0.909 1.000 0.786 CB 1.344 15 residues pruned to eliminate duplicates Z: 25 30.654 2.153 0.753 0.678 0.958 0.583 CB 1.469 14 residues pruned to eliminate duplicates Z: 67 69.762 2.480 0.910 0.609 0.924 0.576 CB 1.769 67 residues pruned to eliminate duplicates Z: 17 42.156 2.297 1.189 0.912 0.875 0.750 CB 1.697 17 residues pruned to eliminate duplicates Z: 168 67.499 2.209 0.608 0.559 0.922 0.635 CB 1.506 178 residues pruned to eliminate duplicates Z: 21 34.138 2.212 0.696 0.933 0.950 0.700 CB 1.495 21 residues pruned to eliminate duplicates Z: 7 5.750 1.537 0.423 0.651 0.833 0.333 CB 1.119 7 residues pruned to eliminate duplicates Z: 18 15.164 1.770 0.525 0.701 1.000 0.765 CB 1.134 18 residues pruned to eliminate duplicates Z: 14 27.744 2.207 0.711 0.844 1.000 0.692 CB 1.515 14 residues pruned to eliminate duplicates Z: 19 11.569 2.149 0.196 0.494 0.889 0.611 CB 1.201 19 residues pruned to eliminate duplicates Z: 119 58.813 2.201 0.615 0.587 0.949 0.653 CB 1.477 119 residues pruned to eliminate duplicates Z: 51 48.154 2.398 0.781 0.524 0.880 0.660 CB 1.769 51 residues pruned to eliminate duplicates Z: 20 44.231 2.164 1.096 0.900 0.947 0.737 CB 1.687 20 residues pruned to eliminate duplicates Z: 13 21.908 2.034 0.615 0.842 1.000 0.833 CB 1.435 13 residues pruned to eliminate duplicates Z: 13 12.798 1.935 0.590 0.385 0.833 0.417 CB 1.629 13 residues pruned to eliminate duplicates Z: 14 21.313 2.214 0.436 0.897 0.923 0.692 CB 1.442 14 residues pruned to eliminate duplicates Z: 28 50.737 2.329 1.059 0.741 1.000 0.778 CB 1.640 28 residues pruned to eliminate duplicates Z: 89 90.792 2.437 0.916 0.724 0.943 0.636 CB 1.796 89 residues pruned to eliminate duplicates Z: 31 55.369 2.363 0.853 0.909 0.933 0.467 CB 1.755 31 residues pruned to eliminate duplicates Z: 17 41.212 2.301 0.844 0.925 1.000 0.938 CA 1.704 17 residues pruned to eliminate duplicates Z: 15 16.912 1.993 0.177 0.824 1.000 0.643 CB 1.456 15 residues pruned to eliminate duplicates Z: 36 53.201 2.524 0.765 0.663 0.943 0.600 CB 1.840 36 residues pruned to eliminate duplicates Z: 24 46.419 2.361 0.850 0.930 0.957 0.522 CB 1.619 24 residues pruned to eliminate duplicates Z: 17 24.375 2.219 0.637 0.700 0.938 0.500 CB 1.491 20 residues pruned to eliminate duplicates Z: 28 55.587 2.341 0.832 0.917 0.963 0.889 CA 1.828 28 residues pruned to eliminate duplicates Z: 15 15.425 2.162 0.034 0.940 1.000 1.000 CB 1.281 15 residues pruned to eliminate duplicates Z: 23 44.925 2.449 0.820 0.805 0.909 0.818 CB 1.812 23 residues pruned to eliminate duplicates Z: 75 71.091 2.471 0.807 0.610 0.946 0.716 CB 1.762 75 residues pruned to eliminate duplicates Z: 11 25.696 2.218 0.664 0.900 1.000 0.800 CA 1.573 11 residues pruned to eliminate duplicates Z: 17 24.840 2.153 0.505 0.857 0.938 0.812 CB 1.506 17 residues pruned to eliminate duplicates Z: 8 9.136 1.985 0.216 0.786 1.000 0.714 CA 1.112 8 residues pruned to eliminate duplicates Z: 17 11.854 1.994 0.498 0.369 0.812 0.375 CB 1.406 17 residues pruned to eliminate duplicates Z: 7 10.181 1.724 0.369 0.827 1.000 1.000 CA 1.327 7 residues pruned to eliminate duplicates Z: 39 26.396 2.041 0.548 0.587 0.895 0.632 CB 1.393 43 residues pruned to eliminate duplicates Z: 11 8.296 2.119 0.558 0.337 0.900 0.600 CB 1.054 11 residues pruned to eliminate duplicates Z: 17 43.415 2.273 0.966 0.892 1.000 0.750 CB 1.745 17 residues pruned to eliminate duplicates Z: 13 24.393 2.074 0.559 0.888 1.000 0.750 CA 1.568 13 residues pruned to eliminate duplicates Z: 14 33.085 2.332 0.693 0.879 0.923 0.923 CA 1.826 14 residues pruned to eliminate duplicates Z: 8 10.935 1.655 0.881 0.766 0.857 0.286 CA 1.224 8 residues pruned to eliminate duplicates Z: 12 18.282 2.200 0.592 0.821 0.909 0.727 CB 1.311 12 residues pruned to eliminate duplicates Z: 40 29.279 2.125 0.629 0.538 0.897 0.667 CB 1.453 40 residues pruned to eliminate duplicates Z: 13 14.428 1.709 0.587 0.936 1.000 0.917 CB 1.069 Z: 14 28.094 2.270 0.724 0.629 0.923 0.769 CB 1.910 14 residues pruned to eliminate duplicates Z: 15 16.375 2.252 0.787 0.500 0.857 0.643 CB 1.269 15 residues pruned to eliminate duplicates Z: 17 31.662 2.193 0.897 0.865 0.938 0.562 CB 1.487 17 residues pruned to eliminate duplicates Z: 44 18.811 1.920 0.452 0.516 0.907 0.628 CB 1.116 44 residues pruned to eliminate duplicates Z: 18 25.462 2.161 0.836 0.714 0.824 0.471 CB 1.557 17 residues pruned to eliminate duplicates Z: 19 22.356 2.060 0.668 0.641 0.889 0.333 CB 1.511 13 residues pruned to eliminate duplicates Z: 8 11.622 1.697 0.688 0.811 0.857 0.714 CA 1.364 8 residues pruned to eliminate duplicates Z: 37 43.528 2.321 0.782 0.668 1.000 0.722 CB 1.502 37 residues pruned to eliminate duplicates Z: 47 41.815 2.236 0.610 0.667 0.978 0.696 CB 1.500 47 residues pruned to eliminate duplicates Z: 34 50.122 2.445 1.008 0.633 0.939 0.636 CB 1.669 34 residues pruned to eliminate duplicates Z: 13 22.099 1.972 0.657 0.899 1.000 0.667 CA 1.395 13 residues pruned to eliminate duplicates Z: 137 100.327 2.481 0.865 0.626 0.941 0.669 CB 1.754 137 residues pruned to eliminate duplicates Z: 35 54.119 2.530 0.779 0.668 0.941 0.500 CB 1.876 35 residues pruned to eliminate duplicates Z: 50 65.893 2.387 0.794 0.786 0.939 0.755 CB 1.821 50 residues pruned to eliminate duplicates Z: 17 34.091 2.263 0.578 0.895 1.000 0.812 CB 1.711 17 residues pruned to eliminate duplicates Z: 14 28.499 2.291 0.798 0.881 1.000 0.846 CB 1.389 14 residues pruned to eliminate duplicates Z: 6 8.477 2.047 0.316 0.633 1.000 0.600 CB 1.242 6 residues pruned to eliminate duplicates Z: 16 42.889 2.370 0.901 0.919 1.000 0.800 CB 1.733 16 residues pruned to eliminate duplicates Z: 18 34.388 2.183 0.791 0.882 1.000 0.647 CB 1.543 18 residues pruned to eliminate duplicates Z: 31 50.960 2.259 0.721 0.899 1.000 0.867 CB 1.712 31 residues pruned to eliminate duplicates Z: 38 20.621 1.862 0.434 0.605 0.973 0.676 CB 1.181 38 residues pruned to eliminate duplicates Z: 6 16.125 2.066 0.979 0.816 1.000 0.600 CB 1.341 6 residues pruned to eliminate duplicates Z: 12 7.689 1.899 0.066 0.603 0.818 0.818 CB 1.269 12 residues pruned to eliminate duplicates Z: 90 80.198 2.461 0.954 0.694 0.865 0.674 CB 1.711 90 residues pruned to eliminate duplicates Z: 14 10.936 1.719 0.205 0.944 1.000 1.000 CB 1.014 14 residues pruned to eliminate duplicates Z: 30 45.559 2.236 0.666 0.890 0.966 0.828 CB 1.693 30 residues pruned to eliminate duplicates Z: 10 6.168 2.123 0.298 0.375 0.667 0.556 CB 1.279 10 residues pruned to eliminate duplicates Z: 14 21.025 2.176 0.458 0.877 0.923 0.846 CB 1.446 14 residues pruned to eliminate duplicates Z: 14 22.580 1.943 0.507 0.933 1.000 0.923 CB 1.491 14 residues pruned to eliminate duplicates Z: 67 67.536 2.459 0.780 0.605 0.955 0.591 CB 1.801 67 residues pruned to eliminate duplicates Z: 15 32.475 2.195 0.802 0.882 1.000 0.929 CB 1.587 15 residues pruned to eliminate duplicates Z: 17 42.187 2.342 0.792 0.899 1.000 0.875 CB 1.796 17 residues pruned to eliminate duplicates Z: 13 17.773 2.149 0.544 0.640 1.000 0.833 CB 1.356 13 residues pruned to eliminate duplicates Z: 45 52.363 2.330 0.860 0.702 0.909 0.682 CB 1.667 45 residues pruned to eliminate duplicates Z: 8 10.376 1.964 0.372 0.710 0.857 0.429 CB 1.403 8 residues pruned to eliminate duplicates Z: 16 35.957 2.154 1.190 0.909 1.000 0.733 CB 1.397 16 residues pruned to eliminate duplicates Z: 13 22.749 2.029 0.718 0.838 1.000 0.750 CB 1.408 13 residues pruned to eliminate duplicates Z: 22 37.227 2.109 0.824 0.911 1.000 0.619 CB 1.497 22 residues pruned to eliminate duplicates Z: 31 49.799 2.272 0.859 0.858 0.933 0.600 CB 1.699 31 residues pruned to eliminate duplicates Z: 51 42.391 2.373 0.601 0.521 0.940 0.740 CB 1.644 51 residues pruned to eliminate duplicates Z: 29 20.172 1.894 0.762 0.486 0.857 0.607 CB 1.352 29 residues pruned to eliminate duplicates Z: 25 34.130 2.218 0.556 0.831 0.875 0.667 CA 1.733 25 residues pruned to eliminate duplicates Z: 38 36.900 2.265 0.659 0.608 0.973 0.757 CB 1.497 38 residues pruned to eliminate duplicates Z: 16 31.996 2.228 0.776 0.881 1.000 0.600 CB 1.512 16 residues pruned to eliminate duplicates Z: 15 21.969 1.872 0.537 0.903 0.929 0.857 CB 1.566 15 residues pruned to eliminate duplicates Z: 12 11.300 1.934 0.248 0.706 1.000 0.818 CB 1.171 12 residues pruned to eliminate duplicates Z: 19 24.317 2.218 0.501 0.635 0.944 0.667 CB 1.606 19 residues pruned to eliminate duplicates Z: 15 23.077 1.899 0.649 0.931 0.929 0.857 CB 1.483 15 residues pruned to eliminate duplicates Z: 41 40.945 2.419 0.726 0.599 0.900 0.650 CB 1.568 41 residues pruned to eliminate duplicates Z: 179 103.438 2.446 0.826 0.612 0.904 0.646 CB 1.726 179 residues pruned to eliminate duplicates Z: 59 33.557 2.103 0.641 0.481 0.931 0.655 CB 1.398 59 residues pruned to eliminate duplicates Z: 9 16.761 2.321 0.533 0.570 0.875 0.750 CB 1.780 9 residues pruned to eliminate duplicates Z: 38 37.701 2.284 0.935 0.556 0.919 0.622 CB 1.445 38 residues pruned to eliminate duplicates Z: 11 12.409 2.379 0.691 0.476 0.800 0.700 CB 1.250 11 residues pruned to eliminate duplicates Z: 7 5.382 1.789 -0.088 0.575 0.833 0.500 CB 1.504 Z: 15 19.270 2.120 0.329 0.887 0.929 0.929 CB 1.418 15 residues pruned to eliminate duplicates Z: 7 9.634 1.607 0.576 0.734 1.000 0.333 CB 1.259 7 residues pruned to eliminate duplicates Z: 9 10.422 2.231 0.304 0.421 0.875 0.750 CB 1.571 9 residues pruned to eliminate duplicates Z: 6 3.462 1.627 -0.090 0.574 0.800 0.600 O 1.218 6 residues pruned to eliminate duplicates Z: 34 45.852 2.464 0.834 0.645 0.939 0.667 CB 1.642 34 residues pruned to eliminate duplicates Z: 22 31.513 2.284 0.682 0.725 0.905 0.619 CB 1.615 22 residues pruned to eliminate duplicates Z: 11 9.203 1.687 0.843 0.472 0.900 0.500 CB 1.069 11 residues pruned to eliminate duplicates Z: 6 11.703 1.928 1.130 0.726 0.800 0.400 CA 1.299 6 residues pruned to eliminate duplicates Z: 24 45.398 2.509 0.819 0.731 1.000 0.696 CB 1.685 24 residues pruned to eliminate duplicates Z: 89 90.555 2.418 0.902 0.727 0.943 0.750 CB 1.815 89 residues pruned to eliminate duplicates Z: 15 36.512 2.274 0.939 0.944 1.000 0.786 CB 1.532 15 residues pruned to eliminate duplicates Z: 21 41.171 2.197 1.033 0.909 0.950 0.700 CB 1.540 21 residues pruned to eliminate duplicates Z: 14 22.531 1.925 0.556 0.944 1.000 0.846 CB 1.445 14 residues pruned to eliminate duplicates Z: 24 43.647 2.348 0.628 0.933 0.957 0.913 CB 1.737 24 residues pruned to eliminate duplicates Z: 63 34.519 2.092 0.870 0.491 0.903 0.532 CB 1.251 63 residues pruned to eliminate duplicates Z: 15 34.572 2.215 1.026 0.860 0.929 0.643 CB 1.630 15 residues pruned to eliminate duplicates Z: 16 21.681 1.867 0.491 0.916 0.933 0.733 CB 1.522 16 residues pruned to eliminate duplicates Z: 62 60.515 2.335 0.776 0.689 0.918 0.689 CB 1.712 62 residues pruned to eliminate duplicates Z: 6 9.512 2.081 0.570 0.776 0.800 0.600 CB 1.275 6 residues pruned to eliminate duplicates Z: 24 47.286 2.381 0.925 0.911 0.957 0.609 CB 1.593 24 residues pruned to eliminate duplicates Z: 31 34.793 2.107 0.748 0.659 0.967 0.667 CB 1.538 31 residues pruned to eliminate duplicates Z: 9 11.035 2.075 0.196 0.600 1.000 0.625 CB 1.429 9 residues pruned to eliminate duplicates Z: 15 24.674 1.912 0.835 0.922 0.929 0.786 CB 1.424 15 residues pruned to eliminate duplicates Z: 13 17.346 2.169 0.353 0.842 0.917 0.667 CB 1.386 13 residues pruned to eliminate duplicates Z: 6 10.246 1.941 0.276 0.832 1.000 0.600 CA 1.389 6 residues pruned to eliminate duplicates Z: 22 35.221 2.159 0.859 0.911 0.952 0.619 CB 1.426 22 residues pruned to eliminate duplicates Z: 13 34.850 2.477 0.736 0.894 0.917 0.417 CB 1.830 13 residues pruned to eliminate duplicates Z: 13 21.765 2.262 0.385 0.872 0.917 0.500 CB 1.594 13 residues pruned to eliminate duplicates Z: 41 24.853 1.991 0.532 0.545 0.900 0.600 CB 1.370 41 residues pruned to eliminate duplicates Z: 7 10.005 1.806 0.363 0.752 1.000 0.667 CA 1.326 7 residues pruned to eliminate duplicates Z: 17 35.479 2.177 0.924 0.914 0.938 0.562 CB 1.598 17 residues pruned to eliminate duplicates Z: 16 23.661 2.166 0.362 0.919 1.000 0.933 CB 1.460 16 residues pruned to eliminate duplicates Z: 21 42.475 2.423 0.683 0.821 1.000 0.750 CB 1.763 21 residues pruned to eliminate duplicates Z: 39 24.625 1.985 0.510 0.583 0.895 0.605 CB 1.376 39 residues pruned to eliminate duplicates Z: 13 17.851 2.134 0.418 0.641 1.000 0.833 CA 1.493 13 residues pruned to eliminate duplicates Z: 47 34.492 2.228 0.543 0.633 0.978 0.717 CB 1.334 47 residues pruned to eliminate duplicates Z: 25 45.150 2.329 0.713 0.890 1.000 0.833 CB 1.662 26 residues pruned to eliminate duplicates Z: 14 31.722 2.306 0.769 0.937 0.923 0.923 CB 1.626 14 residues pruned to eliminate duplicates Z: 24 57.755 2.397 1.258 0.940 0.957 0.565 CB 1.616 24 residues pruned to eliminate duplicates Z: 16 37.795 2.318 0.912 0.895 0.933 0.600 CB 1.691 16 residues pruned to eliminate duplicates Z: 11 26.463 2.211 0.655 0.927 1.000 0.900 CB 1.603 11 residues pruned to eliminate duplicates Z: 26 23.422 2.019 0.451 0.702 0.920 0.720 CB 1.445 26 residues pruned to eliminate duplicates Z: 14 19.933 1.905 0.525 0.842 0.923 0.308 CA 1.536 14 residues pruned to eliminate duplicates Z: 18 27.451 2.093 0.718 0.856 0.941 0.706 CA 1.451 18 residues pruned to eliminate duplicates Z: 95 89.950 2.465 0.940 0.707 0.926 0.596 CB 1.736 95 residues pruned to eliminate duplicates Z: 29 30.714 2.283 0.615 0.508 0.929 0.607 CB 1.682 29 residues pruned to eliminate duplicates Z: 40 40.161 2.268 0.747 0.588 0.949 0.641 CB 1.571 40 residues pruned to eliminate duplicates Z: 16 36.395 2.276 0.957 0.911 0.933 0.733 CB 1.602 16 residues pruned to eliminate duplicates Z: 14 21.886 1.947 0.478 0.929 1.000 0.846 CB 1.475 14 residues pruned to eliminate duplicates Z: 88 69.070 2.425 0.670 0.648 0.931 0.667 CB 1.712 89 residues pruned to eliminate duplicates Z: 20 19.413 2.097 0.605 0.650 0.842 0.474 CB 1.366 20 residues pruned to eliminate duplicates Z: 18 11.725 1.770 0.464 0.664 0.941 0.647 CB 1.001 18 residues pruned to eliminate duplicates Z: 16 22.368 2.137 0.418 0.880 1.000 0.733 CB 1.381 16 residues pruned to eliminate duplicates Z: 49 34.250 2.201 0.663 0.543 0.917 0.667 CB 1.413 49 residues pruned to eliminate duplicates Z: 8 13.635 1.908 0.692 0.801 1.000 0.857 CB 1.227 8 residues pruned to eliminate duplicates Z: 13 22.193 1.937 0.575 0.931 1.000 0.917 CB 1.468 13 residues pruned to eliminate duplicates Z: 19 22.153 2.167 0.418 0.634 0.944 0.778 CB 1.586 19 residues pruned to eliminate duplicates Z: 93 59.734 2.340 0.880 0.567 0.891 0.717 CB 1.490 93 residues pruned to eliminate duplicates Z: 29 37.928 2.243 0.688 0.821 0.857 0.714 CB 1.673 29 residues pruned to eliminate duplicates Z: 23 34.467 2.514 0.589 0.687 0.909 0.727 CB 1.705 23 residues pruned to eliminate duplicates Z: 6 13.919 2.206 0.684 0.768 0.800 0.800 CA 1.651 6 residues pruned to eliminate duplicates Z: 51 37.618 2.249 0.729 0.515 0.940 0.680 CB 1.433 51 residues pruned to eliminate duplicates Z: 45 38.468 2.151 0.958 0.566 0.886 0.636 CB 1.457 45 residues pruned to eliminate duplicates Z: 13 13.659 1.877 0.390 0.715 1.000 0.833 CB 1.245 13 residues pruned to eliminate duplicates Z: 17 36.914 2.177 0.840 0.937 1.000 0.938 CB 1.603 17 residues pruned to eliminate duplicates Z: 30 57.883 2.355 0.897 0.897 1.000 0.862 CB 1.722 30 residues pruned to eliminate duplicates Z: 16 22.926 2.184 0.798 0.823 0.867 0.800 CB 1.315 16 residues pruned to eliminate duplicates Z: 74 81.599 2.384 0.890 0.740 0.959 0.712 CB 1.783 74 residues pruned to eliminate duplicates Z: 13 11.083 1.786 0.759 0.513 0.917 0.500 CB 1.097 Z: 7 3.585 1.556 0.519 0.249 0.667 0.500 N 1.239 7 residues pruned to eliminate duplicates Z: 7 11.212 2.114 0.307 0.727 0.833 0.500 CB 1.619 7 residues pruned to eliminate duplicates Z: 9 9.068 1.821 0.020 0.865 1.000 0.875 CB 1.264 9 residues pruned to eliminate duplicates Z: 26 26.833 2.244 0.644 0.596 0.840 0.600 CB 1.581 26 residues pruned to eliminate duplicates Z: 9 12.120 2.178 0.293 0.517 0.875 0.500 CB 1.710 9 residues pruned to eliminate duplicates Z: 20 23.547 2.143 0.518 0.568 0.947 0.842 CB 1.641 20 residues pruned to eliminate duplicates Z: 31 46.506 2.297 0.549 0.900 0.967 0.867 CB 1.763 31 residues pruned to eliminate duplicates Z: 36 52.558 2.548 0.634 0.650 0.971 0.657 CA 1.910 36 residues pruned to eliminate duplicates Z: 20 33.906 2.070 1.270 0.885 0.947 0.316 CB 1.262 20 residues pruned to eliminate duplicates Z: 6 6.335 1.749 0.257 0.724 1.000 0.600 CB 1.053 6 residues pruned to eliminate duplicates Z: 23 42.348 2.151 1.158 0.920 0.955 0.727 CB 1.435 24 residues pruned to eliminate duplicates Z: 69 86.933 2.473 0.896 0.787 0.971 0.706 CB 1.800 69 residues pruned to eliminate duplicates Z: 40 25.576 1.931 0.695 0.594 0.846 0.667 CB 1.352 40 residues pruned to eliminate duplicates Z: 85 90.910 2.511 0.839 0.755 0.964 0.762 CB 1.776 85 residues pruned to eliminate duplicates Z: 7 10.373 1.901 0.702 0.381 1.000 0.667 CB 1.485 7 residues pruned to eliminate duplicates Z: 40 28.602 2.049 0.519 0.572 0.974 0.667 CB 1.409 40 residues pruned to eliminate duplicates Z: 35 39.580 2.250 0.781 0.628 0.882 0.618 CB 1.702 35 residues pruned to eliminate duplicates Z: 7 8.208 1.868 0.176 0.778 1.000 0.667 CB 1.194 7 residues pruned to eliminate duplicates Z: 13 16.738 2.086 0.463 0.680 0.917 0.583 CB 1.464 13 residues pruned to eliminate duplicates Z: 6 8.268 1.934 0.502 0.749 0.800 0.600 CB 1.274 6 residues pruned to eliminate duplicates Z: 24 24.660 2.117 0.625 0.604 0.913 0.739 CB 1.482 24 residues pruned to eliminate duplicates Z: 42 26.492 1.960 0.661 0.548 0.878 0.561 CB 1.381 42 residues pruned to eliminate duplicates Z: 12 18.757 2.351 0.752 0.557 0.909 0.818 CB 1.429 12 residues pruned to eliminate duplicates Z: 6 11.558 2.151 0.145 0.783 1.000 0.600 CB 1.636 6 residues pruned to eliminate duplicates Z: 13 20.704 2.091 0.753 0.604 1.000 0.750 CB 1.477 13 residues pruned to eliminate duplicates Z: 23 40.065 2.435 0.806 0.795 0.864 0.636 CB 1.737 23 residues pruned to eliminate duplicates Z: 23 42.556 2.547 0.718 0.734 0.955 0.636 CB 1.761 23 residues pruned to eliminate duplicates Z: 21 18.360 2.131 0.573 0.456 0.900 0.700 CB 1.424 21 residues pruned to eliminate duplicates Z: 67 52.667 2.250 0.845 0.586 0.894 0.576 CB 1.610 67 residues pruned to eliminate duplicates Z: 90 49.932 2.227 0.682 0.551 0.888 0.551 CB 1.514 90 residues pruned to eliminate duplicates Z: 49 48.713 2.289 0.922 0.634 0.958 0.708 CB 1.471 49 residues pruned to eliminate duplicates Z: 15 36.349 2.332 1.117 0.921 0.929 0.571 CB 1.491 15 residues pruned to eliminate duplicates Z: 7 12.468 2.113 0.371 0.672 1.000 0.500 CA 1.499 7 residues pruned to eliminate duplicates Z: 49 45.440 2.258 0.825 0.635 0.938 0.708 CB 1.496 49 residues pruned to eliminate duplicates Z: 6 6.660 1.949 0.501 0.745 0.800 0.800 CB 1.022 7 residues pruned to eliminate duplicates Z: 21 35.953 2.200 0.854 0.918 0.950 0.650 CB 1.463 21 residues pruned to eliminate duplicates Z: 130 68.205 2.272 0.704 0.599 0.946 0.605 CB 1.493 130 residues pruned to eliminate duplicates Z: 16 22.879 2.111 0.298 0.924 1.000 0.800 CB 1.514 16 residues pruned to eliminate duplicates Z: 23 20.622 2.097 0.454 0.526 0.909 0.818 CB 1.546 21 residues pruned to eliminate duplicates Z: 12 17.556 2.309 0.697 0.501 0.818 0.727 CB 1.650 12 residues pruned to eliminate duplicates Z: 6 6.297 1.827 0.619 0.780 0.600 0.600 CB 1.240 6 residues pruned to eliminate duplicates Z: 14 19.369 2.254 0.642 0.489 0.923 0.615 CB 1.590 14 residues pruned to eliminate duplicates Z: 33 29.587 2.135 0.784 0.597 0.875 0.656 CB 1.430 33 residues pruned to eliminate duplicates Z: 12 21.207 2.223 0.693 0.693 0.909 0.727 CB 1.567 12 residues pruned to eliminate duplicates Z: 6 8.268 1.557 0.487 0.743 1.000 1.000 CA 1.285 6 residues pruned to eliminate duplicates Z: 14 25.283 2.363 0.444 0.832 0.923 0.538 CB 1.672 14 residues pruned to eliminate duplicates Z: 12 13.498 2.201 0.565 0.432 0.818 0.636 CB 1.550 12 residues pruned to eliminate duplicates Z: 15 24.080 1.881 0.484 0.933 1.000 1.000 CB 1.609 15 residues pruned to eliminate duplicates Z: 11 19.657 2.244 0.641 0.558 1.000 0.900 CB 1.596 11 residues pruned to eliminate duplicates Z: 7 8.382 1.794 0.117 0.891 1.000 0.833 CB 1.227 7 residues pruned to eliminate duplicates Z: 8 7.303 1.795 0.292 0.643 0.857 0.571 CA 1.215 8 residues pruned to eliminate duplicates Z: 39 20.848 1.963 0.491 0.535 0.868 0.579 CB 1.286 39 residues pruned to eliminate duplicates Z: 7 7.005 1.801 0.163 0.722 1.000 0.833 CB 1.118 7 residues pruned to eliminate duplicates Z: 14 17.127 1.968 0.702 0.513 0.923 0.615 CB 1.516 14 residues pruned to eliminate duplicates Z: 49 41.130 2.233 0.830 0.602 0.958 0.646 CB 1.376 49 residues pruned to eliminate duplicates Z: 8 7.088 1.631 0.717 0.697 1.000 1.000 CB 0.799 Z: 13 9.657 1.751 -0.005 0.923 1.000 1.000 CB 1.125 13 residues pruned to eliminate duplicates Z: 17 32.613 2.297 0.571 0.904 1.000 0.875 CA 1.609 17 residues pruned to eliminate duplicates Z: 7 15.716 2.107 0.484 0.779 1.000 0.500 CA 1.604 7 residues pruned to eliminate duplicates Z: 15 25.721 2.202 1.086 0.915 0.857 0.429 CB 1.234 15 residues pruned to eliminate duplicates Z: 17 20.393 2.145 0.640 0.843 0.875 0.750 CB 1.233 17 residues pruned to eliminate duplicates Z: 12 32.372 2.399 0.749 0.876 1.000 0.545 CA 1.690 12 residues pruned to eliminate duplicates Z: 67 41.764 2.155 0.599 0.617 0.955 0.803 CB 1.399 67 residues pruned to eliminate duplicates Z: 90 63.723 2.306 0.798 0.629 0.921 0.629 CB 1.566 90 residues pruned to eliminate duplicates Z: 6 5.763 1.835 0.170 0.812 1.000 0.800 CB 0.915 6 residues pruned to eliminate duplicates Z: 7 3.725 2.141 0.060 0.500 0.500 0.500 CB 1.340 7 residues pruned to eliminate duplicates Z: 29 54.669 2.273 0.985 0.902 0.964 0.714 CB 1.694 29 residues pruned to eliminate duplicates Z: 39 39.565 2.282 0.764 0.590 0.947 0.658 CB 1.544 39 residues pruned to eliminate duplicates Z: 20 21.820 2.119 0.693 0.574 0.842 0.737 CB 1.544 21 residues pruned to eliminate duplicates Z: 18 42.133 2.312 0.885 0.912 1.000 0.882 CB 1.661 18 residues pruned to eliminate duplicates Z: 14 18.272 2.179 0.351 0.894 0.923 0.846 CB 1.338 14 residues pruned to eliminate duplicates Z: 15 43.389 2.430 0.802 0.936 1.000 0.786 CB 1.844 15 residues pruned to eliminate duplicates Z: 102 83.490 2.409 0.791 0.679 0.950 0.713 CB 1.718 102 residues pruned to eliminate duplicates Z: 16 24.664 2.143 0.629 0.920 1.000 0.933 CB 1.285 16 residues pruned to eliminate duplicates Z: 23 37.108 2.178 0.749 0.871 0.955 0.591 CA 1.587 23 residues pruned to eliminate duplicates Z: 35 48.945 2.445 0.874 0.646 0.912 0.618 CB 1.753 35 residues pruned to eliminate duplicates Z: 6 7.443 1.720 0.848 0.658 0.800 0.800 N 1.130 Z: 25 52.889 2.290 0.941 0.884 1.000 0.750 CB 1.755 25 residues pruned to eliminate duplicates Z: 9 4.633 1.742 0.028 0.323 0.875 0.500 CB 1.269 5 residues pruned to eliminate duplicates Z: 39 48.782 2.466 0.741 0.679 0.947 0.763 CB 1.650 39 residues pruned to eliminate duplicates Z: 13 24.951 2.252 0.502 0.917 0.917 0.667 CB 1.640 13 residues pruned to eliminate duplicates Z: 40 32.351 2.139 0.592 0.623 0.949 0.667 CB 1.428 40 residues pruned to eliminate duplicates Z: 25 32.312 2.128 0.569 0.736 0.958 0.583 CB 1.668 25 residues pruned to eliminate duplicates Z: 25 39.365 2.317 0.570 0.883 0.958 0.833 CB 1.666 25 residues pruned to eliminate duplicates Z: 17 34.742 2.446 0.567 0.936 1.000 1.000 CB 1.578 17 residues pruned to eliminate duplicates Z: 31 43.245 2.341 0.898 0.642 0.933 0.833 CB 1.668 31 residues pruned to eliminate duplicates Z: 27 16.412 1.702 0.638 0.685 0.962 0.731 CB 1.013 15 residues pruned to eliminate duplicates Z: 13 10.537 1.817 0.776 0.445 0.917 0.583 CB 1.088 14 residues pruned to eliminate duplicates Z: 26 49.531 2.246 0.915 0.898 1.000 0.880 CB 1.647 26 residues pruned to eliminate duplicates Z: 31 49.438 2.293 1.003 0.724 0.967 0.833 CB 1.661 31 residues pruned to eliminate duplicates Z: 6 7.804 1.954 0.486 0.506 1.000 0.200 CA 1.195 6 residues pruned to eliminate duplicates Z: 17 12.998 2.233 0.416 0.400 0.875 0.625 CB 1.306 17 residues pruned to eliminate duplicates Z: 33 59.873 2.290 0.867 0.848 1.000 0.812 CB 1.836 33 residues pruned to eliminate duplicates 6 1.977 2.256 0.197 0.255 0.400 0.200 CB 1.084 ? Z: 6 9.417 2.228 0.308 0.427 1.000 0.400 CA 1.558 6 residues pruned to eliminate duplicates Z: 12 14.304 1.967 0.994 0.456 0.818 0.636 CB 1.406 12 residues pruned to eliminate duplicates Z: 11 11.797 2.094 0.092 0.810 1.000 0.900 CB 1.246 11 residues pruned to eliminate duplicates Z: 24 29.879 2.200 0.716 0.675 0.957 0.652 CB 1.469 24 residues pruned to eliminate duplicates Z: 12 14.134 2.196 0.719 0.418 0.818 0.636 CB 1.503 12 residues pruned to eliminate duplicates Z: 11 13.194 2.059 0.529 0.794 0.800 0.400 CB 1.281 11 residues pruned to eliminate duplicates Z: 9 7.551 1.666 0.139 0.881 1.000 0.750 CB 1.019 9 residues pruned to eliminate duplicates Z: 17 41.735 2.294 1.006 0.926 0.938 0.750 CA 1.696 17 residues pruned to eliminate duplicates Z: 16 34.757 2.139 0.803 0.894 1.000 0.733 CA 1.669 16 residues pruned to eliminate duplicates Z: 17 16.733 1.993 0.936 0.499 0.812 0.688 CB 1.336 17 residues pruned to eliminate duplicates Z: 6 2.117 1.465 0.040 0.477 0.800 0.600 CB 0.795 6 residues pruned to eliminate duplicates Z: 30 56.608 2.295 0.891 0.904 1.000 0.862 CB 1.725 30 residues pruned to eliminate duplicates Z: 48 73.889 2.371 0.844 0.848 1.000 0.830 CB 1.828 48 residues pruned to eliminate duplicates Z: 11 10.918 1.818 0.695 0.483 1.000 0.600 CB 1.140 11 residues pruned to eliminate duplicates Z: 46 25.434 2.103 0.640 0.453 0.800 0.533 CB 1.442 46 residues pruned to eliminate duplicates Z: 13 13.649 1.687 0.583 0.926 1.000 0.917 CB 1.034 13 residues pruned to eliminate duplicates Z: 12 14.418 2.163 0.503 0.445 0.909 0.727 CA 1.556 12 residues pruned to eliminate duplicates Z: 45 26.626 2.035 0.685 0.547 0.955 0.636 CB 1.172 45 residues pruned to eliminate duplicates Z: 49 48.316 2.268 0.713 0.669 0.917 0.729 CB 1.675 49 residues pruned to eliminate duplicates Z: 36 29.361 2.128 0.594 0.594 0.943 0.571 CB 1.419 36 residues pruned to eliminate duplicates Z: 69 54.749 2.390 0.729 0.594 0.882 0.647 CB 1.665 69 residues pruned to eliminate duplicates Z: 51 35.101 2.255 0.607 0.518 0.900 0.660 CB 1.496 51 residues pruned to eliminate duplicates Z: 10 6.834 2.076 0.340 0.168 0.778 0.667 CB 1.578 10 residues pruned to eliminate duplicates Z: 12 14.512 2.156 0.392 0.387 1.000 0.636 CB 1.644 12 residues pruned to eliminate duplicates Z: 12 5.315 1.634 0.344 0.537 0.909 0.545 CB 0.775 12 residues pruned to eliminate duplicates Z: 86 61.620 2.255 0.815 0.588 0.965 0.624 CB 1.556 85 residues pruned to eliminate duplicates Z: 15 15.455 2.156 0.337 0.527 0.929 0.714 CB 1.503 15 residues pruned to eliminate duplicates Z: 8 12.435 1.793 0.488 0.875 1.000 0.857 CB 1.282 8 residues pruned to eliminate duplicates Z: 9 10.508 1.941 -0.035 0.882 1.000 0.875 CB 1.436 9 residues pruned to eliminate duplicates Z: 27 52.111 2.370 0.832 0.917 0.962 0.808 CB 1.726 27 residues pruned to eliminate duplicates Z: 14 21.747 1.916 0.510 0.947 1.000 0.846 CB 1.441 14 residues pruned to eliminate duplicates Z: 32 51.090 2.337 0.924 0.735 0.968 0.677 CB 1.708 32 residues pruned to eliminate duplicates Z: 12 17.627 2.039 0.546 0.729 0.909 0.727 CB 1.508 12 residues pruned to eliminate duplicates Z: 21 40.179 2.329 0.883 0.831 0.900 0.650 CB 1.711 21 residues pruned to eliminate duplicates Z: 16 38.406 2.255 1.080 0.907 0.933 0.600 CB 1.610 16 residues pruned to eliminate duplicates Z: 23 46.647 2.369 1.158 0.849 0.864 0.455 CB 1.670 23 residues pruned to eliminate duplicates Z: 38 18.999 1.908 0.381 0.554 0.892 0.595 CB 1.261 38 residues pruned to eliminate duplicates Z: 7 6.055 1.788 -0.047 0.807 1.000 1.000 CB 1.109 7 residues pruned to eliminate duplicates Z: 12 32.961 2.215 1.233 0.941 1.000 0.545 CB 1.395 12 residues pruned to eliminate duplicates Z: 30 58.229 2.316 0.929 0.922 0.966 0.655 CB 1.763 30 residues pruned to eliminate duplicates Z: 17 29.890 2.135 0.591 0.877 1.000 0.875 CB 1.597 17 residues pruned to eliminate duplicates Z: 14 14.729 2.181 0.600 0.516 0.846 0.692 CB 1.361 14 residues pruned to eliminate duplicates Z: 6 3.342 1.449 0.290 0.532 0.800 0.600 CB 0.968 Z: 25 28.607 2.273 0.677 0.514 0.875 0.750 CB 1.727 25 residues pruned to eliminate duplicates Z: 13 14.520 1.692 0.529 0.942 1.000 1.000 CB 1.123 13 residues pruned to eliminate duplicates Z: 35 43.302 2.373 0.813 0.573 1.000 0.647 CB 1.609 35 residues pruned to eliminate duplicates Z: 16 33.559 2.152 0.907 0.930 1.000 0.600 CB 1.477 16 residues pruned to eliminate duplicates Z: 8 3.997 1.624 -0.045 0.515 0.857 0.571 O 1.120 Z: 40 45.089 2.275 0.950 0.612 1.000 0.667 CB 1.464 40 residues pruned to eliminate duplicates Z: 12 6.459 1.600 0.402 0.461 0.909 0.455 CB 0.994 12 residues pruned to eliminate duplicates Z: 34 25.004 2.064 0.701 0.488 0.879 0.455 CB 1.428 34 residues pruned to eliminate duplicates Z: 7 9.954 1.898 0.397 0.744 1.000 0.667 CB 1.232 7 residues pruned to eliminate duplicates Z: 12 19.250 2.048 0.550 0.895 0.909 0.545 CB 1.441 12 residues pruned to eliminate duplicates Z: 6 6.855 1.674 1.081 0.538 1.000 0.800 CB 0.848 Z: 24 28.482 1.938 0.606 0.871 1.000 0.870 CA 1.391 23 residues pruned to eliminate duplicates Z: 115 91.128 2.466 0.835 0.660 0.930 0.746 CB 1.749 115 residues pruned to eliminate duplicates Z: 30 13.402 1.798 0.444 0.534 0.931 0.586 CB 0.995 30 residues pruned to eliminate duplicates Z: 7 4.572 1.622 0.184 0.528 0.833 0.500 N 1.135 8 residues pruned to eliminate duplicates Z: 12 11.948 2.112 0.750 0.483 0.818 0.636 CB 1.212 12 residues pruned to eliminate duplicates Z: 36 30.025 2.016 0.820 0.567 0.943 0.657 CB 1.375 36 residues pruned to eliminate duplicates Z: 33 15.819 1.810 0.420 0.562 0.906 0.688 CB 1.131 33 residues pruned to eliminate duplicates Z: 7 7.669 1.626 1.250 0.544 0.833 0.667 CB 0.984 6 residues pruned to eliminate duplicates Z: 15 33.606 2.463 0.853 0.646 1.000 0.786 CA 1.717 15 residues pruned to eliminate duplicates Z: 141 67.059 2.226 0.687 0.576 0.929 0.614 CB 1.511 151 residues pruned to eliminate duplicates Z: 40 34.230 2.220 0.857 0.606 0.923 0.641 CB 1.302 40 residues pruned to eliminate duplicates Z: 25 42.829 2.317 0.736 0.909 0.917 0.833 CB 1.682 25 residues pruned to eliminate duplicates Z: 13 17.346 2.141 0.818 0.457 0.833 0.333 CA 1.613 13 residues pruned to eliminate duplicates Z: 10 10.313 2.372 0.569 0.358 0.667 0.333 CB 1.615 10 residues pruned to eliminate duplicates Z: 7 3.204 1.506 0.425 0.426 0.667 0.333 CA 0.988 Z: 15 32.565 2.068 1.390 0.940 1.000 0.929 CB 1.223 15 residues pruned to eliminate duplicates Z: 25 12.881 1.629 0.538 0.596 0.958 0.583 CB 0.999 25 residues pruned to eliminate duplicates Z: 22 37.613 2.188 0.916 0.919 0.952 0.667 CB 1.449 22 residues pruned to eliminate duplicates Z: 81 73.845 2.403 1.009 0.618 0.913 0.575 CB 1.677 81 residues pruned to eliminate duplicates Z: 7 2.046 1.366 0.620 0.241 0.667 0.333 CA 0.765 Z: 30 34.298 2.217 0.839 0.613 0.931 0.517 CB 1.507 30 residues pruned to eliminate duplicates Z: 22 21.973 1.859 0.861 0.788 0.905 0.571 CB 1.189 22 residues pruned to eliminate duplicates Z: 9 4.456 1.754 0.263 0.450 0.875 0.625 CB 0.856 Z: 29 61.953 2.418 1.051 0.900 0.929 0.536 CB 1.816 29 residues pruned to eliminate duplicates Z: 73 58.865 2.320 0.792 0.593 0.931 0.639 CB 1.641 73 residues pruned to eliminate duplicates Z: 7 7.852 1.641 0.847 0.898 1.000 0.833 CB 0.756 7 residues pruned to eliminate duplicates Z: 10 27.448 2.367 0.949 0.716 1.000 0.778 CB 1.630 10 residues pruned to eliminate duplicates Z: 13 15.061 1.720 0.642 0.941 1.000 0.833 CB 1.068 13 residues pruned to eliminate duplicates Z: 32 58.808 2.282 0.842 0.909 1.000 0.645 CB 1.784 32 residues pruned to eliminate duplicates Z: 22 36.191 2.119 1.103 0.936 0.952 0.429 CB 1.295 22 residues pruned to eliminate duplicates Z: 37 44.055 2.312 0.795 0.582 0.944 0.694 CB 1.731 37 residues pruned to eliminate duplicates Z: 91 43.463 2.164 0.537 0.582 0.889 0.667 CB 1.432 91 residues pruned to eliminate duplicates Z: 36 44.618 2.418 0.704 0.686 0.886 0.800 CB 1.742 36 residues pruned to eliminate duplicates Z: 12 27.421 2.203 0.911 0.880 0.909 0.636 CB 1.565 15 residues pruned to eliminate duplicates Z: 77 37.030 2.049 0.623 0.554 0.961 0.671 CB 1.262 77 residues pruned to eliminate duplicates Z: 38 41.933 2.274 0.935 0.612 0.919 0.595 CB 1.533 38 residues pruned to eliminate duplicates Z: 9 13.750 2.182 0.470 0.659 0.875 0.750 CA 1.495 9 residues pruned to eliminate duplicates Z: 6 9.312 2.145 0.183 0.647 1.000 1.000 CA 1.430 6 residues pruned to eliminate duplicates Z: 66 68.124 2.445 0.819 0.613 0.985 0.800 CB 1.735 66 residues pruned to eliminate duplicates Z: 19 28.570 2.191 0.504 0.702 0.944 0.833 CB 1.801 19 residues pruned to eliminate duplicates Z: 16 8.232 1.734 0.271 0.534 0.800 0.800 CB 1.166 12 residues pruned to eliminate duplicates Z: 87 86.943 2.418 0.840 0.753 0.930 0.767 CB 1.808 87 residues pruned to eliminate duplicates Z: 31 30.995 2.279 0.801 0.525 0.867 0.600 CB 1.552 31 residues pruned to eliminate duplicates Z: 18 31.134 2.429 0.567 0.586 1.000 0.588 CA 1.827 18 residues pruned to eliminate duplicates Z: 9 8.534 1.637 0.304 0.881 1.000 1.000 CB 1.023 Z: 7 7.740 1.705 0.178 0.877 1.000 0.667 CB 1.142 7 residues pruned to eliminate duplicates Z: 7 10.864 1.890 0.332 0.697 1.000 0.667 CA 1.472 7 residues pruned to eliminate duplicates Z: 7 6.681 1.417 0.818 0.536 0.833 0.667 CA 1.227 7 residues pruned to eliminate duplicates Z: 8 2.293 1.575 0.151 0.464 0.714 0.571 CB 0.694 Z: 26 21.052 1.934 0.649 0.634 0.880 0.720 CB 1.323 26 residues pruned to eliminate duplicates Z: 17 8.364 1.947 0.194 0.455 0.812 0.688 CB 1.159 17 residues pruned to eliminate duplicates Z: 14 15.439 1.707 0.662 0.936 1.000 0.846 CB 1.051 14 residues pruned to eliminate duplicates Z: 84 46.226 2.199 0.638 0.550 0.916 0.639 CB 1.465 84 residues pruned to eliminate duplicates Z: 15 14.082 1.646 0.474 0.936 1.000 0.857 CB 1.080 15 residues pruned to eliminate duplicates Z: 8 4.010 1.567 0.411 0.456 0.714 0.429 CB 1.004 Z: 8 6.353 1.575 0.542 0.654 0.857 0.714 N 1.000 Z: 12 21.657 2.079 0.569 0.678 1.000 0.909 CB 1.699 12 residues pruned to eliminate duplicates Z: 41 45.580 2.449 0.652 0.543 0.950 0.650 CB 1.797 41 residues pruned to eliminate duplicates Z: 9 8.763 1.732 0.781 0.337 0.875 0.625 CB 1.372 Z: 13 12.040 2.009 0.492 0.460 0.833 0.583 CA 1.449 13 residues pruned to eliminate duplicates Z: 77 43.745 2.034 0.722 0.621 0.934 0.605 CB 1.368 86 residues pruned to eliminate duplicates Z: 17 14.482 2.038 0.738 0.418 0.812 0.625 CB 1.370 17 residues pruned to eliminate duplicates Z: 14 25.418 2.304 0.479 0.891 1.000 0.769 CB 1.487 14 residues pruned to eliminate duplicates Z: 65 68.697 2.484 0.762 0.642 0.953 0.688 CB 1.803 65 residues pruned to eliminate duplicates Z: 26 46.048 2.559 0.608 0.677 1.000 0.560 CB 1.901 26 residues pruned to eliminate duplicates Z: 14 14.414 1.682 0.574 0.918 1.000 0.615 CB 1.065 14 residues pruned to eliminate duplicates Z: 40 58.819 2.294 0.970 0.772 0.949 0.795 CB 1.727 40 residues pruned to eliminate duplicates Z: 58 59.584 2.302 0.688 0.738 0.930 0.789 CB 1.764 58 residues pruned to eliminate duplicates Z: 24 32.213 2.130 0.755 0.698 0.913 0.652 CA 1.643 24 residues pruned to eliminate duplicates Z: 21 31.652 2.142 0.604 0.791 0.950 0.850 CB 1.679 21 residues pruned to eliminate duplicates Z: 13 28.759 2.354 0.695 0.876 0.917 0.583 CB 1.649 13 residues pruned to eliminate duplicates Z: 7 3.831 1.530 0.908 0.217 0.667 0.167 N 1.121 Z: 7 8.968 1.803 0.467 0.658 1.000 0.667 CB 1.196 7 residues pruned to eliminate duplicates Z: 44 44.982 2.291 0.781 0.640 0.907 0.674 CB 1.626 44 residues pruned to eliminate duplicates Z: 7 15.550 2.419 0.420 0.747 0.833 0.500 CA 1.778 7 residues pruned to eliminate duplicates Z: 142 91.861 2.400 0.820 0.658 0.936 0.723 CB 1.635 142 residues pruned to eliminate duplicates Z: 15 25.563 2.096 0.625 0.903 0.929 0.786 CB 1.540 15 residues pruned to eliminate duplicates Z: 42 28.813 1.989 0.681 0.533 0.976 0.537 CB 1.335 42 residues pruned to eliminate duplicates Z: 12 36.690 2.336 0.978 0.929 1.000 0.909 CA 1.675 12 residues pruned to eliminate duplicates Z: 17 31.532 2.333 0.907 0.644 1.000 0.812 CB 1.548 17 residues pruned to eliminate duplicates Z: 13 21.280 1.899 1.023 0.878 0.917 0.750 CB 1.266 13 residues pruned to eliminate duplicates Z: 36 40.011 2.242 0.779 0.629 0.943 0.657 CB 1.593 36 residues pruned to eliminate duplicates Z: 23 48.459 2.400 0.993 0.828 0.955 0.682 CA 1.703 23 residues pruned to eliminate duplicates 6 1.790 1.356 1.041 0.276 0.800 0.600 CB 0.466 ? Z: 50 37.852 2.176 0.589 0.637 0.898 0.633 CB 1.532 50 residues pruned to eliminate duplicates Z: 7 3.393 1.859 0.231 0.734 0.500 0.500 CA 0.981 7 residues pruned to eliminate duplicates Z: 52 29.733 2.167 0.630 0.504 0.843 0.647 CB 1.392 52 residues pruned to eliminate duplicates Z: 13 16.897 1.713 0.895 0.929 1.000 0.833 CB 1.051 13 residues pruned to eliminate duplicates Z: 15 27.678 1.889 1.083 0.932 1.000 0.500 CB 1.313 15 residues pruned to eliminate duplicates Z: 8 5.186 1.626 -0.076 0.889 1.000 0.571 CB 0.939 8 residues pruned to eliminate duplicates Z: 11 10.687 2.107 0.563 0.377 0.800 0.600 CB 1.463 11 residues pruned to eliminate duplicates Z: 12 16.521 2.145 0.879 0.521 0.818 0.545 CB 1.480 12 residues pruned to eliminate duplicates Z: 90 86.034 2.435 0.860 0.704 0.944 0.742 CB 1.772 90 residues pruned to eliminate duplicates Z: 19 24.650 2.117 0.803 0.596 1.000 0.667 CB 1.390 19 residues pruned to eliminate duplicates Z: 43 33.196 2.140 0.719 0.488 0.952 0.548 CB 1.480 43 residues pruned to eliminate duplicates Z: 25 53.013 2.332 1.203 0.908 0.917 0.500 CB 1.632 25 residues pruned to eliminate duplicates Z: 16 28.423 2.171 0.600 0.901 1.000 0.867 CB 1.508 16 residues pruned to eliminate duplicates Z: 39 40.698 2.276 0.893 0.585 1.000 0.684 CB 1.412 39 residues pruned to eliminate duplicates Z: 32 26.789 1.928 0.682 0.657 0.935 0.581 CB 1.371 32 residues pruned to eliminate duplicates Z: 21 42.888 2.464 0.730 0.878 0.950 0.750 CB 1.719 21 residues pruned to eliminate duplicates Z: 9 7.289 1.736 0.024 0.844 1.000 1.000 CB 1.079 8 residues pruned to eliminate duplicates Z: 25 62.218 2.370 1.248 0.927 1.000 0.583 CB 1.671 25 residues pruned to eliminate duplicates Z: 15 17.840 2.268 0.718 0.401 0.857 0.500 CB 1.585 15 residues pruned to eliminate duplicates Z: 30 18.266 2.119 0.470 0.475 0.897 0.586 CB 1.246 30 residues pruned to eliminate duplicates Z: 21 44.053 2.445 0.731 0.855 0.950 0.700 CA 1.808 21 residues pruned to eliminate duplicates Z: 17 37.864 2.265 1.165 0.877 0.875 0.625 CA 1.602 17 residues pruned to eliminate duplicates Z: 10 6.837 1.729 0.229 0.518 0.889 0.556 CB 1.186 8 residues pruned to eliminate duplicates Z: 18 30.584 2.380 0.866 0.592 0.941 0.706 CB 1.626 18 residues pruned to eliminate duplicates Z: 59 75.560 2.528 1.012 0.663 0.948 0.655 CB 1.769 59 residues pruned to eliminate duplicates Z: 10 7.550 2.011 0.186 0.636 0.889 0.444 CB 1.045 10 residues pruned to eliminate duplicates Z: 21 54.188 2.291 1.503 0.898 0.900 0.350 CB 1.680 21 residues pruned to eliminate duplicates Z: 32 35.832 2.254 0.744 0.714 1.000 0.774 CB 1.349 32 residues pruned to eliminate duplicates Z: 9 21.416 2.319 0.440 0.812 1.000 0.625 CA 1.729 9 residues pruned to eliminate duplicates Z: 23 28.961 2.170 0.610 0.659 1.000 0.682 CB 1.525 23 residues pruned to eliminate duplicates Z: 32 54.579 2.327 0.783 0.902 0.968 0.806 CB 1.741 32 residues pruned to eliminate duplicates Z: 7 6.372 2.031 0.621 0.137 1.000 0.500 CB 1.241 7 residues pruned to eliminate duplicates Z: 7 6.656 1.809 0.144 0.793 1.000 0.333 CB 1.015 7 residues pruned to eliminate duplicates Z: 23 19.463 1.735 0.779 0.701 0.909 0.455 CB 1.232 23 residues pruned to eliminate duplicates Z: 10 12.327 2.101 0.408 0.516 1.000 0.667 CB 1.368 10 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 35 31.130 2.115 0.968 0.559 0.882 0.588 CB 1.373 35 residues pruned to eliminate duplicates Z: 38 28.241 2.103 0.869 0.540 0.838 0.622 CB 1.355 38 residues pruned to eliminate duplicates 6 1.402 1.569 -0.084 0.129 0.800 0.000 CB 0.867 ? Z: 20 24.653 2.118 0.694 0.541 1.000 0.737 CB 1.514 20 residues pruned to eliminate duplicates Z: 21 20.578 2.089 0.582 0.520 0.900 0.750 CB 1.517 21 residues pruned to eliminate duplicates Z: 19 26.077 2.222 0.598 0.574 1.000 0.611 CB 1.612 19 residues pruned to eliminate duplicates Z: 21 19.858 2.064 0.564 0.515 0.900 0.650 CB 1.506 21 residues pruned to eliminate duplicates Z: 19 21.352 2.214 0.456 0.574 0.889 0.722 CB 1.636 19 residues pruned to eliminate duplicates Z: 22 16.924 1.977 0.420 0.508 0.857 0.667 CB 1.522 22 residues pruned to eliminate duplicates Z: 21 20.092 2.079 0.477 0.550 0.900 0.650 CB 1.548 21 residues pruned to eliminate duplicates Z: 19 26.540 2.182 0.628 0.593 1.000 0.667 CB 1.610 20 residues pruned to eliminate duplicates Z: 19 25.391 2.204 0.637 0.595 0.944 0.722 CB 1.604 19 residues pruned to eliminate duplicates Z: 19 22.612 2.186 0.530 0.623 0.889 0.667 CA 1.596 19 residues pruned to eliminate duplicates Z: 20 20.798 2.151 0.642 0.552 0.895 0.737 CB 1.435 20 residues pruned to eliminate duplicates Z: 18 25.116 2.235 0.547 0.600 1.000 0.824 CB 1.601 18 residues pruned to eliminate duplicates Z: 28 18.328 1.990 0.536 0.506 0.926 0.556 CB 1.238 30 residues pruned to eliminate duplicates Z: 13 29.223 2.266 0.934 0.736 1.000 0.667 CB 1.557 13 residues pruned to eliminate duplicates Z: 19 23.112 2.191 0.523 0.573 0.944 0.611 CB 1.611 19 residues pruned to eliminate duplicates Z: 19 21.560 2.202 0.422 0.584 0.944 0.778 CB 1.585 19 residues pruned to eliminate duplicates Z: 11 10.199 1.907 0.304 0.616 0.900 0.600 CB 1.291 16 residues pruned to eliminate duplicates Z: 7 9.669 1.815 0.198 0.865 1.000 0.667 CB 1.330 7 residues pruned to eliminate duplicates Z: 33 17.808 1.881 0.384 0.554 0.938 0.562 CB 1.224 33 residues pruned to eliminate duplicates Z: 16 15.251 1.857 0.447 0.714 1.000 0.733 CB 1.208 16 residues pruned to eliminate duplicates Z: 8 9.907 1.871 0.198 0.891 1.000 0.714 CB 1.201 8 residues pruned to eliminate duplicates Z: 19 11.903 1.719 0.336 0.718 1.000 0.833 CB 1.003 19 residues pruned to eliminate duplicates Z: 36 17.216 1.888 0.432 0.505 0.886 0.543 CB 1.209 36 residues pruned to eliminate duplicates Z: 71 46.496 2.168 0.739 0.567 0.929 0.600 CB 1.489 71 residues pruned to eliminate duplicates Z: 8 9.477 1.740 0.896 0.587 1.000 0.429 CB 0.999 8 residues pruned to eliminate duplicates Z: 37 20.372 1.921 0.496 0.586 0.917 0.694 CB 1.188 37 residues pruned to eliminate duplicates Z: 73 48.898 2.195 0.803 0.589 0.931 0.611 CB 1.436 73 residues pruned to eliminate duplicates Z: 18 14.109 1.787 0.498 0.705 1.000 0.706 CB 1.061 18 residues pruned to eliminate duplicates Z: 30 17.272 1.863 0.491 0.597 0.897 0.586 CB 1.175 30 residues pruned to eliminate duplicates Z: 18 14.423 1.790 0.403 0.704 1.000 0.706 CB 1.156 18 residues pruned to eliminate duplicates Z: 19 12.988 1.767 0.405 0.677 0.944 0.611 CB 1.109 19 residues pruned to eliminate duplicates Z: 31 18.144 1.874 0.495 0.590 0.900 0.667 CB 1.205 31 residues pruned to eliminate duplicates Z: 78 47.939 2.180 0.677 0.583 0.961 0.584 CB 1.436 78 residues pruned to eliminate duplicates Z: 36 15.935 1.844 0.443 0.531 0.914 0.657 CB 1.074 36 residues pruned to eliminate duplicates Z: 30 19.775 1.882 0.497 0.619 0.966 0.690 CB 1.207 30 residues pruned to eliminate duplicates Z: 13 12.921 1.890 0.413 0.651 1.000 0.667 CB 1.214 13 residues pruned to eliminate duplicates Z: 20 16.528 2.071 0.467 0.502 0.947 0.632 CB 1.314 20 residues pruned to eliminate duplicates Z: 38 22.056 1.858 0.535 0.562 0.973 0.622 CB 1.231 38 residues pruned to eliminate duplicates Z: 38 17.862 1.856 0.355 0.577 0.946 0.568 CB 1.147 38 residues pruned to eliminate duplicates Z: 31 17.894 1.823 0.404 0.662 0.967 0.633 CB 1.136 31 residues pruned to eliminate duplicates Z: 66 38.150 2.140 0.589 0.551 0.892 0.585 CB 1.484 66 residues pruned to eliminate duplicates Z: 37 18.571 1.899 0.384 0.543 0.917 0.639 CB 1.231 37 residues pruned to eliminate duplicates Z: 36 21.268 1.948 0.478 0.586 0.943 0.714 CB 1.220 36 residues pruned to eliminate duplicates Z: 36 18.910 1.945 0.363 0.588 0.886 0.686 CB 1.252 36 residues pruned to eliminate duplicates Z: 20 15.058 2.016 0.308 0.491 0.947 0.579 CB 1.395 20 residues pruned to eliminate duplicates Z: 20 15.838 2.113 0.495 0.467 0.947 0.474 CB 1.256 20 residues pruned to eliminate duplicates Z: 37 23.990 1.964 0.502 0.600 0.972 0.639 CB 1.267 37 residues pruned to eliminate duplicates Z: 38 19.370 1.902 0.352 0.615 0.973 0.703 CB 1.141 38 residues pruned to eliminate duplicates Z: 18 13.808 2.106 0.406 0.506 0.882 0.471 CB 1.274 18 residues pruned to eliminate duplicates Z: 13 12.347 2.186 0.465 0.410 0.917 0.417 CB 1.334 13 residues pruned to eliminate duplicates Z: 74 50.434 2.179 0.767 0.592 0.959 0.534 CB 1.464 74 residues pruned to eliminate duplicates Z: 9 14.681 2.028 0.878 0.543 1.000 0.750 CB 1.307 9 residues pruned to eliminate duplicates Z: 55 51.747 2.352 0.804 0.573 0.963 0.481 CB 1.606 55 residues pruned to eliminate duplicates Z: 70 36.911 2.081 0.671 0.527 0.957 0.609 CB 1.300 70 residues pruned to eliminate duplicates Z: 76 41.849 2.115 0.642 0.573 0.920 0.507 CB 1.409 76 residues pruned to eliminate duplicates Z: 76 57.246 2.290 0.803 0.565 0.947 0.600 CB 1.587 76 residues pruned to eliminate duplicates Z: 72 47.085 2.220 0.673 0.580 0.944 0.592 CB 1.477 72 residues pruned to eliminate duplicates Z: 74 50.330 2.222 0.744 0.576 0.945 0.575 CB 1.494 74 residues pruned to eliminate duplicates Z: 56 47.609 2.292 0.764 0.594 0.909 0.545 CB 1.596 56 residues pruned to eliminate duplicates Z: 59 58.476 2.374 0.804 0.644 0.948 0.621 CB 1.652 59 residues pruned to eliminate duplicates Z: 75 49.239 2.181 0.807 0.581 0.946 0.568 CB 1.421 75 residues pruned to eliminate duplicates Z: 61 38.886 2.127 0.605 0.593 0.983 0.717 CB 1.369 61 residues pruned to eliminate duplicates Z: 63 41.430 2.123 0.678 0.613 0.968 0.629 CB 1.371 63 residues pruned to eliminate duplicates Z: 43 41.150 2.314 0.740 0.606 0.952 0.643 CB 1.497 43 residues pruned to eliminate duplicates Z: 67 41.539 2.135 0.735 0.593 0.924 0.652 CB 1.367 67 residues pruned to eliminate duplicates Z: 74 49.242 2.209 0.760 0.583 0.932 0.630 CB 1.469 74 residues pruned to eliminate duplicates Z: 31 42.078 2.366 0.914 0.594 1.000 0.533 CB 1.551 31 residues pruned to eliminate duplicates Z: 35 68.738 2.521 1.095 0.678 1.000 0.529 CB 1.894 35 residues pruned to eliminate duplicates Z: 67 58.683 2.303 0.911 0.630 0.939 0.621 CB 1.547 147 residues pruned to eliminate duplicates Z: 23 57.267 2.397 1.283 0.810 0.909 0.682 CA 1.874 23 residues pruned to eliminate duplicates Z: 68 58.111 2.321 0.912 0.620 0.940 0.657 CB 1.519 68 residues pruned to eliminate duplicates Z: 73 50.126 2.187 0.685 0.618 0.986 0.681 CB 1.455 73 residues pruned to eliminate duplicates Z: 48 49.266 2.409 0.714 0.585 0.957 0.532 CB 1.675 48 residues pruned to eliminate duplicates Z: 45 45.951 2.332 0.792 0.548 0.955 0.636 CB 1.657 45 residues pruned to eliminate duplicates Z: 71 41.533 2.161 0.591 0.595 0.900 0.686 CB 1.465 71 residues pruned to eliminate duplicates Z: 74 43.808 2.189 0.562 0.579 0.945 0.644 CB 1.471 74 residues pruned to eliminate duplicates Z: 35 60.941 2.498 0.823 0.689 1.000 0.765 CB 1.932 35 residues pruned to eliminate duplicates Z: 42 60.192 2.468 0.900 0.629 1.000 0.683 CB 1.776 42 residues pruned to eliminate duplicates Z: 43 52.346 2.433 0.822 0.617 0.952 0.643 CB 1.712 43 residues pruned to eliminate duplicates Z: 43 53.921 2.454 0.801 0.602 0.976 0.667 CB 1.751 43 residues pruned to eliminate duplicates Z: 55 48.916 2.344 0.678 0.581 0.963 0.630 CB 1.626 55 residues pruned to eliminate duplicates Z: 36 58.558 2.464 0.862 0.663 0.971 0.686 CB 1.910 36 residues pruned to eliminate duplicates Z: 37 50.898 2.463 0.823 0.605 0.972 0.667 CB 1.759 37 residues pruned to eliminate duplicates Z: 81 53.613 2.334 0.657 0.564 0.913 0.625 CB 1.597 81 residues pruned to eliminate duplicates Z: 49 45.575 2.399 0.732 0.556 0.938 0.646 CB 1.600 49 residues pruned to eliminate duplicates Z: 32 32.063 2.258 0.699 0.559 0.903 0.645 CB 1.570 32 residues pruned to eliminate duplicates Z: 40 24.057 2.051 0.532 0.495 0.872 0.590 CB 1.414 40 residues pruned to eliminate duplicates Z: 17 22.552 2.185 0.291 0.756 0.938 0.688 CB 1.698 17 residues pruned to eliminate duplicates Z: 17 25.566 2.191 0.420 0.811 1.000 0.812 CB 1.567 17 residues pruned to eliminate duplicates Z: 16 31.626 2.296 0.526 0.874 1.000 0.933 CB 1.696 16 residues pruned to eliminate duplicates Z: 43 35.804 2.253 0.710 0.611 0.881 0.643 CB 1.465 43 residues pruned to eliminate duplicates Z: 46 40.347 2.251 0.708 0.564 0.956 0.444 CB 1.539 46 residues pruned to eliminate duplicates Z: 75 65.960 2.289 0.680 0.720 0.959 0.730 CB 1.704 75 residues pruned to eliminate duplicates Z: 123 73.737 2.358 0.736 0.583 0.926 0.574 CB 1.626 123 residues pruned to eliminate duplicates Z: 43 33.754 2.223 0.702 0.507 0.905 0.476 CB 1.511 43 residues pruned to eliminate duplicates Z: 50 59.268 2.428 0.770 0.708 0.939 0.592 CB 1.737 50 residues pruned to eliminate duplicates Z: 31 37.726 2.305 0.782 0.616 0.933 0.733 CB 1.610 31 residues pruned to eliminate duplicates Z: 42 45.318 2.295 0.967 0.531 0.927 0.488 CB 1.640 42 residues pruned to eliminate duplicates Z: 32 37.658 2.255 0.831 0.582 0.968 0.677 CB 1.565 32 residues pruned to eliminate duplicates Z: 44 43.044 2.326 0.793 0.566 0.907 0.512 CB 1.628 44 residues pruned to eliminate duplicates Z: 32 33.004 2.245 0.789 0.590 0.871 0.613 CB 1.554 32 residues pruned to eliminate duplicates Z: 32 34.319 2.279 0.874 0.585 0.839 0.548 CB 1.585 32 residues pruned to eliminate duplicates Z: 49 49.072 2.375 0.825 0.576 0.917 0.500 CB 1.656 49 residues pruned to eliminate duplicates Z: 16 16.950 2.156 0.784 0.350 0.933 0.467 CB 1.434 16 residues pruned to eliminate duplicates Z: 15 17.906 2.165 0.861 0.377 0.857 0.643 CB 1.580 15 residues pruned to eliminate duplicates Z: 33 33.609 2.241 0.838 0.620 0.875 0.750 CB 1.471 33 residues pruned to eliminate duplicates Z: 31 36.236 2.278 0.765 0.630 0.900 0.633 CB 1.618 31 residues pruned to eliminate duplicates Z: 22 15.666 1.934 0.690 0.301 0.857 0.476 CB 1.522 22 residues pruned to eliminate duplicates Z: 42 39.825 2.232 0.843 0.542 0.902 0.415 CB 1.608 42 residues pruned to eliminate duplicates Z: 67 63.958 2.381 0.850 0.631 0.924 0.652 CB 1.710 67 residues pruned to eliminate duplicates Z: 55 42.102 2.252 0.741 0.538 0.889 0.611 CB 1.583 55 residues pruned to eliminate duplicates Z: 105 60.068 2.214 0.686 0.608 0.942 0.644 CB 1.511 105 residues pruned to eliminate duplicates Z: 39 32.269 2.161 0.690 0.528 0.868 0.605 CB 1.605 39 residues pruned to eliminate duplicates Z: 102 52.896 2.197 0.626 0.581 0.921 0.614 CB 1.480 102 residues pruned to eliminate duplicates Z: 108 63.213 2.325 0.685 0.575 0.907 0.626 CB 1.602 108 residues pruned to eliminate duplicates Z: 72 51.211 2.286 0.686 0.583 0.915 0.648 CB 1.590 72 residues pruned to eliminate duplicates Z: 25 26.406 2.158 0.555 0.635 0.958 0.667 CB 1.476 25 residues pruned to eliminate duplicates Z: 79 59.428 2.360 0.721 0.614 0.897 0.603 CB 1.657 79 residues pruned to eliminate duplicates Z: 15 27.685 2.308 0.578 0.758 0.929 0.714 CB 1.739 15 residues pruned to eliminate duplicates Z: 42 32.342 2.238 0.528 0.556 0.927 0.488 CB 1.510 42 residues pruned to eliminate duplicates Z: 72 54.971 2.368 0.691 0.600 0.958 0.521 CB 1.546 72 residues pruned to eliminate duplicates Z: 28 25.719 2.127 0.620 0.637 0.926 0.630 CB 1.365 28 residues pruned to eliminate duplicates Z: 107 73.281 2.322 0.783 0.615 0.934 0.594 CB 1.650 107 residues pruned to eliminate duplicates Z: 66 46.190 2.285 0.592 0.508 0.969 0.615 CB 1.611 66 residues pruned to eliminate duplicates Z: 115 57.772 2.201 0.613 0.612 0.921 0.649 CB 1.488 115 residues pruned to eliminate duplicates Z: 45 44.013 2.316 0.667 0.661 0.932 0.682 CB 1.589 45 residues pruned to eliminate duplicates Z: 57 42.483 2.241 0.740 0.540 0.911 0.625 CB 1.537 57 residues pruned to eliminate duplicates Z: 82 48.936 2.278 0.660 0.490 0.914 0.617 CB 1.591 82 residues pruned to eliminate duplicates Z: 42 34.815 2.223 0.598 0.592 0.927 0.659 CB 1.513 42 residues pruned to eliminate duplicates Z: 92 66.560 2.353 0.700 0.590 0.956 0.670 CB 1.674 92 residues pruned to eliminate duplicates Z: 43 43.203 2.240 0.745 0.601 0.952 0.595 CB 1.626 43 residues pruned to eliminate duplicates Z: 146 72.127 2.248 0.699 0.599 0.945 0.662 CB 1.510 146 residues pruned to eliminate duplicates Z: 37 28.255 1.987 0.698 0.591 0.944 0.611 CB 1.355 37 residues pruned to eliminate duplicates Z: 39 24.685 1.980 0.779 0.528 0.895 0.553 CB 1.236 39 residues pruned to eliminate duplicates Z: 36 26.610 2.005 0.659 0.562 0.943 0.543 CB 1.350 36 residues pruned to eliminate duplicates Z: 36 27.739 2.051 0.672 0.568 0.943 0.543 CB 1.358 36 residues pruned to eliminate duplicates Z: 36 28.703 2.066 0.677 0.559 0.971 0.571 CB 1.361 36 residues pruned to eliminate duplicates Z: 36 24.767 2.034 0.602 0.547 0.914 0.514 CB 1.342 36 residues pruned to eliminate duplicates Z: 38 26.961 1.970 0.700 0.554 0.919 0.622 CB 1.366 38 residues pruned to eliminate duplicates Z: 37 29.980 1.972 0.779 0.598 0.972 0.611 CB 1.334 37 residues pruned to eliminate duplicates Z: 36 28.643 2.055 0.684 0.564 0.971 0.686 CB 1.354 36 residues pruned to eliminate duplicates Z: 37 27.900 2.010 0.717 0.550 0.944 0.639 CB 1.358 37 residues pruned to eliminate duplicates Z: 36 27.475 2.066 0.639 0.563 0.943 0.657 CB 1.368 36 residues pruned to eliminate duplicates Z: 36 28.204 2.065 0.713 0.551 0.943 0.571 CB 1.361 36 residues pruned to eliminate duplicates Z: 36 28.128 2.061 0.635 0.560 0.971 0.600 CB 1.370 36 residues pruned to eliminate duplicates Z: 36 26.383 2.054 0.616 0.547 0.943 0.600 CB 1.361 36 residues pruned to eliminate duplicates Z: 37 25.942 1.992 0.644 0.554 0.944 0.528 CB 1.326 37 residues pruned to eliminate duplicates Z: 38 28.355 1.984 0.674 0.547 0.973 0.622 CB 1.378 38 residues pruned to eliminate duplicates Z: 36 26.513 2.049 0.640 0.553 0.971 0.571 CB 1.303 36 residues pruned to eliminate duplicates Z: 29 30.179 2.169 0.752 0.538 0.964 0.607 CB 1.499 29 residues pruned to eliminate duplicates Z: 36 25.372 2.043 0.577 0.563 0.971 0.686 CB 1.290 36 residues pruned to eliminate duplicates Z: 36 27.212 2.049 0.674 0.562 0.971 0.743 CB 1.300 36 residues pruned to eliminate duplicates Z: 29 26.049 2.205 0.694 0.481 0.929 0.607 CB 1.446 29 residues pruned to eliminate duplicates Z: 35 26.733 2.072 0.709 0.550 0.912 0.647 CB 1.352 35 residues pruned to eliminate duplicates Z: 36 28.466 2.054 0.681 0.563 0.971 0.600 CB 1.350 36 residues pruned to eliminate duplicates Z: 36 26.601 2.040 0.587 0.573 0.971 0.629 CB 1.332 36 residues pruned to eliminate duplicates Z: 37 27.322 2.047 0.626 0.597 0.972 0.667 CB 1.283 37 residues pruned to eliminate duplicates Z: 68 61.856 2.477 0.803 0.603 0.881 0.642 CB 1.741 68 residues pruned to eliminate duplicates Z: 29 44.088 2.526 0.661 0.694 0.964 0.571 CB 1.725 29 residues pruned to eliminate duplicates Z: 36 47.397 2.536 0.740 0.635 0.886 0.543 CB 1.806 36 residues pruned to eliminate duplicates Z: 64 55.315 2.425 0.740 0.561 0.905 0.571 CB 1.720 64 residues pruned to eliminate duplicates Z: 104 62.179 2.316 0.681 0.585 0.932 0.621 CB 1.555 104 residues pruned to eliminate duplicates Z: 68 65.872 2.453 0.804 0.610 0.940 0.597 CB 1.742 68 residues pruned to eliminate duplicates Z: 67 57.718 2.391 0.800 0.564 0.955 0.576 CB 1.625 67 residues pruned to eliminate duplicates Z: 79 62.620 2.359 0.908 0.585 0.885 0.641 CB 1.640 79 residues pruned to eliminate duplicates Z: 36 58.461 2.599 0.814 0.648 0.943 0.571 CB 1.936 36 residues pruned to eliminate duplicates Z: 36 57.692 2.516 0.850 0.661 0.943 0.714 CB 1.914 36 residues pruned to eliminate duplicates Z: 151 103.897 2.469 0.848 0.639 0.933 0.667 CB 1.750 151 residues pruned to eliminate duplicates Z: 75 53.821 2.296 0.659 0.591 0.959 0.662 CB 1.570 75 residues pruned to eliminate duplicates Z: 67 67.420 2.484 0.792 0.605 0.939 0.652 CB 1.796 67 residues pruned to eliminate duplicates Z: 37 55.181 2.509 0.833 0.638 0.944 0.611 CB 1.861 37 residues pruned to eliminate duplicates Z: 36 57.474 2.572 0.768 0.648 0.971 0.657 CB 1.915 36 residues pruned to eliminate duplicates Z: 35 62.215 2.579 0.818 0.660 1.000 0.618 CB 1.962 35 residues pruned to eliminate duplicates Z: 36 58.260 2.581 0.775 0.638 0.971 0.543 CB 1.943 36 residues pruned to eliminate duplicates Z: 37 47.113 2.519 0.614 0.651 0.944 0.611 CB 1.776 37 residues pruned to eliminate duplicates Z: 74 55.070 2.288 0.718 0.606 0.973 0.644 CB 1.525 74 residues pruned to eliminate duplicates Z: 38 54.788 2.505 0.727 0.629 1.000 0.622 CB 1.844 38 residues pruned to eliminate duplicates Z: 70 65.761 2.448 0.819 0.590 0.928 0.594 CB 1.758 70 residues pruned to eliminate duplicates Z: 67 64.275 2.479 0.734 0.623 0.909 0.591 CB 1.802 67 residues pruned to eliminate duplicates Z: 35 64.306 2.606 0.788 0.692 1.000 0.735 CB 1.986 35 residues pruned to eliminate duplicates Z: 36 52.944 2.547 0.621 0.671 0.971 0.686 CB 1.906 36 residues pruned to eliminate duplicates Z: 14 24.645 2.376 0.806 0.533 0.923 0.615 CA 1.669 14 residues pruned to eliminate duplicates Z: 37 48.424 2.552 0.526 0.628 0.972 0.611 CB 1.890 37 residues pruned to eliminate duplicates Z: 44 47.727 2.413 0.870 0.537 0.884 0.558 CB 1.761 44 residues pruned to eliminate duplicates Z: 90 59.832 2.294 0.634 0.616 0.966 0.697 CB 1.568 97 residues pruned to eliminate duplicates Z: 67 67.479 2.497 0.784 0.609 0.939 0.621 CB 1.790 67 residues pruned to eliminate duplicates Z: 42 44.080 2.406 0.868 0.508 0.878 0.512 CB 1.731 42 residues pruned to eliminate duplicates Z: 65 63.074 2.490 0.722 0.613 0.906 0.578 CB 1.823 65 residues pruned to eliminate duplicates Z: 35 55.029 2.579 0.747 0.648 0.941 0.559 CB 1.939 35 residues pruned to eliminate duplicates Z: 44 49.329 2.401 0.819 0.560 0.907 0.512 CB 1.792 44 residues pruned to eliminate duplicates Z: 37 52.425 2.580 0.679 0.603 0.972 0.583 CB 1.880 37 residues pruned to eliminate duplicates Z: 44 45.867 2.402 0.781 0.564 0.907 0.512 CB 1.694 44 residues pruned to eliminate duplicates Z: 67 65.344 2.463 0.699 0.623 0.955 0.682 CB 1.793 67 residues pruned to eliminate duplicates Z: 52 69.745 2.507 0.779 0.685 0.980 0.647 CB 1.885 52 residues pruned to eliminate duplicates Z: 30 46.154 2.391 0.694 0.675 1.000 0.621 CB 1.801 30 residues pruned to eliminate duplicates Z: 105 57.885 2.308 0.585 0.570 0.942 0.615 CB 1.539 105 residues pruned to eliminate duplicates Z: 109 59.219 2.272 0.664 0.550 0.907 0.546 CB 1.582 109 residues pruned to eliminate duplicates Z: 65 60.074 2.377 0.867 0.580 0.891 0.625 CB 1.758 65 residues pruned to eliminate duplicates Z: 35 33.507 2.221 0.862 0.572 0.853 0.618 CB 1.519 35 residues pruned to eliminate duplicates Z: 66 62.169 2.468 0.671 0.621 0.923 0.569 CB 1.808 66 residues pruned to eliminate duplicates Z: 50 53.671 2.370 0.771 0.607 0.898 0.592 CB 1.837 50 residues pruned to eliminate duplicates Z: 103 65.297 2.313 0.722 0.586 0.951 0.627 CB 1.573 103 residues pruned to eliminate duplicates Z: 32 40.139 2.336 0.797 0.595 0.935 0.645 CB 1.677 32 residues pruned to eliminate duplicates Z: 56 52.369 2.306 0.854 0.614 0.945 0.618 CB 1.568 56 residues pruned to eliminate duplicates Z: 41 41.547 2.373 0.792 0.509 0.900 0.625 CB 1.702 41 residues pruned to eliminate duplicates Z: 68 62.793 2.467 0.782 0.571 0.940 0.657 CB 1.732 68 residues pruned to eliminate duplicates Z: 103 59.567 2.287 0.732 0.576 0.902 0.598 CB 1.535 103 residues pruned to eliminate duplicates Z: 33 34.084 2.247 0.729 0.565 0.906 0.562 CB 1.607 33 residues pruned to eliminate duplicates Z: 69 65.376 2.445 0.811 0.590 0.926 0.574 CB 1.773 69 residues pruned to eliminate duplicates Z: 66 63.565 2.481 0.749 0.610 0.908 0.569 CB 1.804 66 residues pruned to eliminate duplicates Z: 33 30.347 2.254 0.647 0.564 0.844 0.594 CB 1.610 33 residues pruned to eliminate duplicates Z: 35 35.017 2.276 0.796 0.573 0.882 0.618 CB 1.552 35 residues pruned to eliminate duplicates Z: 42 44.024 2.403 0.858 0.523 0.854 0.561 CB 1.764 42 residues pruned to eliminate duplicates Z: 34 35.256 2.291 0.826 0.551 0.879 0.606 CB 1.589 34 residues pruned to eliminate duplicates Z: 65 63.921 2.417 0.765 0.592 0.953 0.578 CB 1.799 65 residues pruned to eliminate duplicates Z: 35 34.412 2.266 0.815 0.559 0.824 0.559 CB 1.645 35 residues pruned to eliminate duplicates Z: 39 35.053 2.215 0.795 0.565 0.842 0.579 CB 1.596 39 residues pruned to eliminate duplicates Z: 48 44.962 2.360 0.800 0.533 0.872 0.511 CB 1.714 48 residues pruned to eliminate duplicates Z: 34 39.198 2.287 0.758 0.616 0.939 0.576 CB 1.619 34 residues pruned to eliminate duplicates Z: 35 37.825 2.300 0.868 0.589 0.882 0.588 CB 1.572 35 residues pruned to eliminate duplicates Z: 13 16.821 2.114 0.625 0.501 1.000 0.417 CB 1.413 13 residues pruned to eliminate duplicates Z: 35 39.166 2.288 0.765 0.627 0.912 0.647 CB 1.619 35 residues pruned to eliminate duplicates Z: 40 45.110 2.402 0.836 0.556 0.897 0.590 CB 1.729 40 residues pruned to eliminate duplicates Z: 58 51.591 2.288 0.897 0.611 0.930 0.596 CB 1.524 58 residues pruned to eliminate duplicates Z: 98 70.122 2.425 0.786 0.595 0.918 0.649 CB 1.636 98 residues pruned to eliminate duplicates Z: 55 49.600 2.310 0.904 0.615 0.907 0.630 CB 1.517 55 residues pruned to eliminate duplicates Z: 25 34.863 2.233 1.015 0.656 0.958 0.625 CB 1.428 25 residues pruned to eliminate duplicates Z: 46 52.247 2.319 0.975 0.646 0.933 0.600 CB 1.590 46 residues pruned to eliminate duplicates Z: 24 32.467 2.265 0.808 0.655 0.957 0.609 CB 1.497 24 residues pruned to eliminate duplicates Z: 53 53.375 2.364 0.965 0.586 0.904 0.654 CB 1.624 53 residues pruned to eliminate duplicates Z: 41 39.862 2.305 0.975 0.536 0.925 0.600 CB 1.445 41 residues pruned to eliminate duplicates Z: 25 33.426 2.217 0.771 0.663 0.958 0.583 CB 1.559 25 residues pruned to eliminate duplicates Z: 25 33.877 2.199 0.901 0.643 0.958 0.625 CB 1.511 25 residues pruned to eliminate duplicates Z: 14 28.478 2.358 0.912 0.808 0.923 0.692 CB 1.451 14 residues pruned to eliminate duplicates Z: 16 24.340 2.283 0.673 0.732 0.867 0.733 CB 1.541 16 residues pruned to eliminate duplicates Z: 90 72.710 2.425 0.760 0.632 0.933 0.584 CB 1.711 90 residues pruned to eliminate duplicates Z: 24 31.244 2.173 0.682 0.684 1.000 0.652 CB 1.504 24 residues pruned to eliminate duplicates Z: 33 24.500 1.970 0.754 0.586 0.844 0.562 CB 1.369 33 residues pruned to eliminate duplicates Z: 24 34.860 2.262 0.738 0.702 1.000 0.696 CB 1.538 24 residues pruned to eliminate duplicates Z: 90 74.537 2.418 0.786 0.631 0.944 0.629 CB 1.714 90 residues pruned to eliminate duplicates Z: 12 14.127 2.028 0.608 0.479 0.909 0.455 CB 1.468 12 residues pruned to eliminate duplicates Z: 26 28.708 2.155 1.019 0.580 0.840 0.560 CB 1.455 26 residues pruned to eliminate duplicates Z: 25 29.143 2.232 0.646 0.697 0.917 0.708 CB 1.476 25 residues pruned to eliminate duplicates Z: 63 51.788 2.349 0.726 0.601 0.903 0.629 CB 1.631 63 residues pruned to eliminate duplicates Z: 32 32.034 2.126 0.673 0.620 0.935 0.645 CB 1.544 42 residues pruned to eliminate duplicates Z: 56 48.746 2.311 0.865 0.599 0.909 0.545 CB 1.527 56 residues pruned to eliminate duplicates Z: 44 37.451 2.203 0.699 0.623 0.930 0.651 CB 1.461 44 residues pruned to eliminate duplicates Z: 42 34.370 2.178 0.558 0.622 0.976 0.659 CB 1.445 42 residues pruned to eliminate duplicates Z: 41 39.487 2.227 0.667 0.643 0.975 0.650 CB 1.510 41 residues pruned to eliminate duplicates Z: 18 24.364 2.174 0.597 0.687 0.941 0.588 CB 1.523 18 residues pruned to eliminate duplicates Z: 19 20.440 2.168 0.601 0.579 0.889 0.500 CB 1.447 19 residues pruned to eliminate duplicates Z: 18 27.773 2.245 0.826 0.665 0.941 0.647 CB 1.499 18 residues pruned to eliminate duplicates Z: 18 25.233 2.240 0.687 0.637 0.941 0.647 CB 1.514 18 residues pruned to eliminate duplicates Z: 15 20.470 2.202 0.758 0.603 0.857 0.429 CB 1.494 15 residues pruned to eliminate duplicates Z: 19 19.896 2.131 0.792 0.577 0.778 0.500 CB 1.467 19 residues pruned to eliminate duplicates Z: 19 23.023 2.223 0.650 0.598 0.889 0.556 CB 1.516 19 residues pruned to eliminate duplicates Z: 19 25.651 2.196 0.677 0.639 0.944 0.500 CB 1.526 19 residues pruned to eliminate duplicates Z: 20 18.452 2.189 0.556 0.522 0.842 0.632 CB 1.444 20 residues pruned to eliminate duplicates Z: 19 24.409 2.210 0.583 0.613 0.944 0.611 CB 1.564 19 residues pruned to eliminate duplicates Z: 19 22.741 2.231 0.593 0.611 0.944 0.667 CB 1.437 19 residues pruned to eliminate duplicates Z: 19 18.197 2.178 0.335 0.607 0.889 0.611 CB 1.499 19 residues pruned to eliminate duplicates Z: 20 21.333 2.154 0.372 0.563 1.000 0.684 CB 1.558 20 residues pruned to eliminate duplicates Z: 17 21.059 2.274 0.410 0.643 0.938 0.562 CB 1.532 17 residues pruned to eliminate duplicates Z: 27 20.805 2.178 0.421 0.508 0.962 0.577 CB 1.360 27 residues pruned to eliminate duplicates Z: 26 25.000 2.243 0.427 0.556 0.960 0.600 CB 1.541 26 residues pruned to eliminate duplicates Z: 40 26.676 2.019 0.572 0.558 0.872 0.615 CB 1.460 40 residues pruned to eliminate duplicates Z: 10 11.973 2.046 0.247 0.509 1.000 0.444 CB 1.550 10 residues pruned to eliminate duplicates Z: 26 23.285 2.047 0.412 0.695 0.960 0.600 CB 1.405 26 residues pruned to eliminate duplicates Z: 34 22.137 1.957 0.448 0.628 0.879 0.667 CB 1.372 34 residues pruned to eliminate duplicates Z: 33 25.772 2.025 0.465 0.643 0.938 0.688 CB 1.433 33 residues pruned to eliminate duplicates Z: 43 23.167 1.949 0.487 0.515 0.905 0.571 CB 1.343 43 residues pruned to eliminate duplicates Z: 11 9.298 1.936 0.259 0.495 0.900 0.500 CB 1.347 11 residues pruned to eliminate duplicates Z: 42 27.223 2.007 0.590 0.548 0.902 0.732 CB 1.409 42 residues pruned to eliminate duplicates Z: 40 27.391 2.051 0.499 0.588 0.949 0.590 CB 1.382 40 residues pruned to eliminate duplicates Z: 32 25.028 1.985 0.573 0.605 0.935 0.613 CB 1.393 32 residues pruned to eliminate duplicates Z: 31 23.933 1.967 0.592 0.604 0.933 0.567 CB 1.354 31 residues pruned to eliminate duplicates Z: 17 23.241 1.953 0.650 0.868 0.938 0.688 CB 1.405 17 residues pruned to eliminate duplicates Z: 31 26.539 1.975 0.676 0.604 0.933 0.500 CB 1.421 31 residues pruned to eliminate duplicates Z: 18 20.610 1.872 0.631 0.752 0.941 0.706 CB 1.390 18 residues pruned to eliminate duplicates Z: 33 22.243 1.935 0.633 0.580 0.906 0.719 CB 1.271 33 residues pruned to eliminate duplicates Z: 16 27.470 2.009 0.816 0.849 1.000 0.867 CB 1.442 16 residues pruned to eliminate duplicates Z: 25 21.658 1.883 0.755 0.689 0.875 0.667 CB 1.286 25 residues pruned to eliminate duplicates Z: 42 28.262 1.984 0.670 0.536 0.902 0.561 CB 1.425 42 residues pruned to eliminate duplicates Z: 32 30.580 1.993 0.783 0.595 0.968 0.548 CB 1.459 32 residues pruned to eliminate duplicates Z: 17 23.413 1.936 0.897 0.804 0.875 0.625 CB 1.397 17 residues pruned to eliminate duplicates Z: 18 25.368 1.878 0.885 0.811 0.941 0.706 CB 1.409 18 residues pruned to eliminate duplicates Z: 27 21.164 1.841 0.809 0.621 0.885 0.500 CB 1.256 27 residues pruned to eliminate duplicates Z: 33 23.615 1.938 0.732 0.560 0.844 0.375 CB 1.390 33 residues pruned to eliminate duplicates Z: 31 26.419 1.982 0.667 0.579 1.000 0.533 CB 1.353 31 residues pruned to eliminate duplicates Z: 41 28.531 2.016 0.711 0.558 0.875 0.525 CB 1.413 41 residues pruned to eliminate duplicates Z: 31 29.407 1.977 0.708 0.635 0.967 0.667 CB 1.450 31 residues pruned to eliminate duplicates Z: 30 22.934 1.896 0.689 0.611 0.897 0.655 CB 1.335 30 residues pruned to eliminate duplicates Z: 31 25.635 1.980 0.780 0.607 0.900 0.500 CB 1.333 31 residues pruned to eliminate duplicates Z: 42 28.154 2.045 0.695 0.547 0.878 0.585 CB 1.380 42 residues pruned to eliminate duplicates Z: 30 25.411 2.025 0.750 0.592 0.828 0.483 CB 1.473 30 residues pruned to eliminate duplicates Z: 14 12.977 2.023 0.735 0.320 0.769 0.308 CB 1.625 14 residues pruned to eliminate duplicates Z: 50 26.165 1.921 0.574 0.495 0.878 0.531 CB 1.416 50 residues pruned to eliminate duplicates Z: 13 12.342 2.081 0.649 0.331 0.833 0.417 CB 1.499 13 residues pruned to eliminate duplicates Z: 34 22.987 1.929 0.769 0.531 0.879 0.485 CB 1.294 34 residues pruned to eliminate duplicates Z: 32 22.482 1.973 0.507 0.540 0.935 0.645 CB 1.395 32 residues pruned to eliminate duplicates Z: 15 11.960 2.009 0.553 0.310 0.857 0.429 CB 1.476 15 residues pruned to eliminate duplicates Z: 33 23.199 1.959 0.735 0.563 0.875 0.531 CB 1.298 33 residues pruned to eliminate duplicates Z: 30 26.431 2.005 0.745 0.585 0.931 0.448 CB 1.389 30 residues pruned to eliminate duplicates Z: 32 23.848 1.911 0.690 0.595 0.871 0.516 CB 1.390 32 residues pruned to eliminate duplicates Z: 72 45.528 2.126 0.779 0.589 0.901 0.620 CB 1.455 72 residues pruned to eliminate duplicates Z: 51 43.346 2.268 0.785 0.588 0.940 0.740 CB 1.481 51 residues pruned to eliminate duplicates Z: 51 41.744 2.279 0.706 0.592 0.920 0.700 CB 1.511 51 residues pruned to eliminate duplicates Z: 50 45.375 2.305 0.820 0.595 0.918 0.694 CB 1.536 50 residues pruned to eliminate duplicates Z: 52 41.280 2.266 0.758 0.593 0.922 0.608 CB 1.441 52 residues pruned to eliminate duplicates Z: 38 37.278 2.314 0.663 0.608 0.973 0.784 CB 1.478 38 residues pruned to eliminate duplicates Z: 91 58.127 2.353 0.644 0.599 0.922 0.667 CB 1.562 100 residues pruned to eliminate duplicates Z: 37 42.996 2.336 0.843 0.627 0.972 0.750 CB 1.518 37 residues pruned to eliminate duplicates Z: 48 43.604 2.289 0.817 0.596 0.957 0.702 CB 1.457 48 residues pruned to eliminate duplicates Z: 34 39.603 2.303 0.902 0.624 0.939 0.697 CB 1.490 34 residues pruned to eliminate duplicates Z: 51 44.228 2.270 0.868 0.572 0.980 0.620 CB 1.403 51 residues pruned to eliminate duplicates Z: 39 46.423 2.305 1.005 0.617 0.947 0.632 CB 1.540 39 residues pruned to eliminate duplicates Z: 51 45.297 2.290 0.870 0.609 0.920 0.640 CB 1.466 51 residues pruned to eliminate duplicates Z: 39 44.192 2.323 0.998 0.594 0.921 0.526 CB 1.533 39 residues pruned to eliminate duplicates Z: 52 43.142 2.250 0.919 0.572 0.882 0.627 CB 1.479 52 residues pruned to eliminate duplicates Z: 50 46.088 2.299 0.886 0.581 0.939 0.612 CB 1.496 50 residues pruned to eliminate duplicates Z: 39 44.636 2.273 1.034 0.606 0.947 0.711 CB 1.495 39 residues pruned to eliminate duplicates Z: 61 50.106 2.261 0.903 0.583 0.950 0.617 CB 1.461 61 residues pruned to eliminate duplicates Z: 36 45.416 2.293 1.036 0.638 0.971 0.686 CB 1.488 36 residues pruned to eliminate duplicates Z: 37 46.330 2.354 0.973 0.605 0.972 0.583 CB 1.547 37 residues pruned to eliminate duplicates Z: 36 44.505 2.247 1.075 0.625 0.971 0.629 CB 1.476 36 residues pruned to eliminate duplicates Z: 40 44.412 2.274 1.035 0.599 0.923 0.487 CB 1.515 40 residues pruned to eliminate duplicates Z: 34 49.803 2.333 1.159 0.668 0.970 0.667 CB 1.519 34 residues pruned to eliminate duplicates Z: 39 37.556 2.242 1.059 0.563 0.895 0.579 CB 1.389 39 residues pruned to eliminate duplicates Z: 149 96.036 2.410 0.849 0.656 0.919 0.689 CB 1.668 149 residues pruned to eliminate duplicates Z: 35 48.808 2.357 0.946 0.663 1.000 0.676 CB 1.569 35 residues pruned to eliminate duplicates Z: 49 48.727 2.319 0.841 0.610 0.979 0.708 CB 1.516 49 residues pruned to eliminate duplicates Z: 39 40.997 2.307 0.895 0.614 0.921 0.632 CB 1.482 39 residues pruned to eliminate duplicates Z: 34 47.601 2.326 1.050 0.681 0.970 0.758 CB 1.518 34 residues pruned to eliminate duplicates Z: 49 35.321 2.200 0.680 0.545 0.938 0.688 CB 1.409 49 residues pruned to eliminate duplicates Z: 51 43.354 2.280 0.849 0.575 0.920 0.560 CB 1.471 51 residues pruned to eliminate duplicates Z: 38 46.850 2.322 0.943 0.623 0.973 0.730 CB 1.563 38 residues pruned to eliminate duplicates Z: 39 42.432 2.309 0.933 0.594 1.000 0.658 CB 1.409 39 residues pruned to eliminate duplicates Z: 39 45.098 2.273 1.051 0.623 0.947 0.579 CB 1.475 39 residues pruned to eliminate duplicates Z: 10 6.370 2.142 0.381 0.236 0.778 0.444 CB 1.253 10 residues pruned to eliminate duplicates Z: 92 48.790 2.159 0.792 0.547 0.890 0.637 CB 1.418 92 residues pruned to eliminate duplicates Z: 38 49.077 2.338 1.044 0.619 0.973 0.622 CB 1.550 38 residues pruned to eliminate duplicates Z: 157 87.762 2.383 0.783 0.622 0.904 0.686 CB 1.630 157 residues pruned to eliminate duplicates Z: 56 42.953 2.233 0.847 0.584 0.927 0.673 CB 1.397 56 residues pruned to eliminate duplicates Z: 59 40.617 2.226 0.776 0.556 0.931 0.690 CB 1.371 59 residues pruned to eliminate duplicates Z: 12 16.362 2.219 0.486 0.670 0.909 0.818 CB 1.407 12 residues pruned to eliminate duplicates Z: 22 25.026 2.195 0.635 0.533 0.952 0.762 CB 1.547 22 residues pruned to eliminate duplicates Z: 11 18.182 2.244 0.497 0.684 0.900 0.800 CB 1.606 11 residues pruned to eliminate duplicates Z: 54 41.698 2.387 0.578 0.572 0.887 0.698 CB 1.599 54 residues pruned to eliminate duplicates Z: 51 45.859 2.277 0.889 0.598 0.980 0.680 CB 1.402 51 residues pruned to eliminate duplicates Z: 59 50.293 2.317 0.770 0.601 0.983 0.741 CB 1.488 59 residues pruned to eliminate duplicates Z: 49 45.230 2.261 0.801 0.627 0.958 0.708 CB 1.485 49 residues pruned to eliminate duplicates Z: 81 56.954 2.346 0.795 0.572 0.938 0.625 CB 1.504 81 residues pruned to eliminate duplicates Z: 139 95.769 2.381 0.919 0.676 0.920 0.688 CB 1.649 139 residues pruned to eliminate duplicates Z: 90 66.272 2.353 0.859 0.602 0.955 0.685 CB 1.527 90 residues pruned to eliminate duplicates Z: 50 53.289 2.392 0.777 0.650 0.939 0.714 CB 1.659 50 residues pruned to eliminate duplicates Z: 23 21.279 2.147 0.638 0.543 0.909 0.682 CB 1.360 23 residues pruned to eliminate duplicates Z: 52 45.697 2.371 0.697 0.611 0.882 0.647 CB 1.622 52 residues pruned to eliminate duplicates Z: 51 45.977 2.363 0.627 0.634 0.900 0.720 CB 1.656 51 residues pruned to eliminate duplicates Z: 14 25.227 2.328 0.630 0.669 0.923 0.769 CB 1.708 14 residues pruned to eliminate duplicates Z: 91 82.752 2.426 0.806 0.733 0.967 0.644 CB 1.671 91 residues pruned to eliminate duplicates Z: 131 91.919 2.458 0.857 0.644 0.900 0.662 CB 1.715 131 residues pruned to eliminate duplicates Z: 12 19.146 2.225 0.797 0.569 0.909 0.636 CB 1.486 12 residues pruned to eliminate duplicates Z: 43 45.369 2.414 0.632 0.645 0.952 0.690 CB 1.629 43 residues pruned to eliminate duplicates Z: 143 90.261 2.402 0.809 0.642 0.923 0.704 CB 1.655 143 residues pruned to eliminate duplicates Z: 103 86.652 2.479 0.857 0.650 0.931 0.676 CB 1.740 103 residues pruned to eliminate duplicates Z: 48 49.329 2.410 0.853 0.578 0.894 0.702 CB 1.672 48 residues pruned to eliminate duplicates Z: 42 47.236 2.459 0.733 0.642 0.927 0.707 CB 1.636 42 residues pruned to eliminate duplicates Z: 125 92.010 2.481 0.831 0.650 0.903 0.669 CB 1.750 125 residues pruned to eliminate duplicates Z: 41 50.481 2.455 0.761 0.669 0.975 0.750 CB 1.620 41 residues pruned to eliminate duplicates Z: 100 83.459 2.467 0.839 0.667 0.919 0.677 CB 1.723 100 residues pruned to eliminate duplicates Z: 107 75.031 2.423 0.803 0.631 0.858 0.642 CB 1.718 107 residues pruned to eliminate duplicates Z: 130 88.187 2.435 0.776 0.643 0.922 0.674 CB 1.702 130 residues pruned to eliminate duplicates Z: 26 47.317 2.536 0.810 0.747 0.960 0.760 CB 1.722 26 residues pruned to eliminate duplicates Z: 92 87.308 2.473 0.807 0.720 0.945 0.736 CB 1.777 92 residues pruned to eliminate duplicates Z: 76 83.296 2.478 0.900 0.762 0.920 0.707 CB 1.760 76 residues pruned to eliminate duplicates Z: 89 56.400 2.283 0.814 0.558 0.920 0.625 CB 1.492 89 residues pruned to eliminate duplicates Z: 44 47.235 2.401 0.753 0.599 0.930 0.628 CB 1.675 44 residues pruned to eliminate duplicates Z: 17 32.863 2.541 0.843 0.637 0.938 0.812 CB 1.646 17 residues pruned to eliminate duplicates Z: 78 86.788 2.518 0.884 0.753 0.935 0.753 CB 1.779 78 residues pruned to eliminate duplicates Z: 43 42.736 2.337 0.802 0.580 0.905 0.595 CB 1.603 43 residues pruned to eliminate duplicates Z: 31 37.303 2.421 0.824 0.559 0.900 0.633 CB 1.618 31 residues pruned to eliminate duplicates Z: 43 46.088 2.439 0.812 0.624 0.929 0.786 CB 1.542 43 residues pruned to eliminate duplicates Z: 27 50.425 2.532 0.946 0.721 0.962 0.769 CB 1.709 27 residues pruned to eliminate duplicates Z: 27 46.740 2.515 0.854 0.727 0.962 0.808 CB 1.667 27 residues pruned to eliminate duplicates Z: 43 45.300 2.387 0.696 0.627 0.952 0.667 CB 1.609 43 residues pruned to eliminate duplicates Z: 28 51.665 2.518 1.124 0.702 0.926 0.704 CB 1.671 28 residues pruned to eliminate duplicates Z: 137 98.128 2.472 0.909 0.622 0.919 0.662 CB 1.729 137 residues pruned to eliminate duplicates Z: 130 85.658 2.433 0.784 0.614 0.930 0.643 CB 1.676 130 residues pruned to eliminate duplicates Z: 88 93.113 2.492 0.966 0.726 0.943 0.655 CB 1.763 88 residues pruned to eliminate duplicates Z: 137 96.174 2.468 0.878 0.611 0.926 0.632 CB 1.729 137 residues pruned to eliminate duplicates Z: 40 57.172 2.509 1.076 0.639 0.923 0.615 CB 1.672 40 residues pruned to eliminate duplicates Z: 28 45.979 2.489 1.149 0.677 0.889 0.741 CB 1.581 28 residues pruned to eliminate duplicates Z: 91 84.700 2.479 0.934 0.670 0.933 0.689 CB 1.706 91 residues pruned to eliminate duplicates Z: 90 87.675 2.503 0.939 0.676 0.933 0.685 CB 1.745 90 residues pruned to eliminate duplicates Z: 130 90.949 2.463 0.798 0.639 0.907 0.612 CB 1.750 130 residues pruned to eliminate duplicates Z: 89 89.833 2.491 0.990 0.690 0.932 0.670 CB 1.742 89 residues pruned to eliminate duplicates Z: 91 89.998 2.479 0.955 0.680 0.944 0.744 CB 1.756 91 residues pruned to eliminate duplicates Z: 77 92.103 2.522 1.045 0.749 0.921 0.750 CB 1.781 77 residues pruned to eliminate duplicates Z: 89 85.953 2.466 0.969 0.700 0.909 0.693 CB 1.730 89 residues pruned to eliminate duplicates Z: 103 89.995 2.458 0.917 0.663 0.941 0.716 CB 1.727 103 residues pruned to eliminate duplicates Z: 127 93.925 2.457 0.913 0.631 0.913 0.635 CB 1.724 127 residues pruned to eliminate duplicates Z: 52 70.446 2.463 0.874 0.777 0.941 0.627 CB 1.778 52 residues pruned to eliminate duplicates Z: 101 91.039 2.484 1.009 0.676 0.910 0.700 CB 1.705 101 residues pruned to eliminate duplicates Z: 164 108.929 2.472 0.842 0.647 0.933 0.718 CB 1.753 164 residues pruned to eliminate duplicates Z: 91 86.236 2.472 0.985 0.672 0.944 0.678 CB 1.674 91 residues pruned to eliminate duplicates Z: 180 105.652 2.449 0.859 0.621 0.905 0.676 CB 1.709 180 residues pruned to eliminate duplicates Z: 114 97.492 2.485 0.985 0.654 0.929 0.637 CB 1.734 114 residues pruned to eliminate duplicates Z: 87 87.982 2.479 0.988 0.708 0.919 0.767 CB 1.735 87 residues pruned to eliminate duplicates Z: 99 92.906 2.425 0.994 0.696 0.949 0.653 CB 1.710 99 residues pruned to eliminate duplicates Z: 106 82.422 2.431 0.982 0.633 0.867 0.629 CB 1.700 106 residues pruned to eliminate duplicates Z: 108 82.140 2.440 0.830 0.655 0.925 0.682 CB 1.664 108 residues pruned to eliminate duplicates Z: 96 94.833 2.475 0.990 0.689 0.947 0.695 CB 1.754 96 residues pruned to eliminate duplicates Z: 127 93.525 2.413 0.902 0.667 0.937 0.690 CB 1.661 127 residues pruned to eliminate duplicates Z: 86 86.116 2.496 0.885 0.718 0.929 0.706 CB 1.754 86 residues pruned to eliminate duplicates Z: 71 102.248 2.545 1.128 0.787 0.971 0.743 CB 1.806 71 residues pruned to eliminate duplicates Z: 114 87.836 2.467 0.877 0.668 0.894 0.726 CB 1.708 114 residues pruned to eliminate duplicates Z: 47 81.367 2.504 0.959 0.821 1.000 0.739 CB 1.851 47 residues pruned to eliminate duplicates Z: 54 68.688 2.456 0.870 0.748 0.925 0.774 CB 1.781 54 residues pruned to eliminate duplicates Z: 132 91.607 2.423 0.880 0.619 0.924 0.634 CB 1.700 132 residues pruned to eliminate duplicates Z: 162 91.525 2.369 0.881 0.611 0.913 0.646 CB 1.595 162 residues pruned to eliminate duplicates Z: 87 97.517 2.506 1.000 0.730 0.953 0.733 CB 1.789 87 residues pruned to eliminate duplicates Z: 88 90.777 2.500 0.982 0.705 0.920 0.701 CB 1.772 88 residues pruned to eliminate duplicates Z: 113 99.136 2.499 1.029 0.665 0.920 0.661 CB 1.725 113 residues pruned to eliminate duplicates Z: 92 95.521 2.481 1.020 0.713 0.945 0.648 CB 1.743 92 residues pruned to eliminate duplicates Z: 94 87.861 2.448 0.954 0.698 0.935 0.667 CB 1.701 94 residues pruned to eliminate duplicates Z: 97 93.913 2.492 1.039 0.682 0.938 0.656 CB 1.702 97 residues pruned to eliminate duplicates Z: 95 91.204 2.440 1.021 0.686 0.947 0.670 CB 1.698 95 residues pruned to eliminate duplicates Z: 110 91.983 2.424 0.961 0.667 0.917 0.670 CB 1.731 110 residues pruned to eliminate duplicates Z: 91 90.969 2.439 1.031 0.702 0.922 0.644 CB 1.746 91 residues pruned to eliminate duplicates Z: 84 94.865 2.524 1.045 0.721 0.928 0.663 CB 1.781 84 residues pruned to eliminate duplicates Z: 91 93.247 2.468 1.087 0.685 0.933 0.644 CB 1.725 91 residues pruned to eliminate duplicates Z: 86 96.082 2.512 1.009 0.717 0.965 0.612 CB 1.759 86 residues pruned to eliminate duplicates Z: 163 114.194 2.457 0.947 0.660 0.938 0.648 CB 1.723 163 residues pruned to eliminate duplicates Z: 161 112.399 2.473 0.927 0.667 0.906 0.656 CB 1.764 161 residues pruned to eliminate duplicates Z: 103 88.863 2.469 0.967 0.667 0.912 0.598 CB 1.703 103 residues pruned to eliminate duplicates Z: 84 93.123 2.518 1.028 0.721 0.916 0.699 CB 1.790 84 residues pruned to eliminate duplicates Z: 175 109.466 2.464 0.883 0.622 0.920 0.684 CB 1.733 175 residues pruned to eliminate duplicates Z: 147 95.532 2.402 0.932 0.625 0.932 0.616 CB 1.626 147 residues pruned to eliminate duplicates Z: 104 92.143 2.453 1.028 0.677 0.922 0.612 CB 1.681 104 residues pruned to eliminate duplicates Z: 119 96.026 2.463 0.946 0.682 0.915 0.610 CB 1.704 119 residues pruned to eliminate duplicates Z: 19 13.472 2.191 0.279 0.417 0.778 0.444 CB 1.590 19 residues pruned to eliminate duplicates Z: 113 99.958 2.488 1.048 0.668 0.920 0.661 CB 1.726 113 residues pruned to eliminate duplicates Z: 90 55.236 2.395 0.665 0.514 0.865 0.652 CB 1.673 90 residues pruned to eliminate duplicates Z: 103 89.120 2.463 0.962 0.675 0.912 0.647 CB 1.705 103 residues pruned to eliminate duplicates Z: 131 99.679 2.455 0.982 0.653 0.908 0.623 CB 1.716 131 residues pruned to eliminate duplicates Z: 163 112.333 2.472 0.891 0.648 0.944 0.710 CB 1.741 163 residues pruned to eliminate duplicates Z: 128 93.077 2.397 0.948 0.646 0.937 0.622 CB 1.647 128 residues pruned to eliminate duplicates Z: 91 84.908 2.477 0.921 0.677 0.933 0.633 CB 1.713 91 residues pruned to eliminate duplicates Z: 174 119.075 2.474 0.928 0.651 0.948 0.671 CB 1.740 174 residues pruned to eliminate duplicates Z: 163 109.992 2.459 0.944 0.639 0.926 0.648 CB 1.714 163 residues pruned to eliminate duplicates Z: 109 86.385 2.428 0.961 0.646 0.917 0.611 CB 1.662 109 residues pruned to eliminate duplicates Z: 119 97.238 2.499 0.917 0.665 0.924 0.644 CB 1.736 119 residues pruned to eliminate duplicates Z: 61 47.148 2.412 0.780 0.432 0.867 0.550 CB 1.756 61 residues pruned to eliminate duplicates Z: 106 89.277 2.455 1.003 0.645 0.914 0.600 CB 1.692 106 residues pruned to eliminate duplicates Z: 76 71.918 2.462 0.850 0.618 0.920 0.707 CB 1.773 76 residues pruned to eliminate duplicates Z: 27 46.639 2.494 0.846 0.634 0.962 0.654 CB 1.822 27 residues pruned to eliminate duplicates Z: 76 69.080 2.447 0.885 0.588 0.907 0.640 CB 1.753 76 residues pruned to eliminate duplicates Z: 76 69.402 2.445 0.833 0.604 0.933 0.680 CB 1.737 76 residues pruned to eliminate duplicates Z: 13 18.803 2.033 0.851 0.524 0.917 0.417 CB 1.537 13 residues pruned to eliminate duplicates Z: 51 49.531 2.428 0.823 0.497 0.900 0.560 CB 1.763 51 residues pruned to eliminate duplicates Z: 26 35.499 2.444 0.756 0.613 0.840 0.560 CB 1.769 26 residues pruned to eliminate duplicates Z: 28 36.341 2.327 0.880 0.584 0.852 0.667 CA 1.730 28 residues pruned to eliminate duplicates Z: 51 46.944 2.443 0.736 0.476 0.920 0.640 CB 1.744 51 residues pruned to eliminate duplicates Z: 27 41.336 2.454 0.948 0.612 0.923 0.692 CB 1.652 27 residues pruned to eliminate duplicates Z: 75 74.073 2.472 0.886 0.615 0.959 0.635 CB 1.727 75 residues pruned to eliminate duplicates Z: 15 30.813 2.346 0.854 0.724 0.929 0.714 CA 1.665 15 residues pruned to eliminate duplicates Z: 42 41.012 2.414 0.707 0.467 0.927 0.732 CB 1.735 42 residues pruned to eliminate duplicates Z: 21 25.649 2.258 0.717 0.541 0.850 0.450 CB 1.671 21 residues pruned to eliminate duplicates Z: 50 49.213 2.420 0.739 0.520 0.939 0.694 CB 1.745 50 residues pruned to eliminate duplicates Z: 26 36.233 2.460 0.845 0.603 0.840 0.720 CB 1.723 26 residues pruned to eliminate duplicates Z: 72 64.458 2.428 0.808 0.589 0.944 0.648 CB 1.696 72 residues pruned to eliminate duplicates Z: 77 72.865 2.446 0.847 0.614 0.947 0.658 CB 1.754 77 residues pruned to eliminate duplicates Z: 18 37.465 2.428 0.914 0.597 1.000 0.588 CA 1.782 18 residues pruned to eliminate duplicates Z: 27 40.384 2.398 0.940 0.621 0.923 0.654 CB 1.646 27 residues pruned to eliminate duplicates Z: 51 51.554 2.430 0.813 0.509 0.940 0.580 CB 1.744 51 residues pruned to eliminate duplicates Z: 76 69.705 2.436 0.900 0.599 0.907 0.667 CB 1.745 76 residues pruned to eliminate duplicates Z: 77 68.859 2.438 0.872 0.607 0.908 0.737 CB 1.722 77 residues pruned to eliminate duplicates Z: 51 49.134 2.394 0.844 0.513 0.900 0.680 CB 1.726 51 residues pruned to eliminate duplicates Z: 28 34.153 2.282 0.871 0.599 0.926 0.630 CB 1.513 37 residues pruned to eliminate duplicates Z: 149 107.216 2.460 0.935 0.640 0.946 0.642 CB 1.718 149 residues pruned to eliminate duplicates Z: 52 47.523 2.387 0.745 0.507 0.922 0.588 CB 1.722 52 residues pruned to eliminate duplicates Z: 83 50.896 2.216 0.713 0.559 0.915 0.622 CB 1.528 83 residues pruned to eliminate duplicates Z: 77 70.131 2.437 0.810 0.606 0.961 0.671 CB 1.717 77 residues pruned to eliminate duplicates Z: 26 29.227 2.314 0.758 0.392 0.920 0.600 CB 1.751 26 residues pruned to eliminate duplicates Z: 54 45.184 2.303 0.792 0.474 0.925 0.660 CB 1.670 54 residues pruned to eliminate duplicates Z: 73 67.242 2.436 0.870 0.593 0.931 0.736 CB 1.710 73 residues pruned to eliminate duplicates Z: 30 25.142 2.344 0.594 0.361 0.862 0.655 CB 1.683 30 residues pruned to eliminate duplicates Z: 50 53.176 2.439 0.825 0.533 0.939 0.612 CB 1.759 50 residues pruned to eliminate duplicates Z: 27 30.687 2.345 0.825 0.372 0.923 0.577 CB 1.747 27 residues pruned to eliminate duplicates Z: 51 54.493 2.441 0.863 0.516 0.940 0.680 CB 1.774 51 residues pruned to eliminate duplicates Z: 51 55.898 2.449 0.779 0.600 0.960 0.780 CB 1.718 51 residues pruned to eliminate duplicates Z: 77 70.906 2.442 0.816 0.606 0.934 0.724 CB 1.775 77 residues pruned to eliminate duplicates Z: 51 57.818 2.436 0.872 0.593 0.940 0.640 CB 1.746 51 residues pruned to eliminate duplicates Z: 76 68.352 2.419 0.763 0.611 0.960 0.667 CB 1.736 76 residues pruned to eliminate duplicates Z: 49 55.886 2.443 0.934 0.543 0.958 0.625 CB 1.708 49 residues pruned to eliminate duplicates Z: 50 52.029 2.423 0.837 0.531 0.939 0.714 CB 1.725 50 residues pruned to eliminate duplicates Z: 56 41.517 2.273 0.819 0.500 0.873 0.673 CB 1.552 56 residues pruned to eliminate duplicates Z: 26 29.095 2.335 0.805 0.382 0.920 0.640 CB 1.702 26 residues pruned to eliminate duplicates Z: 26 29.072 2.371 0.753 0.376 0.920 0.680 CB 1.735 26 residues pruned to eliminate duplicates Z: 24 27.623 2.383 0.658 0.376 0.957 0.609 CB 1.740 24 residues pruned to eliminate duplicates Z: 50 50.630 2.401 0.880 0.519 0.939 0.673 CB 1.676 50 residues pruned to eliminate duplicates Z: 49 52.836 2.426 0.841 0.542 0.938 0.750 CB 1.749 49 residues pruned to eliminate duplicates Z: 76 69.576 2.439 0.798 0.625 0.947 0.720 CB 1.720 76 residues pruned to eliminate duplicates Z: 77 66.786 2.408 0.810 0.601 0.921 0.697 CB 1.734 77 residues pruned to eliminate duplicates Z: 76 67.637 2.450 0.789 0.614 0.907 0.720 CB 1.764 76 residues pruned to eliminate duplicates Z: 30 42.480 2.352 0.689 0.744 0.897 0.690 CB 1.780 30 residues pruned to eliminate duplicates Z: 77 69.481 2.398 0.823 0.646 0.921 0.737 CB 1.727 77 residues pruned to eliminate duplicates Z: 163 109.291 2.439 0.923 0.653 0.938 0.679 CB 1.692 163 residues pruned to eliminate duplicates Z: 32 40.374 2.313 0.714 0.704 0.935 0.677 CB 1.624 32 residues pruned to eliminate duplicates Z: 77 69.336 2.412 0.802 0.626 0.947 0.618 CB 1.715 77 residues pruned to eliminate duplicates Z: 30 43.636 2.399 0.745 0.747 0.966 0.655 CB 1.608 30 residues pruned to eliminate duplicates Z: 29 59.284 2.436 1.038 0.781 1.000 0.607 CB 1.761 29 residues pruned to eliminate duplicates Z: 52 55.242 2.378 0.875 0.593 0.961 0.686 CB 1.651 51 residues pruned to eliminate duplicates Z: 23 55.737 2.487 1.048 0.950 0.955 0.727 CB 1.686 23 residues pruned to eliminate duplicates Z: 76 68.984 2.396 0.891 0.616 0.947 0.587 CB 1.665 76 residues pruned to eliminate duplicates Z: 53 58.951 2.393 0.916 0.614 0.981 0.596 CB 1.631 53 residues pruned to eliminate duplicates Z: 53 57.282 2.406 0.890 0.602 0.962 0.558 CB 1.648 53 residues pruned to eliminate duplicates Z: 54 55.258 2.397 0.823 0.602 0.962 0.585 CB 1.639 55 residues pruned to eliminate duplicates Z: 24 55.010 2.419 1.090 0.950 0.957 0.739 CB 1.635 24 residues pruned to eliminate duplicates Z: 29 52.781 2.436 0.958 0.789 0.964 0.571 CB 1.683 29 residues pruned to eliminate duplicates Z: 56 57.175 2.381 0.826 0.598 0.964 0.618 CB 1.677 56 residues pruned to eliminate duplicates Z: 29 55.622 2.448 1.045 0.788 1.000 0.500 CB 1.631 29 residues pruned to eliminate duplicates Z: 26 51.236 2.433 1.070 0.818 0.920 0.520 CB 1.679 26 residues pruned to eliminate duplicates Z: 76 71.049 2.422 0.892 0.637 0.933 0.627 CB 1.687 76 residues pruned to eliminate duplicates Z: 26 51.671 2.440 1.094 0.823 0.960 0.560 CB 1.593 26 residues pruned to eliminate duplicates Z: 31 49.705 2.369 1.018 0.760 0.967 0.533 CB 1.559 31 residues pruned to eliminate duplicates Z: 77 65.712 2.393 0.875 0.602 0.921 0.645 CB 1.654 77 residues pruned to eliminate duplicates Z: 30 54.173 2.416 1.039 0.756 0.966 0.655 CB 1.684 30 residues pruned to eliminate duplicates Z: 7 4.522 2.049 0.112 0.336 1.000 0.833 CB 0.969 7 residues pruned to eliminate duplicates Z: 62 42.056 2.277 0.597 0.567 0.934 0.639 CB 1.485 62 residues pruned to eliminate duplicates Z: 38 39.759 2.273 0.716 0.633 0.973 0.784 CB 1.520 38 residues pruned to eliminate duplicates Z: 39 35.663 2.281 0.633 0.595 0.947 0.711 CB 1.497 39 residues pruned to eliminate duplicates Z: 62 33.529 2.186 0.615 0.514 0.918 0.689 CB 1.306 62 residues pruned to eliminate duplicates Z: 56 33.344 2.203 0.623 0.513 0.927 0.709 CB 1.339 56 residues pruned to eliminate duplicates Z: 138 88.938 2.371 0.744 0.664 0.942 0.745 CB 1.677 138 residues pruned to eliminate duplicates Z: 60 43.019 2.265 0.662 0.569 0.966 0.627 CB 1.441 60 residues pruned to eliminate duplicates Z: 50 33.431 2.232 0.651 0.578 0.918 0.694 CB 1.308 50 residues pruned to eliminate duplicates Z: 52 36.786 2.255 0.662 0.538 0.941 0.627 CB 1.407 52 residues pruned to eliminate duplicates Z: 40 38.522 2.251 0.985 0.587 0.923 0.641 CB 1.375 40 residues pruned to eliminate duplicates Z: 32 37.989 2.281 0.907 0.676 1.000 0.677 CB 1.334 32 residues pruned to eliminate duplicates Z: 38 40.674 2.287 0.859 0.607 1.000 0.757 CB 1.421 38 residues pruned to eliminate duplicates Z: 139 89.012 2.362 0.810 0.654 0.928 0.674 CB 1.656 139 residues pruned to eliminate duplicates Z: 37 43.964 2.318 0.966 0.623 0.972 0.722 CB 1.472 37 residues pruned to eliminate duplicates Z: 38 40.385 2.281 0.900 0.606 0.946 0.676 CB 1.465 38 residues pruned to eliminate duplicates Z: 49 41.318 2.247 0.832 0.586 0.979 0.708 CB 1.363 49 residues pruned to eliminate duplicates Z: 49 38.993 2.204 0.790 0.608 0.938 0.688 CB 1.372 49 residues pruned to eliminate duplicates Z: 49 37.152 2.261 0.760 0.576 0.938 0.708 CB 1.335 49 residues pruned to eliminate duplicates Z: 49 39.860 2.264 0.825 0.584 0.958 0.646 CB 1.341 49 residues pruned to eliminate duplicates Z: 54 37.542 2.193 0.749 0.500 0.962 0.717 CB 1.397 54 residues pruned to eliminate duplicates Z: 202 89.929 2.298 0.749 0.591 0.925 0.657 CB 1.563 202 residues pruned to eliminate duplicates Z: 38 44.305 2.303 0.900 0.620 1.000 0.703 CB 1.486 38 residues pruned to eliminate duplicates Z: 44 41.152 2.256 0.876 0.544 0.977 0.651 CB 1.455 44 residues pruned to eliminate duplicates Z: 37 44.433 2.314 1.017 0.604 1.000 0.667 CB 1.437 37 residues pruned to eliminate duplicates Z: 35 30.300 2.246 0.949 0.496 0.882 0.500 CB 1.351 35 residues pruned to eliminate duplicates Z: 38 41.422 2.304 0.968 0.574 0.973 0.649 CB 1.437 38 residues pruned to eliminate duplicates Z: 39 41.018 2.269 0.979 0.605 0.921 0.605 CB 1.457 39 residues pruned to eliminate duplicates Z: 56 36.924 2.219 0.777 0.514 0.927 0.564 CB 1.343 56 residues pruned to eliminate duplicates Z: 39 44.379 2.272 0.987 0.607 0.974 0.658 CB 1.480 39 residues pruned to eliminate duplicates Z: 50 38.281 2.228 0.865 0.577 0.939 0.571 CB 1.301 50 residues pruned to eliminate duplicates Z: 39 42.012 2.288 0.916 0.596 1.000 0.711 CB 1.418 39 residues pruned to eliminate duplicates Z: 50 37.112 2.247 0.725 0.572 0.959 0.633 CB 1.330 50 residues pruned to eliminate duplicates Z: 37 43.065 2.308 0.935 0.601 1.000 0.694 CB 1.460 37 residues pruned to eliminate duplicates Z: 38 40.237 2.286 0.997 0.592 0.946 0.703 CB 1.403 38 residues pruned to eliminate duplicates Z: 50 30.531 2.200 0.628 0.548 0.939 0.653 CB 1.238 50 residues pruned to eliminate duplicates Z: 48 38.642 2.270 0.832 0.568 0.915 0.681 CB 1.387 48 residues pruned to eliminate duplicates Z: 47 36.589 2.220 0.780 0.574 0.913 0.674 CB 1.391 47 residues pruned to eliminate duplicates Z: 50 36.327 2.214 0.718 0.575 0.939 0.694 CB 1.352 50 residues pruned to eliminate duplicates Z: 49 34.100 2.226 0.654 0.569 0.958 0.646 CB 1.306 49 residues pruned to eliminate duplicates Z: 47 40.442 2.271 0.814 0.618 0.935 0.652 CB 1.385 47 residues pruned to eliminate duplicates Z: 50 35.916 2.223 0.728 0.572 0.980 0.653 CB 1.272 50 residues pruned to eliminate duplicates Z: 138 89.400 2.352 0.761 0.662 0.942 0.679 CB 1.686 138 residues pruned to eliminate duplicates Z: 182 86.652 2.309 0.657 0.613 0.917 0.641 CB 1.648 182 residues pruned to eliminate duplicates Z: 65 41.054 2.230 0.729 0.510 0.922 0.594 CB 1.430 65 residues pruned to eliminate duplicates Z: 135 85.748 2.329 0.777 0.649 0.955 0.679 CB 1.631 135 residues pruned to eliminate duplicates Z: 137 83.229 2.356 0.700 0.648 0.949 0.721 CB 1.637 137 residues pruned to eliminate duplicates Z: 102 79.855 2.382 0.775 0.664 0.921 0.713 CB 1.753 102 residues pruned to eliminate duplicates Z: 59 42.351 2.241 0.825 0.548 0.914 0.621 CB 1.420 59 residues pruned to eliminate duplicates Z: 104 77.621 2.373 0.779 0.658 0.903 0.689 CB 1.733 104 residues pruned to eliminate duplicates Z: 89 75.186 2.405 0.767 0.670 0.898 0.727 CB 1.796 89 residues pruned to eliminate duplicates Z: 44 55.707 2.418 0.845 0.650 0.907 0.721 CB 1.825 44 residues pruned to eliminate duplicates Z: 91 86.689 2.413 0.854 0.717 0.922 0.756 CB 1.819 91 residues pruned to eliminate duplicates Z: 92 60.582 2.300 0.841 0.588 0.923 0.648 CB 1.493 92 residues pruned to eliminate duplicates Z: 131 77.352 2.330 0.757 0.621 0.892 0.646 CB 1.657 131 residues pruned to eliminate duplicates Z: 102 82.262 2.382 0.822 0.667 0.911 0.703 CB 1.775 102 residues pruned to eliminate duplicates Z: 155 79.758 2.330 0.714 0.593 0.896 0.623 CB 1.643 155 residues pruned to eliminate duplicates Z: 100 84.395 2.399 0.837 0.686 0.919 0.717 CB 1.765 100 residues pruned to eliminate duplicates Z: 152 84.601 2.342 0.722 0.606 0.927 0.695 CB 1.664 152 residues pruned to eliminate duplicates Z: 111 77.503 2.325 0.789 0.647 0.900 0.627 CB 1.721 111 residues pruned to eliminate duplicates Z: 95 85.582 2.358 0.882 0.707 0.936 0.691 CB 1.760 95 residues pruned to eliminate duplicates Z: 91 85.791 2.394 0.896 0.709 0.933 0.678 CB 1.766 91 residues pruned to eliminate duplicates Z: 148 84.574 2.335 0.792 0.629 0.925 0.673 CB 1.597 148 residues pruned to eliminate duplicates Z: 45 52.944 2.379 0.874 0.614 0.886 0.636 CB 1.813 45 residues pruned to eliminate duplicates Z: 45 53.469 2.329 0.855 0.640 0.977 0.750 CB 1.674 45 residues pruned to eliminate duplicates Z: 86 71.591 2.364 0.819 0.698 0.906 0.718 CB 1.664 86 residues pruned to eliminate duplicates Z: 85 80.526 2.391 0.853 0.726 0.917 0.750 CB 1.764 85 residues pruned to eliminate duplicates Z: 28 48.672 2.437 0.955 0.711 1.000 0.741 CB 1.624 28 residues pruned to eliminate duplicates Z: 28 54.621 2.513 1.046 0.694 0.963 0.667 CB 1.778 28 residues pruned to eliminate duplicates Z: 88 76.370 2.385 0.791 0.690 0.931 0.678 CB 1.729 88 residues pruned to eliminate duplicates Z: 75 89.580 2.459 0.900 0.758 0.973 0.811 CB 1.821 75 residues pruned to eliminate duplicates Z: 43 50.258 2.399 0.802 0.622 0.905 0.619 CB 1.768 43 residues pruned to eliminate duplicates Z: 103 77.408 2.370 0.765 0.653 0.912 0.686 CB 1.743 103 residues pruned to eliminate duplicates Z: 76 88.608 2.433 0.931 0.756 0.973 0.787 CB 1.782 76 residues pruned to eliminate duplicates Z: 87 79.844 2.395 0.891 0.690 0.930 0.663 CB 1.717 87 residues pruned to eliminate duplicates Z: 105 80.347 2.368 0.850 0.659 0.904 0.654 CB 1.716 105 residues pruned to eliminate duplicates Z: 101 81.366 2.370 0.856 0.667 0.920 0.650 CB 1.723 101 residues pruned to eliminate duplicates Z: 138 92.720 2.347 0.918 0.658 0.934 0.642 CB 1.626 138 residues pruned to eliminate duplicates Z: 102 79.968 2.395 0.784 0.663 0.931 0.653 CB 1.719 102 residues pruned to eliminate duplicates Z: 88 92.275 2.444 0.925 0.739 0.943 0.736 CB 1.800 88 residues pruned to eliminate duplicates Z: 86 75.467 2.395 0.747 0.690 0.941 0.659 CB 1.746 86 residues pruned to eliminate duplicates Z: 91 93.724 2.414 0.955 0.714 0.967 0.644 CB 1.783 91 residues pruned to eliminate duplicates Z: 39 36.769 2.329 0.837 0.548 0.842 0.579 CB 1.580 39 residues pruned to eliminate duplicates Z: 89 91.682 2.446 0.835 0.728 0.977 0.773 CB 1.814 89 residues pruned to eliminate duplicates Z: 78 80.860 2.423 0.906 0.729 0.922 0.727 CB 1.761 78 residues pruned to eliminate duplicates Z: 91 91.516 2.416 0.892 0.733 0.956 0.722 CB 1.791 91 residues pruned to eliminate duplicates Z: 90 93.137 2.433 0.934 0.737 0.944 0.697 CB 1.797 90 residues pruned to eliminate duplicates Z: 77 82.322 2.421 0.949 0.751 0.908 0.592 CB 1.763 77 residues pruned to eliminate duplicates Z: 76 90.881 2.437 0.992 0.763 0.960 0.640 CB 1.782 76 residues pruned to eliminate duplicates Z: 96 81.338 2.359 0.822 0.684 0.947 0.663 CB 1.732 96 residues pruned to eliminate duplicates Z: 90 94.049 2.431 0.951 0.737 0.955 0.809 CB 1.780 90 residues pruned to eliminate duplicates Z: 51 71.733 2.396 0.873 0.767 0.960 0.700 CB 1.858 51 residues pruned to eliminate duplicates Z: 87 76.138 2.408 0.821 0.690 0.919 0.674 CB 1.713 87 residues pruned to eliminate duplicates Z: 103 76.925 2.360 0.800 0.653 0.912 0.667 CB 1.706 103 residues pruned to eliminate duplicates Z: 90 82.918 2.375 0.863 0.723 0.933 0.674 CB 1.741 90 residues pruned to eliminate duplicates Z: 59 60.513 2.357 0.723 0.713 0.948 0.759 CB 1.701 59 residues pruned to eliminate duplicates Z: 86 82.179 2.394 0.902 0.700 0.941 0.647 CB 1.734 86 residues pruned to eliminate duplicates Z: 91 90.308 2.410 0.854 0.720 0.967 0.667 CB 1.806 91 residues pruned to eliminate duplicates Z: 47 69.259 2.459 0.717 0.811 0.978 0.804 CB 1.886 47 residues pruned to eliminate duplicates Z: 90 76.454 2.366 0.774 0.663 0.944 0.640 CB 1.759 90 residues pruned to eliminate duplicates Z: 76 85.012 2.441 0.896 0.754 0.947 0.693 CB 1.786 76 residues pruned to eliminate duplicates Z: 88 77.515 2.396 0.825 0.682 0.931 0.678 CB 1.727 88 residues pruned to eliminate duplicates Z: 142 89.845 2.349 0.831 0.641 0.957 0.681 CB 1.611 142 residues pruned to eliminate duplicates Z: 95 84.995 2.379 0.806 0.712 0.947 0.681 CB 1.777 95 residues pruned to eliminate duplicates Z: 148 89.251 2.329 0.827 0.650 0.939 0.660 CB 1.603 148 residues pruned to eliminate duplicates Z: 75 90.175 2.454 0.905 0.768 0.973 0.743 CB 1.817 75 residues pruned to eliminate duplicates Z: 90 87.965 2.435 0.820 0.730 0.955 0.708 CB 1.791 90 residues pruned to eliminate duplicates Z: 75 88.445 2.457 0.989 0.754 0.932 0.716 CB 1.799 75 residues pruned to eliminate duplicates Z: 104 81.913 2.376 0.823 0.659 0.932 0.660 CB 1.725 104 residues pruned to eliminate duplicates Z: 110 79.008 2.375 0.792 0.648 0.917 0.661 CB 1.689 110 residues pruned to eliminate duplicates Z: 84 82.343 2.410 0.923 0.708 0.916 0.711 CB 1.763 84 residues pruned to eliminate duplicates Z: 101 80.052 2.364 0.782 0.675 0.920 0.680 CB 1.758 101 residues pruned to eliminate duplicates Z: 102 81.347 2.348 0.819 0.662 0.941 0.644 CB 1.734 102 residues pruned to eliminate duplicates Z: 97 88.635 2.402 0.895 0.689 0.958 0.688 CB 1.744 97 residues pruned to eliminate duplicates Z: 48 73.857 2.422 0.850 0.800 1.000 0.766 CB 1.850 48 residues pruned to eliminate duplicates Z: 75 93.543 2.454 1.011 0.770 0.973 0.730 CB 1.785 75 residues pruned to eliminate duplicates Z: 102 81.341 2.398 0.839 0.669 0.901 0.663 CB 1.743 102 residues pruned to eliminate duplicates Z: 136 89.565 2.355 0.874 0.647 0.941 0.563 CB 1.619 136 residues pruned to eliminate duplicates Z: 61 58.264 2.359 0.751 0.678 0.900 0.667 CB 1.717 61 residues pruned to eliminate duplicates Z: 118 75.875 2.335 0.822 0.628 0.880 0.598 CB 1.661 118 residues pruned to eliminate duplicates Z: 77 83.911 2.429 0.948 0.748 0.921 0.539 CB 1.769 77 residues pruned to eliminate duplicates Z: 87 81.693 2.405 0.931 0.692 0.930 0.663 CB 1.710 87 residues pruned to eliminate duplicates Z: 75 95.357 2.449 1.021 0.778 0.986 0.622 CB 1.777 75 residues pruned to eliminate duplicates Z: 50 69.886 2.389 0.920 0.785 0.939 0.592 CB 1.805 50 residues pruned to eliminate duplicates Z: 88 89.897 2.453 0.840 0.733 0.966 0.621 CB 1.793 88 residues pruned to eliminate duplicates Z: 88 95.159 2.443 0.964 0.730 0.966 0.678 CB 1.791 88 residues pruned to eliminate duplicates Z: 90 91.932 2.408 0.910 0.722 0.978 0.719 CB 1.774 90 residues pruned to eliminate duplicates Z: 43 72.171 2.397 0.927 0.829 1.000 0.619 CB 1.814 43 residues pruned to eliminate duplicates Z: 90 91.789 2.437 0.892 0.721 0.966 0.584 CB 1.789 90 residues pruned to eliminate duplicates Z: 89 92.718 2.421 0.952 0.740 0.955 0.636 CB 1.768 89 residues pruned to eliminate duplicates Z: 98 86.940 2.393 0.889 0.701 0.938 0.608 CB 1.733 98 residues pruned to eliminate duplicates Z: 84 84.733 2.399 0.952 0.720 0.940 0.675 CB 1.733 84 residues pruned to eliminate duplicates Z: 148 85.871 2.335 0.807 0.633 0.918 0.599 CB 1.614 148 residues pruned to eliminate duplicates Z: 103 80.050 2.378 0.843 0.666 0.912 0.608 CB 1.702 103 residues pruned to eliminate duplicates Z: 87 82.891 2.392 0.955 0.697 0.942 0.581 CB 1.695 87 residues pruned to eliminate duplicates Z: 101 88.695 2.372 0.908 0.697 0.950 0.660 CB 1.724 101 residues pruned to eliminate duplicates Z: 55 60.985 2.323 0.908 0.718 0.926 0.537 CB 1.660 55 residues pruned to eliminate duplicates Z: 100 89.253 2.372 0.929 0.684 0.949 0.657 CB 1.743 100 residues pruned to eliminate duplicates Z: 11 6.902 2.124 0.516 0.312 0.700 0.400 CB 1.193 11 residues pruned to eliminate duplicates Z: 19 14.102 2.108 0.426 0.415 0.944 0.500 CB 1.280 19 residues pruned to eliminate duplicates Z: 11 6.734 2.119 0.374 0.376 0.700 0.500 CB 1.193 11 residues pruned to eliminate duplicates Z: 62 28.787 2.177 0.517 0.458 0.836 0.623 CB 1.394 62 residues pruned to eliminate duplicates Z: 12 7.425 2.063 0.374 0.356 0.818 0.545 CB 1.128 12 residues pruned to eliminate duplicates Z: 15 7.438 1.980 0.351 0.370 0.786 0.643 CB 1.087 15 residues pruned to eliminate duplicates Z: 61 62.577 2.351 0.848 0.707 0.917 0.633 CB 1.680 61 residues pruned to eliminate duplicates Z: 10 7.938 2.203 0.457 0.301 0.778 0.556 CB 1.324 10 residues pruned to eliminate duplicates Z: 11 6.943 2.103 0.391 0.350 0.800 0.500 CB 1.104 11 residues pruned to eliminate duplicates Z: 155 85.591 2.320 0.783 0.595 0.929 0.636 CB 1.640 155 residues pruned to eliminate duplicates Z: 29 24.758 2.166 0.594 0.575 0.857 0.679 CB 1.472 29 residues pruned to eliminate duplicates Z: 151 89.264 2.351 0.787 0.623 0.920 0.653 CB 1.679 151 residues pruned to eliminate duplicates Z: 51 38.767 2.272 0.673 0.491 0.940 0.700 CB 1.549 51 residues pruned to eliminate duplicates Z: 86 48.235 2.237 0.704 0.531 0.906 0.624 CB 1.469 86 residues pruned to eliminate duplicates Z: 9 14.961 2.172 0.792 0.643 0.875 0.625 CB 1.359 9 residues pruned to eliminate duplicates Z: 56 34.814 2.191 0.695 0.481 0.873 0.636 CB 1.476 56 residues pruned to eliminate duplicates Z: 50 40.065 2.274 0.717 0.525 0.918 0.673 CB 1.558 50 residues pruned to eliminate duplicates Z: 49 36.876 2.271 0.658 0.509 0.917 0.729 CB 1.529 49 residues pruned to eliminate duplicates Z: 50 36.465 2.259 0.598 0.520 0.918 0.633 CB 1.541 50 residues pruned to eliminate duplicates Z: 50 41.201 2.278 0.744 0.513 0.959 0.714 CB 1.524 50 residues pruned to eliminate duplicates Z: 18 30.973 2.306 0.672 0.663 1.000 0.765 CB 1.676 18 residues pruned to eliminate duplicates Z: 49 36.823 2.275 0.615 0.504 0.938 0.625 CB 1.536 49 residues pruned to eliminate duplicates Z: 71 55.148 2.219 0.860 0.619 0.943 0.729 CB 1.513 71 residues pruned to eliminate duplicates Z: 49 40.488 2.278 0.728 0.527 0.958 0.729 CB 1.509 49 residues pruned to eliminate duplicates Z: 50 39.736 2.268 0.706 0.532 0.939 0.653 CB 1.514 50 residues pruned to eliminate duplicates Z: 29 25.395 2.197 0.659 0.490 0.929 0.643 CB 1.433 29 residues pruned to eliminate duplicates Z: 28 33.465 2.266 0.780 0.631 0.889 0.556 CB 1.589 28 residues pruned to eliminate duplicates Z: 72 47.275 2.173 0.751 0.592 0.944 0.746 CB 1.432 72 residues pruned to eliminate duplicates Z: 28 27.321 2.219 0.797 0.610 0.852 0.630 CB 1.394 28 residues pruned to eliminate duplicates Z: 51 39.292 2.277 0.762 0.530 0.900 0.720 CB 1.494 51 residues pruned to eliminate duplicates Z: 76 47.988 2.224 0.650 0.606 0.920 0.667 CB 1.484 76 residues pruned to eliminate duplicates Z: 71 53.453 2.248 0.713 0.640 0.957 0.714 CB 1.521 71 residues pruned to eliminate duplicates Z: 26 30.499 2.167 0.786 0.610 0.960 0.600 CB 1.479 26 residues pruned to eliminate duplicates Z: 41 37.879 2.304 0.732 0.510 0.950 0.625 CB 1.563 41 residues pruned to eliminate duplicates Z: 50 36.436 2.251 0.726 0.481 0.878 0.714 CB 1.556 50 residues pruned to eliminate duplicates Z: 50 41.110 2.263 0.784 0.542 0.918 0.714 CB 1.519 50 residues pruned to eliminate duplicates Z: 29 31.503 2.286 0.691 0.555 0.964 0.714 CB 1.513 29 residues pruned to eliminate duplicates Z: 72 57.493 2.252 0.817 0.671 0.958 0.775 CB 1.486 72 residues pruned to eliminate duplicates Z: 51 38.372 2.254 0.693 0.515 0.920 0.680 CB 1.522 51 residues pruned to eliminate duplicates Z: 45 25.707 2.098 0.571 0.421 0.841 0.682 CB 1.517 45 residues pruned to eliminate duplicates Z: 41 37.697 2.276 0.711 0.526 0.950 0.725 CB 1.571 41 residues pruned to eliminate duplicates Z: 28 21.570 2.209 0.688 0.377 0.889 0.704 CB 1.429 Z: 7 21.991 2.254 1.083 0.639 1.000 1.000 CA 1.679 7 residues pruned to eliminate duplicates Z: 10 19.854 2.434 0.823 0.471 1.000 0.667 CB 1.537 10 residues pruned to eliminate duplicates Z: 75 50.315 2.181 0.723 0.623 0.959 0.757 CB 1.444 103 residues pruned to eliminate duplicates Z: 24 25.600 2.311 0.722 0.422 0.957 0.696 CB 1.520 Z: 6 5.912 1.883 0.514 0.310 1.000 0.400 CA 1.145 6 residues pruned to eliminate duplicates Z: 50 35.406 2.131 0.677 0.565 0.939 0.673 CB 1.414 26 residues pruned to eliminate duplicates Z: 6 6.949 2.254 0.669 0.206 0.800 0.400 CA 1.462 6 residues pruned to eliminate duplicates Z: 16 15.491 2.095 0.555 0.304 0.933 0.667 CB 1.636 16 residues pruned to eliminate duplicates Z: 52 37.360 2.164 0.643 0.579 0.922 0.706 CB 1.479 48 residues pruned to eliminate duplicates Z: 6 4.840 1.744 0.614 0.294 0.800 0.200 CB 1.211 6 residues pruned to eliminate duplicates Z: 49 42.665 2.277 0.757 0.541 0.979 0.667 CB 1.510 101 residues pruned to eliminate duplicates Z: 72 53.290 2.253 0.707 0.655 0.958 0.676 CB 1.487 72 residues pruned to eliminate duplicates Z: 62 52.250 2.284 0.635 0.658 0.984 0.738 CB 1.572 62 residues pruned to eliminate duplicates Z: 63 49.068 2.236 0.682 0.649 0.952 0.774 CB 1.515 63 residues pruned to eliminate duplicates Z: 29 31.029 2.150 0.578 0.744 0.929 0.821 CB 1.496 Z: 23 38.600 2.137 0.773 0.848 1.000 0.682 CB 1.611 24 residues pruned to eliminate duplicates Z: 24 34.520 2.080 0.729 0.881 1.000 0.739 CB 1.449 24 residues pruned to eliminate duplicates Z: 50 38.613 2.219 0.553 0.638 1.000 0.673 CB 1.408 30 residues pruned to eliminate duplicates Z: 22 32.838 2.149 0.694 0.884 0.952 0.714 CB 1.494 22 residues pruned to eliminate duplicates Z: 26 35.608 2.185 0.652 0.799 1.000 0.680 CB 1.518 26 residues pruned to eliminate duplicates Z: 24 31.397 2.046 0.803 0.885 0.913 0.783 CB 1.404 24 residues pruned to eliminate duplicates Z: 23 41.971 2.221 0.935 0.888 1.000 0.682 CB 1.500 22 residues pruned to eliminate duplicates Z: 24 35.755 2.108 0.790 0.903 0.957 0.696 CA 1.472 24 residues pruned to eliminate duplicates Z: 35 38.622 2.207 0.746 0.707 0.941 0.588 CB 1.513 36 residues pruned to eliminate duplicates Z: 20 33.247 2.151 0.854 0.894 0.895 0.632 CB 1.533 20 residues pruned to eliminate duplicates Z: 24 43.285 2.243 0.988 0.853 1.000 0.696 CB 1.497 24 residues pruned to eliminate duplicates Z: 23 36.705 2.149 0.891 0.917 0.955 0.591 CB 1.424 23 residues pruned to eliminate duplicates Z: 35 43.012 2.248 0.696 0.738 1.000 0.647 CB 1.563 35 residues pruned to eliminate duplicates Z: 23 40.146 2.228 0.921 0.894 0.955 0.682 CB 1.503 23 residues pruned to eliminate duplicates Z: 25 36.841 2.129 1.022 0.810 0.917 0.583 CB 1.454 25 residues pruned to eliminate duplicates Z: 31 33.708 2.080 0.811 0.752 1.000 0.700 CB 1.305 31 residues pruned to eliminate duplicates Z: 73 56.532 2.253 0.773 0.666 0.944 0.653 CB 1.515 121 residues pruned to eliminate duplicates Z: 76 53.304 2.207 0.881 0.635 0.920 0.680 CB 1.420 76 residues pruned to eliminate duplicates Z: 26 42.591 2.182 0.993 0.829 1.000 0.600 CB 1.474 Z: 23 38.168 2.149 1.134 0.922 0.909 0.591 CB 1.372 21 residues pruned to eliminate duplicates Z: 23 39.292 2.165 0.974 0.927 0.955 0.591 CB 1.439 23 residues pruned to eliminate duplicates 751 residues left after pruning, divided into chains as follows: A: 4 B: 719 C: 28 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 42.67 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.567, Connect. = 0.792 for dens.mod. cycle 1 = 0.300, Contrast = 0.642, Connect. = 0.812 for dens.mod. cycle 2 = 0.300, Contrast = 0.781, Connect. = 0.833 for dens.mod. cycle 3 = 0.300, Contrast = 0.795, Connect. = 0.834 for dens.mod. cycle 4 = 0.300, Contrast = 0.809, Connect. = 0.836 for dens.mod. cycle 5 = 0.300, Contrast = 0.814, Connect. = 0.837 for dens.mod. cycle 6 = 0.300, Contrast = 0.819, Connect. = 0.838 for dens.mod. cycle 7 = 0.300, Contrast = 0.821, Connect. = 0.839 for dens.mod. cycle 8 = 0.300, Contrast = 0.822, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.822, Connect. = 0.840 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4165 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 994 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 15 23.501 2.237 0.463 0.793 1.000 0.929 CB 1.485 B: 35 24.228 2.012 0.647 0.542 0.912 0.500 CB 1.320 C: 14 20.010 2.270 0.124 0.902 1.000 0.923 CB 1.551 14 residues pruned to eliminate duplicates D: 17 43.194 2.373 1.028 0.876 0.938 0.812 CB 1.739 E: 30 68.546 2.419 1.021 0.933 0.966 0.724 CB 1.882 F: 24 48.438 2.421 0.835 0.935 0.957 0.652 CB 1.657 G: 26 48.086 2.296 1.125 0.891 0.920 0.560 CB 1.540 24 residues pruned to eliminate duplicates H: 32 58.020 2.360 0.975 0.891 0.903 0.581 CB 1.780 30 residues pruned to eliminate duplicates I: 23 49.078 2.374 0.826 0.830 1.000 0.727 CA 1.816 J: 16 51.093 2.500 1.045 0.922 1.000 0.533 CB 1.814 K: 30 64.134 2.354 1.105 0.906 0.966 0.759 CB 1.771 30 residues pruned to eliminate duplicates L: 30 61.512 2.415 0.899 0.922 0.966 0.724 CB 1.814 30 residues pruned to eliminate duplicates M: 17 36.155 2.360 0.655 0.942 1.000 0.812 CB 1.605 17 residues pruned to eliminate duplicates N: 67 55.734 2.334 0.880 0.625 0.939 0.667 CB 1.479 23 residues pruned to eliminate duplicates O: 18 40.559 2.187 1.084 0.875 1.000 0.882 CB 1.570 19 residues pruned to eliminate duplicates P: 15 49.185 2.543 0.891 0.930 1.000 0.857 CB 1.912 15 residues pruned to eliminate duplicates Q: 76 68.625 2.444 0.777 0.619 0.933 0.760 CB 1.746 26 residues pruned to eliminate duplicates R: 23 53.804 2.485 1.030 0.923 0.955 0.682 CB 1.673 26 residues pruned to eliminate duplicates S: 30 56.770 2.349 0.838 0.891 0.966 0.793 CB 1.818 T: 14 22.133 2.320 0.233 0.920 1.000 0.923 CB 1.511 14 residues pruned to eliminate duplicates U: 32 64.011 2.378 0.984 0.925 0.935 0.742 CB 1.829 32 residues pruned to eliminate duplicates V: 32 53.274 2.281 0.735 0.885 0.968 0.774 CB 1.803 32 residues pruned to eliminate duplicates W: 18 33.938 2.252 0.876 0.897 0.941 0.882 CB 1.482 18 residues pruned to eliminate duplicates X: 31 65.946 2.425 0.966 0.897 0.967 0.700 CB 1.870 32 residues pruned to eliminate duplicates Y: 17 31.765 2.326 0.494 0.892 0.938 0.750 CB 1.751 Z: 14 27.599 2.183 0.574 0.886 0.923 0.846 CB 1.741 Z: 20 43.375 2.385 0.763 0.846 0.947 0.789 CB 1.856 20 residues pruned to eliminate duplicates Z: 16 38.720 2.532 0.607 0.925 1.000 0.933 CB 1.724 Z: 24 50.696 2.438 0.987 0.937 0.957 0.783 CB 1.588 24 residues pruned to eliminate duplicates Z: 25 56.672 2.360 1.191 0.916 0.958 0.542 CB 1.649 24 residues pruned to eliminate duplicates Z: 15 29.246 2.290 0.474 0.893 1.000 0.786 CB 1.662 13 residues pruned to eliminate duplicates Z: 15 40.064 2.411 0.733 0.912 1.000 0.786 CB 1.816 Z: 17 47.778 2.405 1.050 0.931 1.000 0.875 CB 1.694 17 residues pruned to eliminate duplicates Z: 16 51.096 2.449 0.997 0.926 1.000 0.933 CB 1.892 16 residues pruned to eliminate duplicates Z: 24 38.652 2.504 0.757 0.709 0.913 0.565 CB 1.659 16 residues pruned to eliminate duplicates Z: 14 29.743 2.244 0.827 0.868 1.000 0.769 CB 1.471 Z: 17 46.608 2.351 1.165 0.895 0.938 0.750 CB 1.750 17 residues pruned to eliminate duplicates Z: 15 44.984 2.486 1.073 0.932 1.000 0.714 CB 1.630 Z: 31 32.290 2.242 0.695 0.797 0.833 0.600 CB 1.435 23 residues pruned to eliminate duplicates Z: 14 31.221 2.388 0.631 0.861 0.923 0.769 CB 1.769 14 residues pruned to eliminate duplicates Z: 30 50.525 2.303 0.565 0.930 1.000 0.897 CB 1.821 30 residues pruned to eliminate duplicates Z: 8 26.467 2.446 0.599 0.907 1.000 0.714 CB 1.818 8 residues pruned to eliminate duplicates Z: 13 36.657 2.446 0.901 0.872 1.000 0.667 CB 1.658 14 residues pruned to eliminate duplicates Z: 26 50.167 2.289 0.966 0.877 0.960 0.680 CB 1.687 26 residues pruned to eliminate duplicates Z: 32 47.473 2.290 0.493 0.898 1.000 0.806 CB 1.783 32 residues pruned to eliminate duplicates Z: 152 87.484 2.334 0.822 0.635 0.927 0.675 CB 1.591 73 residues pruned to eliminate duplicates Z: 22 37.830 2.475 0.579 0.870 0.905 0.810 CB 1.704 22 residues pruned to eliminate duplicates Z: 15 31.987 2.175 1.034 0.897 1.000 0.857 CB 1.383 14 residues pruned to eliminate duplicates Z: 16 36.320 2.258 0.754 0.885 0.933 0.867 CB 1.832 16 residues pruned to eliminate duplicates Z: 31 70.066 2.404 1.052 0.944 1.000 0.767 CB 1.797 31 residues pruned to eliminate duplicates Z: 35 37.777 2.294 0.546 0.679 1.000 0.765 CB 1.549 35 residues pruned to eliminate duplicates Z: 24 53.532 2.418 1.049 0.939 0.957 0.652 CB 1.637 24 residues pruned to eliminate duplicates Z: 14 29.150 2.354 0.634 0.888 1.000 0.615 CB 1.515 13 residues pruned to eliminate duplicates Z: 15 38.043 2.498 0.673 0.921 1.000 0.714 CB 1.712 15 residues pruned to eliminate duplicates Z: 8 18.618 2.303 0.205 0.900 1.000 0.857 CB 1.810 8 residues pruned to eliminate duplicates Z: 30 67.921 2.417 1.070 0.923 0.966 0.690 CB 1.834 30 residues pruned to eliminate duplicates Z: 25 43.443 2.336 0.627 0.909 0.958 0.875 CB 1.729 25 residues pruned to eliminate duplicates Z: 16 46.714 2.382 1.000 0.919 0.933 0.733 CB 1.912 16 residues pruned to eliminate duplicates Z: 16 24.738 2.262 0.538 0.822 0.800 0.800 CB 1.737 16 residues pruned to eliminate duplicates Z: 29 57.937 2.280 0.857 0.917 1.000 0.786 CA 1.825 28 residues pruned to eliminate duplicates Z: 17 31.634 2.164 0.789 0.915 0.938 0.688 CA 1.540 17 residues pruned to eliminate duplicates Z: 28 62.081 2.350 0.945 0.929 1.000 0.889 CB 1.830 28 residues pruned to eliminate duplicates Z: 16 32.514 2.408 0.703 0.884 0.933 0.867 CB 1.585 16 residues pruned to eliminate duplicates Z: 16 28.229 2.249 0.488 0.894 1.000 0.800 CB 1.563 Z: 19 52.029 2.339 1.158 0.913 1.000 0.833 CB 1.719 16 residues pruned to eliminate duplicates Z: 21 43.221 2.388 0.749 0.860 0.950 0.550 CB 1.792 21 residues pruned to eliminate duplicates Z: 16 44.586 2.395 1.013 0.914 1.000 0.800 CB 1.689 16 residues pruned to eliminate duplicates Z: 16 27.505 2.259 0.455 0.878 1.000 0.800 CB 1.568 15 residues pruned to eliminate duplicates Z: 12 24.658 2.461 0.284 0.884 1.000 0.727 CB 1.700 12 residues pruned to eliminate duplicates Z: 31 51.725 2.287 0.697 0.850 1.000 0.767 CB 1.802 31 residues pruned to eliminate duplicates Z: 18 39.858 2.281 0.930 0.908 1.000 0.941 CB 1.559 18 residues pruned to eliminate duplicates Z: 30 44.660 2.333 0.420 0.872 0.966 0.793 CB 1.890 30 residues pruned to eliminate duplicates Z: 17 37.214 2.293 0.670 0.908 1.000 0.875 CA 1.725 17 residues pruned to eliminate duplicates Z: 17 32.708 2.218 0.589 0.924 1.000 0.812 CB 1.629 16 residues pruned to eliminate duplicates Z: 51 44.566 2.367 0.678 0.540 0.920 0.660 CB 1.659 51 residues pruned to eliminate duplicates Z: 31 57.269 2.330 0.841 0.899 0.967 0.767 CB 1.801 30 residues pruned to eliminate duplicates Z: 25 51.099 2.321 0.992 0.934 0.958 0.708 CB 1.642 25 residues pruned to eliminate duplicates Z: 15 29.161 2.324 0.572 0.906 0.929 0.786 CB 1.634 15 residues pruned to eliminate duplicates Z: 23 46.918 2.391 0.799 0.837 0.955 0.636 CB 1.822 23 residues pruned to eliminate duplicates Z: 16 44.281 2.536 0.863 0.931 1.000 0.933 CB 1.692 16 residues pruned to eliminate duplicates Z: 34 26.451 2.145 0.565 0.572 0.879 0.636 CB 1.456 16 residues pruned to eliminate duplicates Z: 17 48.265 2.366 0.917 0.910 1.000 0.750 CB 1.886 15 residues pruned to eliminate duplicates Z: 14 30.442 2.404 0.583 0.859 0.923 0.692 CB 1.768 14 residues pruned to eliminate duplicates Z: 21 39.368 2.215 1.042 0.918 0.900 0.550 CB 1.525 Z: 77 84.926 2.447 0.917 0.744 0.934 0.711 CB 1.786 77 residues pruned to eliminate duplicates Z: 14 27.005 2.371 0.557 0.854 0.923 0.692 CA 1.624 14 residues pruned to eliminate duplicates Z: 17 31.650 2.292 0.644 0.868 0.938 0.688 CB 1.637 17 residues pruned to eliminate duplicates Z: 28 58.314 2.345 0.914 0.913 0.926 0.815 CB 1.912 28 residues pruned to eliminate duplicates Z: 33 44.485 2.218 0.503 0.885 0.969 0.750 CB 1.758 33 residues pruned to eliminate duplicates Z: 30 66.452 2.391 1.159 0.898 0.931 0.586 CB 1.836 30 residues pruned to eliminate duplicates Z: 16 29.588 2.267 0.496 0.913 1.000 0.867 CB 1.594 16 residues pruned to eliminate duplicates Z: 16 43.750 2.341 0.876 0.937 1.000 0.933 CA 1.790 16 residues pruned to eliminate duplicates Z: 18 25.696 2.149 0.695 0.576 0.882 0.647 CB 1.802 18 residues pruned to eliminate duplicates Z: 30 55.414 2.402 0.684 0.923 0.966 0.862 CB 1.851 30 residues pruned to eliminate duplicates Z: 12 28.232 2.130 0.793 0.894 1.000 0.455 CB 1.599 Z: 31 54.194 2.335 0.691 0.877 1.000 0.867 CB 1.821 31 residues pruned to eliminate duplicates Z: 39 41.517 2.316 0.801 0.617 0.947 0.579 CB 1.525 16 residues pruned to eliminate duplicates Z: 22 29.114 2.159 0.478 0.880 0.905 0.810 CB 1.595 22 residues pruned to eliminate duplicates Z: 16 50.160 2.438 1.046 0.925 1.000 0.733 CB 1.822 16 residues pruned to eliminate duplicates Z: 15 25.050 2.203 0.653 0.899 1.000 0.929 CB 1.314 15 residues pruned to eliminate duplicates Z: 42 47.540 2.399 0.713 0.652 0.927 0.683 CB 1.692 42 residues pruned to eliminate duplicates Z: 15 49.068 2.487 0.913 0.917 1.000 0.714 CB 1.945 15 residues pruned to eliminate duplicates Z: 17 47.475 2.255 1.345 0.916 1.000 0.688 CB 1.586 17 residues pruned to eliminate duplicates Z: 33 40.647 2.261 0.966 0.613 0.875 0.625 CB 1.659 17 residues pruned to eliminate duplicates Z: 8 15.273 1.953 0.602 0.801 1.000 0.857 CB 1.418 Z: 31 50.580 2.307 0.621 0.883 0.967 0.800 CB 1.846 31 residues pruned to eliminate duplicates Z: 34 45.694 2.404 0.882 0.589 0.939 0.485 CB 1.719 34 residues pruned to eliminate duplicates Z: 21 32.496 2.162 0.596 0.916 0.950 0.850 CB 1.565 21 residues pruned to eliminate duplicates Z: 16 40.417 2.256 0.869 0.933 0.933 0.867 CA 1.851 16 residues pruned to eliminate duplicates Z: 41 50.746 2.443 0.851 0.646 0.875 0.750 CB 1.769 41 residues pruned to eliminate duplicates Z: 17 45.792 2.382 0.834 0.924 1.000 1.000 CB 1.840 17 residues pruned to eliminate duplicates Z: 16 34.693 2.369 0.525 0.906 1.000 0.867 CB 1.763 16 residues pruned to eliminate duplicates Z: 13 11.468 2.060 0.383 0.534 0.833 0.500 CB 1.348 Z: 64 43.310 2.268 0.724 0.531 0.889 0.651 CB 1.524 60 residues pruned to eliminate duplicates Z: 15 36.556 2.329 0.662 0.901 1.000 0.929 CB 1.801 15 residues pruned to eliminate duplicates Z: 15 28.034 2.220 0.459 0.827 1.000 0.643 CA 1.743 15 residues pruned to eliminate duplicates Z: 7 12.770 2.051 0.256 0.858 1.000 1.000 CB 1.490 7 residues pruned to eliminate duplicates Z: 16 25.372 2.215 0.614 0.872 0.933 0.800 CB 1.432 16 residues pruned to eliminate duplicates Z: 25 45.778 2.330 0.753 0.903 0.958 0.833 CB 1.702 25 residues pruned to eliminate duplicates Z: 13 24.932 2.191 0.746 0.821 0.917 0.750 CB 1.554 12 residues pruned to eliminate duplicates Z: 31 45.011 2.251 0.518 0.863 0.967 0.800 CB 1.825 31 residues pruned to eliminate duplicates Z: 151 92.623 2.456 0.751 0.608 0.913 0.653 CB 1.738 133 residues pruned to eliminate duplicates Z: 12 35.933 2.483 0.837 0.911 1.000 0.818 CB 1.684 13 residues pruned to eliminate duplicates Z: 26 39.264 2.199 0.517 0.892 0.960 0.920 CB 1.761 26 residues pruned to eliminate duplicates Z: 17 58.412 2.385 1.373 0.937 0.938 0.812 CB 1.915 17 residues pruned to eliminate duplicates Z: 17 42.285 2.336 0.830 0.907 1.000 0.938 CA 1.758 17 residues pruned to eliminate duplicates Z: 32 63.217 2.406 0.919 0.907 0.935 0.613 CB 1.869 32 residues pruned to eliminate duplicates Z: 14 33.056 2.291 0.912 0.846 0.923 0.769 CB 1.686 14 residues pruned to eliminate duplicates Z: 30 60.822 2.409 0.801 0.931 0.966 0.862 CB 1.884 30 residues pruned to eliminate duplicates Z: 14 30.119 2.366 0.398 0.898 1.000 0.846 CA 1.807 14 residues pruned to eliminate duplicates Z: 102 81.238 2.405 0.843 0.667 0.881 0.723 CB 1.774 102 residues pruned to eliminate duplicates Z: 7 17.206 2.021 1.102 0.826 0.833 0.667 CB 1.497 7 residues pruned to eliminate duplicates Z: 14 23.581 2.271 0.341 0.879 1.000 0.846 CB 1.558 14 residues pruned to eliminate duplicates Z: 55 46.692 2.350 0.670 0.553 0.926 0.630 CB 1.661 54 residues pruned to eliminate duplicates Z: 22 38.569 2.107 0.825 0.918 1.000 0.810 CB 1.544 21 residues pruned to eliminate duplicates Z: 31 60.196 2.350 0.880 0.893 0.967 0.833 CB 1.848 31 residues pruned to eliminate duplicates Z: 22 43.974 2.372 0.716 0.864 0.952 0.810 CB 1.815 22 residues pruned to eliminate duplicates Z: 29 60.705 2.368 0.879 0.900 1.000 0.821 CB 1.842 30 residues pruned to eliminate duplicates Z: 32 34.762 2.279 0.779 0.614 0.903 0.613 CB 1.531 29 residues pruned to eliminate duplicates Z: 97 87.838 2.458 0.973 0.670 0.917 0.583 CB 1.724 97 residues pruned to eliminate duplicates Z: 14 44.630 2.478 0.912 0.941 1.000 1.000 CB 1.814 14 residues pruned to eliminate duplicates Z: 17 34.142 2.269 0.900 0.836 0.938 0.625 CB 1.581 17 residues pruned to eliminate duplicates Z: 15 49.001 2.502 1.129 0.944 1.000 0.929 CB 1.702 15 residues pruned to eliminate duplicates Z: 31 49.996 2.296 0.679 0.855 0.967 0.800 CB 1.808 31 residues pruned to eliminate duplicates Z: 13 19.998 2.167 0.784 0.796 0.750 0.583 CB 1.536 13 residues pruned to eliminate duplicates Z: 28 52.047 2.338 0.672 0.932 1.000 0.852 CA 1.790 28 residues pruned to eliminate duplicates Z: 6 12.601 2.020 0.444 0.853 1.000 0.600 CA 1.429 6 residues pruned to eliminate duplicates Z: 24 40.509 2.361 0.677 0.829 0.957 0.739 CB 1.678 24 residues pruned to eliminate duplicates Z: 16 41.702 2.377 0.903 0.926 1.000 0.800 CB 1.670 16 residues pruned to eliminate duplicates Z: 24 40.320 2.273 0.707 0.835 0.957 0.826 CA 1.696 24 residues pruned to eliminate duplicates Z: 8 7.247 1.821 0.230 0.702 0.857 0.714 CA 1.186 8 residues pruned to eliminate duplicates Z: 40 41.176 2.301 0.867 0.608 0.974 0.667 CB 1.422 40 residues pruned to eliminate duplicates Z: 50 30.849 2.154 0.564 0.529 0.918 0.714 CB 1.384 50 residues pruned to eliminate duplicates Z: 17 34.939 2.300 0.514 0.922 1.000 0.875 CB 1.764 17 residues pruned to eliminate duplicates Z: 7 10.213 1.961 0.595 0.712 0.833 0.667 CA 1.319 7 residues pruned to eliminate duplicates Z: 28 57.034 2.290 0.762 0.944 1.000 0.926 CB 1.884 28 residues pruned to eliminate duplicates Z: 31 42.140 2.277 0.438 0.891 0.933 0.833 CB 1.809 31 residues pruned to eliminate duplicates Z: 13 19.030 2.099 0.686 0.704 0.833 0.500 CA 1.547 13 residues pruned to eliminate duplicates Z: 21 45.921 2.347 1.005 0.855 0.900 0.500 CB 1.789 21 residues pruned to eliminate duplicates Z: 14 26.580 2.252 0.549 0.870 0.923 0.769 CB 1.672 14 residues pruned to eliminate duplicates Z: 17 29.654 2.248 0.431 0.899 1.000 0.812 CA 1.647 17 residues pruned to eliminate duplicates Z: 17 25.347 2.146 0.227 0.925 1.000 0.875 CB 1.688 17 residues pruned to eliminate duplicates Z: 17 37.429 2.282 0.673 0.920 1.000 0.875 CB 1.727 19 residues pruned to eliminate duplicates Z: 22 36.053 2.292 0.610 0.849 0.905 0.619 CB 1.746 22 residues pruned to eliminate duplicates Z: 18 30.760 2.104 0.652 0.880 1.000 0.824 CB 1.556 18 residues pruned to eliminate duplicates Z: 40 42.826 2.450 0.598 0.660 0.923 0.795 CB 1.636 40 residues pruned to eliminate duplicates Z: 12 21.152 2.326 0.397 0.866 0.909 0.636 CB 1.580 12 residues pruned to eliminate duplicates Z: 21 35.986 2.170 0.797 0.926 0.950 0.850 CB 1.523 21 residues pruned to eliminate duplicates Z: 43 33.400 2.251 0.583 0.560 0.929 0.643 CB 1.470 39 residues pruned to eliminate duplicates Z: 27 50.076 2.400 0.608 0.920 0.962 0.846 CA 1.864 27 residues pruned to eliminate duplicates Z: 91 88.723 2.491 0.853 0.718 0.944 0.722 CB 1.762 91 residues pruned to eliminate duplicates Z: 32 29.758 2.229 0.852 0.544 0.806 0.452 CB 1.537 32 residues pruned to eliminate duplicates Z: 28 61.765 2.413 0.949 0.926 0.926 0.889 CB 1.914 28 residues pruned to eliminate duplicates Z: 29 55.704 2.215 0.950 0.941 1.000 0.750 CB 1.691 29 residues pruned to eliminate duplicates Z: 16 38.033 2.408 0.678 0.895 1.000 0.733 CA 1.742 16 residues pruned to eliminate duplicates Z: 32 51.696 2.246 0.652 0.890 1.000 0.742 CB 1.800 32 residues pruned to eliminate duplicates Z: 14 28.180 2.273 0.743 0.937 1.000 0.846 CB 1.373 14 residues pruned to eliminate duplicates Z: 31 48.824 2.361 0.595 0.891 0.933 0.767 CB 1.824 31 residues pruned to eliminate duplicates Z: 13 41.344 2.434 1.144 0.879 1.000 0.833 CB 1.659 14 residues pruned to eliminate duplicates Z: 18 23.443 2.099 0.613 0.824 0.941 0.882 CB 1.348 18 residues pruned to eliminate duplicates Z: 20 35.903 2.178 0.872 0.907 0.947 0.737 CB 1.515 20 residues pruned to eliminate duplicates Z: 14 31.379 2.251 0.598 0.904 1.000 0.769 CB 1.723 14 residues pruned to eliminate duplicates Z: 42 53.200 2.455 0.987 0.643 0.854 0.683 CB 1.745 42 residues pruned to eliminate duplicates Z: 16 34.029 2.171 0.919 0.911 1.000 0.733 CB 1.494 16 residues pruned to eliminate duplicates Z: 12 30.429 2.447 0.607 0.868 1.000 0.818 CB 1.705 12 residues pruned to eliminate duplicates Z: 100 87.599 2.490 0.818 0.677 0.919 0.727 CB 1.798 100 residues pruned to eliminate duplicates Z: 14 35.009 2.377 1.104 0.921 0.923 0.615 CB 1.480 14 residues pruned to eliminate duplicates Z: 25 58.800 2.374 1.144 0.938 1.000 0.500 CB 1.640 26 residues pruned to eliminate duplicates Z: 20 32.866 2.182 0.688 0.941 0.947 0.737 CB 1.500 20 residues pruned to eliminate duplicates Z: 30 47.469 2.426 0.749 0.772 0.966 0.793 CB 1.692 30 residues pruned to eliminate duplicates Z: 16 19.354 2.214 0.417 0.916 0.933 0.933 CB 1.205 16 residues pruned to eliminate duplicates Z: 137 94.163 2.487 0.785 0.616 0.919 0.713 CB 1.773 137 residues pruned to eliminate duplicates Z: 14 27.648 2.477 0.653 0.538 0.923 0.385 CB 1.954 14 residues pruned to eliminate duplicates Z: 76 69.472 2.453 0.793 0.632 0.920 0.747 CB 1.751 75 residues pruned to eliminate duplicates Z: 12 29.411 2.140 0.977 0.880 1.000 0.727 CB 1.520 Z: 28 60.354 2.358 1.006 0.923 0.926 0.778 CB 1.864 28 residues pruned to eliminate duplicates Z: 162 114.284 2.466 0.899 0.681 0.938 0.621 CB 1.736 162 residues pruned to eliminate duplicates Z: 30 59.181 2.357 0.967 0.889 0.966 0.931 CB 1.767 30 residues pruned to eliminate duplicates Z: 8 8.314 1.913 0.202 0.538 0.857 0.571 O 1.536 Z: 31 56.484 2.407 0.705 0.915 0.967 0.833 CB 1.838 31 residues pruned to eliminate duplicates Z: 31 61.979 2.309 0.938 0.895 1.000 0.500 CB 1.812 31 residues pruned to eliminate duplicates Z: 23 49.715 2.340 0.928 0.828 0.955 0.682 CB 1.854 23 residues pruned to eliminate duplicates Z: 12 18.617 2.199 0.597 0.717 1.000 0.818 CB 1.313 12 residues pruned to eliminate duplicates Z: 30 49.546 2.349 0.597 0.873 0.966 0.793 CB 1.850 30 residues pruned to eliminate duplicates Z: 14 22.650 2.057 0.518 0.879 0.923 0.769 CA 1.580 14 residues pruned to eliminate duplicates Z: 16 23.797 2.163 0.571 0.860 0.867 0.667 CA 1.535 16 residues pruned to eliminate duplicates Z: 8 9.006 1.715 0.530 0.740 0.857 0.714 CB 1.220 8 residues pruned to eliminate duplicates Z: 23 38.596 2.076 1.068 0.907 0.955 0.682 CB 1.428 23 residues pruned to eliminate duplicates Z: 29 62.754 2.429 1.043 0.911 0.929 0.536 CB 1.824 29 residues pruned to eliminate duplicates Z: 9 12.655 1.748 0.496 0.725 1.000 0.625 CA 1.396 8 residues pruned to eliminate duplicates Z: 90 92.032 2.415 0.932 0.738 0.933 0.753 CB 1.811 90 residues pruned to eliminate duplicates Z: 11 23.689 2.366 0.744 0.668 1.000 0.900 CB 1.554 11 residues pruned to eliminate duplicates Z: 24 55.670 2.434 1.169 0.941 0.957 0.522 CB 1.596 24 residues pruned to eliminate duplicates Z: 44 41.296 2.339 0.797 0.502 0.860 0.628 CB 1.738 44 residues pruned to eliminate duplicates Z: 24 50.055 2.404 0.741 0.939 1.000 0.957 CB 1.732 24 residues pruned to eliminate duplicates Z: 13 17.722 2.203 0.355 0.841 0.833 0.667 CB 1.533 13 residues pruned to eliminate duplicates Z: 16 34.902 2.297 0.771 0.880 1.000 0.667 CB 1.605 16 residues pruned to eliminate duplicates Z: 31 55.095 2.316 0.835 0.890 0.967 0.733 CB 1.761 31 residues pruned to eliminate duplicates Z: 17 26.353 2.153 0.506 0.891 1.000 0.875 CB 1.462 17 residues pruned to eliminate duplicates Z: 14 22.907 1.988 0.811 0.866 0.923 0.769 CB 1.400 14 residues pruned to eliminate duplicates Z: 18 28.971 2.115 0.786 0.835 1.000 0.647 CB 1.394 18 residues pruned to eliminate duplicates Z: 31 53.532 2.321 0.721 0.893 0.967 0.833 CB 1.817 31 residues pruned to eliminate duplicates Z: 30 46.892 2.360 0.839 0.740 0.931 0.655 CB 1.738 30 residues pruned to eliminate duplicates Z: 25 32.437 2.293 0.734 0.640 0.958 0.667 CB 1.525 25 residues pruned to eliminate duplicates Z: 13 22.987 2.229 0.306 0.911 1.000 0.917 CB 1.616 13 residues pruned to eliminate duplicates Z: 31 62.844 2.327 0.908 0.911 1.000 0.567 CB 1.831 30 residues pruned to eliminate duplicates Z: 11 30.473 2.277 0.831 0.924 1.000 0.900 CB 1.623 11 residues pruned to eliminate duplicates Z: 87 77.994 2.412 0.819 0.678 0.930 0.721 CB 1.750 87 residues pruned to eliminate duplicates Z: 7 10.392 1.966 0.810 0.403 0.833 0.167 CA 1.584 Z: 16 28.892 2.199 0.940 0.919 1.000 0.733 CB 1.232 16 residues pruned to eliminate duplicates Z: 67 59.355 2.309 0.939 0.622 0.924 0.652 CB 1.573 67 residues pruned to eliminate duplicates Z: 24 51.697 2.413 0.804 0.923 0.957 0.870 CA 1.819 24 residues pruned to eliminate duplicates Z: 30 34.003 2.349 0.673 0.584 0.897 0.655 CB 1.654 30 residues pruned to eliminate duplicates Z: 55 47.246 2.401 0.672 0.590 0.907 0.704 CB 1.620 55 residues pruned to eliminate duplicates Z: 21 48.117 2.525 0.747 0.828 0.950 0.800 CB 1.934 21 residues pruned to eliminate duplicates Z: 15 23.077 2.223 0.484 0.917 1.000 0.786 CB 1.319 15 residues pruned to eliminate duplicates Z: 30 60.482 2.422 0.863 0.926 0.966 0.862 CB 1.808 30 residues pruned to eliminate duplicates Z: 44 51.271 2.393 0.780 0.628 1.000 0.698 CB 1.627 44 residues pruned to eliminate duplicates Z: 14 31.496 2.393 0.733 0.834 0.923 0.615 CB 1.710 14 residues pruned to eliminate duplicates Z: 21 28.776 2.260 0.826 0.660 0.900 0.500 CB 1.494 21 residues pruned to eliminate duplicates Z: 23 37.195 2.138 0.822 0.927 0.955 0.864 CB 1.494 23 residues pruned to eliminate duplicates Z: 38 40.227 2.285 0.867 0.601 0.973 0.595 CB 1.446 44 residues pruned to eliminate duplicates Z: 14 29.757 2.334 0.646 0.880 1.000 0.846 CB 1.557 14 residues pruned to eliminate duplicates Z: 10 16.330 2.028 0.649 0.855 1.000 0.778 CB 1.201 9 residues pruned to eliminate duplicates Z: 147 93.831 2.428 0.744 0.639 0.938 0.712 CB 1.715 150 residues pruned to eliminate duplicates Z: 13 18.324 2.262 0.275 0.866 0.833 0.833 CB 1.612 13 residues pruned to eliminate duplicates Z: 28 47.136 2.259 0.617 0.922 0.963 0.815 CB 1.814 28 residues pruned to eliminate duplicates Z: 9 9.543 2.263 0.376 0.433 0.750 0.500 CA 1.547 9 residues pruned to eliminate duplicates Z: 13 18.660 2.108 0.587 0.625 0.917 0.500 CB 1.562 13 residues pruned to eliminate duplicates Z: 20 45.005 2.388 0.753 0.839 1.000 0.737 CB 1.841 20 residues pruned to eliminate duplicates Z: 12 22.294 2.258 0.853 0.668 1.000 0.727 CB 1.375 12 residues pruned to eliminate duplicates Z: 14 44.697 2.502 1.089 0.948 1.000 0.769 CB 1.638 14 residues pruned to eliminate duplicates Z: 14 34.710 2.297 0.917 0.871 1.000 0.615 CA 1.595 14 residues pruned to eliminate duplicates Z: 9 12.074 2.048 0.070 0.797 0.875 0.500 CB 1.717 9 residues pruned to eliminate duplicates Z: 14 36.028 2.323 0.756 0.926 1.000 0.846 CB 1.718 14 residues pruned to eliminate duplicates Z: 30 51.766 2.303 0.923 0.874 0.897 0.448 CB 1.762 31 residues pruned to eliminate duplicates Z: 7 6.755 1.608 0.534 0.741 0.833 0.667 CB 1.080 7 residues pruned to eliminate duplicates Z: 34 36.588 2.253 0.761 0.610 0.939 0.636 CB 1.540 34 residues pruned to eliminate duplicates Z: 16 38.076 2.362 0.639 0.929 1.000 0.933 CB 1.778 16 residues pruned to eliminate duplicates Z: 29 59.552 2.309 0.957 0.925 0.964 0.786 CA 1.812 29 residues pruned to eliminate duplicates Z: 9 2.804 1.754 0.371 0.154 0.750 0.250 N 0.840 Z: 62 44.358 2.198 0.601 0.643 0.934 0.689 CB 1.511 62 residues pruned to eliminate duplicates Z: 7 7.437 1.986 0.001 0.496 1.000 0.500 CB 1.533 3 residues pruned to eliminate duplicates Z: 22 34.536 2.135 0.775 0.919 0.952 0.714 CB 1.471 22 residues pruned to eliminate duplicates Z: 10 13.501 1.967 0.547 0.608 0.889 0.778 CB 1.502 Z: 29 64.200 2.303 1.072 0.928 0.964 0.393 CA 1.846 29 residues pruned to eliminate duplicates Z: 18 40.521 2.172 1.097 0.903 1.000 0.706 CB 1.538 18 residues pruned to eliminate duplicates Z: 23 37.448 2.424 0.609 0.826 0.864 0.636 CB 1.788 23 residues pruned to eliminate duplicates Z: 9 15.577 2.132 0.224 0.890 0.875 0.750 CB 1.734 9 residues pruned to eliminate duplicates Z: 6 11.329 2.033 0.449 0.753 1.000 0.800 CA 1.373 6 residues pruned to eliminate duplicates Z: 42 53.697 2.453 0.897 0.683 0.902 0.732 CB 1.689 42 residues pruned to eliminate duplicates Z: 51 58.322 2.439 0.815 0.635 0.960 0.740 CB 1.710 51 residues pruned to eliminate duplicates Z: 15 19.797 1.937 0.334 0.919 0.929 0.857 CB 1.553 Z: 40 25.171 1.954 0.589 0.564 0.949 0.615 CB 1.285 35 residues pruned to eliminate duplicates Z: 44 35.939 2.109 0.769 0.611 0.930 0.698 CB 1.422 26 residues pruned to eliminate duplicates Z: 10 18.499 2.378 0.600 0.885 0.778 0.556 CB 1.504 10 residues pruned to eliminate duplicates Z: 12 14.789 2.031 0.359 0.580 1.000 0.727 CB 1.495 12 residues pruned to eliminate duplicates Z: 6 7.248 1.878 0.853 0.722 0.600 0.600 CA 1.270 6 residues pruned to eliminate duplicates Z: 14 20.162 2.057 0.505 0.850 0.923 0.615 CA 1.450 14 residues pruned to eliminate duplicates Z: 15 38.913 2.284 1.017 0.902 1.000 1.000 CB 1.609 15 residues pruned to eliminate duplicates Z: 19 42.832 2.206 1.047 0.913 0.944 0.722 CB 1.676 19 residues pruned to eliminate duplicates Z: 54 42.501 2.370 0.677 0.551 0.887 0.698 CB 1.576 54 residues pruned to eliminate duplicates Z: 16 35.025 2.279 0.721 0.896 1.000 0.867 CB 1.651 16 residues pruned to eliminate duplicates Z: 14 30.179 2.379 0.592 0.865 0.923 0.846 CA 1.755 14 residues pruned to eliminate duplicates Z: 27 36.684 2.334 0.841 0.597 0.923 0.615 CB 1.654 27 residues pruned to eliminate duplicates Z: 13 28.453 2.380 0.600 0.889 1.000 0.833 CB 1.553 13 residues pruned to eliminate duplicates Z: 23 48.636 2.436 0.752 0.942 0.955 0.818 CB 1.766 23 residues pruned to eliminate duplicates Z: 49 34.527 2.144 0.617 0.545 0.958 0.688 CB 1.435 94 residues pruned to eliminate duplicates Z: 27 44.508 2.548 0.780 0.712 0.923 0.769 CB 1.719 27 residues pruned to eliminate duplicates Z: 23 42.879 2.453 0.717 0.798 0.955 0.727 CB 1.751 23 residues pruned to eliminate duplicates Z: 15 14.671 1.786 0.282 0.928 0.929 0.929 CB 1.291 Z: 31 51.173 2.292 0.813 0.894 0.933 0.400 CB 1.727 31 residues pruned to eliminate duplicates Z: 14 24.054 2.118 0.458 0.881 1.000 0.769 CB 1.565 14 residues pruned to eliminate duplicates Z: 37 30.415 2.150 0.638 0.579 0.944 0.667 CB 1.413 37 residues pruned to eliminate duplicates Z: 27 29.543 2.079 0.820 0.632 0.962 0.615 CB 1.407 15 residues pruned to eliminate duplicates Z: 20 38.718 2.192 0.949 0.817 1.000 0.684 CB 1.578 20 residues pruned to eliminate duplicates Z: 30 55.362 2.320 0.972 0.891 0.931 0.517 CB 1.735 30 residues pruned to eliminate duplicates Z: 151 86.156 2.343 0.865 0.613 0.907 0.647 CB 1.596 138 residues pruned to eliminate duplicates Z: 16 20.573 2.125 0.313 0.862 1.000 0.800 CB 1.397 16 residues pruned to eliminate duplicates Z: 52 40.154 2.298 0.682 0.582 0.922 0.667 CB 1.459 52 residues pruned to eliminate duplicates Z: 79 57.804 2.396 0.704 0.547 0.897 0.654 CB 1.705 86 residues pruned to eliminate duplicates Z: 15 26.172 2.229 0.653 0.924 1.000 0.929 CB 1.333 15 residues pruned to eliminate duplicates Z: 29 47.277 2.180 0.651 0.921 1.000 0.929 CB 1.746 29 residues pruned to eliminate duplicates Z: 47 46.927 2.330 0.819 0.519 0.935 0.652 CB 1.714 47 residues pruned to eliminate duplicates Z: 65 65.301 2.480 0.798 0.615 0.938 0.594 CB 1.752 65 residues pruned to eliminate duplicates Z: 49 46.889 2.329 0.848 0.610 0.958 0.625 CB 1.479 47 residues pruned to eliminate duplicates Z: 31 57.631 2.318 0.960 0.892 0.933 0.667 CB 1.783 31 residues pruned to eliminate duplicates Z: 14 18.086 1.955 0.259 0.912 1.000 0.923 CB 1.444 15 residues pruned to eliminate duplicates Z: 6 5.324 2.112 0.174 0.504 0.600 0.600 CB 1.595 6 residues pruned to eliminate duplicates Z: 23 61.249 2.484 1.292 0.943 0.955 0.500 CB 1.666 23 residues pruned to eliminate duplicates Z: 54 45.769 2.280 0.704 0.591 0.943 0.585 CB 1.572 54 residues pruned to eliminate duplicates Z: 13 22.101 2.101 0.753 0.873 0.917 0.750 CB 1.376 14 residues pruned to eliminate duplicates Z: 50 30.393 2.112 0.570 0.485 0.980 0.612 CB 1.357 50 residues pruned to eliminate duplicates Z: 27 37.755 2.396 0.754 0.608 0.923 0.615 CB 1.723 27 residues pruned to eliminate duplicates Z: 14 19.442 1.861 0.622 0.934 1.000 1.000 CB 1.245 15 residues pruned to eliminate duplicates Z: 49 33.206 2.163 0.648 0.523 0.958 0.625 CB 1.372 49 residues pruned to eliminate duplicates Z: 27 51.746 2.321 0.846 0.934 0.962 0.846 CB 1.718 27 residues pruned to eliminate duplicates Z: 28 56.677 2.352 0.841 0.929 1.000 0.852 CA 1.764 28 residues pruned to eliminate duplicates Z: 30 66.887 2.431 1.111 0.924 0.931 0.586 CB 1.826 30 residues pruned to eliminate duplicates Z: 31 52.457 2.429 0.940 0.685 0.967 0.533 CB 1.775 31 residues pruned to eliminate duplicates Z: 18 38.520 2.216 0.832 0.910 1.000 0.765 CB 1.632 18 residues pruned to eliminate duplicates Z: 21 39.727 2.306 0.799 0.866 0.900 0.750 CB 1.741 21 residues pruned to eliminate duplicates Z: 18 35.666 2.155 1.078 0.874 0.882 0.412 CB 1.594 18 residues pruned to eliminate duplicates Z: 19 46.123 2.485 0.930 0.875 0.944 0.833 CB 1.745 19 residues pruned to eliminate duplicates Z: 16 24.966 2.212 0.868 0.893 0.933 0.867 CB 1.200 16 residues pruned to eliminate duplicates Z: 50 39.998 2.246 0.837 0.582 0.939 0.633 CB 1.363 49 residues pruned to eliminate duplicates Z: 25 31.732 2.230 0.717 0.660 0.958 0.667 CB 1.521 26 residues pruned to eliminate duplicates Z: 23 31.770 2.308 0.596 0.797 0.864 0.773 CB 1.642 23 residues pruned to eliminate duplicates Z: 29 49.570 2.315 0.697 0.877 0.964 0.786 CA 1.796 29 residues pruned to eliminate duplicates Z: 15 26.858 1.946 0.918 0.946 0.929 0.786 CB 1.433 14 residues pruned to eliminate duplicates Z: 36 46.515 2.391 0.974 0.604 0.886 0.457 CB 1.704 36 residues pruned to eliminate duplicates Z: 13 24.316 2.214 0.485 0.870 1.000 0.833 CB 1.559 13 residues pruned to eliminate duplicates Z: 25 52.170 2.346 0.856 0.918 1.000 0.958 CB 1.724 25 residues pruned to eliminate duplicates Z: 30 54.321 2.324 0.709 0.886 1.000 0.828 CB 1.832 30 residues pruned to eliminate duplicates Z: 18 34.283 2.203 0.844 0.875 0.941 0.647 CB 1.582 18 residues pruned to eliminate duplicates Z: 17 39.897 2.363 0.560 0.921 1.000 0.938 CA 1.903 17 residues pruned to eliminate duplicates Z: 61 38.948 2.174 0.619 0.612 0.933 0.600 CB 1.378 61 residues pruned to eliminate duplicates Z: 15 33.971 2.564 0.988 0.439 0.929 0.357 CB 2.042 15 residues pruned to eliminate duplicates Z: 140 94.984 2.439 0.798 0.664 0.928 0.712 CB 1.702 140 residues pruned to eliminate duplicates Z: 46 38.410 2.244 0.756 0.614 0.978 0.667 CB 1.333 46 residues pruned to eliminate duplicates Z: 6 11.440 2.050 0.751 0.715 1.000 0.600 CB 1.173 6 residues pruned to eliminate duplicates Z: 14 21.648 1.960 0.483 0.940 1.000 0.923 CB 1.435 14 residues pruned to eliminate duplicates Z: 11 27.254 2.249 0.808 0.871 1.000 0.800 CB 1.546 12 residues pruned to eliminate duplicates 6 1.933 1.877 0.288 0.290 0.600 0.600 CB 0.754 ? Z: 24 33.790 2.144 0.667 0.886 0.957 0.870 CB 1.487 Z: 17 51.034 2.411 1.023 0.909 1.000 0.688 CB 1.857 17 residues pruned to eliminate duplicates Z: 10 7.446 2.209 0.394 0.433 0.556 0.556 CB 1.554 10 residues pruned to eliminate duplicates Z: 13 20.837 2.271 0.369 0.861 0.917 0.667 CB 1.551 13 residues pruned to eliminate duplicates Z: 15 19.291 1.904 0.369 0.896 1.000 0.857 CB 1.416 15 residues pruned to eliminate duplicates Z: 20 23.944 1.975 0.789 0.764 0.895 0.579 CB 1.375 20 residues pruned to eliminate duplicates Z: 32 49.380 2.244 0.629 0.858 1.000 0.871 CB 1.787 32 residues pruned to eliminate duplicates Z: 15 42.546 2.510 1.091 0.870 0.929 0.571 CB 1.704 15 residues pruned to eliminate duplicates Z: 8 14.941 2.369 0.527 0.486 1.000 0.857 CB 1.584 8 residues pruned to eliminate duplicates Z: 104 77.867 2.365 0.842 0.651 0.913 0.602 CB 1.678 104 residues pruned to eliminate duplicates Z: 17 30.922 2.185 0.888 0.876 0.938 0.750 CB 1.452 17 residues pruned to eliminate duplicates Z: 7 10.793 1.954 0.266 0.868 1.000 1.000 CA 1.302 7 residues pruned to eliminate duplicates Z: 13 10.074 1.888 0.465 0.390 1.000 0.583 CB 1.181 Z: 21 23.027 1.968 0.714 0.632 0.950 0.800 CB 1.419 21 residues pruned to eliminate duplicates Z: 35 39.264 2.417 0.672 0.617 0.882 0.618 CB 1.690 35 residues pruned to eliminate duplicates Z: 70 50.593 2.323 0.756 0.538 0.928 0.522 CB 1.551 70 residues pruned to eliminate duplicates Z: 53 78.538 2.416 0.904 0.794 0.981 0.769 CB 1.865 53 residues pruned to eliminate duplicates Z: 15 17.425 2.237 0.497 0.423 1.000 0.500 CB 1.507 15 residues pruned to eliminate duplicates Z: 22 9.569 1.978 0.265 0.398 0.857 0.429 CB 1.085 22 residues pruned to eliminate duplicates Z: 13 26.548 2.079 1.033 0.919 0.833 0.750 CB 1.534 13 residues pruned to eliminate duplicates Z: 15 23.156 1.915 0.608 0.921 0.929 0.786 CB 1.522 15 residues pruned to eliminate duplicates Z: 30 27.637 1.984 0.685 0.647 1.000 0.621 CB 1.339 15 residues pruned to eliminate duplicates Z: 7 5.322 1.582 0.147 0.835 1.000 0.333 CB 0.897 Z: 16 45.788 2.359 1.158 0.938 0.933 0.800 CB 1.729 16 residues pruned to eliminate duplicates Z: 50 48.498 2.402 0.730 0.544 0.939 0.653 CB 1.701 50 residues pruned to eliminate duplicates Z: 24 37.417 2.152 0.779 0.902 0.957 0.652 CB 1.519 24 residues pruned to eliminate duplicates Z: 8 9.959 1.862 0.123 0.891 1.000 1.000 CA 1.294 8 residues pruned to eliminate duplicates Z: 50 47.318 2.417 0.723 0.519 0.939 0.633 CB 1.696 50 residues pruned to eliminate duplicates Z: 29 56.965 2.339 0.879 0.921 0.893 0.714 CB 1.931 29 residues pruned to eliminate duplicates Z: 34 55.211 2.557 0.636 0.673 1.000 0.606 CB 1.958 34 residues pruned to eliminate duplicates Z: 28 50.832 2.255 0.726 0.906 1.000 0.815 CA 1.787 28 residues pruned to eliminate duplicates Z: 51 43.286 2.291 0.839 0.601 0.960 0.680 CB 1.375 51 residues pruned to eliminate duplicates Z: 6 5.596 1.841 -0.147 0.846 1.000 1.000 CB 1.183 Z: 18 35.700 2.088 0.955 0.888 1.000 0.882 CB 1.527 18 residues pruned to eliminate duplicates Z: 9 11.514 2.247 0.177 0.522 0.875 0.750 CB 1.722 9 residues pruned to eliminate duplicates Z: 8 8.087 1.732 0.498 0.748 0.714 0.571 N 1.322 8 residues pruned to eliminate duplicates Z: 129 82.387 2.337 0.847 0.641 0.875 0.586 CB 1.690 129 residues pruned to eliminate duplicates Z: 7 3.263 1.784 -0.035 0.481 0.833 0.333 CB 0.947 Z: 37 43.257 2.307 0.804 0.638 0.972 0.639 CB 1.566 37 residues pruned to eliminate duplicates Z: 29 27.671 2.244 0.427 0.712 0.929 0.750 CB 1.452 29 residues pruned to eliminate duplicates Z: 7 10.955 1.965 0.626 0.719 0.833 0.333 CB 1.378 7 residues pruned to eliminate duplicates Z: 33 52.495 2.226 0.736 0.895 1.000 0.812 CB 1.721 33 residues pruned to eliminate duplicates Z: 53 60.477 2.402 0.810 0.646 0.923 0.577 CB 1.823 53 residues pruned to eliminate duplicates Z: 17 39.124 2.223 1.041 0.884 1.000 0.625 CB 1.558 17 residues pruned to eliminate duplicates Z: 14 19.890 1.853 0.629 0.942 1.000 0.846 CB 1.267 14 residues pruned to eliminate duplicates Z: 106 81.323 2.462 0.811 0.638 0.886 0.657 CB 1.766 106 residues pruned to eliminate duplicates Z: 145 88.547 2.366 0.798 0.648 0.924 0.750 CB 1.637 145 residues pruned to eliminate duplicates Z: 14 18.321 2.178 0.339 0.806 0.923 0.692 CB 1.445 14 residues pruned to eliminate duplicates Z: 13 25.164 2.095 0.766 0.881 1.000 0.833 CB 1.421 13 residues pruned to eliminate duplicates Z: 20 35.375 2.415 0.858 0.823 0.842 0.263 CB 1.623 20 residues pruned to eliminate duplicates Z: 23 46.324 2.389 0.726 0.870 0.955 0.864 CA 1.832 23 residues pruned to eliminate duplicates Z: 22 37.642 2.176 0.752 0.918 0.952 0.762 CB 1.595 22 residues pruned to eliminate duplicates Z: 13 19.073 2.268 0.430 0.874 0.833 0.833 CB 1.483 13 residues pruned to eliminate duplicates Z: 14 30.643 2.408 0.581 0.875 0.923 0.692 CB 1.758 14 residues pruned to eliminate duplicates Z: 61 40.827 2.209 0.841 0.498 0.900 0.600 CB 1.443 61 residues pruned to eliminate duplicates Z: 13 17.326 1.933 0.445 0.828 1.000 0.833 CB 1.348 11 residues pruned to eliminate duplicates Z: 11 6.401 1.604 0.228 0.462 1.000 0.500 CB 1.068 Z: 24 54.224 2.420 1.098 0.937 0.957 0.435 CB 1.620 24 residues pruned to eliminate duplicates Z: 90 83.040 2.392 0.820 0.698 0.933 0.719 CB 1.809 90 residues pruned to eliminate duplicates Z: 17 33.024 2.174 1.012 0.871 0.938 0.750 CB 1.468 17 residues pruned to eliminate duplicates Z: 35 25.713 1.942 0.718 0.637 0.941 0.529 CB 1.236 35 residues pruned to eliminate duplicates Z: 30 16.403 2.083 0.482 0.454 0.862 0.517 CB 1.200 30 residues pruned to eliminate duplicates Z: 17 30.944 2.188 0.797 0.881 1.000 0.875 CB 1.424 17 residues pruned to eliminate duplicates Z: 39 28.347 2.047 0.650 0.575 0.895 0.500 CB 1.415 39 residues pruned to eliminate duplicates Z: 24 48.553 2.398 1.038 0.809 0.870 0.522 CB 1.820 24 residues pruned to eliminate duplicates Z: 14 21.951 2.175 0.486 0.852 0.923 0.769 CA 1.509 14 residues pruned to eliminate duplicates Z: 29 48.122 2.337 0.947 0.711 1.000 0.750 CB 1.650 29 residues pruned to eliminate duplicates Z: 11 24.734 2.263 0.683 0.870 1.000 0.500 CB 1.499 11 residues pruned to eliminate duplicates Z: 14 41.559 2.420 1.037 0.934 0.923 0.923 CB 1.767 14 residues pruned to eliminate duplicates Z: 106 60.647 2.299 0.682 0.575 0.914 0.590 CB 1.557 125 residues pruned to eliminate duplicates Z: 12 5.623 1.768 0.061 0.339 0.818 0.727 CB 1.316 12 residues pruned to eliminate duplicates Z: 71 49.706 2.309 0.699 0.561 0.914 0.643 CB 1.561 71 residues pruned to eliminate duplicates Z: 25 25.897 2.174 0.654 0.673 0.917 0.500 CB 1.366 25 residues pruned to eliminate duplicates Z: 16 35.180 2.246 0.863 0.888 1.000 0.800 CB 1.564 16 residues pruned to eliminate duplicates Z: 18 38.371 2.239 0.895 0.913 1.000 0.529 CB 1.553 18 residues pruned to eliminate duplicates Z: 26 46.814 2.263 0.689 0.919 1.000 0.800 CA 1.727 26 residues pruned to eliminate duplicates Z: 9 5.043 1.742 0.344 0.331 0.750 0.375 CB 1.222 Z: 6 4.120 1.639 -0.040 0.839 0.800 0.800 CB 1.094 6 residues pruned to eliminate duplicates Z: 15 36.512 2.125 1.227 0.942 1.000 0.571 CB 1.430 15 residues pruned to eliminate duplicates Z: 48 45.454 2.294 0.842 0.622 0.957 0.638 CB 1.461 48 residues pruned to eliminate duplicates Z: 10 7.544 1.577 0.431 0.855 0.889 0.667 CB 0.925 10 residues pruned to eliminate duplicates Z: 16 39.086 2.334 1.115 0.843 0.933 0.667 CB 1.632 16 residues pruned to eliminate duplicates Z: 36 46.838 2.338 0.968 0.650 0.971 0.743 CB 1.540 36 residues pruned to eliminate duplicates Z: 16 25.438 2.170 1.099 0.873 0.867 0.667 CB 1.211 16 residues pruned to eliminate duplicates Z: 10 5.836 1.833 0.246 0.552 0.889 0.778 CB 0.911 9 residues pruned to eliminate duplicates Z: 17 43.374 2.296 0.977 0.894 1.000 0.812 CB 1.714 17 residues pruned to eliminate duplicates Z: 42 45.403 2.317 0.868 0.611 0.976 0.659 CB 1.511 42 residues pruned to eliminate duplicates Z: 6 20.696 2.203 1.088 0.781 1.000 0.400 CA 1.570 6 residues pruned to eliminate duplicates Z: 18 37.466 2.121 1.209 0.929 1.000 0.647 CB 1.357 20 residues pruned to eliminate duplicates Z: 16 31.465 2.255 0.761 0.907 1.000 0.733 CB 1.453 16 residues pruned to eliminate duplicates Z: 31 23.325 1.974 0.510 0.593 0.900 0.633 CB 1.452 31 residues pruned to eliminate duplicates Z: 54 46.154 2.278 0.861 0.587 0.906 0.472 CB 1.518 54 residues pruned to eliminate duplicates Z: 38 32.034 2.106 0.643 0.649 0.919 0.622 CB 1.442 60 residues pruned to eliminate duplicates Z: 15 45.066 2.450 1.062 0.919 1.000 0.714 CB 1.680 15 residues pruned to eliminate duplicates Z: 31 54.691 2.501 0.814 0.699 0.967 0.567 CA 1.899 31 residues pruned to eliminate duplicates Z: 18 22.129 2.185 0.710 0.658 0.941 0.706 CB 1.318 25 residues pruned to eliminate duplicates Z: 15 13.300 2.161 0.490 0.350 0.857 0.500 CB 1.515 15 residues pruned to eliminate duplicates Z: 11 29.142 2.241 0.885 0.902 1.000 0.800 CB 1.556 13 residues pruned to eliminate duplicates Z: 30 51.116 2.314 0.818 0.863 0.931 0.621 CB 1.778 30 residues pruned to eliminate duplicates Z: 17 34.571 2.203 0.952 0.861 1.000 0.688 CB 1.476 17 residues pruned to eliminate duplicates Z: 17 19.045 1.803 0.550 0.843 0.875 0.500 CB 1.450 17 residues pruned to eliminate duplicates Z: 26 36.514 2.316 0.865 0.627 0.920 0.640 CB 1.630 26 residues pruned to eliminate duplicates Z: 14 14.326 1.966 0.673 0.476 0.923 0.538 CB 1.341 13 residues pruned to eliminate duplicates Z: 23 34.887 2.126 0.869 0.895 0.909 0.682 CB 1.476 Z: 22 21.754 2.026 0.794 0.553 0.905 0.476 CB 1.371 22 residues pruned to eliminate duplicates Z: 19 18.458 2.028 0.445 0.643 0.889 0.556 CB 1.461 13 residues pruned to eliminate duplicates Z: 15 25.933 2.197 0.772 0.897 0.929 0.857 CB 1.373 15 residues pruned to eliminate duplicates Z: 51 41.636 2.269 0.705 0.612 0.940 0.740 CB 1.457 51 residues pruned to eliminate duplicates Z: 6 11.785 2.024 0.400 0.843 1.000 0.800 CB 1.385 6 residues pruned to eliminate duplicates Z: 9 19.845 2.206 0.946 0.704 0.875 0.625 CB 1.551 9 residues pruned to eliminate duplicates Z: 29 27.488 2.257 0.560 0.398 0.964 0.607 CB 1.702 29 residues pruned to eliminate duplicates Z: 14 24.605 1.966 0.594 0.910 1.000 0.846 CB 1.545 14 residues pruned to eliminate duplicates Z: 21 36.120 2.198 0.814 0.929 0.950 0.600 CB 1.493 22 residues pruned to eliminate duplicates Z: 9 9.048 1.631 0.604 0.738 1.000 0.500 CB 0.987 9 residues pruned to eliminate duplicates Z: 14 18.356 1.859 0.585 0.918 1.000 0.923 CB 1.219 14 residues pruned to eliminate duplicates Z: 6 6.825 1.952 0.275 0.836 0.600 0.400 CB 1.530 Z: 31 20.493 1.862 0.780 0.597 0.933 0.700 CB 1.103 20 residues pruned to eliminate duplicates Z: 55 43.634 2.274 0.790 0.579 0.944 0.759 CB 1.431 55 residues pruned to eliminate duplicates Z: 26 24.982 2.139 0.523 0.603 0.960 0.760 CB 1.448 29 residues pruned to eliminate duplicates Z: 53 48.543 2.391 0.695 0.552 0.942 0.635 CB 1.675 53 residues pruned to eliminate duplicates Z: 9 20.193 2.351 0.320 0.912 1.000 0.875 CB 1.629 9 residues pruned to eliminate duplicates Z: 6 6.653 1.958 0.058 0.847 0.800 0.800 CB 1.332 6 residues pruned to eliminate duplicates Z: 13 10.446 1.684 0.726 0.694 0.917 0.750 CB 0.948 Z: 10 18.894 2.341 0.284 0.874 1.000 0.667 CB 1.524 10 residues pruned to eliminate duplicates Z: 10 21.071 2.086 0.900 0.846 0.889 0.556 CA 1.482 10 residues pruned to eliminate duplicates Z: 7 17.833 2.056 0.743 0.845 1.000 1.000 CA 1.511 7 residues pruned to eliminate duplicates Z: 12 31.795 2.403 0.886 0.879 1.000 0.818 CB 1.534 12 residues pruned to eliminate duplicates Z: 10 19.706 2.292 0.270 0.905 1.000 1.000 CB 1.607 10 residues pruned to eliminate duplicates Z: 15 21.439 1.883 0.550 0.880 0.929 0.857 CB 1.532 15 residues pruned to eliminate duplicates Z: 17 13.736 1.838 0.505 0.641 0.938 0.812 CB 1.162 17 residues pruned to eliminate duplicates Z: 9 8.967 1.965 0.490 0.291 0.875 0.625 CB 1.565 9 residues pruned to eliminate duplicates Z: 7 13.404 2.071 0.307 0.877 1.000 1.000 CB 1.468 7 residues pruned to eliminate duplicates Z: 16 40.573 2.299 1.153 0.916 1.000 0.733 CB 1.495 16 residues pruned to eliminate duplicates Z: 9 9.105 1.741 0.239 0.863 0.875 0.875 N 1.252 9 residues pruned to eliminate duplicates Z: 6 10.193 1.955 0.322 0.715 1.000 0.600 CA 1.451 6 residues pruned to eliminate duplicates Z: 14 18.952 1.855 0.625 0.945 1.000 0.923 CB 1.207 14 residues pruned to eliminate duplicates Z: 55 33.396 2.256 0.540 0.567 0.926 0.685 CB 1.323 55 residues pruned to eliminate duplicates Z: 10 11.510 2.179 0.550 0.343 0.889 0.333 CB 1.517 10 residues pruned to eliminate duplicates Z: 9 5.422 1.666 0.122 0.357 0.875 0.375 O 1.368 Z: 41 23.663 2.013 0.493 0.594 0.875 0.650 CB 1.300 41 residues pruned to eliminate duplicates Z: 17 26.902 2.159 0.689 0.851 0.938 0.688 CB 1.456 17 residues pruned to eliminate duplicates Z: 16 18.767 1.874 0.352 0.885 0.933 0.733 CB 1.480 16 residues pruned to eliminate duplicates Z: 15 24.203 2.212 0.547 0.921 0.929 0.929 CB 1.432 15 residues pruned to eliminate duplicates Z: 11 2.484 1.554 -0.059 0.286 0.600 0.400 CB 1.139 11 residues pruned to eliminate duplicates Z: 47 37.955 2.168 0.684 0.634 0.957 0.739 CB 1.413 39 residues pruned to eliminate duplicates Z: 12 16.781 2.172 0.466 0.921 1.000 0.818 CB 1.118 12 residues pruned to eliminate duplicates Z: 6 9.152 1.882 0.317 0.762 1.000 0.400 CB 1.309 6 residues pruned to eliminate duplicates Z: 27 24.593 2.145 0.564 0.620 0.885 0.654 CB 1.452 27 residues pruned to eliminate duplicates Z: 43 46.620 2.438 0.802 0.480 0.976 0.667 CB 1.712 43 residues pruned to eliminate duplicates Z: 71 91.346 2.517 0.942 0.774 0.943 0.743 CB 1.860 71 residues pruned to eliminate duplicates Z: 6 7.456 1.797 0.386 0.762 1.000 0.600 CA 1.062 6 residues pruned to eliminate duplicates Z: 28 30.155 2.341 0.695 0.531 0.889 0.630 CB 1.596 28 residues pruned to eliminate duplicates Z: 20 24.755 2.045 0.876 0.743 0.842 0.632 CB 1.414 20 residues pruned to eliminate duplicates Z: 7 12.605 1.998 0.305 0.861 1.000 0.833 CB 1.450 7 residues pruned to eliminate duplicates Z: 86 96.929 2.513 0.993 0.720 0.953 0.776 CB 1.806 86 residues pruned to eliminate duplicates Z: 11 7.618 1.815 0.633 0.309 0.900 0.600 CB 1.117 9 residues pruned to eliminate duplicates Z: 17 46.364 2.437 0.918 0.920 1.000 0.750 CB 1.747 17 residues pruned to eliminate duplicates Z: 24 33.402 2.410 0.716 0.663 0.913 0.783 CB 1.587 24 residues pruned to eliminate duplicates Z: 26 29.904 2.405 0.646 0.612 0.800 0.760 CB 1.698 26 residues pruned to eliminate duplicates Z: 13 22.550 2.088 0.748 0.683 1.000 0.500 CA 1.508 13 residues pruned to eliminate duplicates Z: 15 26.842 2.109 1.026 0.915 1.000 0.857 CB 1.187 15 residues pruned to eliminate duplicates Z: 12 20.996 2.229 0.639 0.674 0.909 0.545 CB 1.623 12 residues pruned to eliminate duplicates Z: 14 21.382 1.836 0.809 0.939 1.000 0.769 CB 1.241 14 residues pruned to eliminate duplicates Z: 9 12.983 1.967 0.538 0.668 1.000 0.625 CB 1.299 9 residues pruned to eliminate duplicates Z: 31 50.654 2.561 0.993 0.647 0.933 0.633 CB 1.692 31 residues pruned to eliminate duplicates Z: 15 23.552 1.928 0.639 0.911 1.000 0.857 CB 1.412 15 residues pruned to eliminate duplicates Z: 36 24.642 2.023 0.643 0.566 0.914 0.571 CB 1.286 36 residues pruned to eliminate duplicates Z: 6 6.319 1.655 0.242 0.560 1.000 0.200 O 1.298 6 residues pruned to eliminate duplicates Z: 7 8.073 1.756 0.346 0.849 0.833 0.667 CA 1.241 7 residues pruned to eliminate duplicates Z: 7 11.110 1.775 0.923 0.499 1.000 0.667 CB 1.330 7 residues pruned to eliminate duplicates Z: 38 38.360 2.290 0.742 0.624 0.946 0.784 CB 1.487 38 residues pruned to eliminate duplicates Z: 14 18.611 2.175 0.357 0.829 0.923 0.692 CB 1.427 14 residues pruned to eliminate duplicates Z: 7 10.571 1.906 0.474 0.873 1.000 0.833 CB 1.119 7 residues pruned to eliminate duplicates Z: 6 15.125 2.250 0.780 0.599 0.800 0.600 CA 1.922 6 residues pruned to eliminate duplicates Z: 25 18.877 1.850 0.556 0.700 0.917 0.667 CB 1.217 25 residues pruned to eliminate duplicates Z: 21 23.496 2.159 0.517 0.684 1.000 0.700 CB 1.355 14 residues pruned to eliminate duplicates Z: 12 26.928 2.213 0.690 0.905 1.000 0.909 CB 1.545 11 residues pruned to eliminate duplicates Z: 10 6.864 1.861 0.178 0.412 0.778 0.333 CB 1.471 10 residues pruned to eliminate duplicates Z: 72 57.252 2.404 0.849 0.563 0.887 0.606 CB 1.620 72 residues pruned to eliminate duplicates Z: 13 19.767 2.027 0.573 0.815 1.000 0.583 CB 1.361 13 residues pruned to eliminate duplicates Z: 91 46.675 2.212 0.544 0.529 0.889 0.611 CB 1.574 131 residues pruned to eliminate duplicates Z: 30 57.309 2.297 1.016 0.916 0.966 0.552 CB 1.681 30 residues pruned to eliminate duplicates Z: 7 6.011 1.759 0.035 0.850 0.833 0.833 CB 1.199 7 residues pruned to eliminate duplicates Z: 23 39.918 2.519 0.735 0.754 0.909 0.773 CB 1.708 23 residues pruned to eliminate duplicates Z: 7 4.562 1.845 -0.148 0.724 0.833 0.667 CB 1.161 6 residues pruned to eliminate duplicates Z: 87 93.204 2.465 1.005 0.713 0.942 0.674 CB 1.779 87 residues pruned to eliminate duplicates Z: 15 16.466 1.787 0.539 0.897 1.000 0.714 CB 1.145 15 residues pruned to eliminate duplicates Z: 35 23.567 1.932 0.446 0.604 0.941 0.676 CB 1.393 Z: 14 15.043 2.230 -0.060 0.950 1.000 1.000 CB 1.372 14 residues pruned to eliminate duplicates Z: 14 22.021 1.857 0.856 0.943 1.000 0.769 CB 1.228 14 residues pruned to eliminate duplicates Z: 19 21.703 2.129 0.532 0.591 0.944 0.833 CB 1.523 17 residues pruned to eliminate duplicates Z: 7 8.114 1.843 0.372 0.636 0.833 0.500 CA 1.384 7 residues pruned to eliminate duplicates Z: 6 5.944 1.585 0.559 0.656 0.800 0.600 CA 1.164 Z: 16 31.183 2.256 0.870 0.760 0.933 0.800 CB 1.623 16 residues pruned to eliminate duplicates Z: 11 17.658 2.136 0.710 0.586 0.900 0.700 CB 1.564 11 residues pruned to eliminate duplicates Z: 13 34.051 2.400 0.815 0.872 1.000 0.583 CB 1.646 13 residues pruned to eliminate duplicates Z: 56 43.608 2.222 0.749 0.606 0.909 0.564 CB 1.506 56 residues pruned to eliminate duplicates Z: 69 44.651 2.290 0.657 0.575 0.897 0.603 CB 1.480 69 residues pruned to eliminate duplicates Z: 82 39.316 2.112 0.755 0.545 0.901 0.605 CB 1.252 82 residues pruned to eliminate duplicates Z: 33 53.864 2.306 0.747 0.823 1.000 0.719 CB 1.786 33 residues pruned to eliminate duplicates Z: 139 91.706 2.475 0.758 0.606 0.928 0.674 CB 1.748 139 residues pruned to eliminate duplicates Z: 14 20.281 1.855 0.770 0.942 1.000 0.615 CB 1.187 14 residues pruned to eliminate duplicates Z: 11 5.414 2.012 0.128 0.353 0.800 0.400 CB 1.105 11 residues pruned to eliminate duplicates Z: 16 20.787 2.193 0.324 0.934 1.000 0.933 CB 1.290 16 residues pruned to eliminate duplicates Z: 16 37.112 2.338 0.760 0.917 1.000 0.733 CB 1.643 16 residues pruned to eliminate duplicates Z: 39 29.846 2.031 0.719 0.576 0.921 0.579 CB 1.399 35 residues pruned to eliminate duplicates Z: 13 26.972 2.403 0.457 0.864 1.000 0.750 CB 1.630 13 residues pruned to eliminate duplicates Z: 18 37.548 2.207 0.738 0.908 1.000 0.824 CB 1.687 18 residues pruned to eliminate duplicates Z: 40 20.733 1.977 0.537 0.435 0.897 0.641 CB 1.302 94 residues pruned to eliminate duplicates Z: 96 80.979 2.466 0.785 0.674 0.884 0.674 CB 1.818 96 residues pruned to eliminate duplicates Z: 11 7.870 1.756 0.225 0.658 0.900 0.700 CB 1.110 Z: 18 24.817 2.207 0.569 0.627 1.000 0.706 CB 1.543 19 residues pruned to eliminate duplicates Z: 21 34.141 2.268 0.799 0.742 0.950 0.650 CB 1.586 21 residues pruned to eliminate duplicates Z: 12 30.083 2.375 0.653 0.854 1.000 0.636 CB 1.706 12 residues pruned to eliminate duplicates Z: 28 25.079 2.100 0.799 0.601 0.852 0.667 CB 1.362 28 residues pruned to eliminate duplicates Z: 6 6.116 1.657 0.554 0.821 0.800 0.600 CA 1.006 6 residues pruned to eliminate duplicates Z: 13 19.935 1.818 0.756 0.948 1.000 0.917 CB 1.245 13 residues pruned to eliminate duplicates 7 1.957 1.581 0.257 0.247 0.500 0.500 CB 1.076 ? Z: 9 6.221 2.135 0.469 0.379 0.750 0.750 CB 1.065 9 residues pruned to eliminate duplicates Z: 6 7.544 2.065 0.087 0.845 1.000 0.800 CB 1.117 6 residues pruned to eliminate duplicates Z: 162 113.347 2.491 0.915 0.650 0.932 0.671 CB 1.748 162 residues pruned to eliminate duplicates Z: 37 22.153 1.895 0.654 0.547 0.889 0.500 CB 1.265 37 residues pruned to eliminate duplicates Z: 23 46.549 2.466 0.697 0.848 0.955 0.727 CB 1.842 23 residues pruned to eliminate duplicates Z: 13 15.614 1.890 0.264 0.937 1.000 1.000 CB 1.313 13 residues pruned to eliminate duplicates Z: 7 8.885 1.884 0.808 0.811 0.833 0.833 CB 0.975 7 residues pruned to eliminate duplicates Z: 6 11.266 2.123 0.631 0.849 0.800 0.800 CA 1.348 6 residues pruned to eliminate duplicates Z: 53 31.222 2.192 0.441 0.593 0.923 0.615 CB 1.358 53 residues pruned to eliminate duplicates Z: 16 44.743 2.376 0.828 0.927 1.000 0.733 CA 1.864 16 residues pruned to eliminate duplicates Z: 22 45.697 2.437 1.073 0.736 0.952 0.571 CB 1.677 22 residues pruned to eliminate duplicates Z: 115 106.697 2.429 0.972 0.736 0.965 0.693 CB 1.750 115 residues pruned to eliminate duplicates Z: 12 21.929 2.111 0.638 0.755 1.000 0.636 CB 1.524 12 residues pruned to eliminate duplicates Z: 47 31.539 2.123 0.736 0.525 0.935 0.587 CB 1.316 47 residues pruned to eliminate duplicates Z: 19 25.534 2.125 0.760 0.668 0.944 0.611 CB 1.460 18 residues pruned to eliminate duplicates Z: 39 49.520 2.331 0.807 0.674 0.947 0.763 CB 1.715 39 residues pruned to eliminate duplicates Z: 75 64.151 2.425 0.916 0.587 0.919 0.635 CB 1.606 75 residues pruned to eliminate duplicates Z: 12 10.152 1.696 0.405 0.690 1.000 0.727 CB 1.079 11 residues pruned to eliminate duplicates Z: 14 22.302 1.949 0.622 0.929 1.000 0.538 CB 1.369 14 residues pruned to eliminate duplicates Z: 26 18.488 1.868 0.439 0.704 0.920 0.640 CB 1.242 26 residues pruned to eliminate duplicates Z: 9 3.883 1.851 0.473 0.346 0.875 0.750 CB 0.680 Z: 59 37.403 2.141 0.596 0.573 0.966 0.638 CB 1.386 59 residues pruned to eliminate duplicates Z: 26 38.119 2.240 0.390 0.924 1.000 0.920 CB 1.719 26 residues pruned to eliminate duplicates Z: 18 30.167 2.084 0.983 0.824 0.941 0.588 CB 1.420 18 residues pruned to eliminate duplicates Z: 17 22.287 1.999 0.807 0.879 0.812 0.438 CB 1.377 Z: 6 7.165 2.104 -0.004 0.650 1.000 0.600 CB 1.330 6 residues pruned to eliminate duplicates Z: 29 70.406 2.411 1.270 0.942 0.964 0.607 CB 1.749 29 residues pruned to eliminate duplicates Z: 32 38.252 2.271 0.758 0.643 0.903 0.677 CB 1.667 34 residues pruned to eliminate duplicates Z: 12 10.828 2.126 0.151 0.719 0.909 0.727 CB 1.203 12 residues pruned to eliminate duplicates Z: 51 46.083 2.386 0.652 0.530 0.940 0.660 CB 1.709 51 residues pruned to eliminate duplicates Z: 25 57.770 2.383 1.052 0.915 1.000 0.542 CB 1.705 25 residues pruned to eliminate duplicates Z: 36 27.044 2.035 0.594 0.626 0.943 0.800 CB 1.327 26 residues pruned to eliminate duplicates Z: 15 43.115 2.270 1.207 0.896 1.000 0.714 CB 1.648 15 residues pruned to eliminate duplicates Z: 9 8.597 1.985 0.220 0.672 0.875 0.625 CB 1.224 9 residues pruned to eliminate duplicates Z: 7 7.567 1.749 0.342 0.528 1.000 0.833 CB 1.281 7 residues pruned to eliminate duplicates Z: 38 42.583 2.302 0.946 0.628 0.919 0.730 CB 1.507 38 residues pruned to eliminate duplicates Z: 8 6.641 1.429 0.265 0.896 1.000 1.000 CB 0.995 6 residues pruned to eliminate duplicates Z: 23 44.282 2.171 1.180 0.916 0.909 0.500 CB 1.549 36 residues pruned to eliminate duplicates Z: 7 5.244 1.666 0.417 0.375 0.833 0.667 CB 1.244 7 residues pruned to eliminate duplicates Z: 8 5.036 1.955 0.665 0.482 0.857 0.571 CB 0.694 Z: 14 8.538 1.855 0.248 0.509 0.923 0.538 CB 1.099 14 residues pruned to eliminate duplicates Z: 32 64.967 2.323 1.037 0.913 0.968 0.548 CB 1.804 32 residues pruned to eliminate duplicates Z: 12 22.251 2.187 0.415 0.899 1.000 0.909 CB 1.549 12 residues pruned to eliminate duplicates Z: 14 18.811 1.834 0.551 0.919 1.000 0.923 CB 1.292 14 residues pruned to eliminate duplicates Z: 17 14.810 2.166 0.473 0.468 0.875 0.750 CB 1.370 17 residues pruned to eliminate duplicates Z: 31 24.489 1.912 0.649 0.638 0.933 0.767 CB 1.336 30 residues pruned to eliminate duplicates Z: 11 10.945 2.043 0.425 0.472 0.900 0.700 CB 1.358 Z: 33 23.914 1.988 0.513 0.566 0.969 0.594 CB 1.361 33 residues pruned to eliminate duplicates Z: 25 18.129 1.962 0.482 0.602 0.917 0.708 CB 1.260 25 residues pruned to eliminate duplicates Z: 36 56.407 2.564 0.904 0.656 0.914 0.486 CB 1.848 36 residues pruned to eliminate duplicates Z: 16 33.833 2.277 0.912 0.896 0.933 0.667 CB 1.539 16 residues pruned to eliminate duplicates Z: 6 7.109 1.607 0.842 0.683 1.000 0.600 CB 0.908 6 residues pruned to eliminate duplicates Z: 17 38.714 2.252 0.964 0.894 1.000 0.875 CB 1.570 17 residues pruned to eliminate duplicates Z: 7 2.331 1.754 -0.366 0.477 0.667 0.333 CB 1.315 Z: 7 4.119 1.297 0.567 0.424 1.000 0.500 N 0.895 Z: 17 37.107 2.289 0.589 0.934 1.000 0.812 CB 1.778 17 residues pruned to eliminate duplicates Z: 9 8.043 2.211 0.621 0.416 0.750 0.500 CB 1.155 9 residues pruned to eliminate duplicates Z: 13 8.926 1.580 0.624 0.549 0.833 0.417 CB 1.149 Z: 11 7.300 2.179 0.287 0.218 0.800 0.600 CB 1.433 11 residues pruned to eliminate duplicates Z: 21 25.923 2.097 0.466 0.740 0.900 0.750 CB 1.690 21 residues pruned to eliminate duplicates Z: 20 32.015 2.410 0.622 0.715 0.895 0.842 CB 1.728 20 residues pruned to eliminate duplicates Z: 34 36.565 2.343 0.737 0.597 0.909 0.697 CB 1.569 34 residues pruned to eliminate duplicates Z: 17 13.593 1.939 0.410 0.568 0.875 0.500 CB 1.331 17 residues pruned to eliminate duplicates Z: 26 33.547 2.269 0.834 0.651 0.880 0.560 CB 1.593 26 residues pruned to eliminate duplicates Z: 11 16.725 2.259 0.116 0.922 1.000 1.000 CB 1.475 11 residues pruned to eliminate duplicates Z: 50 48.532 2.268 0.737 0.663 0.918 0.735 CB 1.647 50 residues pruned to eliminate duplicates Z: 7 3.060 1.405 0.430 0.404 0.667 0.500 CB 1.031 Z: 15 19.411 2.245 0.926 0.425 0.857 0.571 CB 1.514 15 residues pruned to eliminate duplicates Z: 26 51.363 2.252 1.290 0.879 0.920 0.480 CB 1.570 26 residues pruned to eliminate duplicates Z: 11 8.005 1.704 0.391 0.576 0.900 0.700 CB 1.103 11 residues pruned to eliminate duplicates Z: 35 25.492 1.944 0.749 0.543 0.941 0.559 CB 1.310 35 residues pruned to eliminate duplicates Z: 15 26.229 2.124 0.641 0.800 0.929 0.571 CB 1.666 15 residues pruned to eliminate duplicates Z: 64 34.992 2.116 0.658 0.472 0.921 0.603 CB 1.405 64 residues pruned to eliminate duplicates Z: 8 4.061 1.766 0.209 0.415 0.857 0.429 CB 0.916 7 residues pruned to eliminate duplicates Z: 15 36.149 2.150 1.242 0.932 1.000 0.786 CB 1.400 15 residues pruned to eliminate duplicates Z: 15 22.079 1.923 0.641 0.913 0.929 0.643 CB 1.426 15 residues pruned to eliminate duplicates Z: 35 31.870 2.113 0.569 0.708 0.912 0.706 CB 1.496 22 residues pruned to eliminate duplicates Z: 25 28.324 2.279 0.651 0.518 0.917 0.625 CB 1.647 25 residues pruned to eliminate duplicates Z: 28 34.530 2.222 0.709 0.679 0.926 0.704 CB 1.602 28 residues pruned to eliminate duplicates Z: 9 15.180 2.005 0.718 0.777 0.875 0.750 CB 1.394 9 residues pruned to eliminate duplicates Z: 8 7.614 1.649 0.240 0.820 0.857 0.571 CA 1.244 8 residues pruned to eliminate duplicates Z: 33 30.138 2.157 0.974 0.536 0.906 0.688 CB 1.332 33 residues pruned to eliminate duplicates Z: 8 15.841 2.204 1.016 0.603 0.857 0.571 CB 1.425 8 residues pruned to eliminate duplicates Z: 12 11.949 1.662 0.651 0.741 1.000 0.727 CB 1.058 12 residues pruned to eliminate duplicates Z: 34 50.147 2.272 0.652 0.836 0.970 0.818 CB 1.796 34 residues pruned to eliminate duplicates Z: 19 38.316 2.221 1.160 0.826 0.889 0.333 CB 1.597 19 residues pruned to eliminate duplicates Z: 84 88.234 2.390 0.966 0.746 0.976 0.687 CB 1.694 84 residues pruned to eliminate duplicates Z: 6 4.443 1.491 0.513 0.489 0.800 0.800 CB 1.114 Z: 26 24.921 2.142 0.690 0.447 0.920 0.520 CB 1.581 26 residues pruned to eliminate duplicates Z: 13 20.536 1.977 0.620 0.930 1.000 0.750 CB 1.294 13 residues pruned to eliminate duplicates Z: 39 46.684 2.301 0.918 0.633 0.974 0.711 CB 1.555 39 residues pruned to eliminate duplicates Z: 10 8.148 1.635 0.480 0.692 1.000 0.778 CB 0.942 Z: 7 8.382 1.941 0.710 0.618 0.833 0.500 CA 1.107 7 residues pruned to eliminate duplicates Z: 24 14.091 1.867 0.498 0.486 0.913 0.522 CB 1.167 24 residues pruned to eliminate duplicates Z: 9 7.177 1.864 0.497 0.496 0.875 0.875 CB 1.043 9 residues pruned to eliminate duplicates Z: 7 5.223 1.571 0.113 0.881 0.833 0.833 CB 1.060 7 residues pruned to eliminate duplicates Z: 15 16.634 1.786 0.344 0.935 1.000 1.000 CB 1.291 15 residues pruned to eliminate duplicates Z: 30 34.961 2.348 0.627 0.588 1.000 0.724 CB 1.561 30 residues pruned to eliminate duplicates Z: 31 45.307 2.289 0.837 0.744 1.000 0.767 CB 1.581 31 residues pruned to eliminate duplicates Z: 21 21.555 2.248 0.472 0.576 0.900 0.800 CB 1.504 21 residues pruned to eliminate duplicates Z: 53 31.892 2.172 0.484 0.588 0.962 0.769 CB 1.311 53 residues pruned to eliminate duplicates Z: 67 63.433 2.452 0.741 0.616 0.955 0.667 CB 1.717 67 residues pruned to eliminate duplicates Z: 14 8.430 2.104 0.256 0.542 0.846 0.538 CB 1.003 14 residues pruned to eliminate duplicates Z: 18 10.429 1.989 0.505 0.339 0.941 0.529 CB 1.069 18 residues pruned to eliminate duplicates Z: 7 4.307 1.796 -0.075 0.695 0.833 0.667 CB 1.063 7 residues pruned to eliminate duplicates Z: 29 21.762 1.991 0.330 0.688 0.964 0.714 CB 1.356 34 residues pruned to eliminate duplicates Z: 39 38.383 2.427 0.657 0.465 0.921 0.684 CB 1.741 39 residues pruned to eliminate duplicates Z: 27 28.494 2.119 0.633 0.648 0.923 0.654 CB 1.525 27 residues pruned to eliminate duplicates Z: 18 33.648 2.328 0.647 0.849 0.941 0.824 CB 1.677 18 residues pruned to eliminate duplicates Z: 42 38.347 2.237 0.892 0.574 0.951 0.537 CB 1.385 42 residues pruned to eliminate duplicates Z: 50 39.067 2.239 0.787 0.598 0.939 0.755 CB 1.352 50 residues pruned to eliminate duplicates Z: 16 41.414 2.335 1.167 0.915 0.933 0.733 CB 1.600 16 residues pruned to eliminate duplicates Z: 17 14.355 2.036 0.777 0.426 0.812 0.562 CB 1.319 17 residues pruned to eliminate duplicates Z: 6 4.788 1.546 0.907 0.297 1.000 0.400 CA 0.911 6 residues pruned to eliminate duplicates Z: 8 5.178 1.819 0.131 0.364 0.857 0.286 CB 1.285 9 residues pruned to eliminate duplicates Z: 6 8.917 2.117 0.633 0.655 1.000 0.600 CB 0.999 6 residues pruned to eliminate duplicates Z: 6 3.138 1.687 0.427 0.297 0.600 0.600 CB 1.220 Z: 16 33.901 2.244 0.966 0.858 0.933 0.800 CB 1.566 16 residues pruned to eliminate duplicates Z: 25 21.307 1.883 0.533 0.713 0.917 0.708 CB 1.355 25 residues pruned to eliminate duplicates Z: 13 11.140 2.100 0.329 0.364 1.000 0.833 CB 1.334 13 residues pruned to eliminate duplicates Z: 29 22.871 2.277 0.531 0.404 0.857 0.607 CB 1.599 29 residues pruned to eliminate duplicates Z: 11 20.205 1.956 1.127 0.900 0.800 0.700 CB 1.371 11 residues pruned to eliminate duplicates Z: 29 28.549 2.160 0.764 0.529 0.929 0.464 CB 1.483 29 residues pruned to eliminate duplicates Z: 41 41.399 2.232 0.986 0.619 0.950 0.725 CB 1.389 41 residues pruned to eliminate duplicates Z: 13 11.305 1.885 0.463 0.404 0.917 0.833 CB 1.429 13 residues pruned to eliminate duplicates Z: 47 32.674 2.227 0.494 0.624 0.935 0.761 CB 1.378 47 residues pruned to eliminate duplicates Z: 7 3.922 1.600 0.448 0.766 1.000 0.833 CB 0.546 Z: 8 2.346 1.786 0.085 0.235 0.857 0.286 CB 0.726 8 residues pruned to eliminate duplicates Z: 19 21.827 2.064 0.716 0.644 0.889 0.778 CB 1.428 19 residues pruned to eliminate duplicates Z: 9 16.514 2.179 0.898 0.598 0.875 0.750 CB 1.470 9 residues pruned to eliminate duplicates Z: 13 19.347 2.283 0.823 0.572 0.917 0.667 CB 1.366 13 residues pruned to eliminate duplicates Z: 14 19.616 1.828 0.867 0.925 1.000 0.385 CB 1.119 14 residues pruned to eliminate duplicates Z: 11 29.572 2.165 1.103 0.725 0.900 0.800 CB 1.863 11 residues pruned to eliminate duplicates Z: 6 5.251 2.077 -0.216 0.690 1.000 0.600 CB 1.213 6 residues pruned to eliminate duplicates Z: 28 33.607 2.283 0.616 0.605 1.000 0.815 CB 1.586 28 residues pruned to eliminate duplicates Z: 17 21.146 2.125 0.312 0.868 0.938 0.750 CA 1.478 17 residues pruned to eliminate duplicates Z: 15 9.663 1.928 0.640 0.403 0.786 0.429 CB 1.151 15 residues pruned to eliminate duplicates Z: 71 48.248 2.156 0.725 0.660 0.914 0.714 CB 1.463 118 residues pruned to eliminate duplicates Z: 7 10.950 2.016 0.550 0.731 1.000 0.500 CB 1.162 7 residues pruned to eliminate duplicates 6 1.793 1.588 -0.118 0.413 0.800 0.800 CB 0.784 ? Z: 13 23.716 1.845 1.036 0.924 1.000 0.750 CB 1.280 13 residues pruned to eliminate duplicates Z: 10 21.823 2.223 0.730 0.758 0.889 0.444 CB 1.692 10 residues pruned to eliminate duplicates Z: 49 33.367 2.073 0.669 0.552 0.958 0.667 CB 1.381 49 residues pruned to eliminate duplicates Z: 9 3.292 1.405 0.421 0.285 0.750 0.500 O 0.990 9 residues pruned to eliminate duplicates Z: 23 24.577 1.930 0.800 0.809 0.955 0.682 CB 1.207 23 residues pruned to eliminate duplicates Z: 105 69.442 2.361 0.781 0.560 0.894 0.635 CB 1.708 259 residues pruned to eliminate duplicates Z: 17 10.911 2.088 0.264 0.499 0.875 0.625 CB 1.183 17 residues pruned to eliminate duplicates Z: 27 39.778 2.287 1.034 0.707 0.962 0.692 CB 1.444 27 residues pruned to eliminate duplicates Z: 43 37.509 2.243 0.704 0.568 0.976 0.595 CB 1.452 43 residues pruned to eliminate duplicates Z: 6 4.382 1.410 0.424 0.411 1.000 0.600 CB 1.072 Z: 33 55.993 2.301 0.878 0.868 1.000 0.719 CB 1.673 33 residues pruned to eliminate duplicates Z: 6 14.201 2.029 0.549 0.836 1.000 0.600 CB 1.513 6 residues pruned to eliminate duplicates Z: 7 3.875 1.520 0.482 0.428 0.833 0.500 CB 0.908 Z: 38 29.287 2.302 0.602 0.434 0.892 0.514 CB 1.567 38 residues pruned to eliminate duplicates Z: 14 21.313 1.928 0.497 0.925 1.000 1.000 CB 1.438 14 residues pruned to eliminate duplicates Z: 6 8.066 1.784 1.061 0.776 0.800 0.800 CB 0.961 6 residues pruned to eliminate duplicates Z: 19 41.229 2.203 1.134 0.764 1.000 0.722 CA 1.635 19 residues pruned to eliminate duplicates Z: 88 64.054 2.363 0.810 0.613 0.920 0.621 CB 1.569 88 residues pruned to eliminate duplicates Z: 8 8.476 1.992 0.649 0.551 0.714 0.571 CB 1.299 8 residues pruned to eliminate duplicates Z: 15 28.191 1.931 0.875 0.931 1.000 0.786 CB 1.454 15 residues pruned to eliminate duplicates Z: 8 11.437 2.016 0.251 0.466 1.000 0.571 CA 1.775 8 residues pruned to eliminate duplicates Z: 24 64.322 2.439 1.257 0.953 1.000 0.696 CB 1.677 25 residues pruned to eliminate duplicates Z: 12 20.067 2.260 0.469 0.862 0.909 0.545 CB 1.472 12 residues pruned to eliminate duplicates Z: 37 40.657 2.332 0.856 0.566 0.944 0.639 CB 1.554 Z: 31 22.751 1.912 0.789 0.606 0.867 0.467 CB 1.266 31 residues pruned to eliminate duplicates Z: 24 46.608 2.280 1.086 0.867 0.913 0.652 CB 1.637 24 residues pruned to eliminate duplicates Z: 32 65.326 2.356 1.001 0.913 0.968 0.548 CB 1.819 32 residues pruned to eliminate duplicates Z: 9 9.056 1.994 0.462 0.449 0.875 0.625 CB 1.322 9 residues pruned to eliminate duplicates Z: 10 17.773 2.220 0.569 0.555 1.000 0.778 CB 1.613 Z: 9 13.512 1.778 0.625 0.731 1.000 0.625 CA 1.343 Z: 35 34.811 2.235 0.661 0.594 0.941 0.676 CB 1.562 35 residues pruned to eliminate duplicates Z: 23 49.668 2.396 0.756 0.867 1.000 0.773 CB 1.842 23 residues pruned to eliminate duplicates Z: 33 38.439 2.270 0.762 0.642 0.938 0.656 CB 1.587 9 residues pruned to eliminate duplicates Z: 46 48.914 2.389 0.869 0.612 0.933 0.733 CB 1.573 36 residues pruned to eliminate duplicates Z: 30 28.148 1.980 0.728 0.650 0.966 0.655 CB 1.376 30 residues pruned to eliminate duplicates Z: 28 31.390 2.285 0.885 0.446 0.926 0.519 CB 1.602 28 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 7 4.537 1.785 0.299 0.520 1.000 0.500 CB 0.783 Z: 14 18.539 1.863 0.604 0.878 1.000 0.692 CB 1.248 14 residues pruned to eliminate duplicates Z: 17 18.146 2.212 0.270 0.650 0.938 0.812 CB 1.499 17 residues pruned to eliminate duplicates Z: 19 22.107 2.159 0.530 0.589 0.944 0.611 CB 1.534 19 residues pruned to eliminate duplicates Z: 21 20.976 2.044 0.597 0.548 0.900 0.550 CB 1.523 21 residues pruned to eliminate duplicates Z: 19 22.143 2.139 0.694 0.594 0.889 0.667 CB 1.482 19 residues pruned to eliminate duplicates Z: 19 22.499 2.155 0.667 0.580 0.889 0.611 CB 1.538 19 residues pruned to eliminate duplicates Z: 19 20.782 2.117 0.576 0.602 0.944 0.667 CB 1.412 19 residues pruned to eliminate duplicates Z: 19 20.950 2.141 0.557 0.590 0.889 0.667 CB 1.529 19 residues pruned to eliminate duplicates Z: 20 18.746 2.053 0.555 0.575 0.895 0.579 CB 1.402 20 residues pruned to eliminate duplicates Z: 19 23.100 2.187 0.601 0.588 0.944 0.722 CB 1.514 19 residues pruned to eliminate duplicates Z: 20 21.221 2.161 0.645 0.562 0.895 0.579 CB 1.440 20 residues pruned to eliminate duplicates Z: 25 19.832 2.157 0.470 0.514 0.917 0.708 CB 1.374 25 residues pruned to eliminate duplicates Z: 19 25.003 2.191 0.598 0.594 1.000 0.667 CB 1.539 19 residues pruned to eliminate duplicates Z: 20 19.872 2.125 0.589 0.546 0.895 0.579 CB 1.442 20 residues pruned to eliminate duplicates Z: 41 25.575 2.056 0.513 0.557 0.925 0.650 CB 1.329 41 residues pruned to eliminate duplicates Z: 76 33.843 2.165 0.448 0.531 0.880 0.627 CB 1.374 76 residues pruned to eliminate duplicates Z: 41 27.961 2.042 0.665 0.573 0.900 0.625 CB 1.346 41 residues pruned to eliminate duplicates Z: 24 20.571 1.974 0.627 0.622 0.957 0.652 CB 1.244 24 residues pruned to eliminate duplicates Z: 9 12.090 2.001 0.509 0.648 1.000 0.625 CB 1.233 9 residues pruned to eliminate duplicates Z: 9 10.901 2.030 0.455 0.599 1.000 0.750 CB 1.187 9 residues pruned to eliminate duplicates Z: 26 23.031 1.887 0.691 0.730 0.960 0.760 CB 1.222 26 residues pruned to eliminate duplicates Z: 11 7.797 1.730 0.324 0.533 1.000 0.600 CB 1.041 11 residues pruned to eliminate duplicates Z: 24 18.003 1.962 0.509 0.611 0.913 0.652 CB 1.250 24 residues pruned to eliminate duplicates Z: 25 20.128 1.990 0.521 0.662 0.958 0.833 CB 1.219 25 residues pruned to eliminate duplicates Z: 16 17.640 1.840 0.673 0.662 1.000 0.733 CB 1.273 16 residues pruned to eliminate duplicates Z: 25 18.650 1.953 0.575 0.605 0.917 0.750 CB 1.222 25 residues pruned to eliminate duplicates Z: 24 19.649 1.974 0.533 0.639 0.957 0.783 CB 1.242 24 residues pruned to eliminate duplicates Z: 24 18.186 1.938 0.497 0.627 0.957 0.696 CB 1.212 24 residues pruned to eliminate duplicates Z: 17 18.458 1.837 0.892 0.795 0.812 0.625 CB 1.262 17 residues pruned to eliminate duplicates Z: 34 20.023 1.826 0.701 0.621 0.939 0.606 CB 1.066 34 residues pruned to eliminate duplicates Z: 17 18.131 1.855 0.693 0.657 0.938 0.750 CB 1.331 17 residues pruned to eliminate duplicates Z: 24 18.954 1.904 0.592 0.635 0.957 0.652 CB 1.201 24 residues pruned to eliminate duplicates Z: 24 19.809 1.975 0.638 0.627 0.913 0.696 CB 1.240 24 residues pruned to eliminate duplicates Z: 24 21.244 1.969 0.698 0.640 0.957 0.609 CB 1.215 24 residues pruned to eliminate duplicates Z: 17 21.237 1.814 0.948 0.835 0.938 0.625 CB 1.201 17 residues pruned to eliminate duplicates Z: 15 18.621 1.801 0.933 0.682 0.929 0.643 CB 1.303 15 residues pruned to eliminate duplicates Z: 33 20.711 1.939 0.789 0.459 0.938 0.531 CB 1.173 33 residues pruned to eliminate duplicates Z: 23 18.203 1.780 0.816 0.629 0.955 0.500 CB 1.114 23 residues pruned to eliminate duplicates Z: 31 20.774 1.971 0.843 0.474 0.900 0.533 CB 1.191 31 residues pruned to eliminate duplicates Z: 37 17.212 1.956 0.583 0.440 0.889 0.583 CB 1.108 37 residues pruned to eliminate duplicates Z: 11 7.278 1.800 0.623 0.365 0.900 0.400 CB 1.011 11 residues pruned to eliminate duplicates Z: 167 82.931 2.328 0.718 0.601 0.922 0.663 CB 1.586 167 residues pruned to eliminate duplicates Z: 17 10.692 2.051 0.565 0.310 0.875 0.562 CB 1.174 17 residues pruned to eliminate duplicates Z: 12 13.195 2.108 0.512 0.440 0.909 0.545 CB 1.460 12 residues pruned to eliminate duplicates Z: 30 22.068 1.915 0.799 0.505 0.931 0.448 CB 1.272 30 residues pruned to eliminate duplicates Z: 14 13.717 1.952 0.622 0.377 1.000 0.538 CB 1.370 14 residues pruned to eliminate duplicates Z: 32 19.466 1.939 0.760 0.493 0.871 0.484 CB 1.184 32 residues pruned to eliminate duplicates Z: 17 10.342 2.055 0.408 0.318 0.875 0.562 CB 1.249 17 residues pruned to eliminate duplicates Z: 19 9.511 1.941 0.517 0.292 0.833 0.500 CB 1.154 19 residues pruned to eliminate duplicates Z: 34 17.829 1.871 0.765 0.458 0.879 0.515 CB 1.116 34 residues pruned to eliminate duplicates Z: 16 9.972 2.078 0.503 0.323 0.867 0.600 CB 1.155 16 residues pruned to eliminate duplicates Z: 79 33.960 2.137 0.548 0.508 0.910 0.692 CB 1.267 79 residues pruned to eliminate duplicates Z: 93 44.333 2.179 0.565 0.544 0.946 0.641 CB 1.373 93 residues pruned to eliminate duplicates Z: 21 24.011 2.330 0.491 0.528 0.950 0.750 CB 1.583 21 residues pruned to eliminate duplicates Z: 143 83.573 2.361 0.722 0.659 0.930 0.704 CB 1.601 143 residues pruned to eliminate duplicates Z: 34 31.808 2.289 0.442 0.662 0.970 0.667 CB 1.489 34 residues pruned to eliminate duplicates Z: 38 34.218 2.272 0.511 0.629 0.973 0.703 CB 1.491 38 residues pruned to eliminate duplicates Z: 40 33.804 2.256 0.597 0.607 0.923 0.667 CB 1.470 40 residues pruned to eliminate duplicates Z: 38 35.482 2.288 0.526 0.625 0.973 0.757 CB 1.527 38 residues pruned to eliminate duplicates Z: 39 31.285 2.262 0.402 0.629 0.974 0.711 CB 1.456 39 residues pruned to eliminate duplicates Z: 152 81.618 2.344 0.673 0.640 0.927 0.709 CB 1.602 152 residues pruned to eliminate duplicates Z: 38 36.115 2.310 0.585 0.598 0.973 0.757 CB 1.518 38 residues pruned to eliminate duplicates Z: 88 33.772 2.116 0.523 0.531 0.874 0.575 CB 1.247 88 residues pruned to eliminate duplicates Z: 140 89.002 2.372 0.744 0.674 0.950 0.712 CB 1.636 140 residues pruned to eliminate duplicates Z: 39 33.583 2.282 0.600 0.572 0.947 0.658 CB 1.469 39 residues pruned to eliminate duplicates Z: 50 30.434 2.239 0.442 0.583 0.898 0.653 CB 1.384 50 residues pruned to eliminate duplicates Z: 77 42.490 2.147 0.713 0.538 0.961 0.618 CB 1.329 77 residues pruned to eliminate duplicates Z: 39 36.179 2.264 0.654 0.608 0.974 0.737 CB 1.452 39 residues pruned to eliminate duplicates Z: 44 37.527 2.300 0.612 0.581 0.953 0.674 CB 1.498 44 residues pruned to eliminate duplicates Z: 68 36.322 2.273 0.480 0.531 0.881 0.612 CB 1.453 68 residues pruned to eliminate duplicates Z: 38 36.718 2.298 0.679 0.599 0.946 0.757 CB 1.505 38 residues pruned to eliminate duplicates Z: 90 40.440 2.134 0.686 0.540 0.888 0.629 CB 1.291 90 residues pruned to eliminate duplicates Z: 41 29.411 2.196 0.753 0.546 0.850 0.650 CB 1.358 41 residues pruned to eliminate duplicates Z: 51 34.561 2.251 0.692 0.576 0.900 0.640 CB 1.325 51 residues pruned to eliminate duplicates Z: 54 38.181 2.262 0.736 0.563 0.925 0.679 CB 1.359 54 residues pruned to eliminate duplicates Z: 43 42.507 2.312 0.858 0.557 0.952 0.595 CB 1.517 43 residues pruned to eliminate duplicates Z: 39 36.221 2.292 0.891 0.588 0.895 0.684 CB 1.392 39 residues pruned to eliminate duplicates Z: 70 36.158 2.219 0.561 0.512 0.899 0.565 CB 1.382 70 residues pruned to eliminate duplicates Z: 35 41.786 2.317 0.822 0.665 0.971 0.824 CB 1.501 35 residues pruned to eliminate duplicates Z: 66 41.444 2.273 0.649 0.535 0.923 0.646 CB 1.436 66 residues pruned to eliminate duplicates Z: 41 34.119 2.243 0.830 0.569 0.925 0.625 CB 1.329 41 residues pruned to eliminate duplicates Z: 90 62.349 2.326 0.810 0.609 0.921 0.719 CB 1.536 90 residues pruned to eliminate duplicates Z: 155 87.920 2.339 0.806 0.629 0.922 0.675 CB 1.611 155 residues pruned to eliminate duplicates Z: 38 41.833 2.310 0.921 0.577 0.973 0.622 CB 1.479 38 residues pruned to eliminate duplicates Z: 49 37.118 2.246 0.672 0.595 0.958 0.750 CB 1.360 49 residues pruned to eliminate duplicates Z: 72 35.640 2.161 0.692 0.511 0.901 0.577 CB 1.269 72 residues pruned to eliminate duplicates Z: 71 37.714 2.198 0.633 0.506 0.900 0.643 CB 1.387 71 residues pruned to eliminate duplicates Z: 155 90.840 2.348 0.802 0.640 0.948 0.740 CB 1.601 155 residues pruned to eliminate duplicates Z: 56 36.929 2.219 0.731 0.539 0.927 0.600 CB 1.345 56 residues pruned to eliminate duplicates Z: 43 41.383 2.284 0.899 0.541 0.952 0.643 CB 1.484 43 residues pruned to eliminate duplicates Z: 151 78.052 2.334 0.663 0.616 0.920 0.687 CB 1.599 151 residues pruned to eliminate duplicates Z: 61 37.018 2.251 0.694 0.491 0.883 0.583 CB 1.431 61 residues pruned to eliminate duplicates Z: 92 63.215 2.329 0.821 0.590 0.956 0.648 CB 1.499 92 residues pruned to eliminate duplicates Z: 58 36.417 2.214 0.675 0.530 0.947 0.614 CB 1.333 58 residues pruned to eliminate duplicates Z: 67 43.017 2.257 0.778 0.516 0.909 0.576 CB 1.429 67 residues pruned to eliminate duplicates Z: 131 62.522 2.242 0.736 0.562 0.931 0.646 CB 1.425 131 residues pruned to eliminate duplicates Z: 49 38.901 2.259 0.824 0.581 0.938 0.583 CB 1.345 49 residues pruned to eliminate duplicates Z: 16 8.472 2.006 0.413 0.508 0.733 0.467 CB 1.045 16 residues pruned to eliminate duplicates Z: 12 10.715 2.115 0.530 0.610 0.818 0.545 CB 1.099 12 residues pruned to eliminate duplicates Z: 24 17.877 2.077 0.506 0.462 0.913 0.478 CB 1.358 24 residues pruned to eliminate duplicates Z: 48 37.769 2.260 0.840 0.560 0.915 0.660 CB 1.366 48 residues pruned to eliminate duplicates Z: 19 13.805 2.011 0.558 0.533 0.889 0.500 CB 1.131 19 residues pruned to eliminate duplicates Z: 27 18.415 2.193 0.452 0.510 0.885 0.654 CB 1.270 27 residues pruned to eliminate duplicates Z: 139 91.348 2.350 0.825 0.670 0.942 0.710 CB 1.645 139 residues pruned to eliminate duplicates Z: 91 87.073 2.417 0.795 0.720 0.944 0.733 CB 1.837 91 residues pruned to eliminate duplicates Z: 91 86.810 2.387 0.842 0.730 0.944 0.778 CB 1.791 91 residues pruned to eliminate duplicates Z: 92 85.226 2.389 0.859 0.704 0.934 0.758 CB 1.788 92 residues pruned to eliminate duplicates Z: 44 51.388 2.364 0.914 0.642 0.884 0.744 CB 1.715 44 residues pruned to eliminate duplicates Z: 91 84.281 2.424 0.762 0.719 0.944 0.778 CB 1.807 91 residues pruned to eliminate duplicates Z: 17 20.881 2.164 0.611 0.478 0.938 0.562 CB 1.634 17 residues pruned to eliminate duplicates Z: 93 53.853 2.312 0.708 0.547 0.891 0.630 CB 1.523 93 residues pruned to eliminate duplicates Z: 122 61.621 2.229 0.826 0.573 0.909 0.636 CB 1.411 122 residues pruned to eliminate duplicates Z: 42 51.549 2.405 0.852 0.637 0.951 0.683 CB 1.671 42 residues pruned to eliminate duplicates Z: 110 78.248 2.337 0.837 0.653 0.908 0.725 CB 1.667 110 residues pruned to eliminate duplicates Z: 101 81.791 2.376 0.800 0.668 0.920 0.680 CB 1.780 101 residues pruned to eliminate duplicates Z: 102 80.338 2.392 0.830 0.662 0.901 0.683 CB 1.744 102 residues pruned to eliminate duplicates Z: 89 64.150 2.298 0.878 0.609 0.943 0.705 CB 1.515 89 residues pruned to eliminate duplicates Z: 173 89.702 2.305 0.751 0.634 0.924 0.686 CB 1.616 173 residues pruned to eliminate duplicates Z: 92 83.853 2.370 0.910 0.721 0.923 0.703 CB 1.723 92 residues pruned to eliminate duplicates Z: 89 76.831 2.406 0.828 0.670 0.920 0.739 CB 1.730 89 residues pruned to eliminate duplicates Z: 42 59.255 2.442 0.982 0.669 0.927 0.756 CB 1.765 42 residues pruned to eliminate duplicates Z: 43 54.738 2.395 0.991 0.658 0.881 0.667 CB 1.736 43 residues pruned to eliminate duplicates Z: 140 86.932 2.332 0.789 0.631 0.935 0.683 CB 1.672 140 residues pruned to eliminate duplicates Z: 90 96.154 2.434 0.990 0.726 0.944 0.697 CB 1.818 90 residues pruned to eliminate duplicates Z: 152 88.763 2.327 0.877 0.626 0.934 0.662 CB 1.573 152 residues pruned to eliminate duplicates Z: 75 91.069 2.463 0.931 0.769 0.973 0.743 CB 1.803 75 residues pruned to eliminate duplicates Z: 91 86.318 2.415 0.883 0.726 0.933 0.744 CB 1.748 91 residues pruned to eliminate duplicates Z: 44 56.730 2.388 0.971 0.616 0.977 0.628 CB 1.687 44 residues pruned to eliminate duplicates Z: 91 90.078 2.430 0.878 0.712 0.944 0.689 CB 1.817 91 residues pruned to eliminate duplicates Z: 50 52.284 2.381 0.847 0.585 0.939 0.612 CB 1.667 50 residues pruned to eliminate duplicates Z: 43 52.814 2.396 0.840 0.652 0.929 0.810 CB 1.728 43 residues pruned to eliminate duplicates Z: 131 82.486 2.339 0.786 0.636 0.915 0.700 CB 1.665 131 residues pruned to eliminate duplicates Z: 139 94.539 2.374 0.873 0.672 0.942 0.674 CB 1.639 139 residues pruned to eliminate duplicates Z: 90 92.824 2.438 0.949 0.739 0.944 0.730 CB 1.771 90 residues pruned to eliminate duplicates Z: 33 51.269 2.426 1.050 0.638 0.906 0.719 CB 1.766 33 residues pruned to eliminate duplicates Z: 77 90.027 2.446 0.975 0.752 0.947 0.724 CB 1.801 77 residues pruned to eliminate duplicates Z: 107 83.771 2.362 0.890 0.665 0.943 0.708 CB 1.658 107 residues pruned to eliminate duplicates Z: 95 79.030 2.393 0.899 0.658 0.915 0.649 CB 1.693 95 residues pruned to eliminate duplicates Z: 128 78.054 2.335 0.776 0.623 0.898 0.661 CB 1.656 128 residues pruned to eliminate duplicates Z: 99 87.746 2.369 0.930 0.701 0.959 0.663 CB 1.682 99 residues pruned to eliminate duplicates Z: 103 87.760 2.397 0.889 0.664 0.951 0.686 CB 1.734 103 residues pruned to eliminate duplicates Z: 89 98.188 2.439 0.968 0.738 0.966 0.750 CB 1.824 89 residues pruned to eliminate duplicates Z: 101 84.951 2.363 0.898 0.680 0.940 0.700 CB 1.708 101 residues pruned to eliminate duplicates Z: 87 81.731 2.417 0.937 0.697 0.930 0.698 CB 1.689 87 residues pruned to eliminate duplicates Z: 92 91.770 2.411 0.978 0.713 0.934 0.670 CB 1.780 92 residues pruned to eliminate duplicates Z: 85 81.540 2.424 0.867 0.703 0.929 0.762 CB 1.759 85 residues pruned to eliminate duplicates Z: 92 92.666 2.406 0.962 0.716 0.956 0.681 CB 1.769 92 residues pruned to eliminate duplicates Z: 113 80.590 2.357 0.791 0.660 0.938 0.705 CB 1.658 113 residues pruned to eliminate duplicates Z: 91 91.507 2.421 0.914 0.735 0.956 0.733 CB 1.762 91 residues pruned to eliminate duplicates Z: 92 84.057 2.411 0.811 0.712 0.945 0.714 CB 1.762 92 residues pruned to eliminate duplicates Z: 143 90.680 2.369 0.846 0.655 0.930 0.655 CB 1.621 143 residues pruned to eliminate duplicates Z: 93 87.581 2.394 0.874 0.711 0.957 0.728 CB 1.758 93 residues pruned to eliminate duplicates Z: 179 87.968 2.321 0.808 0.594 0.916 0.680 CB 1.568 179 residues pruned to eliminate duplicates Z: 104 80.540 2.374 0.847 0.660 0.922 0.641 CB 1.693 104 residues pruned to eliminate duplicates Z: 101 83.979 2.388 0.878 0.664 0.920 0.640 CB 1.750 101 residues pruned to eliminate duplicates Z: 75 89.611 2.456 0.981 0.756 0.959 0.649 CB 1.776 75 residues pruned to eliminate duplicates Z: 140 97.319 2.383 0.870 0.676 0.950 0.712 CB 1.659 140 residues pruned to eliminate duplicates Z: 73 90.099 2.474 0.940 0.766 0.972 0.639 CB 1.799 73 residues pruned to eliminate duplicates Z: 107 75.819 2.342 0.771 0.646 0.906 0.660 CB 1.710 107 residues pruned to eliminate duplicates Z: 138 87.006 2.351 0.859 0.643 0.934 0.635 CB 1.593 138 residues pruned to eliminate duplicates Z: 94 83.369 2.384 0.883 0.694 0.925 0.720 CB 1.744 94 residues pruned to eliminate duplicates Z: 152 85.815 2.326 0.844 0.628 0.921 0.636 CB 1.568 152 residues pruned to eliminate duplicates Z: 91 89.226 2.416 0.915 0.717 0.944 0.667 CB 1.769 91 residues pruned to eliminate duplicates Z: 90 94.455 2.446 0.959 0.725 0.955 0.708 CB 1.786 90 residues pruned to eliminate duplicates Z: 98 83.005 2.373 0.828 0.686 0.928 0.722 CB 1.765 98 residues pruned to eliminate duplicates Z: 148 85.612 2.339 0.796 0.640 0.925 0.673 CB 1.594 148 residues pruned to eliminate duplicates Z: 80 90.196 2.456 0.888 0.744 0.975 0.759 CB 1.805 80 residues pruned to eliminate duplicates Z: 89 90.488 2.433 0.894 0.735 0.932 0.784 CB 1.819 89 residues pruned to eliminate duplicates Z: 117 78.313 2.352 0.776 0.649 0.931 0.603 CB 1.627 117 residues pruned to eliminate duplicates Z: 98 84.039 2.409 0.859 0.686 0.928 0.639 CB 1.731 98 residues pruned to eliminate duplicates Z: 78 87.697 2.438 0.984 0.749 0.922 0.753 CB 1.795 78 residues pruned to eliminate duplicates Z: 76 83.587 2.447 0.834 0.752 0.960 0.733 CB 1.789 76 residues pruned to eliminate duplicates Z: 136 78.022 2.316 0.756 0.607 0.933 0.667 CB 1.599 136 residues pruned to eliminate duplicates Z: 153 81.971 2.319 0.827 0.583 0.914 0.572 CB 1.585 153 residues pruned to eliminate duplicates Z: 179 87.636 2.308 0.778 0.616 0.921 0.596 CB 1.556 179 residues pruned to eliminate duplicates Z: 100 80.960 2.390 0.792 0.674 0.919 0.737 CB 1.761 100 residues pruned to eliminate duplicates Z: 89 79.615 2.409 0.846 0.682 0.932 0.727 CB 1.732 89 residues pruned to eliminate duplicates Z: 91 83.405 2.377 0.841 0.698 0.956 0.711 CB 1.755 91 residues pruned to eliminate duplicates Z: 140 91.246 2.378 0.827 0.644 0.942 0.683 CB 1.652 140 residues pruned to eliminate duplicates Z: 92 88.986 2.411 0.937 0.715 0.934 0.681 CB 1.761 92 residues pruned to eliminate duplicates Z: 90 90.309 2.424 1.012 0.725 0.910 0.674 CB 1.760 90 residues pruned to eliminate duplicates Z: 62 58.817 2.345 0.784 0.658 0.918 0.656 CB 1.693 62 residues pruned to eliminate duplicates Z: 77 86.084 2.416 0.965 0.739 0.947 0.763 CB 1.772 77 residues pruned to eliminate duplicates Z: 157 89.693 2.355 0.839 0.615 0.936 0.622 CB 1.589 157 residues pruned to eliminate duplicates Z: 77 85.790 2.434 0.980 0.744 0.934 0.632 CB 1.757 77 residues pruned to eliminate duplicates Z: 135 88.411 2.351 0.926 0.633 0.925 0.604 CB 1.609 135 residues pruned to eliminate duplicates Z: 102 86.743 2.369 0.903 0.678 0.941 0.653 CB 1.727 102 residues pruned to eliminate duplicates Z: 84 82.473 2.407 0.878 0.719 0.940 0.590 CB 1.748 84 residues pruned to eliminate duplicates Z: 76 93.146 2.455 1.026 0.757 0.960 0.680 CB 1.793 76 residues pruned to eliminate duplicates Z: 76 89.056 2.427 0.980 0.760 0.973 0.600 CB 1.745 76 residues pruned to eliminate duplicates Z: 102 80.935 2.384 0.796 0.669 0.921 0.673 CB 1.747 102 residues pruned to eliminate duplicates Z: 151 83.245 2.347 0.795 0.616 0.900 0.667 CB 1.607 151 residues pruned to eliminate duplicates Z: 104 80.986 2.372 0.878 0.657 0.903 0.583 CB 1.715 104 residues pruned to eliminate duplicates Z: 179 84.834 2.289 0.802 0.615 0.910 0.624 CB 1.519 179 residues pruned to eliminate duplicates Z: 129 77.051 2.349 0.827 0.616 0.883 0.500 CB 1.610 129 residues pruned to eliminate duplicates Z: 112 88.394 2.358 0.917 0.675 0.946 0.667 CB 1.670 112 residues pruned to eliminate duplicates Z: 105 82.128 2.375 0.900 0.649 0.933 0.683 CB 1.665 105 residues pruned to eliminate duplicates Z: 37 22.513 2.091 0.605 0.449 0.861 0.556 CB 1.368 37 residues pruned to eliminate duplicates Z: 116 80.764 2.358 0.850 0.644 0.922 0.617 CB 1.638 116 residues pruned to eliminate duplicates Z: 114 85.571 2.359 0.877 0.655 0.929 0.628 CB 1.694 114 residues pruned to eliminate duplicates Z: 97 80.658 2.380 0.910 0.663 0.927 0.667 CB 1.679 97 residues pruned to eliminate duplicates Z: 38 25.042 2.115 0.610 0.444 0.919 0.541 CB 1.394 38 residues pruned to eliminate duplicates Z: 19 13.104 2.193 0.596 0.335 0.778 0.444 CB 1.360 19 residues pruned to eliminate duplicates Z: 130 70.149 2.264 0.682 0.636 0.907 0.636 CB 1.574 130 residues pruned to eliminate duplicates Z: 97 78.886 2.374 0.879 0.661 0.938 0.604 CB 1.658 97 residues pruned to eliminate duplicates Z: 50 29.273 2.141 0.544 0.478 0.918 0.673 CB 1.408 50 residues pruned to eliminate duplicates Z: 27 22.465 2.135 0.439 0.524 0.962 0.577 CB 1.457 27 residues pruned to eliminate duplicates Z: 26 29.237 2.174 0.671 0.618 0.920 0.720 CA 1.565 26 residues pruned to eliminate duplicates Z: 49 28.232 2.109 0.546 0.490 0.938 0.583 CB 1.347 49 residues pruned to eliminate duplicates Z: 38 23.611 2.106 0.646 0.505 0.865 0.622 CB 1.288 38 residues pruned to eliminate duplicates Z: 69 41.260 2.144 0.645 0.611 0.912 0.706 CB 1.401 69 residues pruned to eliminate duplicates Z: 40 22.577 2.109 0.516 0.513 0.821 0.641 CB 1.360 40 residues pruned to eliminate duplicates Z: 117 78.039 2.304 0.860 0.660 0.905 0.603 CB 1.611 117 residues pruned to eliminate duplicates Z: 38 24.545 2.135 0.647 0.522 0.811 0.541 CB 1.384 38 residues pruned to eliminate duplicates Z: 50 31.426 2.123 0.602 0.501 0.959 0.490 CB 1.376 50 residues pruned to eliminate duplicates Z: 28 24.178 2.187 0.628 0.608 0.852 0.519 CB 1.385 28 residues pruned to eliminate duplicates Z: 50 28.878 2.153 0.531 0.507 0.918 0.592 CB 1.354 50 residues pruned to eliminate duplicates Z: 81 38.429 2.137 0.544 0.529 0.913 0.688 CB 1.387 81 residues pruned to eliminate duplicates Z: 39 27.876 2.143 0.688 0.525 0.895 0.711 CB 1.363 39 residues pruned to eliminate duplicates Z: 19 21.074 2.065 0.653 0.588 0.944 0.722 CB 1.416 19 residues pruned to eliminate duplicates Z: 30 22.682 2.104 0.486 0.542 0.966 0.759 CB 1.338 30 residues pruned to eliminate duplicates Z: 50 32.275 2.160 0.584 0.524 0.939 0.653 CB 1.401 50 residues pruned to eliminate duplicates Z: 25 19.606 1.821 0.687 0.515 0.917 0.750 CB 1.400 25 residues pruned to eliminate duplicates Z: 113 84.507 2.341 0.890 0.692 0.920 0.679 CB 1.647 113 residues pruned to eliminate duplicates Z: 33 23.531 2.073 0.675 0.559 0.812 0.562 CB 1.392 33 residues pruned to eliminate duplicates Z: 70 56.146 2.347 0.846 0.597 0.942 0.594 CB 1.509 70 residues pruned to eliminate duplicates Z: 67 59.704 2.363 0.887 0.606 0.955 0.545 CB 1.561 67 residues pruned to eliminate duplicates Z: 90 56.056 2.304 0.692 0.580 0.921 0.640 CB 1.532 90 residues pruned to eliminate duplicates Z: 32 27.699 2.195 0.596 0.611 0.935 0.710 CB 1.366 32 residues pruned to eliminate duplicates Z: 58 60.669 2.399 0.945 0.629 0.965 0.719 CB 1.581 58 residues pruned to eliminate duplicates Z: 65 61.135 2.366 0.935 0.626 0.953 0.641 CB 1.555 65 residues pruned to eliminate duplicates Z: 87 55.124 2.291 0.767 0.553 0.919 0.605 CB 1.517 87 residues pruned to eliminate duplicates Z: 31 29.329 2.166 0.883 0.607 0.933 0.567 CB 1.271 31 residues pruned to eliminate duplicates Z: 17 12.192 1.992 0.231 0.558 0.938 0.438 CB 1.253 17 residues pruned to eliminate duplicates Z: 25 44.158 2.475 1.003 0.679 0.958 0.667 CB 1.609 25 residues pruned to eliminate duplicates Z: 36 59.206 2.507 1.023 0.653 0.943 0.457 CB 1.815 36 residues pruned to eliminate duplicates Z: 53 61.815 2.383 0.872 0.652 0.962 0.635 CB 1.735 53 residues pruned to eliminate duplicates Z: 66 63.984 2.347 0.984 0.617 0.985 0.585 CB 1.549 66 residues pruned to eliminate duplicates Z: 65 59.344 2.369 0.897 0.611 0.938 0.594 CB 1.585 65 residues pruned to eliminate duplicates Z: 96 62.964 2.286 0.811 0.590 0.937 0.579 CB 1.528 96 residues pruned to eliminate duplicates Z: 47 49.427 2.344 0.973 0.573 0.957 0.652 CB 1.535 47 residues pruned to eliminate duplicates Z: 43 57.766 2.450 0.954 0.613 1.000 0.548 CB 1.672 43 residues pruned to eliminate duplicates Z: 52 48.912 2.347 0.803 0.552 0.961 0.451 CB 1.601 52 residues pruned to eliminate duplicates Z: 44 48.569 2.451 0.799 0.592 0.953 0.605 CB 1.614 44 residues pruned to eliminate duplicates Z: 55 45.434 2.305 0.812 0.556 0.944 0.574 CB 1.485 55 residues pruned to eliminate duplicates Z: 67 58.494 2.374 0.838 0.616 0.939 0.606 CB 1.574 67 residues pruned to eliminate duplicates Z: 58 56.129 2.348 0.846 0.628 0.965 0.614 CB 1.575 58 residues pruned to eliminate duplicates Z: 67 61.358 2.367 0.936 0.627 0.939 0.697 CB 1.557 67 residues pruned to eliminate duplicates Z: 74 63.276 2.409 0.823 0.588 0.932 0.644 CB 1.664 74 residues pruned to eliminate duplicates Z: 54 46.023 2.315 0.778 0.564 0.925 0.585 CB 1.561 54 residues pruned to eliminate duplicates Z: 43 36.212 2.242 0.679 0.593 0.976 0.690 CB 1.391 43 residues pruned to eliminate duplicates Z: 43 55.043 2.446 0.958 0.619 0.952 0.619 CB 1.664 43 residues pruned to eliminate duplicates Z: 38 34.058 2.241 0.769 0.551 0.946 0.649 CB 1.421 38 residues pruned to eliminate duplicates Z: 74 60.616 2.376 0.813 0.598 0.918 0.644 CB 1.634 74 residues pruned to eliminate duplicates Z: 33 44.363 2.398 0.912 0.616 0.969 0.688 CB 1.582 33 residues pruned to eliminate duplicates Z: 126 59.442 2.229 0.711 0.553 0.904 0.592 CB 1.465 126 residues pruned to eliminate duplicates Z: 84 63.955 2.349 0.821 0.597 0.940 0.711 CB 1.592 84 residues pruned to eliminate duplicates Z: 44 52.111 2.452 0.859 0.582 0.953 0.628 CB 1.690 44 residues pruned to eliminate duplicates Z: 38 50.173 2.487 0.801 0.639 0.946 0.676 CB 1.708 38 residues pruned to eliminate duplicates Z: 59 54.586 2.359 0.821 0.619 0.948 0.655 CB 1.572 59 residues pruned to eliminate duplicates Z: 13 35.987 2.556 1.040 0.570 0.917 0.417 CA 2.031 13 residues pruned to eliminate duplicates Z: 52 53.013 2.364 0.861 0.579 0.961 0.627 CB 1.628 52 residues pruned to eliminate duplicates Z: 55 44.271 2.344 0.702 0.532 0.926 0.574 CB 1.581 55 residues pruned to eliminate duplicates Z: 9 26.224 2.407 1.039 0.532 1.000 0.500 CA 1.830 9 residues pruned to eliminate duplicates Z: 44 48.736 2.405 0.795 0.583 0.953 0.558 CB 1.667 44 residues pruned to eliminate duplicates Z: 40 31.025 2.260 0.561 0.516 0.872 0.590 CB 1.590 40 residues pruned to eliminate duplicates Z: 53 42.473 2.302 0.648 0.576 0.942 0.615 CB 1.532 53 residues pruned to eliminate duplicates Z: 36 49.684 2.481 0.870 0.586 0.971 0.629 CB 1.716 36 residues pruned to eliminate duplicates Z: 44 35.600 2.279 0.689 0.516 0.907 0.488 CB 1.530 44 residues pruned to eliminate duplicates Z: 72 53.633 2.349 0.653 0.563 0.944 0.662 CB 1.634 72 residues pruned to eliminate duplicates Z: 37 49.322 2.501 0.753 0.595 0.972 0.667 CB 1.761 37 residues pruned to eliminate duplicates Z: 82 54.701 2.303 0.749 0.548 0.926 0.642 CB 1.555 82 residues pruned to eliminate duplicates Z: 32 32.525 2.272 0.644 0.573 0.935 0.677 CB 1.559 32 residues pruned to eliminate duplicates Z: 32 27.640 2.277 0.447 0.569 0.903 0.613 CB 1.561 32 residues pruned to eliminate duplicates Z: 32 28.980 2.249 0.506 0.566 0.903 0.581 CB 1.597 32 residues pruned to eliminate duplicates Z: 43 38.415 2.321 0.591 0.646 0.905 0.738 CB 1.549 43 residues pruned to eliminate duplicates Z: 24 25.857 2.117 0.614 0.614 0.913 0.609 CB 1.551 24 residues pruned to eliminate duplicates Z: 74 41.578 2.210 0.538 0.574 0.890 0.603 CB 1.497 74 residues pruned to eliminate duplicates Z: 31 34.399 2.295 0.606 0.603 0.967 0.633 CB 1.598 31 residues pruned to eliminate duplicates Z: 55 30.046 2.029 0.607 0.507 0.870 0.537 CB 1.430 55 residues pruned to eliminate duplicates Z: 88 62.495 2.344 0.750 0.600 0.954 0.621 CB 1.557 88 residues pruned to eliminate duplicates Z: 32 34.767 2.285 0.765 0.582 0.935 0.581 CB 1.531 32 residues pruned to eliminate duplicates Z: 42 35.784 2.251 0.767 0.580 0.902 0.537 CB 1.442 42 residues pruned to eliminate duplicates Z: 31 33.943 2.312 0.654 0.605 0.900 0.667 CB 1.630 31 residues pruned to eliminate duplicates Z: 26 21.564 2.018 0.607 0.554 0.840 0.600 CB 1.502 26 residues pruned to eliminate duplicates Z: 44 37.129 2.252 0.664 0.599 0.907 0.558 CB 1.515 44 residues pruned to eliminate duplicates Z: 30 33.566 2.307 0.712 0.604 0.897 0.586 CB 1.594 30 residues pruned to eliminate duplicates Z: 85 52.889 2.265 0.715 0.590 0.917 0.571 CB 1.488 85 residues pruned to eliminate duplicates Z: 16 16.006 2.301 0.688 0.315 0.733 0.533 CB 1.781 16 residues pruned to eliminate duplicates Z: 96 57.208 2.278 0.757 0.586 0.895 0.600 CB 1.509 96 residues pruned to eliminate duplicates Z: 14 16.054 2.179 0.593 0.450 0.846 0.462 CB 1.597 14 residues pruned to eliminate duplicates Z: 55 30.299 2.093 0.660 0.474 0.889 0.611 CB 1.372 55 residues pruned to eliminate duplicates Z: 29 25.136 2.234 0.616 0.519 0.857 0.571 CB 1.506 29 residues pruned to eliminate duplicates Z: 147 67.779 2.265 0.734 0.530 0.904 0.568 CB 1.533 147 residues pruned to eliminate duplicates Z: 32 36.873 2.294 0.812 0.569 0.968 0.548 CB 1.540 32 residues pruned to eliminate duplicates Z: 26 14.061 1.987 0.612 0.272 0.800 0.520 CB 1.422 26 residues pruned to eliminate duplicates Z: 57 42.153 2.302 0.681 0.518 0.911 0.571 CB 1.569 57 residues pruned to eliminate duplicates Z: 44 39.341 2.312 0.718 0.619 0.884 0.674 CB 1.527 44 residues pruned to eliminate duplicates Z: 76 57.674 2.354 0.762 0.594 0.933 0.600 CB 1.572 76 residues pruned to eliminate duplicates Z: 104 68.984 2.333 0.753 0.610 0.951 0.621 CB 1.574 104 residues pruned to eliminate duplicates Z: 36 32.766 2.204 0.656 0.561 0.914 0.600 CB 1.563 36 residues pruned to eliminate duplicates Z: 58 43.027 2.285 0.726 0.547 0.912 0.596 CB 1.514 58 residues pruned to eliminate duplicates Z: 43 38.501 2.189 0.674 0.632 0.929 0.690 CB 1.542 43 residues pruned to eliminate duplicates Z: 28 28.015 2.373 0.609 0.541 0.852 0.593 CB 1.593 28 residues pruned to eliminate duplicates Z: 13 25.257 2.341 0.813 0.770 0.917 0.667 CB 1.476 13 residues pruned to eliminate duplicates Z: 174 92.137 2.343 0.789 0.639 0.931 0.607 CB 1.577 174 residues pruned to eliminate duplicates Z: 121 71.036 2.331 0.770 0.581 0.908 0.608 CB 1.600 121 residues pruned to eliminate duplicates Z: 42 39.044 2.268 0.676 0.600 0.951 0.707 CB 1.532 42 residues pruned to eliminate duplicates Z: 31 25.051 2.085 0.605 0.589 0.933 0.733 CB 1.345 31 residues pruned to eliminate duplicates Z: 15 27.744 2.220 0.892 0.798 0.929 0.857 CB 1.465 15 residues pruned to eliminate duplicates Z: 55 43.975 2.287 0.708 0.545 0.944 0.611 CB 1.551 55 residues pruned to eliminate duplicates Z: 73 50.857 2.246 0.781 0.608 0.889 0.667 CB 1.522 73 residues pruned to eliminate duplicates Z: 57 41.655 2.272 0.690 0.532 0.911 0.446 CB 1.542 57 residues pruned to eliminate duplicates Z: 104 56.454 2.309 0.682 0.561 0.883 0.583 CB 1.528 104 residues pruned to eliminate duplicates Z: 71 49.935 2.280 0.684 0.615 0.929 0.571 CB 1.501 71 residues pruned to eliminate duplicates Z: 45 35.626 2.190 0.652 0.601 0.932 0.591 CB 1.447 45 residues pruned to eliminate duplicates Z: 73 51.241 2.276 0.740 0.572 0.917 0.528 CB 1.551 73 residues pruned to eliminate duplicates Z: 85 54.446 2.266 0.705 0.576 0.893 0.667 CB 1.601 85 residues pruned to eliminate duplicates Z: 36 27.580 2.002 0.703 0.576 0.943 0.514 CB 1.348 36 residues pruned to eliminate duplicates Z: 35 26.885 2.025 0.665 0.580 0.971 0.500 CB 1.304 35 residues pruned to eliminate duplicates Z: 37 23.401 1.978 0.584 0.534 0.889 0.556 CB 1.354 37 residues pruned to eliminate duplicates Z: 59 36.734 2.189 0.649 0.478 0.914 0.552 CB 1.495 59 residues pruned to eliminate duplicates Z: 36 27.300 2.036 0.669 0.590 0.914 0.543 CB 1.363 36 residues pruned to eliminate duplicates Z: 55 37.253 2.213 0.708 0.445 0.926 0.593 CB 1.533 55 residues pruned to eliminate duplicates Z: 36 26.995 2.038 0.675 0.573 0.943 0.571 CB 1.321 36 residues pruned to eliminate duplicates Z: 35 29.998 2.066 0.680 0.585 0.971 0.647 CB 1.407 35 residues pruned to eliminate duplicates Z: 59 36.726 2.175 0.658 0.466 0.931 0.552 CB 1.486 59 residues pruned to eliminate duplicates Z: 34 24.324 1.956 0.583 0.572 0.970 0.485 CB 1.315 34 residues pruned to eliminate duplicates Z: 36 30.199 2.041 0.720 0.565 0.971 0.514 CB 1.405 36 residues pruned to eliminate duplicates Z: 37 29.400 2.013 0.753 0.569 0.944 0.667 CB 1.375 37 residues pruned to eliminate duplicates Z: 36 24.196 1.971 0.604 0.570 0.943 0.571 CB 1.282 36 residues pruned to eliminate duplicates Z: 87 57.088 2.225 0.743 0.568 0.942 0.709 CB 1.578 87 residues pruned to eliminate duplicates Z: 36 24.073 2.026 0.528 0.555 0.971 0.629 CB 1.283 36 residues pruned to eliminate duplicates Z: 35 28.539 2.107 0.644 0.576 0.971 0.647 CB 1.352 35 residues pruned to eliminate duplicates Z: 36 24.502 2.000 0.592 0.550 0.914 0.543 CB 1.355 36 residues pruned to eliminate duplicates Z: 36 29.312 2.033 0.730 0.569 0.971 0.686 CB 1.357 36 residues pruned to eliminate duplicates Z: 36 26.441 2.034 0.552 0.588 0.971 0.657 CB 1.340 36 residues pruned to eliminate duplicates Z: 6 11.382 2.408 0.745 0.477 0.800 0.600 CB 1.550 6 residues pruned to eliminate duplicates Z: 109 61.013 2.276 0.715 0.564 0.917 0.583 CB 1.542 142 residues pruned to eliminate duplicates Z: 70 49.983 2.325 0.735 0.511 0.957 0.551 CB 1.541 70 residues pruned to eliminate duplicates Z: 36 28.966 2.011 0.722 0.577 0.971 0.571 CB 1.352 36 residues pruned to eliminate duplicates Z: 37 24.398 2.016 0.598 0.582 0.944 0.528 CB 1.235 37 residues pruned to eliminate duplicates Z: 28 41.064 2.411 0.895 0.581 0.963 0.630 CB 1.662 28 residues pruned to eliminate duplicates Z: 24 51.620 2.577 0.875 0.687 1.000 0.609 CB 1.877 24 residues pruned to eliminate duplicates Z: 8 17.772 2.622 0.635 0.433 0.857 0.286 CB 1.958 8 residues pruned to eliminate duplicates Z: 35 53.224 2.523 0.820 0.635 0.971 0.618 CB 1.804 35 residues pruned to eliminate duplicates Z: 24 42.333 2.543 0.703 0.674 1.000 0.565 CB 1.737 24 residues pruned to eliminate duplicates Z: 38 51.028 2.540 0.850 0.590 0.865 0.405 CB 1.895 38 residues pruned to eliminate duplicates Z: 73 47.921 2.291 0.642 0.570 0.931 0.542 CB 1.508 73 residues pruned to eliminate duplicates Z: 66 61.625 2.488 0.684 0.594 0.938 0.569 CB 1.776 66 residues pruned to eliminate duplicates Z: 62 47.316 2.243 0.776 0.608 0.967 0.590 CB 1.419 62 residues pruned to eliminate duplicates Z: 37 53.010 2.556 0.898 0.610 0.889 0.500 CB 1.846 37 residues pruned to eliminate duplicates Z: 35 59.862 2.563 0.942 0.654 0.971 0.559 CB 1.840 35 residues pruned to eliminate duplicates Z: 39 56.082 2.518 0.816 0.602 0.947 0.658 CB 1.905 39 residues pruned to eliminate duplicates Z: 35 59.619 2.605 0.826 0.651 0.941 0.647 CB 1.985 35 residues pruned to eliminate duplicates Z: 68 60.854 2.430 0.744 0.584 0.940 0.597 CB 1.721 68 residues pruned to eliminate duplicates Z: 23 55.671 2.620 0.928 0.751 1.000 0.818 CB 1.878 23 residues pruned to eliminate duplicates Z: 24 44.596 2.542 0.840 0.705 0.957 0.696 CB 1.725 24 residues pruned to eliminate duplicates Z: 102 64.619 2.308 0.785 0.576 0.941 0.584 CB 1.542 102 residues pruned to eliminate duplicates Z: 23 47.693 2.563 0.782 0.729 1.000 0.773 CB 1.811 23 residues pruned to eliminate duplicates Z: 36 58.643 2.571 0.783 0.651 0.971 0.629 CB 1.933 36 residues pruned to eliminate duplicates Z: 23 42.082 2.558 0.711 0.707 0.955 0.682 CB 1.779 23 residues pruned to eliminate duplicates Z: 65 60.765 2.441 0.721 0.600 0.922 0.609 CB 1.783 71 residues pruned to eliminate duplicates Z: 35 57.895 2.569 0.852 0.652 0.941 0.559 CB 1.926 35 residues pruned to eliminate duplicates Z: 65 59.261 2.438 0.818 0.579 0.875 0.641 CB 1.770 65 residues pruned to eliminate duplicates Z: 35 57.196 2.568 0.873 0.636 0.941 0.676 CB 1.907 35 residues pruned to eliminate duplicates Z: 73 52.115 2.299 0.680 0.593 0.944 0.597 CB 1.540 73 residues pruned to eliminate duplicates Z: 37 55.917 2.537 0.786 0.621 0.944 0.556 CA 1.942 37 residues pruned to eliminate duplicates Z: 36 58.718 2.576 0.845 0.638 0.943 0.600 CB 1.946 36 residues pruned to eliminate duplicates Z: 35 54.848 2.568 0.686 0.662 0.971 0.676 CA 1.925 35 residues pruned to eliminate duplicates Z: 37 56.365 2.495 0.835 0.637 0.944 0.639 CA 1.911 37 residues pruned to eliminate duplicates Z: 35 56.119 2.568 0.756 0.643 0.971 0.618 CB 1.924 35 residues pruned to eliminate duplicates Z: 35 60.190 2.579 0.791 0.653 0.971 0.647 CB 1.997 35 residues pruned to eliminate duplicates Z: 36 54.054 2.590 0.729 0.661 0.914 0.600 CB 1.922 36 residues pruned to eliminate duplicates Z: 106 56.840 2.275 0.664 0.569 0.914 0.686 CB 1.499 106 residues pruned to eliminate duplicates Z: 67 62.832 2.476 0.731 0.592 0.939 0.682 CB 1.760 67 residues pruned to eliminate duplicates Z: 37 51.234 2.543 0.774 0.592 0.917 0.639 CB 1.891 37 residues pruned to eliminate duplicates Z: 66 69.012 2.482 0.785 0.625 0.938 0.615 CB 1.830 66 residues pruned to eliminate duplicates Z: 68 62.222 2.436 0.749 0.584 0.925 0.642 CB 1.780 68 residues pruned to eliminate duplicates Z: 66 63.879 2.458 0.743 0.607 0.923 0.554 CB 1.811 66 residues pruned to eliminate duplicates Z: 68 63.042 2.444 0.711 0.622 0.955 0.672 CB 1.718 68 residues pruned to eliminate duplicates Z: 66 66.780 2.475 0.848 0.614 0.923 0.600 CB 1.762 66 residues pruned to eliminate duplicates Z: 65 56.412 2.454 0.581 0.616 0.922 0.609 CB 1.767 65 residues pruned to eliminate duplicates Z: 34 32.007 2.278 0.696 0.591 0.879 0.667 CB 1.504 Z: 17 31.957 2.238 0.622 0.852 1.000 0.875 CB 1.628 21 residues pruned to eliminate duplicates Z: 16 29.543 2.323 0.399 0.923 1.000 0.867 CB 1.649 16 residues pruned to eliminate duplicates Z: 33 34.449 2.348 0.765 0.618 0.844 0.656 CB 1.558 30 residues pruned to eliminate duplicates Z: 17 32.773 2.294 0.594 0.883 0.938 0.750 CB 1.728 17 residues pruned to eliminate duplicates Z: 43 38.284 2.290 0.798 0.500 0.857 0.571 CB 1.674 33 residues pruned to eliminate duplicates Z: 16 40.846 2.364 0.853 0.919 1.000 0.800 CB 1.697 16 residues pruned to eliminate duplicates Z: 31 36.850 2.352 0.763 0.609 0.900 0.533 CB 1.626 31 residues pruned to eliminate duplicates Z: 106 67.262 2.299 0.790 0.579 0.943 0.610 CB 1.568 149 residues pruned to eliminate duplicates Z: 32 37.609 2.339 0.810 0.585 0.903 0.645 CB 1.627 Z: 16 36.750 2.368 0.674 0.910 1.000 0.800 CB 1.698 16 residues pruned to eliminate duplicates Z: 66 62.096 2.454 0.799 0.610 0.908 0.615 CB 1.731 98 residues pruned to eliminate duplicates Z: 34 29.678 2.316 0.602 0.578 0.909 0.606 CB 1.422 Z: 6 6.023 1.789 0.537 0.274 1.000 0.200 CA 1.266 6 residues pruned to eliminate duplicates Z: 68 59.524 2.437 0.789 0.562 0.881 0.597 CB 1.784 102 residues pruned to eliminate duplicates Z: 38 36.174 2.253 0.729 0.589 0.892 0.541 CB 1.572 Z: 8 9.267 1.723 1.029 0.564 0.714 0.286 O 1.318 8 residues pruned to eliminate duplicates Z: 33 40.372 2.271 0.834 0.617 0.938 0.625 CB 1.637 33 residues pruned to eliminate duplicates Z: 103 57.560 2.232 0.694 0.590 0.941 0.569 CB 1.470 141 residues pruned to eliminate duplicates Z: 37 34.442 2.223 0.769 0.612 0.917 0.528 CB 1.432 Z: 9 11.040 1.955 0.693 0.567 0.875 0.500 CA 1.263 9 residues pruned to eliminate duplicates Z: 66 59.477 2.445 0.658 0.637 0.923 0.538 CB 1.733 103 residues pruned to eliminate duplicates Z: 33 37.292 2.362 0.646 0.644 0.938 0.594 CB 1.581 Z: 15 24.679 2.208 0.710 0.839 0.929 0.857 CB 1.406 15 residues pruned to eliminate duplicates Z: 25 32.983 2.272 0.816 0.644 0.958 0.667 CB 1.488 25 residues pruned to eliminate duplicates Z: 26 31.090 2.175 0.848 0.596 0.920 0.480 CB 1.535 26 residues pruned to eliminate duplicates Z: 26 29.789 2.181 0.696 0.648 0.920 0.800 CB 1.524 34 residues pruned to eliminate duplicates Z: 13 40.405 2.431 1.106 0.918 1.000 0.917 CB 1.606 15 residues pruned to eliminate duplicates Z: 15 33.326 2.187 0.994 0.905 1.000 0.929 CB 1.453 15 residues pruned to eliminate duplicates Z: 24 28.312 2.188 0.946 0.617 0.957 0.826 CB 1.297 24 residues pruned to eliminate duplicates Z: 17 30.471 2.295 0.827 0.696 1.000 0.625 CB 1.520 15 residues pruned to eliminate duplicates Z: 15 33.108 2.100 1.239 0.883 1.000 0.857 CB 1.361 15 residues pruned to eliminate duplicates Z: 26 28.316 2.150 0.628 0.605 0.960 0.600 CB 1.525 26 residues pruned to eliminate duplicates Z: 24 31.255 2.232 0.750 0.703 0.957 0.652 CB 1.450 24 residues pruned to eliminate duplicates Z: 25 26.055 2.214 0.605 0.635 0.917 0.625 CB 1.439 25 residues pruned to eliminate duplicates Z: 25 24.305 2.166 0.407 0.627 0.958 0.625 CB 1.507 25 residues pruned to eliminate duplicates Z: 38 34.836 2.191 0.661 0.627 0.892 0.595 CB 1.565 63 residues pruned to eliminate duplicates Z: 14 13.794 2.077 0.466 0.483 0.923 0.615 CB 1.385 Z: 6 5.954 1.430 1.094 0.393 1.000 0.800 CA 0.997 6 residues pruned to eliminate duplicates Z: 43 39.784 2.209 0.792 0.652 0.905 0.595 CB 1.488 33 residues pruned to eliminate duplicates Z: 7 4.823 1.909 0.431 0.210 0.667 0.167 CA 1.523 7 residues pruned to eliminate duplicates Z: 20 20.864 2.089 0.635 0.602 0.842 0.684 CB 1.511 20 residues pruned to eliminate duplicates Z: 18 23.041 2.200 0.710 0.605 0.882 0.588 CB 1.524 18 residues pruned to eliminate duplicates Z: 19 20.197 2.196 0.455 0.589 0.944 0.667 CB 1.448 19 residues pruned to eliminate duplicates Z: 19 17.542 2.141 0.538 0.553 0.889 0.722 CB 1.341 19 residues pruned to eliminate duplicates Z: 16 22.188 2.215 0.733 0.598 0.933 0.667 CB 1.457 16 residues pruned to eliminate duplicates Z: 19 20.775 2.161 0.604 0.587 0.944 0.500 CB 1.376 19 residues pruned to eliminate duplicates Z: 20 24.937 2.027 0.649 0.609 0.947 0.579 CB 1.629 20 residues pruned to eliminate duplicates Z: 19 21.996 2.125 0.788 0.564 0.889 0.611 CB 1.443 19 residues pruned to eliminate duplicates Z: 52 38.699 2.289 0.773 0.574 0.824 0.627 CB 1.509 52 residues pruned to eliminate duplicates Z: 18 25.863 2.292 0.780 0.634 0.882 0.765 CB 1.536 18 residues pruned to eliminate duplicates Z: 20 19.629 2.101 0.862 0.553 0.789 0.526 CB 1.384 20 residues pruned to eliminate duplicates Z: 21 21.390 2.121 0.926 0.556 0.900 0.550 CB 1.232 21 residues pruned to eliminate duplicates Z: 44 37.692 2.119 0.830 0.615 0.953 0.628 CB 1.394 44 residues pruned to eliminate duplicates Z: 8 6.301 1.481 0.752 0.600 0.714 0.286 CB 1.168 8 residues pruned to eliminate duplicates Z: 26 19.455 2.038 0.246 0.681 0.920 0.640 CB 1.410 26 residues pruned to eliminate duplicates Z: 26 23.184 1.975 0.446 0.684 0.960 0.800 CB 1.428 26 residues pruned to eliminate duplicates Z: 40 26.921 1.998 0.555 0.550 0.923 0.564 CB 1.432 40 residues pruned to eliminate duplicates Z: 18 19.965 1.905 0.503 0.815 0.882 0.706 CB 1.457 18 residues pruned to eliminate duplicates Z: 31 28.437 2.010 0.672 0.607 0.967 0.667 CB 1.443 31 residues pruned to eliminate duplicates Z: 30 24.979 2.022 0.473 0.622 0.966 0.655 CB 1.438 30 residues pruned to eliminate duplicates Z: 19 17.116 1.913 0.595 0.700 0.889 0.722 CB 1.239 19 residues pruned to eliminate duplicates Z: 31 30.079 2.016 0.794 0.602 0.933 0.600 CB 1.476 31 residues pruned to eliminate duplicates Z: 40 26.672 2.000 0.555 0.568 0.923 0.513 CB 1.393 40 residues pruned to eliminate duplicates Z: 25 25.191 1.994 0.700 0.734 0.958 0.708 CB 1.283 25 residues pruned to eliminate duplicates Z: 17 19.810 1.900 0.749 0.769 0.812 0.688 CB 1.446 17 residues pruned to eliminate duplicates Z: 32 26.933 1.981 0.788 0.571 0.903 0.452 CB 1.412 32 residues pruned to eliminate duplicates Z: 33 28.571 1.972 0.676 0.594 1.000 0.562 CB 1.397 33 residues pruned to eliminate duplicates Z: 18 22.204 1.911 0.798 0.805 0.882 0.647 CB 1.361 18 residues pruned to eliminate duplicates Z: 27 22.728 1.915 0.570 0.689 0.923 0.615 CB 1.351 27 residues pruned to eliminate duplicates Z: 28 24.556 2.017 0.707 0.610 0.889 0.519 CB 1.391 28 residues pruned to eliminate duplicates Z: 24 28.339 1.951 0.786 0.732 0.957 0.652 CB 1.440 24 residues pruned to eliminate duplicates Z: 32 27.497 1.990 0.675 0.586 0.935 0.613 CB 1.459 32 residues pruned to eliminate duplicates Z: 189 93.141 2.344 0.770 0.608 0.899 0.649 CB 1.644 208 residues pruned to eliminate duplicates Z: 35 24.011 1.930 0.678 0.584 0.824 0.559 CB 1.425 35 residues pruned to eliminate duplicates Z: 13 13.362 2.084 0.567 0.374 0.833 0.417 CB 1.622 13 residues pruned to eliminate duplicates Z: 39 24.831 2.000 0.637 0.580 0.842 0.526 CB 1.353 39 residues pruned to eliminate duplicates Z: 12 12.464 2.162 0.680 0.388 0.727 0.364 CB 1.603 12 residues pruned to eliminate duplicates Z: 36 21.502 1.976 0.594 0.495 0.857 0.543 CB 1.353 36 residues pruned to eliminate duplicates Z: 30 26.551 1.984 0.803 0.584 0.897 0.414 CB 1.419 30 residues pruned to eliminate duplicates Z: 14 13.014 2.057 0.570 0.343 0.846 0.615 CB 1.567 14 residues pruned to eliminate duplicates Z: 14 12.483 2.085 0.474 0.365 0.846 0.462 CB 1.540 14 residues pruned to eliminate duplicates Z: 35 24.253 1.966 0.679 0.533 0.882 0.588 CB 1.383 35 residues pruned to eliminate duplicates Z: 9 7.845 1.943 0.717 0.302 0.875 0.375 CB 1.185 9 residues pruned to eliminate duplicates Z: 17 8.521 1.914 0.583 0.252 0.688 0.312 CB 1.360 17 residues pruned to eliminate duplicates Z: 71 49.869 2.177 0.769 0.596 0.943 0.600 CB 1.499 30 residues pruned to eliminate duplicates Z: 17 30.846 2.303 0.543 0.857 1.000 0.812 CB 1.599 17 residues pruned to eliminate duplicates Z: 50 44.970 2.278 0.849 0.567 0.939 0.653 CB 1.522 38 residues pruned to eliminate duplicates Z: 17 23.381 2.175 0.515 0.893 0.938 0.750 CB 1.357 17 residues pruned to eliminate duplicates Z: 51 43.188 2.309 0.774 0.584 0.900 0.680 CB 1.529 51 residues pruned to eliminate duplicates Z: 62 46.770 2.320 0.751 0.535 0.918 0.705 CB 1.551 64 residues pruned to eliminate duplicates Z: 17 27.878 2.198 0.614 0.858 0.938 0.875 CB 1.544 17 residues pruned to eliminate duplicates Z: 39 39.001 2.266 0.730 0.596 0.947 0.684 CB 1.554 39 residues pruned to eliminate duplicates Z: 49 41.683 2.323 0.713 0.584 0.938 0.729 CB 1.488 49 residues pruned to eliminate duplicates Z: 53 39.307 2.234 0.759 0.533 0.885 0.654 CB 1.519 53 residues pruned to eliminate duplicates Z: 51 43.228 2.312 0.780 0.577 0.920 0.600 CB 1.500 51 residues pruned to eliminate duplicates Z: 30 47.629 2.357 0.948 0.734 0.966 0.724 CB 1.617 30 residues pruned to eliminate duplicates Z: 62 43.949 2.317 0.664 0.545 0.918 0.639 CB 1.522 62 residues pruned to eliminate duplicates Z: 30 41.470 2.302 0.893 0.685 0.931 0.724 CB 1.601 30 residues pruned to eliminate duplicates Z: 50 45.463 2.324 0.798 0.581 0.939 0.694 CB 1.532 50 residues pruned to eliminate duplicates Z: 38 38.664 2.306 0.772 0.554 0.919 0.676 CB 1.606 38 residues pruned to eliminate duplicates Z: 155 91.361 2.412 0.769 0.621 0.929 0.688 CB 1.657 333 residues pruned to eliminate duplicates Z: 48 46.421 2.313 0.770 0.607 0.957 0.745 CB 1.561 Z: 6 4.999 1.587 0.497 0.391 1.000 0.600 CB 1.057 6 residues pruned to eliminate duplicates Z: 38 49.318 2.356 0.959 0.625 0.973 0.703 CB 1.605 38 residues pruned to eliminate duplicates Z: 7 7.408 1.634 0.915 0.475 0.833 0.500 N 1.190 7 residues pruned to eliminate duplicates Z: 66 43.889 2.307 0.655 0.540 0.908 0.646 CB 1.510 48 residues pruned to eliminate duplicates Z: 7 5.933 2.121 0.335 0.341 0.833 0.333 CB 1.221 7 residues pruned to eliminate duplicates Z: 173 103.667 2.421 0.847 0.621 0.924 0.709 CB 1.706 239 residues pruned to eliminate duplicates Z: 39 42.856 2.322 0.867 0.592 0.947 0.763 CB 1.549 Z: 9 5.783 1.871 0.133 0.475 0.875 0.625 CB 1.130 9 residues pruned to eliminate duplicates Z: 60 39.978 2.260 0.656 0.521 0.932 0.644 CB 1.461 38 residues pruned to eliminate duplicates Z: 6 6.181 2.373 0.410 0.368 0.800 0.600 CB 1.190 6 residues pruned to eliminate duplicates Z: 38 45.081 2.338 0.826 0.624 0.973 0.649 CB 1.587 38 residues pruned to eliminate duplicates Z: 89 60.913 2.385 0.679 0.597 0.943 0.773 CB 1.568 61 residues pruned to eliminate duplicates Z: 8 18.714 2.352 0.674 0.717 1.000 0.714 CB 1.476 8 residues pruned to eliminate duplicates Z: 192 91.602 2.326 0.788 0.608 0.916 0.660 CB 1.570 281 residues pruned to eliminate duplicates Z: 53 43.464 2.300 0.772 0.588 0.923 0.673 CB 1.472 Z: 8 15.722 1.979 0.847 0.821 1.000 0.714 CB 1.231 12 residues pruned to eliminate duplicates Z: 8 15.196 1.975 0.659 0.788 1.000 0.714 CB 1.361 8 residues pruned to eliminate duplicates Z: 7 17.359 1.970 0.702 0.857 1.000 0.833 CB 1.558 7 residues pruned to eliminate duplicates Z: 15 12.359 2.245 0.176 0.557 0.857 0.786 CB 1.381 15 residues pruned to eliminate duplicates Z: 79 43.331 2.260 0.708 0.474 0.897 0.551 CB 1.454 49 residues pruned to eliminate duplicates Z: 10 13.906 1.910 0.684 0.543 0.889 0.778 CA 1.556 7 residues pruned to eliminate duplicates Z: 7 12.175 2.164 0.522 0.493 1.000 0.833 CA 1.520 7 residues pruned to eliminate duplicates Z: 13 17.748 2.255 0.715 0.509 0.917 0.583 CB 1.433 13 residues pruned to eliminate duplicates Z: 65 54.180 2.318 0.740 0.633 0.906 0.688 CB 1.636 73 residues pruned to eliminate duplicates Z: 6 14.669 2.310 0.943 0.606 0.800 0.400 CB 1.651 6 residues pruned to eliminate duplicates Z: 44 47.742 2.425 0.796 0.608 0.884 0.628 CB 1.708 44 residues pruned to eliminate duplicates Z: 91 93.171 2.505 0.899 0.708 0.956 0.667 CB 1.789 198 residues pruned to eliminate duplicates Z: 131 91.624 2.464 0.804 0.626 0.923 0.638 CB 1.740 131 residues pruned to eliminate duplicates Z: 104 84.730 2.469 0.826 0.649 0.913 0.699 CB 1.765 104 residues pruned to eliminate duplicates Z: 87 84.436 2.517 0.830 0.704 0.919 0.733 CB 1.787 87 residues pruned to eliminate duplicates Z: 91 80.080 2.491 0.812 0.681 0.900 0.711 CB 1.760 91 residues pruned to eliminate duplicates Z: 131 94.514 2.455 0.829 0.640 0.938 0.685 CB 1.725 131 residues pruned to eliminate duplicates Z: 179 110.100 2.446 0.848 0.632 0.927 0.674 CB 1.739 179 residues pruned to eliminate duplicates Z: 96 97.311 2.510 0.902 0.705 0.947 0.705 CB 1.831 96 residues pruned to eliminate duplicates Z: 93 89.705 2.491 0.854 0.714 0.935 0.728 CB 1.785 93 residues pruned to eliminate duplicates Z: 87 81.617 2.507 0.816 0.695 0.919 0.709 CB 1.762 87 residues pruned to eliminate duplicates Z: 27 47.517 2.542 0.896 0.717 0.923 0.769 CB 1.722 Z: 18 48.391 2.428 0.871 0.878 1.000 0.882 CB 1.874 17 residues pruned to eliminate duplicates Z: 17 40.569 2.399 0.632 0.904 1.000 0.938 CB 1.846 17 residues pruned to eliminate duplicates Z: 89 83.956 2.506 0.868 0.682 0.920 0.693 CB 1.757 117 residues pruned to eliminate duplicates Z: 28 44.477 2.494 0.957 0.697 0.926 0.815 CB 1.582 Z: 17 46.896 2.348 0.846 0.943 1.000 0.938 CB 1.875 18 residues pruned to eliminate duplicates Z: 12 38.415 2.522 0.713 0.938 1.000 1.000 CB 1.864 12 residues pruned to eliminate duplicates Z: 112 86.379 2.461 0.862 0.631 0.892 0.658 CB 1.773 139 residues pruned to eliminate duplicates Z: 113 91.547 2.479 0.890 0.671 0.884 0.688 CB 1.784 113 residues pruned to eliminate duplicates Z: 44 48.951 2.406 0.886 0.607 0.907 0.674 CB 1.638 Z: 17 42.687 2.367 0.681 0.909 1.000 0.812 CB 1.903 17 residues pruned to eliminate duplicates Z: 20 37.036 2.198 0.761 0.914 0.947 0.737 CB 1.638 20 residues pruned to eliminate duplicates Z: 89 91.639 2.512 0.958 0.683 0.932 0.727 CB 1.801 133 residues pruned to eliminate duplicates Z: 137 97.070 2.444 0.892 0.645 0.897 0.647 CB 1.753 137 residues pruned to eliminate duplicates Z: 40 52.055 2.476 0.914 0.624 0.923 0.667 CB 1.695 Z: 16 53.391 2.515 0.967 0.922 1.000 0.733 CB 1.960 17 residues pruned to eliminate duplicates Z: 6 5.781 1.973 0.511 0.206 0.800 0.400 CB 1.535 2 residues pruned to eliminate duplicates Z: 6 8.792 2.101 0.833 0.290 1.000 0.400 CA 1.292 Z: 19 40.259 2.392 0.888 0.732 0.944 0.667 CA 1.805 25 residues pruned to eliminate duplicates Z: 86 87.364 2.517 0.931 0.701 0.918 0.706 CB 1.769 129 residues pruned to eliminate duplicates Z: 138 94.501 2.465 0.845 0.623 0.912 0.620 CB 1.731 138 residues pruned to eliminate duplicates Z: 163 105.643 2.476 0.817 0.633 0.926 0.691 CB 1.759 163 residues pruned to eliminate duplicates Z: 136 94.822 2.481 0.818 0.615 0.926 0.689 CB 1.752 136 residues pruned to eliminate duplicates Z: 85 88.530 2.503 0.951 0.690 0.917 0.726 CB 1.813 85 residues pruned to eliminate duplicates Z: 93 94.024 2.470 0.957 0.723 0.967 0.641 CB 1.714 93 residues pruned to eliminate duplicates Z: 177 107.534 2.477 0.797 0.639 0.926 0.676 CB 1.727 177 residues pruned to eliminate duplicates Z: 93 88.680 2.456 0.983 0.691 0.913 0.685 CB 1.746 93 residues pruned to eliminate duplicates Z: 101 89.565 2.491 0.888 0.678 0.920 0.720 CB 1.757 101 residues pruned to eliminate duplicates Z: 78 96.221 2.519 1.019 0.767 0.961 0.805 CB 1.771 78 residues pruned to eliminate duplicates Z: 101 91.251 2.495 0.981 0.663 0.920 0.710 CB 1.725 101 residues pruned to eliminate duplicates Z: 113 97.486 2.504 0.972 0.666 0.911 0.696 CB 1.756 113 residues pruned to eliminate duplicates Z: 80 95.175 2.514 1.044 0.729 0.937 0.696 CB 1.810 80 residues pruned to eliminate duplicates Z: 76 105.521 2.552 1.102 0.765 0.973 0.733 CB 1.845 76 residues pruned to eliminate duplicates Z: 162 107.765 2.478 0.884 0.649 0.919 0.677 CB 1.722 162 residues pruned to eliminate duplicates Z: 89 94.612 2.507 0.996 0.717 0.932 0.705 CB 1.777 89 residues pruned to eliminate duplicates Z: 102 89.541 2.456 0.921 0.674 0.931 0.683 CB 1.729 102 residues pruned to eliminate duplicates Z: 98 96.135 2.470 0.964 0.689 0.948 0.732 CB 1.785 98 residues pruned to eliminate duplicates Z: 87 85.779 2.498 0.970 0.677 0.907 0.663 CB 1.761 87 residues pruned to eliminate duplicates Z: 74 108.145 2.550 1.154 0.782 0.973 0.699 CB 1.848 74 residues pruned to eliminate duplicates Z: 108 86.886 2.430 0.952 0.638 0.916 0.654 CB 1.700 108 residues pruned to eliminate duplicates Z: 109 89.591 2.436 0.872 0.650 0.935 0.685 CB 1.758 109 residues pruned to eliminate duplicates Z: 178 113.336 2.477 0.852 0.628 0.932 0.650 CB 1.765 178 residues pruned to eliminate duplicates Z: 74 102.955 2.544 1.165 0.771 0.945 0.712 CB 1.821 74 residues pruned to eliminate duplicates Z: 84 95.093 2.529 0.925 0.729 0.952 0.711 CB 1.833 84 residues pruned to eliminate duplicates Z: 75 102.849 2.540 1.137 0.769 0.946 0.743 CB 1.836 75 residues pruned to eliminate duplicates Z: 87 92.916 2.518 0.995 0.700 0.930 0.674 CB 1.787 87 residues pruned to eliminate duplicates Z: 102 98.303 2.481 0.995 0.673 0.941 0.653 CB 1.792 102 residues pruned to eliminate duplicates Z: 60 73.680 2.473 0.852 0.716 0.915 0.661 CB 1.882 60 residues pruned to eliminate duplicates Z: 78 106.202 2.529 1.171 0.754 0.987 0.727 CB 1.781 78 residues pruned to eliminate duplicates Z: 75 105.793 2.560 1.108 0.784 0.959 0.730 CB 1.850 75 residues pruned to eliminate duplicates Z: 154 99.148 2.459 0.824 0.607 0.922 0.614 CB 1.752 154 residues pruned to eliminate duplicates Z: 103 92.508 2.467 0.940 0.678 0.931 0.706 CB 1.745 103 residues pruned to eliminate duplicates Z: 140 98.027 2.473 0.877 0.609 0.914 0.655 CB 1.768 140 residues pruned to eliminate duplicates Z: 76 90.425 2.505 1.033 0.731 0.907 0.720 CB 1.837 76 residues pruned to eliminate duplicates Z: 80 97.720 2.479 1.117 0.725 0.975 0.709 CB 1.755 80 residues pruned to eliminate duplicates Z: 92 96.401 2.484 1.060 0.705 0.945 0.648 CB 1.735 92 residues pruned to eliminate duplicates Z: 101 91.400 2.474 0.955 0.684 0.920 0.680 CB 1.735 101 residues pruned to eliminate duplicates Z: 103 89.476 2.450 0.963 0.648 0.931 0.696 CB 1.723 103 residues pruned to eliminate duplicates Z: 178 114.584 2.469 0.882 0.644 0.932 0.701 CB 1.739 177 residues pruned to eliminate duplicates Z: 31 68.442 2.390 1.050 0.922 0.967 0.767 CB 1.856 31 residues pruned to eliminate duplicates Z: 153 110.772 2.478 0.945 0.652 0.908 0.651 CB 1.783 153 residues pruned to eliminate duplicates Z: 116 100.416 2.509 0.970 0.668 0.913 0.643 CB 1.776 116 residues pruned to eliminate duplicates Z: 162 116.555 2.494 0.911 0.663 0.932 0.677 CB 1.778 162 residues pruned to eliminate duplicates Z: 149 107.527 2.469 0.959 0.631 0.939 0.642 CB 1.721 149 residues pruned to eliminate duplicates Z: 17 13.076 2.326 0.337 0.362 0.812 0.438 CB 1.500 17 residues pruned to eliminate duplicates Z: 97 85.745 2.487 0.911 0.673 0.896 0.656 CB 1.753 97 residues pruned to eliminate duplicates Z: 17 10.402 2.203 0.310 0.379 0.688 0.375 CB 1.492 17 residues pruned to eliminate duplicates Z: 60 41.433 2.413 0.620 0.447 0.881 0.610 CB 1.653 60 residues pruned to eliminate duplicates Z: 18 12.878 2.142 0.381 0.337 0.824 0.353 CB 1.531 18 residues pruned to eliminate duplicates Z: 103 88.844 2.465 0.960 0.629 0.941 0.618 CB 1.712 103 residues pruned to eliminate duplicates Z: 179 109.019 2.464 0.866 0.638 0.916 0.669 CB 1.706 179 residues pruned to eliminate duplicates Z: 163 105.998 2.457 0.849 0.639 0.932 0.667 CB 1.727 163 residues pruned to eliminate duplicates Z: 105 88.399 2.445 0.990 0.651 0.933 0.558 CB 1.660 105 residues pruned to eliminate duplicates Z: 116 95.765 2.505 0.974 0.657 0.896 0.643 CB 1.743 116 residues pruned to eliminate duplicates Z: 127 98.324 2.474 0.956 0.660 0.921 0.635 CB 1.696 127 residues pruned to eliminate duplicates Z: 162 116.823 2.489 0.973 0.653 0.925 0.640 CB 1.757 162 residues pruned to eliminate duplicates Z: 137 99.979 2.483 0.894 0.634 0.912 0.662 CB 1.763 137 residues pruned to eliminate duplicates Z: 54 40.219 2.390 0.687 0.489 0.868 0.509 CB 1.597 54 residues pruned to eliminate duplicates Z: 48 48.180 2.460 0.709 0.497 0.957 0.638 CB 1.751 48 residues pruned to eliminate duplicates Z: 27 37.556 2.348 0.977 0.593 0.846 0.654 CB 1.716 27 residues pruned to eliminate duplicates Z: 9 20.130 2.314 0.852 0.690 0.875 0.750 CA 1.596 9 residues pruned to eliminate duplicates Z: 51 46.716 2.429 0.663 0.511 0.940 0.700 CB 1.721 51 residues pruned to eliminate duplicates Z: 76 65.946 2.446 0.711 0.599 0.960 0.640 CB 1.724 76 residues pruned to eliminate duplicates Z: 37 42.631 2.432 0.769 0.550 0.917 0.639 CB 1.716 37 residues pruned to eliminate duplicates Z: 60 47.615 2.418 0.692 0.476 0.915 0.576 CB 1.697 60 residues pruned to eliminate duplicates Z: 49 50.136 2.442 0.785 0.547 0.938 0.604 CB 1.692 49 residues pruned to eliminate duplicates Z: 50 48.174 2.430 0.667 0.527 0.959 0.612 CB 1.726 50 residues pruned to eliminate duplicates Z: 26 43.003 2.444 0.944 0.585 0.960 0.640 CB 1.737 26 residues pruned to eliminate duplicates Z: 68 62.814 2.437 0.783 0.600 0.925 0.672 CB 1.735 68 residues pruned to eliminate duplicates Z: 51 46.645 2.410 0.797 0.493 0.940 0.540 CB 1.631 51 residues pruned to eliminate duplicates Z: 50 49.849 2.431 0.755 0.517 0.939 0.633 CB 1.749 50 residues pruned to eliminate duplicates Z: 70 57.746 2.386 0.653 0.582 0.957 0.739 CB 1.703 70 residues pruned to eliminate duplicates Z: 27 41.333 2.452 0.781 0.635 0.923 0.654 CB 1.771 27 residues pruned to eliminate duplicates Z: 76 68.984 2.463 0.776 0.613 0.933 0.733 CB 1.752 76 residues pruned to eliminate duplicates Z: 13 27.997 2.277 0.566 0.861 1.000 0.833 CB 1.665 13 residues pruned to eliminate duplicates Z: 75 70.175 2.466 0.804 0.615 0.932 0.689 CB 1.763 75 residues pruned to eliminate duplicates Z: 15 27.543 2.233 0.632 0.873 0.929 0.714 CB 1.585 15 residues pruned to eliminate duplicates Z: 75 75.398 2.458 0.852 0.626 0.973 0.689 CB 1.756 75 residues pruned to eliminate duplicates Z: 61 42.794 2.338 0.671 0.478 0.883 0.617 CB 1.638 61 residues pruned to eliminate duplicates Z: 61 46.265 2.388 0.731 0.472 0.917 0.600 CB 1.622 61 residues pruned to eliminate duplicates Z: 51 46.321 2.390 0.767 0.504 0.900 0.700 CB 1.716 51 residues pruned to eliminate duplicates Z: 89 58.916 2.354 0.777 0.539 0.920 0.568 CB 1.570 89 residues pruned to eliminate duplicates Z: 79 64.740 2.388 0.743 0.596 0.974 0.731 CB 1.649 79 residues pruned to eliminate duplicates Z: 54 39.414 2.325 0.654 0.494 0.849 0.623 CB 1.668 54 residues pruned to eliminate duplicates Z: 75 70.961 2.466 0.846 0.625 0.919 0.703 CB 1.752 75 residues pruned to eliminate duplicates Z: 29 29.504 2.363 0.688 0.380 0.893 0.536 CB 1.779 29 residues pruned to eliminate duplicates Z: 29 27.627 2.366 0.530 0.377 0.964 0.607 CB 1.705 29 residues pruned to eliminate duplicates Z: 50 57.380 2.468 0.825 0.589 0.959 0.714 CB 1.742 50 residues pruned to eliminate duplicates Z: 76 72.264 2.450 0.820 0.626 0.960 0.747 CB 1.731 75 residues pruned to eliminate duplicates Z: 8 15.146 2.149 0.805 0.554 0.857 0.571 CB 1.633 8 residues pruned to eliminate duplicates Z: 50 43.936 2.390 0.684 0.521 0.898 0.694 CB 1.701 50 residues pruned to eliminate duplicates Z: 74 62.625 2.388 0.785 0.596 0.945 0.726 CB 1.660 74 residues pruned to eliminate duplicates Z: 49 51.428 2.435 0.759 0.539 0.958 0.625 CB 1.740 49 residues pruned to eliminate duplicates Z: 56 51.211 2.389 0.688 0.566 0.927 0.764 CB 1.732 56 residues pruned to eliminate duplicates Z: 49 48.692 2.451 0.699 0.538 0.938 0.646 CB 1.734 49 residues pruned to eliminate duplicates Z: 26 27.005 2.414 0.597 0.388 0.920 0.600 CB 1.715 26 residues pruned to eliminate duplicates Z: 25 27.274 2.388 0.602 0.377 0.958 0.583 CB 1.731 25 residues pruned to eliminate duplicates Z: 52 55.341 2.454 0.743 0.585 0.961 0.784 CB 1.739 53 residues pruned to eliminate duplicates Z: 6 5.423 1.829 0.918 0.468 0.800 0.600 N 0.893 6 residues pruned to eliminate duplicates Z: 50 35.742 2.273 0.757 0.428 0.857 0.510 CB 1.607 50 residues pruned to eliminate duplicates Z: 51 46.015 2.373 0.709 0.514 0.960 0.620 CB 1.648 51 residues pruned to eliminate duplicates Z: 77 67.330 2.400 0.774 0.611 0.961 0.724 CB 1.699 77 residues pruned to eliminate duplicates Z: 27 24.787 2.376 0.581 0.389 0.885 0.654 CB 1.646 27 residues pruned to eliminate duplicates Z: 50 55.892 2.462 0.760 0.601 0.959 0.694 CB 1.745 50 residues pruned to eliminate duplicates Z: 26 38.874 2.390 0.455 0.853 0.960 0.840 CB 1.722 26 residues pruned to eliminate duplicates Z: 31 44.360 2.379 0.806 0.727 0.900 0.567 CB 1.706 31 residues pruned to eliminate duplicates Z: 75 68.087 2.444 0.728 0.631 0.959 0.743 CB 1.727 75 residues pruned to eliminate duplicates Z: 76 66.050 2.402 0.737 0.623 0.960 0.680 CB 1.696 76 residues pruned to eliminate duplicates Z: 56 52.674 2.334 0.748 0.572 0.964 0.655 CB 1.684 56 residues pruned to eliminate duplicates Z: 76 64.689 2.398 0.697 0.623 0.947 0.707 CB 1.726 76 residues pruned to eliminate duplicates Z: 32 44.113 2.364 0.645 0.743 1.000 0.742 CB 1.639 32 residues pruned to eliminate duplicates Z: 29 52.693 2.436 0.868 0.774 1.000 0.786 CB 1.718 29 residues pruned to eliminate duplicates Z: 34 45.575 2.353 0.696 0.724 0.970 0.697 CB 1.675 34 residues pruned to eliminate duplicates Z: 76 62.679 2.388 0.816 0.597 0.933 0.627 CB 1.630 76 residues pruned to eliminate duplicates Z: 31 46.201 2.358 0.884 0.724 0.933 0.500 CB 1.662 31 residues pruned to eliminate duplicates Z: 30 51.585 2.412 0.970 0.764 0.966 0.517 CB 1.652 30 residues pruned to eliminate duplicates Z: 24 54.937 2.423 1.083 0.940 0.957 0.609 CB 1.648 24 residues pruned to eliminate duplicates Z: 29 54.799 2.459 1.028 0.788 0.964 0.643 CB 1.672 29 residues pruned to eliminate duplicates Z: 30 53.215 2.403 0.971 0.757 0.966 0.621 CB 1.719 30 residues pruned to eliminate duplicates Z: 50 50.505 2.414 0.829 0.562 0.939 0.592 CB 1.640 50 residues pruned to eliminate duplicates Z: 30 55.392 2.440 1.065 0.765 0.966 0.586 CB 1.671 30 residues pruned to eliminate duplicates Z: 108 71.439 2.280 0.843 0.606 0.944 0.570 CB 1.574 108 residues pruned to eliminate duplicates Z: 15 8.878 1.696 0.593 0.285 0.857 0.571 N 1.304 15 residues pruned to eliminate duplicates Z: 77 72.171 2.415 0.830 0.623 0.974 0.697 CB 1.712 77 residues pruned to eliminate duplicates Z: 34 45.234 2.280 1.000 0.684 0.939 0.515 CB 1.553 34 residues pruned to eliminate duplicates Z: 54 57.719 2.397 0.827 0.608 0.981 0.585 CB 1.664 54 residues pruned to eliminate duplicates Z: 24 61.757 2.446 1.236 0.904 0.957 0.565 CB 1.754 24 residues pruned to eliminate duplicates Z: 30 49.397 2.406 0.952 0.760 0.931 0.586 CB 1.665 30 residues pruned to eliminate duplicates Z: 31 49.835 2.379 0.858 0.739 1.000 0.567 CB 1.661 31 residues pruned to eliminate duplicates Z: 27 31.994 2.142 0.438 0.810 1.000 0.769 CB 1.555 Z: 21 24.715 2.026 0.793 0.795 0.950 0.600 CB 1.237 21 residues pruned to eliminate duplicates Z: 30 31.049 2.110 0.616 0.773 0.966 0.759 CB 1.376 26 residues pruned to eliminate duplicates Z: 22 36.498 2.195 0.656 0.872 1.000 0.762 CB 1.597 22 residues pruned to eliminate duplicates Z: 25 34.923 2.238 0.651 0.803 0.958 0.667 CB 1.544 30 residues pruned to eliminate duplicates Z: 21 33.484 2.177 0.706 0.908 0.950 0.800 CB 1.507 21 residues pruned to eliminate duplicates Z: 24 38.725 2.239 0.735 0.861 0.957 0.739 CB 1.597 27 residues pruned to eliminate duplicates Z: 23 32.771 2.147 0.713 0.884 0.909 0.682 CB 1.510 23 residues pruned to eliminate duplicates Z: 26 35.680 2.194 0.656 0.803 0.960 0.600 CB 1.569 26 residues pruned to eliminate duplicates Z: 27 34.182 2.136 0.767 0.775 0.885 0.500 CB 1.575 27 residues pruned to eliminate duplicates Z: 23 39.317 2.219 0.835 0.863 0.955 0.591 CB 1.581 21 residues pruned to eliminate duplicates Z: 24 34.211 2.118 0.848 0.845 0.913 0.522 CB 1.485 24 residues pruned to eliminate duplicates Z: 26 31.147 2.189 0.567 0.802 0.960 0.640 CB 1.453 26 residues pruned to eliminate duplicates Z: 37 33.871 2.118 0.756 0.639 0.889 0.639 CB 1.498 25 residues pruned to eliminate duplicates Z: 24 34.063 2.112 0.857 0.904 0.913 0.565 CB 1.412 23 residues pruned to eliminate duplicates Z: 24 38.870 2.128 0.940 0.920 0.957 0.609 CB 1.445 24 residues pruned to eliminate duplicates Z: 25 37.652 2.225 0.898 0.816 0.917 0.667 CB 1.508 25 residues pruned to eliminate duplicates Z: 39 35.043 2.025 0.787 0.680 0.974 0.526 CB 1.367 40 residues pruned to eliminate duplicates Z: 23 42.139 2.162 1.019 0.915 0.955 0.636 CB 1.524 23 residues pruned to eliminate duplicates Z: 73 41.423 2.155 0.621 0.612 0.903 0.611 CB 1.392 110 residues pruned to eliminate duplicates Z: 26 39.398 2.215 0.861 0.810 0.960 0.600 CB 1.520 Z: 25 38.913 2.067 1.018 0.907 0.958 0.583 CB 1.412 23 residues pruned to eliminate duplicates Z: 23 38.075 2.145 0.889 0.893 0.955 0.591 CB 1.507 24 residues pruned to eliminate duplicates Z: 24 42.283 2.135 1.142 0.909 0.957 0.696 CB 1.430 23 residues pruned to eliminate duplicates Z: 22 43.456 2.198 1.182 0.951 0.952 0.667 CB 1.432 23 residues pruned to eliminate duplicates 576 residues left after pruning, divided into chains as follows: A: 6 B: 15 C: 6 D: 8 E: 7 F: 11 G: 7 H: 6 I: 483 J: 27 CC for partial structure against native data = 30.16 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 1 used as input for final density modification = 0.300, Contrast = 0.556, Connect. = 0.773 for dens.mod. cycle 1 = 0.300, Contrast = 0.640, Connect. = 0.799 for dens.mod. cycle 2 = 0.300, Contrast = 0.757, Connect. = 0.826 for dens.mod. cycle 3 = 0.300, Contrast = 0.773, Connect. = 0.828 for dens.mod. cycle 4 = 0.300, Contrast = 0.788, Connect. = 0.831 for dens.mod. cycle 5 = 0.300, Contrast = 0.796, Connect. = 0.833 for dens.mod. cycle 6 = 0.300, Contrast = 0.803, Connect. = 0.834 for dens.mod. cycle 7 = 0.300, Contrast = 0.807, Connect. = 0.836 for dens.mod. cycle 8 = 0.300, Contrast = 0.810, Connect. = 0.837 for dens.mod. cycle 9 = 0.300, Contrast = 0.811, Connect. = 0.838 for dens.mod. cycle 10 TimeTaking 485